USER MOD reduce.3.24.130724 H: found=0, std=0, add=1520, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1523 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 82 THR OG1 : rot 180:sc= -0.106 USER MOD Set 1.2: B 8 MET CE :methyl -125:sc= -0.788 (180deg=-1.61!) USER MOD Set 2.1: A 8 MET CE :methyl -123:sc= -0.702 (180deg=-1.55!) USER MOD Set 2.2: B 82 THR OG1 : rot 180:sc= -0.105 USER MOD Single : A 1 GLY N :NH3+ -155:sc= 0.904 (180deg=0.0704!) USER MOD Single : A 2 SER OG : rot 141:sc= 0.194 USER MOD Single : A 6 THR OG1 : rot 104:sc= 1.26 USER MOD Single : A 10 THR OG1 : rot -22:sc= 0.835 USER MOD Single : A 13 ASN : amide:sc= -0.599 K(o=-0.6,f=-2.7!) USER MOD Single : A 16 HIS : no HD1:sc= -2.28 K(o=-2.3,f=-2.8!) USER MOD Single : A 18 HIS : no HD1:sc= -0.777 K(o=-0.78,f=-1.9!) USER MOD Single : A 19 SER OG : rot -87:sc= 1.1 USER MOD Single : A 21 LYS NZ :NH3+ -121:sc= -1.3 (180deg=-1.45) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 81:sc= 0.00362 USER MOD Single : A 30 LYS NZ :NH3+ -164:sc=-0.00125 (180deg=-0.248) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ -151:sc= -0.0333 (180deg=-0.471) USER MOD Single : A 38 GLN : amide:sc= -3.14! C(o=-3.1!,f=-4.5!) USER MOD Single : A 39 THR OG1 : rot 109:sc= 0.769 USER MOD Single : A 42 SER OG : rot 180:sc= -0.176 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 48 GLN :FLIP amide:sc= -0.919 F(o=-2.3,f=-0.92) USER MOD Single : A 49 LYS NZ :NH3+ 170:sc= 0.949 (180deg=0.684) USER MOD Single : A 56 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.0304) USER MOD Single : A 58 MET CE :methyl -175:sc= -0.121 (180deg=-0.182) USER MOD Single : A 59 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0242) USER MOD Single : A 64 ASN : amide:sc= -1.45 K(o=-1.4,f=-2.7!) USER MOD Single : A 72 GLN : amide:sc= -0.01 K(o=-0.01,f=-2!) USER MOD Single : A 85 CYS SG : rot 109:sc= 0.779 USER MOD Single : A 86 ASN :FLIP amide:sc= -6.79! C(o=-8.5!,f=-6.8!) USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 2 SER OG : rot 180:sc= 0.263 USER MOD Single : B 6 THR OG1 : rot 101:sc= 1.29 USER MOD Single : B 10 THR OG1 : rot -19:sc= 0.734 USER MOD Single : B 13 ASN : amide:sc= -0.498 K(o=-0.5,f=-2.8!) USER MOD Single : B 16 HIS : no HD1:sc= -2.48 X(o=-2.5,f=-2.9!) USER MOD Single : B 18 HIS : no HD1:sc= -0.878 K(o=-0.88,f=-2!) USER MOD Single : B 19 SER OG : rot -96:sc= 1.1 USER MOD Single : B 21 LYS NZ :NH3+ -118:sc= -1.56 (180deg=-1.62!) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 TYR OH : rot 180:sc= 0 USER MOD Single : B 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 30 LYS NZ :NH3+ -163:sc= -0.0179 (180deg=-0.282) USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 LYS NZ :NH3+ -108:sc= 0 (180deg=-0.408) USER MOD Single : B 38 GLN : amide:sc= -3.04! C(o=-3!,f=-4.5!) USER MOD Single : B 39 THR OG1 : rot 69:sc= 0.826 USER MOD Single : B 42 SER OG : rot 180:sc= -0.189 USER MOD Single : B 43 SER OG : rot 180:sc= 0 USER MOD Single : B 48 GLN :FLIP amide:sc= -0.831 F(o=-2.2,f=-0.83) USER MOD Single : B 49 LYS NZ :NH3+ 167:sc= -0.714! (180deg=-1.59!) USER MOD Single : B 56 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.0568) USER MOD Single : B 58 MET CE :methyl -176:sc= -0.214 (180deg=-0.251) USER MOD Single : B 59 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0245) USER MOD Single : B 64 ASN : amide:sc= -1.44 K(o=-1.4,f=-2.9!) USER MOD Single : B 72 GLN : amide:sc= -0.0112 K(o=-0.011,f=-2!) USER MOD Single : B 85 CYS SG : rot 110:sc= 0.807 USER MOD Single : B 86 ASN :FLIP amide:sc= -6.88! C(o=-8.5!,f=-6.9!) USER MOD Single : B 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : X 8 ASN : amide:sc= -1.36 K(o=-1.4,f=-2.4!) USER MOD Single : X 9 LYS NZ :NH3+ -129:sc= -0.377 (180deg=-1.25) USER MOD Single : X 12 SER OG : rot -28:sc= 0.325 USER MOD Single : Y 8 ASN : amide:sc= -0.808 X(o=-0.81,f=-0.84) USER MOD Single : Y 9 LYS NZ :NH3+ -164:sc=-0.00832 (180deg=-0.184) USER MOD Single : Y 12 SER OG : rot 54:sc= -0.0674! USER MOD ----------------------------------------------------------------- ATOM 77 N ILE X 5 71.703 17.395 14.388 1.00 0.00 N ATOM 78 CA ILE X 5 71.598 15.902 14.515 1.00 0.00 C ATOM 79 C ILE X 5 72.559 15.205 13.535 1.00 0.00 C ATOM 80 O ILE X 5 73.179 14.220 13.882 1.00 0.00 O ATOM 81 CB ILE X 5 70.135 15.465 14.275 1.00 0.00 C ATOM 82 CG1 ILE X 5 69.678 15.814 12.853 1.00 0.00 C ATOM 83 CG2 ILE X 5 69.233 16.208 15.266 1.00 0.00 C ATOM 84 CD1 ILE X 5 68.300 15.190 12.596 1.00 0.00 C ATOM 0 HA ILE X 5 71.888 15.605 15.523 1.00 0.00 H new ATOM 0 HB ILE X 5 70.070 14.385 14.411 1.00 0.00 H new ATOM 0 HG12 ILE X 5 69.629 16.896 12.730 1.00 0.00 H new ATOM 0 HG13 ILE X 5 70.400 15.443 12.125 1.00 0.00 H new ATOM 0 HG21 ILE X 5 68.196 15.910 15.109 1.00 0.00 H new ATOM 0 HG22 ILE X 5 69.531 15.961 16.285 1.00 0.00 H new ATOM 0 HG23 ILE X 5 69.329 17.283 15.110 1.00 0.00 H new ATOM 0 HD11 ILE X 5 67.972 15.436 11.586 1.00 0.00 H new ATOM 0 HD12 ILE X 5 68.365 14.107 12.703 1.00 0.00 H new ATOM 0 HD13 ILE X 5 67.583 15.583 13.316 1.00 0.00 H new ATOM 96 N ASP X 6 72.695 15.711 12.329 1.00 0.00 N ATOM 97 CA ASP X 6 73.624 15.087 11.323 1.00 0.00 C ATOM 98 C ASP X 6 73.585 13.558 11.430 1.00 0.00 C ATOM 99 O ASP X 6 74.524 12.871 11.074 1.00 0.00 O ATOM 100 CB ASP X 6 75.059 15.590 11.548 1.00 0.00 C ATOM 101 CG ASP X 6 75.654 14.963 12.816 1.00 0.00 C ATOM 102 OD1 ASP X 6 75.225 15.333 13.896 1.00 0.00 O ATOM 103 OD2 ASP X 6 76.531 14.125 12.683 1.00 0.00 O ATOM 0 H ASP X 6 72.198 16.537 11.994 1.00 0.00 H new ATOM 0 HA ASP X 6 73.296 15.375 10.324 1.00 0.00 H new ATOM 0 HB2 ASP X 6 75.678 15.340 10.686 1.00 0.00 H new ATOM 0 HB3 ASP X 6 75.060 16.676 11.637 1.00 0.00 H new ATOM 108 N TRP X 7 72.513 13.017 11.923 1.00 0.00 N ATOM 109 CA TRP X 7 72.434 11.541 12.056 1.00 0.00 C ATOM 110 C TRP X 7 72.556 10.867 10.674 1.00 0.00 C ATOM 111 O TRP X 7 73.387 10.006 10.470 1.00 0.00 O ATOM 112 CB TRP X 7 71.107 11.181 12.738 1.00 0.00 C ATOM 113 CG TRP X 7 70.823 9.727 12.576 1.00 0.00 C ATOM 114 CD1 TRP X 7 71.384 8.725 13.290 1.00 0.00 C ATOM 115 CD2 TRP X 7 69.912 9.108 11.638 1.00 0.00 C ATOM 116 NE1 TRP X 7 70.872 7.522 12.836 1.00 0.00 N ATOM 117 CE2 TRP X 7 69.957 7.711 11.818 1.00 0.00 C ATOM 118 CE3 TRP X 7 69.058 9.627 10.655 1.00 0.00 C ATOM 119 CZ2 TRP X 7 69.179 6.854 11.045 1.00 0.00 C ATOM 120 CZ3 TRP X 7 68.273 8.772 9.876 1.00 0.00 C ATOM 121 CH2 TRP X 7 68.335 7.384 10.070 1.00 0.00 C ATOM 0 H TRP X 7 71.690 13.530 12.239 1.00 0.00 H new ATOM 0 HA TRP X 7 73.260 11.177 12.667 1.00 0.00 H new ATOM 0 HB2 TRP X 7 71.154 11.434 13.797 1.00 0.00 H new ATOM 0 HB3 TRP X 7 70.297 11.768 12.306 1.00 0.00 H new ATOM 0 HD1 TRP X 7 72.109 8.844 14.081 1.00 0.00 H new ATOM 0 HE1 TRP X 7 71.137 6.609 13.207 1.00 0.00 H new ATOM 0 HE3 TRP X 7 69.006 10.694 10.498 1.00 0.00 H new ATOM 0 HZ2 TRP X 7 69.229 5.786 11.199 1.00 0.00 H new ATOM 0 HZ3 TRP X 7 67.617 9.181 9.122 1.00 0.00 H new ATOM 0 HH2 TRP X 7 67.729 6.726 9.464 1.00 0.00 H new ATOM 132 N ASN X 8 71.768 11.243 9.706 1.00 0.00 N ATOM 133 CA ASN X 8 71.912 10.574 8.379 1.00 0.00 C ATOM 134 C ASN X 8 73.376 10.652 7.961 1.00 0.00 C ATOM 135 O ASN X 8 73.886 9.783 7.289 1.00 0.00 O ATOM 136 CB ASN X 8 71.036 11.247 7.326 1.00 0.00 C ATOM 137 CG ASN X 8 70.770 10.276 6.171 1.00 0.00 C ATOM 138 OD1 ASN X 8 69.725 9.656 6.109 1.00 0.00 O ATOM 139 ND2 ASN X 8 71.676 10.121 5.244 1.00 0.00 N ATOM 0 H ASN X 8 71.049 11.964 9.769 1.00 0.00 H new ATOM 0 HA ASN X 8 71.592 9.535 8.462 1.00 0.00 H new ATOM 0 HB2 ASN X 8 70.093 11.562 7.772 1.00 0.00 H new ATOM 0 HB3 ASN X 8 71.527 12.145 6.952 1.00 0.00 H new ATOM 0 HD21 ASN X 8 71.508 9.480 4.468 1.00 0.00 H new ATOM 0 HD22 ASN X 8 72.552 10.641 5.295 1.00 0.00 H new ATOM 146 N LYS X 9 74.078 11.672 8.384 1.00 0.00 N ATOM 147 CA LYS X 9 75.516 11.753 8.028 1.00 0.00 C ATOM 148 C LYS X 9 76.144 10.442 8.497 1.00 0.00 C ATOM 149 O LYS X 9 77.125 9.967 7.960 1.00 0.00 O ATOM 150 CB LYS X 9 76.178 12.949 8.722 1.00 0.00 C ATOM 151 CG LYS X 9 77.477 13.305 7.996 1.00 0.00 C ATOM 152 CD LYS X 9 78.077 14.565 8.618 1.00 0.00 C ATOM 153 CE LYS X 9 79.353 14.958 7.865 1.00 0.00 C ATOM 154 NZ LYS X 9 78.984 15.639 6.591 1.00 0.00 N ATOM 0 H LYS X 9 73.720 12.439 8.952 1.00 0.00 H new ATOM 0 HA LYS X 9 75.651 11.895 6.956 1.00 0.00 H new ATOM 0 HB2 LYS X 9 75.502 13.804 8.720 1.00 0.00 H new ATOM 0 HB3 LYS X 9 76.386 12.709 9.765 1.00 0.00 H new ATOM 0 HG2 LYS X 9 78.184 12.479 8.067 1.00 0.00 H new ATOM 0 HG3 LYS X 9 77.281 13.467 6.936 1.00 0.00 H new ATOM 0 HD2 LYS X 9 77.355 15.380 8.579 1.00 0.00 H new ATOM 0 HD3 LYS X 9 78.304 14.390 9.670 1.00 0.00 H new ATOM 0 HE2 LYS X 9 79.963 15.619 8.481 1.00 0.00 H new ATOM 0 HE3 LYS X 9 79.953 14.072 7.657 1.00 0.00 H new ATOM 0 HZ1 LYS X 9 79.491 15.194 5.800 1.00 0.00 H new ATOM 0 HZ2 LYS X 9 77.959 15.554 6.436 1.00 0.00 H new ATOM 0 HZ3 LYS X 9 79.244 16.644 6.647 1.00 0.00 H new ATOM 168 N ILE X 10 75.527 9.827 9.478 1.00 0.00 N ATOM 169 CA ILE X 10 76.018 8.510 9.970 1.00 0.00 C ATOM 170 C ILE X 10 76.111 7.606 8.756 1.00 0.00 C ATOM 171 O ILE X 10 77.022 6.814 8.606 1.00 0.00 O ATOM 172 CB ILE X 10 74.999 7.913 10.965 1.00 0.00 C ATOM 173 CG1 ILE X 10 75.621 6.706 11.681 1.00 0.00 C ATOM 174 CG2 ILE X 10 73.712 7.450 10.228 1.00 0.00 C ATOM 175 CD1 ILE X 10 74.528 5.969 12.463 1.00 0.00 C ATOM 0 H ILE X 10 74.702 10.186 9.958 1.00 0.00 H new ATOM 0 HA ILE X 10 76.979 8.612 10.474 1.00 0.00 H new ATOM 0 HB ILE X 10 74.737 8.686 11.688 1.00 0.00 H new ATOM 0 HG12 ILE X 10 76.082 6.035 10.956 1.00 0.00 H new ATOM 0 HG13 ILE X 10 76.410 7.035 12.357 1.00 0.00 H new ATOM 0 HG21 ILE X 10 73.009 7.033 10.950 1.00 0.00 H new ATOM 0 HG22 ILE X 10 73.254 8.302 9.726 1.00 0.00 H new ATOM 0 HG23 ILE X 10 73.969 6.689 9.491 1.00 0.00 H new ATOM 0 HD11 ILE X 10 74.963 5.110 12.974 1.00 0.00 H new ATOM 0 HD12 ILE X 10 74.088 6.644 13.197 1.00 0.00 H new ATOM 0 HD13 ILE X 10 73.755 5.628 11.774 1.00 0.00 H new ATOM 187 N LEU X 11 75.160 7.742 7.879 1.00 0.00 N ATOM 188 CA LEU X 11 75.165 6.909 6.643 1.00 0.00 C ATOM 189 C LEU X 11 76.338 7.337 5.758 1.00 0.00 C ATOM 190 O LEU X 11 77.011 6.518 5.164 1.00 0.00 O ATOM 191 CB LEU X 11 73.834 7.089 5.896 1.00 0.00 C ATOM 192 CG LEU X 11 73.864 6.359 4.549 1.00 0.00 C ATOM 193 CD1 LEU X 11 74.209 4.879 4.751 1.00 0.00 C ATOM 194 CD2 LEU X 11 72.481 6.480 3.898 1.00 0.00 C ATOM 0 H LEU X 11 74.379 8.393 7.962 1.00 0.00 H new ATOM 0 HA LEU X 11 75.278 5.856 6.902 1.00 0.00 H new ATOM 0 HB2 LEU X 11 73.015 6.705 6.505 1.00 0.00 H new ATOM 0 HB3 LEU X 11 73.642 8.150 5.736 1.00 0.00 H new ATOM 0 HG LEU X 11 74.624 6.807 3.909 1.00 0.00 H new ATOM 0 HD11 LEU X 11 74.226 4.374 3.785 1.00 0.00 H new ATOM 0 HD12 LEU X 11 75.188 4.795 5.222 1.00 0.00 H new ATOM 0 HD13 LEU X 11 73.458 4.414 5.390 1.00 0.00 H new ATOM 0 HD21 LEU X 11 72.485 5.965 2.937 1.00 0.00 H new ATOM 0 HD22 LEU X 11 71.732 6.029 4.549 1.00 0.00 H new ATOM 0 HD23 LEU X 11 72.242 7.532 3.745 1.00 0.00 H new ATOM 206 N SER X 12 76.592 8.614 5.677 1.00 0.00 N ATOM 207 CA SER X 12 77.725 9.105 4.841 1.00 0.00 C ATOM 208 C SER X 12 78.148 10.491 5.333 1.00 0.00 C ATOM 209 O SER X 12 77.568 11.462 4.877 1.00 0.00 O ATOM 210 CB SER X 12 77.283 9.196 3.380 1.00 0.00 C ATOM 211 OG SER X 12 76.649 7.982 3.003 1.00 0.00 O ATOM 212 OXT SER X 12 79.047 10.557 6.156 1.00 0.00 O ATOM 0 H SER X 12 76.062 9.342 6.156 1.00 0.00 H new ATOM 0 HA SER X 12 78.564 8.414 4.921 1.00 0.00 H new ATOM 0 HB2 SER X 12 76.598 10.033 3.247 1.00 0.00 H new ATOM 0 HB3 SER X 12 78.144 9.384 2.739 1.00 0.00 H new ATOM 0 HG SER X 12 77.011 7.244 3.537 1.00 0.00 H new ATOM 295 N ILE Y 5 57.297 -15.977 -14.149 1.00 0.00 N ATOM 296 CA ILE Y 5 57.504 -14.577 -13.659 1.00 0.00 C ATOM 297 C ILE Y 5 58.955 -14.414 -13.153 1.00 0.00 C ATOM 298 O ILE Y 5 59.322 -14.845 -12.080 1.00 0.00 O ATOM 299 CB ILE Y 5 56.422 -14.221 -12.580 1.00 0.00 C ATOM 300 CG1 ILE Y 5 56.980 -14.276 -11.139 1.00 0.00 C ATOM 301 CG2 ILE Y 5 55.255 -15.207 -12.703 1.00 0.00 C ATOM 302 CD1 ILE Y 5 55.892 -13.909 -10.117 1.00 0.00 C ATOM 0 HA ILE Y 5 57.373 -13.864 -14.473 1.00 0.00 H new ATOM 0 HB ILE Y 5 56.095 -13.198 -12.765 1.00 0.00 H new ATOM 0 HG12 ILE Y 5 57.360 -15.276 -10.929 1.00 0.00 H new ATOM 0 HG13 ILE Y 5 57.821 -13.589 -11.044 1.00 0.00 H new ATOM 0 HG21 ILE Y 5 54.497 -14.968 -11.957 1.00 0.00 H new ATOM 0 HG22 ILE Y 5 54.820 -15.133 -13.700 1.00 0.00 H new ATOM 0 HG23 ILE Y 5 55.617 -16.222 -12.540 1.00 0.00 H new ATOM 0 HD11 ILE Y 5 56.308 -13.955 -9.111 1.00 0.00 H new ATOM 0 HD12 ILE Y 5 55.532 -12.899 -10.315 1.00 0.00 H new ATOM 0 HD13 ILE Y 5 55.063 -14.612 -10.199 1.00 0.00 H new ATOM 314 N ASP Y 6 59.787 -13.793 -13.945 1.00 0.00 N ATOM 315 CA ASP Y 6 61.218 -13.577 -13.551 1.00 0.00 C ATOM 316 C ASP Y 6 61.503 -12.083 -13.617 1.00 0.00 C ATOM 317 O ASP Y 6 62.611 -11.649 -13.858 1.00 0.00 O ATOM 318 CB ASP Y 6 62.146 -14.311 -14.522 1.00 0.00 C ATOM 319 CG ASP Y 6 61.942 -13.765 -15.936 1.00 0.00 C ATOM 320 OD1 ASP Y 6 60.905 -13.171 -16.176 1.00 0.00 O ATOM 321 OD2 ASP Y 6 62.830 -13.944 -16.754 1.00 0.00 O ATOM 0 H ASP Y 6 59.537 -13.420 -14.861 1.00 0.00 H new ATOM 0 HA ASP Y 6 61.390 -13.960 -12.545 1.00 0.00 H new ATOM 0 HB2 ASP Y 6 63.184 -14.181 -14.217 1.00 0.00 H new ATOM 0 HB3 ASP Y 6 61.939 -15.381 -14.501 1.00 0.00 H new ATOM 326 N TRP Y 7 60.507 -11.283 -13.419 1.00 0.00 N ATOM 327 CA TRP Y 7 60.730 -9.826 -13.496 1.00 0.00 C ATOM 328 C TRP Y 7 61.810 -9.428 -12.471 1.00 0.00 C ATOM 329 O TRP Y 7 62.716 -8.691 -12.778 1.00 0.00 O ATOM 330 CB TRP Y 7 59.403 -9.110 -13.214 1.00 0.00 C ATOM 331 CG TRP Y 7 59.147 -9.114 -11.751 1.00 0.00 C ATOM 332 CD1 TRP Y 7 58.836 -10.200 -11.012 1.00 0.00 C ATOM 333 CD2 TRP Y 7 59.208 -7.996 -10.839 1.00 0.00 C ATOM 334 NE1 TRP Y 7 58.713 -9.814 -9.689 1.00 0.00 N ATOM 335 CE2 TRP Y 7 58.934 -8.458 -9.535 1.00 0.00 C ATOM 336 CE3 TRP Y 7 59.476 -6.633 -11.020 1.00 0.00 C ATOM 337 CZ2 TRP Y 7 58.932 -7.587 -8.446 1.00 0.00 C ATOM 338 CZ3 TRP Y 7 59.469 -5.764 -9.926 1.00 0.00 C ATOM 339 CH2 TRP Y 7 59.201 -6.239 -8.649 1.00 0.00 C ATOM 0 H TRP Y 7 59.552 -11.573 -13.208 1.00 0.00 H new ATOM 0 HA TRP Y 7 61.077 -9.537 -14.488 1.00 0.00 H new ATOM 0 HB2 TRP Y 7 59.442 -8.086 -13.586 1.00 0.00 H new ATOM 0 HB3 TRP Y 7 58.588 -9.609 -13.739 1.00 0.00 H new ATOM 0 HD1 TRP Y 7 58.705 -11.203 -11.390 1.00 0.00 H new ATOM 0 HE1 TRP Y 7 58.488 -10.450 -8.924 1.00 0.00 H new ATOM 0 HE3 TRP Y 7 59.689 -6.253 -12.008 1.00 0.00 H new ATOM 0 HZ2 TRP Y 7 58.723 -7.957 -7.453 1.00 0.00 H new ATOM 0 HZ3 TRP Y 7 59.674 -4.714 -10.075 1.00 0.00 H new ATOM 0 HH2 TRP Y 7 59.202 -5.558 -7.811 1.00 0.00 H new ATOM 350 N ASN Y 8 61.757 -9.927 -11.262 1.00 0.00 N ATOM 351 CA ASN Y 8 62.823 -9.546 -10.285 1.00 0.00 C ATOM 352 C ASN Y 8 64.180 -9.789 -10.949 1.00 0.00 C ATOM 353 O ASN Y 8 65.144 -9.111 -10.678 1.00 0.00 O ATOM 354 CB ASN Y 8 62.711 -10.371 -8.994 1.00 0.00 C ATOM 355 CG ASN Y 8 63.261 -9.566 -7.807 1.00 0.00 C ATOM 356 OD1 ASN Y 8 64.039 -8.650 -7.990 1.00 0.00 O ATOM 357 ND2 ASN Y 8 62.884 -9.870 -6.591 1.00 0.00 N ATOM 0 H ASN Y 8 61.042 -10.566 -10.915 1.00 0.00 H new ATOM 0 HA ASN Y 8 62.711 -8.497 -10.012 1.00 0.00 H new ATOM 0 HB2 ASN Y 8 61.670 -10.637 -8.812 1.00 0.00 H new ATOM 0 HB3 ASN Y 8 63.265 -11.304 -9.099 1.00 0.00 H new ATOM 0 HD21 ASN Y 8 63.243 -9.338 -5.798 1.00 0.00 H new ATOM 0 HD22 ASN Y 8 62.231 -10.638 -6.437 1.00 0.00 H new ATOM 364 N LYS Y 9 64.250 -10.729 -11.855 1.00 0.00 N ATOM 365 CA LYS Y 9 65.537 -10.964 -12.559 1.00 0.00 C ATOM 366 C LYS Y 9 65.905 -9.646 -13.226 1.00 0.00 C ATOM 367 O LYS Y 9 67.059 -9.334 -13.431 1.00 0.00 O ATOM 368 CB LYS Y 9 65.388 -12.061 -13.613 1.00 0.00 C ATOM 369 CG LYS Y 9 66.766 -12.438 -14.141 1.00 0.00 C ATOM 370 CD LYS Y 9 66.627 -13.618 -15.098 1.00 0.00 C ATOM 371 CE LYS Y 9 67.955 -13.850 -15.822 1.00 0.00 C ATOM 372 NZ LYS Y 9 68.131 -12.809 -16.873 1.00 0.00 N ATOM 0 H LYS Y 9 63.479 -11.336 -12.133 1.00 0.00 H new ATOM 0 HA LYS Y 9 66.308 -11.291 -11.861 1.00 0.00 H new ATOM 0 HB2 LYS Y 9 64.900 -12.934 -13.180 1.00 0.00 H new ATOM 0 HB3 LYS Y 9 64.755 -11.714 -14.430 1.00 0.00 H new ATOM 0 HG2 LYS Y 9 67.218 -11.589 -14.654 1.00 0.00 H new ATOM 0 HG3 LYS Y 9 67.427 -12.700 -13.315 1.00 0.00 H new ATOM 0 HD2 LYS Y 9 66.340 -14.514 -14.548 1.00 0.00 H new ATOM 0 HD3 LYS Y 9 65.836 -13.421 -15.822 1.00 0.00 H new ATOM 0 HE2 LYS Y 9 68.781 -13.810 -15.112 1.00 0.00 H new ATOM 0 HE3 LYS Y 9 67.969 -14.843 -16.271 1.00 0.00 H new ATOM 0 HZ1 LYS Y 9 68.874 -13.108 -17.536 1.00 0.00 H new ATOM 0 HZ2 LYS Y 9 67.237 -12.682 -17.389 1.00 0.00 H new ATOM 0 HZ3 LYS Y 9 68.405 -11.910 -16.428 1.00 0.00 H new ATOM 386 N ILE Y 10 64.907 -8.846 -13.519 1.00 0.00 N ATOM 387 CA ILE Y 10 65.158 -7.504 -14.124 1.00 0.00 C ATOM 388 C ILE Y 10 66.216 -6.827 -13.269 1.00 0.00 C ATOM 389 O ILE Y 10 67.123 -6.178 -13.751 1.00 0.00 O ATOM 390 CB ILE Y 10 63.856 -6.668 -14.069 1.00 0.00 C ATOM 391 CG1 ILE Y 10 64.001 -5.393 -14.906 1.00 0.00 C ATOM 392 CG2 ILE Y 10 63.514 -6.253 -12.611 1.00 0.00 C ATOM 393 CD1 ILE Y 10 62.752 -4.521 -14.694 1.00 0.00 C ATOM 0 H ILE Y 10 63.924 -9.069 -13.363 1.00 0.00 H new ATOM 0 HA ILE Y 10 65.481 -7.594 -15.161 1.00 0.00 H new ATOM 0 HB ILE Y 10 63.057 -7.293 -14.467 1.00 0.00 H new ATOM 0 HG12 ILE Y 10 64.898 -4.847 -14.612 1.00 0.00 H new ATOM 0 HG13 ILE Y 10 64.112 -5.644 -15.961 1.00 0.00 H new ATOM 0 HG21 ILE Y 10 62.595 -5.667 -12.606 1.00 0.00 H new ATOM 0 HG22 ILE Y 10 63.379 -7.146 -12.001 1.00 0.00 H new ATOM 0 HG23 ILE Y 10 64.328 -5.654 -12.203 1.00 0.00 H new ATOM 0 HD11 ILE Y 10 62.841 -3.609 -15.284 1.00 0.00 H new ATOM 0 HD12 ILE Y 10 61.866 -5.072 -15.009 1.00 0.00 H new ATOM 0 HD13 ILE Y 10 62.663 -4.263 -13.639 1.00 0.00 H new ATOM 405 N LEU Y 11 66.093 -7.009 -11.988 1.00 0.00 N ATOM 406 CA LEU Y 11 67.077 -6.415 -11.040 1.00 0.00 C ATOM 407 C LEU Y 11 68.423 -7.135 -11.174 1.00 0.00 C ATOM 408 O LEU Y 11 69.471 -6.524 -11.129 1.00 0.00 O ATOM 409 CB LEU Y 11 66.537 -6.553 -9.613 1.00 0.00 C ATOM 410 CG LEU Y 11 67.577 -6.095 -8.589 1.00 0.00 C ATOM 411 CD1 LEU Y 11 68.063 -4.679 -8.920 1.00 0.00 C ATOM 412 CD2 LEU Y 11 66.923 -6.102 -7.204 1.00 0.00 C ATOM 0 H LEU Y 11 65.346 -7.549 -11.550 1.00 0.00 H new ATOM 0 HA LEU Y 11 67.225 -5.360 -11.269 1.00 0.00 H new ATOM 0 HB2 LEU Y 11 65.629 -5.960 -9.505 1.00 0.00 H new ATOM 0 HB3 LEU Y 11 66.265 -7.591 -9.422 1.00 0.00 H new ATOM 0 HG LEU Y 11 68.434 -6.768 -8.610 1.00 0.00 H new ATOM 0 HD11 LEU Y 11 68.803 -4.367 -8.183 1.00 0.00 H new ATOM 0 HD12 LEU Y 11 68.514 -4.672 -9.912 1.00 0.00 H new ATOM 0 HD13 LEU Y 11 67.218 -3.991 -8.901 1.00 0.00 H new ATOM 0 HD21 LEU Y 11 67.648 -5.778 -6.458 1.00 0.00 H new ATOM 0 HD22 LEU Y 11 66.071 -5.422 -7.201 1.00 0.00 H new ATOM 0 HD23 LEU Y 11 66.584 -7.110 -6.967 1.00 0.00 H new ATOM 424 N SER Y 12 68.393 -8.434 -11.333 1.00 0.00 N ATOM 425 CA SER Y 12 69.658 -9.219 -11.464 1.00 0.00 C ATOM 426 C SER Y 12 70.603 -8.883 -10.306 1.00 0.00 C ATOM 427 O SER Y 12 70.673 -9.677 -9.383 1.00 0.00 O ATOM 428 CB SER Y 12 70.336 -8.900 -12.806 1.00 0.00 C ATOM 429 OG SER Y 12 70.086 -7.546 -13.155 1.00 0.00 O ATOM 430 OXT SER Y 12 71.248 -7.850 -10.367 1.00 0.00 O ATOM 0 H SER Y 12 67.538 -8.989 -11.378 1.00 0.00 H new ATOM 0 HA SER Y 12 69.422 -10.283 -11.431 1.00 0.00 H new ATOM 0 HB2 SER Y 12 71.409 -9.075 -12.734 1.00 0.00 H new ATOM 0 HB3 SER Y 12 69.956 -9.563 -13.584 1.00 0.00 H new ATOM 0 HG SER Y 12 70.357 -6.962 -12.416 1.00 0.00 H new ATOM 437 N GLY A 1 50.177 -10.532 1.357 1.00 0.00 N ATOM 438 CA GLY A 1 50.775 -9.138 1.560 1.00 0.00 C ATOM 439 C GLY A 1 50.248 -8.264 2.667 1.00 0.00 C ATOM 440 O GLY A 1 49.247 -7.569 2.526 1.00 0.00 O ATOM 0 H1 GLY A 1 50.875 -11.144 0.887 1.00 0.00 H new ATOM 0 H2 GLY A 1 49.925 -10.939 2.280 1.00 0.00 H new ATOM 0 H3 GLY A 1 49.325 -10.461 0.765 1.00 0.00 H new ATOM 0 HA2 GLY A 1 51.846 -9.261 1.722 1.00 0.00 H new ATOM 0 HA3 GLY A 1 50.655 -8.591 0.625 1.00 0.00 H new ATOM 446 N SER A 2 50.896 -8.286 3.812 1.00 0.00 N ATOM 447 CA SER A 2 50.424 -7.449 4.964 1.00 0.00 C ATOM 448 C SER A 2 51.369 -6.261 5.176 1.00 0.00 C ATOM 449 O SER A 2 51.298 -5.277 4.464 1.00 0.00 O ATOM 450 CB SER A 2 50.372 -8.306 6.230 1.00 0.00 C ATOM 451 OG SER A 2 51.675 -8.789 6.522 1.00 0.00 O ATOM 0 H SER A 2 51.728 -8.846 3.997 1.00 0.00 H new ATOM 0 HA SER A 2 49.427 -7.068 4.744 1.00 0.00 H new ATOM 0 HB2 SER A 2 49.994 -7.718 7.066 1.00 0.00 H new ATOM 0 HB3 SER A 2 49.685 -9.141 6.090 1.00 0.00 H new ATOM 0 HG SER A 2 51.822 -8.768 7.491 1.00 0.00 H new ATOM 457 N GLU A 3 52.209 -6.301 6.180 1.00 0.00 N ATOM 458 CA GLU A 3 53.091 -5.129 6.451 1.00 0.00 C ATOM 459 C GLU A 3 54.001 -4.816 5.260 1.00 0.00 C ATOM 460 O GLU A 3 54.203 -3.667 4.918 1.00 0.00 O ATOM 461 CB GLU A 3 53.964 -5.429 7.675 1.00 0.00 C ATOM 462 CG GLU A 3 53.097 -5.443 8.936 1.00 0.00 C ATOM 463 CD GLU A 3 53.970 -5.781 10.148 1.00 0.00 C ATOM 464 OE1 GLU A 3 54.584 -4.872 10.682 1.00 0.00 O ATOM 465 OE2 GLU A 3 54.010 -6.943 10.520 1.00 0.00 O ATOM 0 H GLU A 3 52.321 -7.089 6.818 1.00 0.00 H new ATOM 0 HA GLU A 3 52.453 -4.263 6.630 1.00 0.00 H new ATOM 0 HB2 GLU A 3 54.460 -6.392 7.553 1.00 0.00 H new ATOM 0 HB3 GLU A 3 54.747 -4.676 7.769 1.00 0.00 H new ATOM 0 HG2 GLU A 3 52.622 -4.472 9.075 1.00 0.00 H new ATOM 0 HG3 GLU A 3 52.298 -6.177 8.833 1.00 0.00 H new ATOM 472 N LEU A 4 54.579 -5.809 4.637 1.00 0.00 N ATOM 473 CA LEU A 4 55.496 -5.516 3.495 1.00 0.00 C ATOM 474 C LEU A 4 54.721 -5.000 2.285 1.00 0.00 C ATOM 475 O LEU A 4 55.166 -4.099 1.603 1.00 0.00 O ATOM 476 CB LEU A 4 56.284 -6.776 3.107 1.00 0.00 C ATOM 477 CG LEU A 4 57.468 -6.960 4.062 1.00 0.00 C ATOM 478 CD1 LEU A 4 58.094 -8.347 3.849 1.00 0.00 C ATOM 479 CD2 LEU A 4 58.526 -5.858 3.809 1.00 0.00 C ATOM 0 H LEU A 4 54.459 -6.796 4.864 1.00 0.00 H new ATOM 0 HA LEU A 4 56.192 -4.740 3.816 1.00 0.00 H new ATOM 0 HB2 LEU A 4 55.634 -7.650 3.146 1.00 0.00 H new ATOM 0 HB3 LEU A 4 56.642 -6.691 2.081 1.00 0.00 H new ATOM 0 HG LEU A 4 57.115 -6.881 5.090 1.00 0.00 H new ATOM 0 HD11 LEU A 4 58.936 -8.475 4.530 1.00 0.00 H new ATOM 0 HD12 LEU A 4 57.348 -9.117 4.046 1.00 0.00 H new ATOM 0 HD13 LEU A 4 58.443 -8.435 2.820 1.00 0.00 H new ATOM 0 HD21 LEU A 4 59.365 -5.995 4.492 1.00 0.00 H new ATOM 0 HD22 LEU A 4 58.881 -5.923 2.780 1.00 0.00 H new ATOM 0 HD23 LEU A 4 58.078 -4.878 3.977 1.00 0.00 H new ATOM 491 N GLU A 5 53.589 -5.561 1.984 1.00 0.00 N ATOM 492 CA GLU A 5 52.855 -5.077 0.787 1.00 0.00 C ATOM 493 C GLU A 5 52.373 -3.650 1.036 1.00 0.00 C ATOM 494 O GLU A 5 52.357 -2.818 0.153 1.00 0.00 O ATOM 495 CB GLU A 5 51.677 -6.005 0.479 1.00 0.00 C ATOM 496 CG GLU A 5 50.939 -5.520 -0.776 1.00 0.00 C ATOM 497 CD GLU A 5 50.006 -4.362 -0.415 1.00 0.00 C ATOM 498 OE1 GLU A 5 49.363 -4.447 0.619 1.00 0.00 O ATOM 499 OE2 GLU A 5 49.947 -3.415 -1.179 1.00 0.00 O ATOM 0 H GLU A 5 53.146 -6.319 2.503 1.00 0.00 H new ATOM 0 HA GLU A 5 53.520 -5.080 -0.077 1.00 0.00 H new ATOM 0 HB2 GLU A 5 52.036 -7.023 0.329 1.00 0.00 H new ATOM 0 HB3 GLU A 5 50.992 -6.030 1.327 1.00 0.00 H new ATOM 0 HG2 GLU A 5 51.658 -5.198 -1.530 1.00 0.00 H new ATOM 0 HG3 GLU A 5 50.366 -6.339 -1.211 1.00 0.00 H new ATOM 506 N THR A 6 51.973 -3.366 2.238 1.00 0.00 N ATOM 507 CA THR A 6 51.489 -2.001 2.567 1.00 0.00 C ATOM 508 C THR A 6 52.590 -0.971 2.310 1.00 0.00 C ATOM 509 O THR A 6 52.368 0.073 1.732 1.00 0.00 O ATOM 510 CB THR A 6 51.145 -1.965 4.058 1.00 0.00 C ATOM 511 OG1 THR A 6 50.132 -2.922 4.335 1.00 0.00 O ATOM 512 CG2 THR A 6 50.647 -0.570 4.428 1.00 0.00 C ATOM 0 H THR A 6 51.960 -4.027 3.015 1.00 0.00 H new ATOM 0 HA THR A 6 50.622 -1.766 1.950 1.00 0.00 H new ATOM 0 HB THR A 6 52.033 -2.201 4.644 1.00 0.00 H new ATOM 0 HG1 THR A 6 50.531 -3.703 4.772 1.00 0.00 H new ATOM 0 HG21 THR A 6 50.401 -0.541 5.490 1.00 0.00 H new ATOM 0 HG22 THR A 6 51.426 0.162 4.216 1.00 0.00 H new ATOM 0 HG23 THR A 6 49.758 -0.334 3.843 1.00 0.00 H new ATOM 520 N ALA A 7 53.775 -1.256 2.780 1.00 0.00 N ATOM 521 CA ALA A 7 54.922 -0.317 2.634 1.00 0.00 C ATOM 522 C ALA A 7 55.424 -0.196 1.189 1.00 0.00 C ATOM 523 O ALA A 7 55.988 0.814 0.824 1.00 0.00 O ATOM 524 CB ALA A 7 56.068 -0.837 3.502 1.00 0.00 C ATOM 0 H ALA A 7 53.999 -2.122 3.271 1.00 0.00 H new ATOM 0 HA ALA A 7 54.582 0.672 2.940 1.00 0.00 H new ATOM 0 HB1 ALA A 7 56.924 -0.167 3.414 1.00 0.00 H new ATOM 0 HB2 ALA A 7 55.746 -0.880 4.542 1.00 0.00 H new ATOM 0 HB3 ALA A 7 56.353 -1.835 3.169 1.00 0.00 H new ATOM 530 N MET A 8 55.266 -1.188 0.361 1.00 0.00 N ATOM 531 CA MET A 8 55.804 -1.039 -1.022 1.00 0.00 C ATOM 532 C MET A 8 54.890 -0.125 -1.839 1.00 0.00 C ATOM 533 O MET A 8 55.344 0.741 -2.563 1.00 0.00 O ATOM 534 CB MET A 8 55.972 -2.427 -1.676 1.00 0.00 C ATOM 535 CG MET A 8 54.654 -2.931 -2.271 1.00 0.00 C ATOM 536 SD MET A 8 54.397 -2.176 -3.900 1.00 0.00 S ATOM 537 CE MET A 8 55.748 -3.005 -4.781 1.00 0.00 C ATOM 0 H MET A 8 54.802 -2.072 0.570 1.00 0.00 H new ATOM 0 HA MET A 8 56.789 -0.574 -0.986 1.00 0.00 H new ATOM 0 HB2 MET A 8 56.728 -2.372 -2.459 1.00 0.00 H new ATOM 0 HB3 MET A 8 56.333 -3.139 -0.934 1.00 0.00 H new ATOM 0 HG2 MET A 8 54.675 -4.017 -2.361 1.00 0.00 H new ATOM 0 HG3 MET A 8 53.825 -2.682 -1.608 1.00 0.00 H new ATOM 0 HE1 MET A 8 56.413 -2.257 -5.213 1.00 0.00 H new ATOM 0 HE2 MET A 8 56.308 -3.629 -4.084 1.00 0.00 H new ATOM 0 HE3 MET A 8 55.336 -3.627 -5.576 1.00 0.00 H new ATOM 547 N GLU A 9 53.608 -0.322 -1.744 1.00 0.00 N ATOM 548 CA GLU A 9 52.665 0.513 -2.524 1.00 0.00 C ATOM 549 C GLU A 9 52.608 1.937 -1.966 1.00 0.00 C ATOM 550 O GLU A 9 52.457 2.887 -2.704 1.00 0.00 O ATOM 551 CB GLU A 9 51.282 -0.125 -2.489 1.00 0.00 C ATOM 552 CG GLU A 9 51.284 -1.410 -3.313 1.00 0.00 C ATOM 553 CD GLU A 9 49.867 -1.985 -3.366 1.00 0.00 C ATOM 554 OE1 GLU A 9 48.988 -1.407 -2.748 1.00 0.00 O ATOM 555 OE2 GLU A 9 49.687 -2.995 -4.024 1.00 0.00 O ATOM 0 H GLU A 9 53.172 -1.031 -1.155 1.00 0.00 H new ATOM 0 HA GLU A 9 53.013 0.572 -3.555 1.00 0.00 H new ATOM 0 HB2 GLU A 9 50.998 -0.343 -1.459 1.00 0.00 H new ATOM 0 HB3 GLU A 9 50.541 0.570 -2.884 1.00 0.00 H new ATOM 0 HG2 GLU A 9 51.643 -1.207 -4.322 1.00 0.00 H new ATOM 0 HG3 GLU A 9 51.966 -2.136 -2.872 1.00 0.00 H new ATOM 562 N THR A 10 52.694 2.109 -0.673 1.00 0.00 N ATOM 563 CA THR A 10 52.607 3.492 -0.130 1.00 0.00 C ATOM 564 C THR A 10 53.764 4.340 -0.680 1.00 0.00 C ATOM 565 O THR A 10 53.523 5.362 -1.278 1.00 0.00 O ATOM 566 CB THR A 10 52.547 3.461 1.410 1.00 0.00 C ATOM 567 OG1 THR A 10 51.689 4.495 1.862 1.00 0.00 O ATOM 568 CG2 THR A 10 53.925 3.639 2.042 1.00 0.00 C ATOM 0 H THR A 10 52.818 1.368 0.016 1.00 0.00 H new ATOM 0 HA THR A 10 51.683 3.967 -0.460 1.00 0.00 H new ATOM 0 HB THR A 10 52.168 2.484 1.710 1.00 0.00 H new ATOM 0 HG1 THR A 10 51.611 5.182 1.168 1.00 0.00 H new ATOM 0 HG21 THR A 10 53.834 3.611 3.128 1.00 0.00 H new ATOM 0 HG22 THR A 10 54.583 2.835 1.712 1.00 0.00 H new ATOM 0 HG23 THR A 10 54.343 4.599 1.738 1.00 0.00 H new ATOM 576 N LEU A 11 55.002 3.939 -0.530 1.00 0.00 N ATOM 577 CA LEU A 11 56.121 4.758 -1.100 1.00 0.00 C ATOM 578 C LEU A 11 55.767 5.114 -2.546 1.00 0.00 C ATOM 579 O LEU A 11 55.970 6.219 -2.990 1.00 0.00 O ATOM 580 CB LEU A 11 57.429 3.932 -1.062 1.00 0.00 C ATOM 581 CG LEU A 11 58.201 4.205 0.239 1.00 0.00 C ATOM 582 CD1 LEU A 11 57.335 3.858 1.445 1.00 0.00 C ATOM 583 CD2 LEU A 11 59.464 3.345 0.278 1.00 0.00 C ATOM 0 H LEU A 11 55.287 3.089 -0.043 1.00 0.00 H new ATOM 0 HA LEU A 11 56.263 5.669 -0.519 1.00 0.00 H new ATOM 0 HB2 LEU A 11 57.197 2.870 -1.138 1.00 0.00 H new ATOM 0 HB3 LEU A 11 58.051 4.185 -1.921 1.00 0.00 H new ATOM 0 HG LEU A 11 58.467 5.261 0.272 1.00 0.00 H new ATOM 0 HD11 LEU A 11 57.891 4.055 2.361 1.00 0.00 H new ATOM 0 HD12 LEU A 11 56.431 4.467 1.431 1.00 0.00 H new ATOM 0 HD13 LEU A 11 57.062 2.803 1.406 1.00 0.00 H new ATOM 0 HD21 LEU A 11 60.009 3.541 1.201 1.00 0.00 H new ATOM 0 HD22 LEU A 11 59.188 2.291 0.236 1.00 0.00 H new ATOM 0 HD23 LEU A 11 60.097 3.589 -0.575 1.00 0.00 H new ATOM 595 N ILE A 12 55.208 4.203 -3.271 1.00 0.00 N ATOM 596 CA ILE A 12 54.814 4.511 -4.671 1.00 0.00 C ATOM 597 C ILE A 12 53.727 5.608 -4.667 1.00 0.00 C ATOM 598 O ILE A 12 53.605 6.374 -5.602 1.00 0.00 O ATOM 599 CB ILE A 12 54.325 3.216 -5.330 1.00 0.00 C ATOM 600 CG1 ILE A 12 55.518 2.265 -5.494 1.00 0.00 C ATOM 601 CG2 ILE A 12 53.737 3.508 -6.699 1.00 0.00 C ATOM 602 CD1 ILE A 12 55.035 0.859 -5.877 1.00 0.00 C ATOM 0 H ILE A 12 55.003 3.253 -2.960 1.00 0.00 H new ATOM 0 HA ILE A 12 55.659 4.892 -5.245 1.00 0.00 H new ATOM 0 HB ILE A 12 53.557 2.764 -4.703 1.00 0.00 H new ATOM 0 HG12 ILE A 12 56.192 2.646 -6.261 1.00 0.00 H new ATOM 0 HG13 ILE A 12 56.086 2.220 -4.565 1.00 0.00 H new ATOM 0 HG21 ILE A 12 53.394 2.578 -7.154 1.00 0.00 H new ATOM 0 HG22 ILE A 12 52.895 4.193 -6.595 1.00 0.00 H new ATOM 0 HG23 ILE A 12 54.498 3.963 -7.333 1.00 0.00 H new ATOM 0 HD11 ILE A 12 55.894 0.197 -5.989 1.00 0.00 H new ATOM 0 HD12 ILE A 12 54.380 0.474 -5.096 1.00 0.00 H new ATOM 0 HD13 ILE A 12 54.488 0.906 -6.818 1.00 0.00 H new ATOM 614 N ASN A 13 52.947 5.690 -3.618 1.00 0.00 N ATOM 615 CA ASN A 13 51.869 6.735 -3.530 1.00 0.00 C ATOM 616 C ASN A 13 52.440 8.131 -3.203 1.00 0.00 C ATOM 617 O ASN A 13 52.201 9.093 -3.904 1.00 0.00 O ATOM 618 CB ASN A 13 50.918 6.346 -2.396 1.00 0.00 C ATOM 619 CG ASN A 13 49.681 7.246 -2.435 1.00 0.00 C ATOM 620 OD1 ASN A 13 49.666 8.247 -3.126 1.00 0.00 O ATOM 621 ND2 ASN A 13 48.636 6.933 -1.718 1.00 0.00 N ATOM 0 H ASN A 13 53.008 5.073 -2.808 1.00 0.00 H new ATOM 0 HA ASN A 13 51.366 6.783 -4.496 1.00 0.00 H new ATOM 0 HB2 ASN A 13 50.624 5.301 -2.496 1.00 0.00 H new ATOM 0 HB3 ASN A 13 51.422 6.444 -1.435 1.00 0.00 H new ATOM 0 HD21 ASN A 13 47.807 7.528 -1.737 1.00 0.00 H new ATOM 0 HD22 ASN A 13 48.648 6.094 -1.138 1.00 0.00 H new ATOM 628 N VAL A 14 53.160 8.239 -2.117 1.00 0.00 N ATOM 629 CA VAL A 14 53.724 9.545 -1.685 1.00 0.00 C ATOM 630 C VAL A 14 54.702 10.079 -2.738 1.00 0.00 C ATOM 631 O VAL A 14 54.666 11.237 -3.102 1.00 0.00 O ATOM 632 CB VAL A 14 54.422 9.324 -0.328 1.00 0.00 C ATOM 633 CG1 VAL A 14 55.829 8.742 -0.524 1.00 0.00 C ATOM 634 CG2 VAL A 14 54.494 10.642 0.462 1.00 0.00 C ATOM 0 H VAL A 14 53.383 7.458 -1.501 1.00 0.00 H new ATOM 0 HA VAL A 14 52.936 10.291 -1.577 1.00 0.00 H new ATOM 0 HB VAL A 14 53.832 8.607 0.243 1.00 0.00 H new ATOM 0 HG11 VAL A 14 56.301 8.595 0.448 1.00 0.00 H new ATOM 0 HG12 VAL A 14 55.758 7.785 -1.041 1.00 0.00 H new ATOM 0 HG13 VAL A 14 56.429 9.432 -1.118 1.00 0.00 H new ATOM 0 HG21 VAL A 14 54.990 10.467 1.417 1.00 0.00 H new ATOM 0 HG22 VAL A 14 55.058 11.379 -0.110 1.00 0.00 H new ATOM 0 HG23 VAL A 14 53.485 11.015 0.640 1.00 0.00 H new ATOM 644 N PHE A 15 55.577 9.245 -3.223 1.00 0.00 N ATOM 645 CA PHE A 15 56.564 9.711 -4.243 1.00 0.00 C ATOM 646 C PHE A 15 55.825 10.231 -5.487 1.00 0.00 C ATOM 647 O PHE A 15 56.204 11.227 -6.056 1.00 0.00 O ATOM 648 CB PHE A 15 57.523 8.566 -4.635 1.00 0.00 C ATOM 649 CG PHE A 15 58.632 8.374 -3.614 1.00 0.00 C ATOM 650 CD1 PHE A 15 59.464 9.445 -3.256 1.00 0.00 C ATOM 651 CD2 PHE A 15 58.842 7.110 -3.037 1.00 0.00 C ATOM 652 CE1 PHE A 15 60.488 9.251 -2.325 1.00 0.00 C ATOM 653 CE2 PHE A 15 59.867 6.923 -2.110 1.00 0.00 C ATOM 654 CZ PHE A 15 60.687 7.992 -1.751 1.00 0.00 C ATOM 0 H PHE A 15 55.654 8.262 -2.960 1.00 0.00 H new ATOM 0 HA PHE A 15 57.153 10.521 -3.813 1.00 0.00 H new ATOM 0 HB2 PHE A 15 56.958 7.639 -4.735 1.00 0.00 H new ATOM 0 HB3 PHE A 15 57.961 8.779 -5.610 1.00 0.00 H new ATOM 0 HD1 PHE A 15 59.313 10.418 -3.699 1.00 0.00 H new ATOM 0 HD2 PHE A 15 58.207 6.281 -3.312 1.00 0.00 H new ATOM 0 HE1 PHE A 15 61.127 10.076 -2.048 1.00 0.00 H new ATOM 0 HE2 PHE A 15 60.026 5.950 -1.670 1.00 0.00 H new ATOM 0 HZ PHE A 15 61.477 7.847 -1.029 1.00 0.00 H new ATOM 664 N HIS A 16 54.782 9.599 -5.915 1.00 0.00 N ATOM 665 CA HIS A 16 54.064 10.119 -7.118 1.00 0.00 C ATOM 666 C HIS A 16 53.559 11.547 -6.850 1.00 0.00 C ATOM 667 O HIS A 16 53.549 12.387 -7.729 1.00 0.00 O ATOM 668 CB HIS A 16 52.867 9.210 -7.446 1.00 0.00 C ATOM 669 CG HIS A 16 53.323 7.973 -8.188 1.00 0.00 C ATOM 670 ND1 HIS A 16 52.713 6.739 -7.998 1.00 0.00 N ATOM 671 CD2 HIS A 16 54.291 7.763 -9.148 1.00 0.00 C ATOM 672 CE1 HIS A 16 53.307 5.858 -8.825 1.00 0.00 C ATOM 673 NE2 HIS A 16 54.273 6.429 -9.541 1.00 0.00 N ATOM 0 H HIS A 16 54.391 8.754 -5.497 1.00 0.00 H new ATOM 0 HA HIS A 16 54.754 10.131 -7.962 1.00 0.00 H new ATOM 0 HB2 HIS A 16 52.360 8.922 -6.525 1.00 0.00 H new ATOM 0 HB3 HIS A 16 52.143 9.757 -8.051 1.00 0.00 H new ATOM 0 HD2 HIS A 16 54.960 8.518 -9.535 1.00 0.00 H new ATOM 0 HE1 HIS A 16 53.033 4.816 -8.898 1.00 0.00 H new ATOM 0 HE2 HIS A 16 54.874 5.982 -10.233 1.00 0.00 H new ATOM 682 N ALA A 17 53.097 11.803 -5.662 1.00 0.00 N ATOM 683 CA ALA A 17 52.533 13.147 -5.330 1.00 0.00 C ATOM 684 C ALA A 17 53.534 14.301 -5.521 1.00 0.00 C ATOM 685 O ALA A 17 53.250 15.259 -6.210 1.00 0.00 O ATOM 686 CB ALA A 17 52.102 13.132 -3.864 1.00 0.00 C ATOM 0 H ALA A 17 53.084 11.133 -4.893 1.00 0.00 H new ATOM 0 HA ALA A 17 51.702 13.325 -6.013 1.00 0.00 H new ATOM 0 HB1 ALA A 17 51.686 14.104 -3.597 1.00 0.00 H new ATOM 0 HB2 ALA A 17 51.346 12.361 -3.715 1.00 0.00 H new ATOM 0 HB3 ALA A 17 52.965 12.921 -3.233 1.00 0.00 H new ATOM 692 N HIS A 18 54.674 14.254 -4.880 1.00 0.00 N ATOM 693 CA HIS A 18 55.640 15.397 -5.000 1.00 0.00 C ATOM 694 C HIS A 18 56.495 15.284 -6.268 1.00 0.00 C ATOM 695 O HIS A 18 56.772 16.259 -6.936 1.00 0.00 O ATOM 696 CB HIS A 18 56.553 15.397 -3.772 1.00 0.00 C ATOM 697 CG HIS A 18 55.759 15.801 -2.559 1.00 0.00 C ATOM 698 ND1 HIS A 18 55.649 17.125 -2.157 1.00 0.00 N ATOM 699 CD2 HIS A 18 55.022 15.071 -1.659 1.00 0.00 C ATOM 700 CE1 HIS A 18 54.869 17.151 -1.060 1.00 0.00 C ATOM 701 NE2 HIS A 18 54.465 15.927 -0.717 1.00 0.00 N ATOM 0 H HIS A 18 54.979 13.484 -4.284 1.00 0.00 H new ATOM 0 HA HIS A 18 55.072 16.325 -5.062 1.00 0.00 H new ATOM 0 HB2 HIS A 18 56.983 14.406 -3.625 1.00 0.00 H new ATOM 0 HB3 HIS A 18 57.384 16.086 -3.923 1.00 0.00 H new ATOM 0 HD2 HIS A 18 54.895 13.999 -1.680 1.00 0.00 H new ATOM 0 HE1 HIS A 18 54.604 18.051 -0.525 1.00 0.00 H new ATOM 0 HE2 HIS A 18 53.871 15.672 0.072 1.00 0.00 H new ATOM 710 N SER A 19 56.939 14.105 -6.569 1.00 0.00 N ATOM 711 CA SER A 19 57.816 13.868 -7.754 1.00 0.00 C ATOM 712 C SER A 19 57.156 14.253 -9.082 1.00 0.00 C ATOM 713 O SER A 19 57.830 14.665 -10.005 1.00 0.00 O ATOM 714 CB SER A 19 58.131 12.375 -7.818 1.00 0.00 C ATOM 715 OG SER A 19 57.064 11.703 -8.471 1.00 0.00 O ATOM 0 H SER A 19 56.728 13.265 -6.030 1.00 0.00 H new ATOM 0 HA SER A 19 58.703 14.488 -7.628 1.00 0.00 H new ATOM 0 HB2 SER A 19 59.065 12.210 -8.356 1.00 0.00 H new ATOM 0 HB3 SER A 19 58.268 11.976 -6.813 1.00 0.00 H new ATOM 0 HG SER A 19 56.378 11.463 -7.814 1.00 0.00 H new ATOM 721 N GLY A 20 55.864 14.085 -9.218 1.00 0.00 N ATOM 722 CA GLY A 20 55.199 14.400 -10.524 1.00 0.00 C ATOM 723 C GLY A 20 54.500 15.750 -10.469 1.00 0.00 C ATOM 724 O GLY A 20 53.744 16.088 -11.359 1.00 0.00 O ATOM 0 H GLY A 20 55.241 13.745 -8.485 1.00 0.00 H new ATOM 0 HA2 GLY A 20 55.941 14.403 -11.322 1.00 0.00 H new ATOM 0 HA3 GLY A 20 54.475 13.621 -10.765 1.00 0.00 H new ATOM 728 N LYS A 21 54.725 16.525 -9.435 1.00 0.00 N ATOM 729 CA LYS A 21 54.040 17.860 -9.337 1.00 0.00 C ATOM 730 C LYS A 21 55.077 18.970 -9.208 1.00 0.00 C ATOM 731 O LYS A 21 55.280 19.742 -10.126 1.00 0.00 O ATOM 732 CB LYS A 21 53.109 17.848 -8.129 1.00 0.00 C ATOM 733 CG LYS A 21 52.213 19.092 -8.138 1.00 0.00 C ATOM 734 CD LYS A 21 51.085 18.929 -7.108 1.00 0.00 C ATOM 735 CE LYS A 21 51.616 19.176 -5.691 1.00 0.00 C ATOM 736 NZ LYS A 21 52.206 20.542 -5.611 1.00 0.00 N ATOM 0 H LYS A 21 55.347 16.297 -8.659 1.00 0.00 H new ATOM 0 HA LYS A 21 53.456 18.046 -10.239 1.00 0.00 H new ATOM 0 HB2 LYS A 21 52.494 16.948 -8.144 1.00 0.00 H new ATOM 0 HB3 LYS A 21 53.694 17.819 -7.210 1.00 0.00 H new ATOM 0 HG2 LYS A 21 52.804 19.978 -7.907 1.00 0.00 H new ATOM 0 HG3 LYS A 21 51.791 19.240 -9.132 1.00 0.00 H new ATOM 0 HD2 LYS A 21 50.279 19.629 -7.328 1.00 0.00 H new ATOM 0 HD3 LYS A 21 50.664 17.926 -7.176 1.00 0.00 H new ATOM 0 HE2 LYS A 21 50.808 19.074 -4.966 1.00 0.00 H new ATOM 0 HE3 LYS A 21 52.368 18.428 -5.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 53.206 20.473 -5.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 52.136 21.005 -6.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 51.688 21.103 -4.904 1.00 0.00 H new ATOM 750 N GLU A 22 55.739 19.070 -8.100 1.00 0.00 N ATOM 751 CA GLU A 22 56.758 20.146 -7.962 1.00 0.00 C ATOM 752 C GLU A 22 58.039 19.729 -8.694 1.00 0.00 C ATOM 753 O GLU A 22 59.120 19.784 -8.143 1.00 0.00 O ATOM 754 CB GLU A 22 57.055 20.383 -6.474 1.00 0.00 C ATOM 755 CG GLU A 22 55.871 21.101 -5.822 1.00 0.00 C ATOM 756 CD GLU A 22 55.793 22.540 -6.336 1.00 0.00 C ATOM 757 OE1 GLU A 22 56.823 23.065 -6.724 1.00 0.00 O ATOM 758 OE2 GLU A 22 54.705 23.093 -6.333 1.00 0.00 O ATOM 0 H GLU A 22 55.625 18.463 -7.288 1.00 0.00 H new ATOM 0 HA GLU A 22 56.380 21.070 -8.400 1.00 0.00 H new ATOM 0 HB2 GLU A 22 57.237 19.432 -5.973 1.00 0.00 H new ATOM 0 HB3 GLU A 22 57.960 20.980 -6.364 1.00 0.00 H new ATOM 0 HG2 GLU A 22 54.944 20.573 -6.048 1.00 0.00 H new ATOM 0 HG3 GLU A 22 55.984 21.098 -4.738 1.00 0.00 H new ATOM 765 N GLY A 23 57.933 19.321 -9.941 1.00 0.00 N ATOM 766 CA GLY A 23 59.162 18.918 -10.691 1.00 0.00 C ATOM 767 C GLY A 23 58.815 18.246 -12.026 1.00 0.00 C ATOM 768 O GLY A 23 57.889 18.629 -12.714 1.00 0.00 O ATOM 0 H GLY A 23 57.059 19.252 -10.462 1.00 0.00 H new ATOM 0 HA2 GLY A 23 59.781 19.796 -10.875 1.00 0.00 H new ATOM 0 HA3 GLY A 23 59.753 18.234 -10.082 1.00 0.00 H new ATOM 772 N ASP A 24 59.579 17.244 -12.392 1.00 0.00 N ATOM 773 CA ASP A 24 59.344 16.525 -13.683 1.00 0.00 C ATOM 774 C ASP A 24 58.267 15.455 -13.523 1.00 0.00 C ATOM 775 O ASP A 24 57.979 14.998 -12.435 1.00 0.00 O ATOM 776 CB ASP A 24 60.638 15.851 -14.133 1.00 0.00 C ATOM 777 CG ASP A 24 61.652 16.910 -14.571 1.00 0.00 C ATOM 778 OD1 ASP A 24 61.232 18.017 -14.864 1.00 0.00 O ATOM 779 OD2 ASP A 24 62.829 16.594 -14.615 1.00 0.00 O ATOM 0 H ASP A 24 60.364 16.891 -11.844 1.00 0.00 H new ATOM 0 HA ASP A 24 59.015 17.254 -14.424 1.00 0.00 H new ATOM 0 HB2 ASP A 24 61.050 15.255 -13.319 1.00 0.00 H new ATOM 0 HB3 ASP A 24 60.435 15.167 -14.957 1.00 0.00 H new ATOM 784 N LYS A 25 57.663 15.067 -14.613 1.00 0.00 N ATOM 785 CA LYS A 25 56.587 14.039 -14.562 1.00 0.00 C ATOM 786 C LYS A 25 57.048 12.791 -13.809 1.00 0.00 C ATOM 787 O LYS A 25 56.437 12.397 -12.834 1.00 0.00 O ATOM 788 CB LYS A 25 56.221 13.621 -15.988 1.00 0.00 C ATOM 789 CG LYS A 25 55.722 14.825 -16.791 1.00 0.00 C ATOM 790 CD LYS A 25 54.262 15.134 -16.439 1.00 0.00 C ATOM 791 CE LYS A 25 53.731 16.227 -17.368 1.00 0.00 C ATOM 792 NZ LYS A 25 54.201 17.558 -16.889 1.00 0.00 N ATOM 0 H LYS A 25 57.872 15.423 -15.546 1.00 0.00 H new ATOM 0 HA LYS A 25 55.731 14.474 -14.046 1.00 0.00 H new ATOM 0 HB2 LYS A 25 57.091 13.185 -16.479 1.00 0.00 H new ATOM 0 HB3 LYS A 25 55.450 12.851 -15.960 1.00 0.00 H new ATOM 0 HG2 LYS A 25 56.345 15.694 -16.581 1.00 0.00 H new ATOM 0 HG3 LYS A 25 55.810 14.620 -17.858 1.00 0.00 H new ATOM 0 HD2 LYS A 25 53.655 14.234 -16.536 1.00 0.00 H new ATOM 0 HD3 LYS A 25 54.188 15.457 -15.401 1.00 0.00 H new ATOM 0 HE2 LYS A 25 54.077 16.053 -18.387 1.00 0.00 H new ATOM 0 HE3 LYS A 25 52.642 16.201 -17.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 53.840 18.301 -17.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 53.851 17.723 -15.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 55.241 17.579 -16.888 1.00 0.00 H new ATOM 806 N TYR A 26 58.090 12.137 -14.271 1.00 0.00 N ATOM 807 CA TYR A 26 58.560 10.871 -13.600 1.00 0.00 C ATOM 808 C TYR A 26 59.958 11.030 -12.990 1.00 0.00 C ATOM 809 O TYR A 26 60.676 10.062 -12.831 1.00 0.00 O ATOM 810 CB TYR A 26 58.614 9.750 -14.640 1.00 0.00 C ATOM 811 CG TYR A 26 57.224 9.468 -15.153 1.00 0.00 C ATOM 812 CD1 TYR A 26 56.417 8.532 -14.499 1.00 0.00 C ATOM 813 CD2 TYR A 26 56.746 10.138 -16.284 1.00 0.00 C ATOM 814 CE1 TYR A 26 55.127 8.266 -14.976 1.00 0.00 C ATOM 815 CE2 TYR A 26 55.458 9.873 -16.761 1.00 0.00 C ATOM 816 CZ TYR A 26 54.649 8.937 -16.108 1.00 0.00 C ATOM 817 OH TYR A 26 53.378 8.677 -16.578 1.00 0.00 O ATOM 0 H TYR A 26 58.638 12.422 -15.083 1.00 0.00 H new ATOM 0 HA TYR A 26 57.859 10.639 -12.798 1.00 0.00 H new ATOM 0 HB2 TYR A 26 59.266 10.037 -15.465 1.00 0.00 H new ATOM 0 HB3 TYR A 26 59.039 8.849 -14.197 1.00 0.00 H new ATOM 0 HD1 TYR A 26 56.788 8.014 -13.627 1.00 0.00 H new ATOM 0 HD2 TYR A 26 57.371 10.860 -16.789 1.00 0.00 H new ATOM 0 HE1 TYR A 26 54.502 7.544 -14.471 1.00 0.00 H new ATOM 0 HE2 TYR A 26 55.088 10.391 -17.633 1.00 0.00 H new ATOM 0 HH TYR A 26 53.203 9.228 -17.369 1.00 0.00 H new ATOM 827 N LYS A 27 60.353 12.220 -12.627 1.00 0.00 N ATOM 828 CA LYS A 27 61.701 12.403 -12.007 1.00 0.00 C ATOM 829 C LYS A 27 61.580 13.420 -10.881 1.00 0.00 C ATOM 830 O LYS A 27 60.778 14.332 -10.916 1.00 0.00 O ATOM 831 CB LYS A 27 62.715 12.870 -13.072 1.00 0.00 C ATOM 832 CG LYS A 27 64.053 12.160 -12.849 1.00 0.00 C ATOM 833 CD LYS A 27 65.075 12.669 -13.857 1.00 0.00 C ATOM 834 CE LYS A 27 66.288 11.747 -13.869 1.00 0.00 C ATOM 835 NZ LYS A 27 67.207 12.160 -14.967 1.00 0.00 N ATOM 0 H LYS A 27 59.804 13.073 -12.732 1.00 0.00 H new ATOM 0 HA LYS A 27 62.062 11.458 -11.600 1.00 0.00 H new ATOM 0 HB2 LYS A 27 62.337 12.651 -14.070 1.00 0.00 H new ATOM 0 HB3 LYS A 27 62.850 13.950 -13.012 1.00 0.00 H new ATOM 0 HG2 LYS A 27 64.407 12.340 -11.834 1.00 0.00 H new ATOM 0 HG3 LYS A 27 63.927 11.083 -12.956 1.00 0.00 H new ATOM 0 HD2 LYS A 27 64.629 12.712 -14.851 1.00 0.00 H new ATOM 0 HD3 LYS A 27 65.380 13.683 -13.600 1.00 0.00 H new ATOM 0 HE2 LYS A 27 66.804 11.793 -12.910 1.00 0.00 H new ATOM 0 HE3 LYS A 27 65.973 10.713 -14.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 68.037 11.533 -14.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 66.710 12.095 -15.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 67.516 13.141 -14.811 1.00 0.00 H new ATOM 849 N LEU A 28 62.357 13.226 -9.865 1.00 0.00 N ATOM 850 CA LEU A 28 62.313 14.114 -8.677 1.00 0.00 C ATOM 851 C LEU A 28 63.369 15.220 -8.821 1.00 0.00 C ATOM 852 O LEU A 28 64.245 15.138 -9.641 1.00 0.00 O ATOM 853 CB LEU A 28 62.599 13.228 -7.455 1.00 0.00 C ATOM 854 CG LEU A 28 61.902 13.763 -6.172 1.00 0.00 C ATOM 855 CD1 LEU A 28 61.082 12.658 -5.509 1.00 0.00 C ATOM 856 CD2 LEU A 28 62.947 14.251 -5.172 1.00 0.00 C ATOM 0 H LEU A 28 63.039 12.470 -9.804 1.00 0.00 H new ATOM 0 HA LEU A 28 61.344 14.602 -8.571 1.00 0.00 H new ATOM 0 HB2 LEU A 28 62.258 12.212 -7.656 1.00 0.00 H new ATOM 0 HB3 LEU A 28 63.675 13.176 -7.288 1.00 0.00 H new ATOM 0 HG LEU A 28 61.247 14.585 -6.462 1.00 0.00 H new ATOM 0 HD11 LEU A 28 60.601 13.050 -4.613 1.00 0.00 H new ATOM 0 HD12 LEU A 28 60.321 12.303 -6.204 1.00 0.00 H new ATOM 0 HD13 LEU A 28 61.738 11.831 -5.237 1.00 0.00 H new ATOM 0 HD21 LEU A 28 62.448 14.624 -4.277 1.00 0.00 H new ATOM 0 HD22 LEU A 28 63.606 13.426 -4.903 1.00 0.00 H new ATOM 0 HD23 LEU A 28 63.534 15.053 -5.621 1.00 0.00 H new ATOM 868 N SER A 29 63.281 16.257 -8.029 1.00 0.00 N ATOM 869 CA SER A 29 64.278 17.376 -8.115 1.00 0.00 C ATOM 870 C SER A 29 64.805 17.749 -6.733 1.00 0.00 C ATOM 871 O SER A 29 64.220 17.426 -5.719 1.00 0.00 O ATOM 872 CB SER A 29 63.631 18.599 -8.766 1.00 0.00 C ATOM 873 OG SER A 29 63.291 18.292 -10.112 1.00 0.00 O ATOM 0 H SER A 29 62.558 16.381 -7.320 1.00 0.00 H new ATOM 0 HA SER A 29 65.117 17.038 -8.723 1.00 0.00 H new ATOM 0 HB2 SER A 29 62.739 18.891 -8.211 1.00 0.00 H new ATOM 0 HB3 SER A 29 64.316 19.446 -8.736 1.00 0.00 H new ATOM 0 HG SER A 29 62.449 17.791 -10.131 1.00 0.00 H new ATOM 879 N LYS A 30 65.918 18.441 -6.694 1.00 0.00 N ATOM 880 CA LYS A 30 66.494 18.852 -5.374 1.00 0.00 C ATOM 881 C LYS A 30 65.418 19.466 -4.462 1.00 0.00 C ATOM 882 O LYS A 30 65.441 19.260 -3.271 1.00 0.00 O ATOM 883 CB LYS A 30 67.609 19.885 -5.624 1.00 0.00 C ATOM 884 CG LYS A 30 68.273 20.346 -4.306 1.00 0.00 C ATOM 885 CD LYS A 30 69.399 19.388 -3.917 1.00 0.00 C ATOM 886 CE LYS A 30 70.076 19.893 -2.642 1.00 0.00 C ATOM 887 NZ LYS A 30 70.887 21.104 -2.960 1.00 0.00 N ATOM 0 H LYS A 30 66.450 18.737 -7.512 1.00 0.00 H new ATOM 0 HA LYS A 30 66.894 17.970 -4.874 1.00 0.00 H new ATOM 0 HB2 LYS A 30 68.365 19.452 -6.279 1.00 0.00 H new ATOM 0 HB3 LYS A 30 67.194 20.749 -6.143 1.00 0.00 H new ATOM 0 HG2 LYS A 30 68.669 21.355 -4.423 1.00 0.00 H new ATOM 0 HG3 LYS A 30 67.529 20.386 -3.510 1.00 0.00 H new ATOM 0 HD2 LYS A 30 69.001 18.386 -3.758 1.00 0.00 H new ATOM 0 HD3 LYS A 30 70.127 19.317 -4.725 1.00 0.00 H new ATOM 0 HE2 LYS A 30 69.326 20.132 -1.888 1.00 0.00 H new ATOM 0 HE3 LYS A 30 70.713 19.115 -2.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 71.552 21.290 -2.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 71.418 20.945 -3.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 70.257 21.922 -3.080 1.00 0.00 H new ATOM 901 N LYS A 31 64.500 20.240 -4.962 1.00 0.00 N ATOM 902 CA LYS A 31 63.490 20.848 -4.034 1.00 0.00 C ATOM 903 C LYS A 31 62.395 19.827 -3.694 1.00 0.00 C ATOM 904 O LYS A 31 61.775 19.892 -2.651 1.00 0.00 O ATOM 905 CB LYS A 31 62.888 22.104 -4.685 1.00 0.00 C ATOM 906 CG LYS A 31 61.493 22.391 -4.117 1.00 0.00 C ATOM 907 CD LYS A 31 61.032 23.770 -4.550 1.00 0.00 C ATOM 908 CE LYS A 31 61.052 23.880 -6.078 1.00 0.00 C ATOM 909 NZ LYS A 31 60.185 25.016 -6.503 1.00 0.00 N ATOM 0 H LYS A 31 64.399 20.479 -5.948 1.00 0.00 H new ATOM 0 HA LYS A 31 63.979 21.135 -3.103 1.00 0.00 H new ATOM 0 HB2 LYS A 31 63.541 22.959 -4.510 1.00 0.00 H new ATOM 0 HB3 LYS A 31 62.826 21.966 -5.764 1.00 0.00 H new ATOM 0 HG2 LYS A 31 60.787 21.637 -4.464 1.00 0.00 H new ATOM 0 HG3 LYS A 31 61.514 22.330 -3.029 1.00 0.00 H new ATOM 0 HD2 LYS A 31 60.025 23.958 -4.178 1.00 0.00 H new ATOM 0 HD3 LYS A 31 61.680 24.531 -4.115 1.00 0.00 H new ATOM 0 HE2 LYS A 31 62.072 24.035 -6.429 1.00 0.00 H new ATOM 0 HE3 LYS A 31 60.699 22.951 -6.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 60.197 25.093 -7.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 59.211 24.849 -6.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 60.542 25.900 -6.086 1.00 0.00 H new ATOM 923 N GLU A 32 62.150 18.904 -4.559 1.00 0.00 N ATOM 924 CA GLU A 32 61.090 17.898 -4.280 1.00 0.00 C ATOM 925 C GLU A 32 61.524 16.967 -3.142 1.00 0.00 C ATOM 926 O GLU A 32 60.734 16.605 -2.294 1.00 0.00 O ATOM 927 CB GLU A 32 60.847 17.074 -5.522 1.00 0.00 C ATOM 928 CG GLU A 32 60.203 17.945 -6.593 1.00 0.00 C ATOM 929 CD GLU A 32 59.964 17.104 -7.841 1.00 0.00 C ATOM 930 OE1 GLU A 32 60.914 16.881 -8.574 1.00 0.00 O ATOM 931 OE2 GLU A 32 58.831 16.708 -8.056 1.00 0.00 O ATOM 0 H GLU A 32 62.633 18.795 -5.451 1.00 0.00 H new ATOM 0 HA GLU A 32 60.178 18.419 -3.988 1.00 0.00 H new ATOM 0 HB2 GLU A 32 61.788 16.664 -5.889 1.00 0.00 H new ATOM 0 HB3 GLU A 32 60.200 16.228 -5.289 1.00 0.00 H new ATOM 0 HG2 GLU A 32 59.261 18.354 -6.229 1.00 0.00 H new ATOM 0 HG3 GLU A 32 60.848 18.792 -6.828 1.00 0.00 H new ATOM 938 N LEU A 33 62.772 16.570 -3.113 1.00 0.00 N ATOM 939 CA LEU A 33 63.231 15.661 -2.013 1.00 0.00 C ATOM 940 C LEU A 33 63.197 16.375 -0.671 1.00 0.00 C ATOM 941 O LEU A 33 62.832 15.811 0.340 1.00 0.00 O ATOM 942 CB LEU A 33 64.664 15.146 -2.295 1.00 0.00 C ATOM 943 CG LEU A 33 65.741 16.244 -2.224 1.00 0.00 C ATOM 944 CD1 LEU A 33 66.422 16.283 -0.848 1.00 0.00 C ATOM 945 CD2 LEU A 33 66.826 15.930 -3.253 1.00 0.00 C ATOM 0 H LEU A 33 63.486 16.831 -3.793 1.00 0.00 H new ATOM 0 HA LEU A 33 62.549 14.811 -1.975 1.00 0.00 H new ATOM 0 HB2 LEU A 33 64.907 14.364 -1.576 1.00 0.00 H new ATOM 0 HB3 LEU A 33 64.688 14.689 -3.284 1.00 0.00 H new ATOM 0 HG LEU A 33 65.255 17.201 -2.413 1.00 0.00 H new ATOM 0 HD11 LEU A 33 67.176 17.070 -0.837 1.00 0.00 H new ATOM 0 HD12 LEU A 33 65.676 16.484 -0.079 1.00 0.00 H new ATOM 0 HD13 LEU A 33 66.898 15.323 -0.650 1.00 0.00 H new ATOM 0 HD21 LEU A 33 67.597 16.700 -3.215 1.00 0.00 H new ATOM 0 HD22 LEU A 33 67.270 14.960 -3.029 1.00 0.00 H new ATOM 0 HD23 LEU A 33 66.386 15.906 -4.250 1.00 0.00 H new ATOM 957 N LYS A 34 63.607 17.613 -0.655 1.00 0.00 N ATOM 958 CA LYS A 34 63.634 18.373 0.636 1.00 0.00 C ATOM 959 C LYS A 34 62.238 18.482 1.277 1.00 0.00 C ATOM 960 O LYS A 34 62.106 18.409 2.481 1.00 0.00 O ATOM 961 CB LYS A 34 64.175 19.792 0.399 1.00 0.00 C ATOM 962 CG LYS A 34 65.679 19.747 0.046 1.00 0.00 C ATOM 963 CD LYS A 34 66.383 21.028 0.522 1.00 0.00 C ATOM 964 CE LYS A 34 66.544 21.029 2.054 1.00 0.00 C ATOM 965 NZ LYS A 34 67.725 21.859 2.420 1.00 0.00 N ATOM 0 H LYS A 34 63.924 18.133 -1.473 1.00 0.00 H new ATOM 0 HA LYS A 34 64.283 17.821 1.316 1.00 0.00 H new ATOM 0 HB2 LYS A 34 63.620 20.269 -0.409 1.00 0.00 H new ATOM 0 HB3 LYS A 34 64.023 20.399 1.291 1.00 0.00 H new ATOM 0 HG2 LYS A 34 66.142 18.877 0.511 1.00 0.00 H new ATOM 0 HG3 LYS A 34 65.802 19.636 -1.031 1.00 0.00 H new ATOM 0 HD2 LYS A 34 67.362 21.107 0.049 1.00 0.00 H new ATOM 0 HD3 LYS A 34 65.808 21.901 0.212 1.00 0.00 H new ATOM 0 HE2 LYS A 34 65.645 21.425 2.526 1.00 0.00 H new ATOM 0 HE3 LYS A 34 66.673 20.010 2.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 68.138 21.503 3.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 68.435 21.807 1.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 67.428 22.847 2.549 1.00 0.00 H new ATOM 979 N ASP A 35 61.207 18.695 0.509 1.00 0.00 N ATOM 980 CA ASP A 35 59.845 18.851 1.108 1.00 0.00 C ATOM 981 C ASP A 35 59.220 17.489 1.421 1.00 0.00 C ATOM 982 O ASP A 35 58.496 17.343 2.384 1.00 0.00 O ATOM 983 CB ASP A 35 58.944 19.633 0.142 1.00 0.00 C ATOM 984 CG ASP A 35 58.557 18.752 -1.050 1.00 0.00 C ATOM 985 OD1 ASP A 35 57.884 17.758 -0.833 1.00 0.00 O ATOM 986 OD2 ASP A 35 58.941 19.089 -2.156 1.00 0.00 O ATOM 0 H ASP A 35 61.245 18.768 -0.508 1.00 0.00 H new ATOM 0 HA ASP A 35 59.941 19.401 2.044 1.00 0.00 H new ATOM 0 HB2 ASP A 35 58.047 19.969 0.662 1.00 0.00 H new ATOM 0 HB3 ASP A 35 59.462 20.525 -0.209 1.00 0.00 H new ATOM 991 N LEU A 36 59.486 16.494 0.629 1.00 0.00 N ATOM 992 CA LEU A 36 58.893 15.157 0.903 1.00 0.00 C ATOM 993 C LEU A 36 59.384 14.654 2.265 1.00 0.00 C ATOM 994 O LEU A 36 58.614 14.246 3.112 1.00 0.00 O ATOM 995 CB LEU A 36 59.355 14.199 -0.200 1.00 0.00 C ATOM 996 CG LEU A 36 58.758 12.793 -0.003 1.00 0.00 C ATOM 997 CD1 LEU A 36 57.265 12.784 -0.368 1.00 0.00 C ATOM 998 CD2 LEU A 36 59.504 11.820 -0.913 1.00 0.00 C ATOM 0 H LEU A 36 60.086 16.546 -0.194 1.00 0.00 H new ATOM 0 HA LEU A 36 57.805 15.216 0.919 1.00 0.00 H new ATOM 0 HB2 LEU A 36 59.058 14.590 -1.173 1.00 0.00 H new ATOM 0 HB3 LEU A 36 60.443 14.138 -0.200 1.00 0.00 H new ATOM 0 HG LEU A 36 58.861 12.500 1.042 1.00 0.00 H new ATOM 0 HD11 LEU A 36 56.861 11.782 -0.222 1.00 0.00 H new ATOM 0 HD12 LEU A 36 56.730 13.487 0.270 1.00 0.00 H new ATOM 0 HD13 LEU A 36 57.144 13.076 -1.411 1.00 0.00 H new ATOM 0 HD21 LEU A 36 59.095 10.818 -0.787 1.00 0.00 H new ATOM 0 HD22 LEU A 36 59.389 12.131 -1.951 1.00 0.00 H new ATOM 0 HD23 LEU A 36 60.562 11.815 -0.651 1.00 0.00 H new ATOM 1010 N LEU A 37 60.674 14.672 2.462 1.00 0.00 N ATOM 1011 CA LEU A 37 61.271 14.192 3.739 1.00 0.00 C ATOM 1012 C LEU A 37 60.953 15.146 4.894 1.00 0.00 C ATOM 1013 O LEU A 37 60.677 14.741 6.004 1.00 0.00 O ATOM 1014 CB LEU A 37 62.792 14.159 3.561 1.00 0.00 C ATOM 1015 CG LEU A 37 63.156 13.209 2.412 1.00 0.00 C ATOM 1016 CD1 LEU A 37 64.672 13.231 2.201 1.00 0.00 C ATOM 1017 CD2 LEU A 37 62.695 11.769 2.734 1.00 0.00 C ATOM 0 H LEU A 37 61.352 15.006 1.777 1.00 0.00 H new ATOM 0 HA LEU A 37 60.862 13.209 3.973 1.00 0.00 H new ATOM 0 HB2 LEU A 37 63.165 15.161 3.350 1.00 0.00 H new ATOM 0 HB3 LEU A 37 63.269 13.829 4.484 1.00 0.00 H new ATOM 0 HG LEU A 37 62.652 13.539 1.504 1.00 0.00 H new ATOM 0 HD11 LEU A 37 64.936 12.557 1.386 1.00 0.00 H new ATOM 0 HD12 LEU A 37 64.990 14.244 1.953 1.00 0.00 H new ATOM 0 HD13 LEU A 37 65.171 12.908 3.114 1.00 0.00 H new ATOM 0 HD21 LEU A 37 62.961 11.109 1.909 1.00 0.00 H new ATOM 0 HD22 LEU A 37 63.184 11.426 3.646 1.00 0.00 H new ATOM 0 HD23 LEU A 37 61.614 11.756 2.875 1.00 0.00 H new ATOM 1029 N GLN A 38 61.036 16.421 4.624 1.00 0.00 N ATOM 1030 CA GLN A 38 60.799 17.459 5.669 1.00 0.00 C ATOM 1031 C GLN A 38 59.328 17.516 6.088 1.00 0.00 C ATOM 1032 O GLN A 38 58.999 17.740 7.232 1.00 0.00 O ATOM 1033 CB GLN A 38 61.180 18.814 5.060 1.00 0.00 C ATOM 1034 CG GLN A 38 60.943 19.950 6.063 1.00 0.00 C ATOM 1035 CD GLN A 38 59.461 20.348 6.076 1.00 0.00 C ATOM 1036 OE1 GLN A 38 58.812 20.350 5.047 1.00 0.00 O ATOM 1037 NE2 GLN A 38 58.895 20.679 7.205 1.00 0.00 N ATOM 0 H GLN A 38 61.263 16.795 3.702 1.00 0.00 H new ATOM 0 HA GLN A 38 61.392 17.218 6.551 1.00 0.00 H new ATOM 0 HB2 GLN A 38 62.228 18.801 4.760 1.00 0.00 H new ATOM 0 HB3 GLN A 38 60.593 18.990 4.159 1.00 0.00 H new ATOM 0 HG2 GLN A 38 61.251 19.634 7.060 1.00 0.00 H new ATOM 0 HG3 GLN A 38 61.556 20.812 5.798 1.00 0.00 H new ATOM 0 HE21 GLN A 38 59.439 20.677 8.068 1.00 0.00 H new ATOM 0 HE22 GLN A 38 57.909 20.939 7.224 1.00 0.00 H new ATOM 1046 N THR A 39 58.447 17.390 5.138 1.00 0.00 N ATOM 1047 CA THR A 39 56.997 17.524 5.445 1.00 0.00 C ATOM 1048 C THR A 39 56.540 16.481 6.462 1.00 0.00 C ATOM 1049 O THR A 39 55.864 16.804 7.417 1.00 0.00 O ATOM 1050 CB THR A 39 56.185 17.366 4.156 1.00 0.00 C ATOM 1051 OG1 THR A 39 56.565 18.377 3.233 1.00 0.00 O ATOM 1052 CG2 THR A 39 54.690 17.487 4.462 1.00 0.00 C ATOM 0 H THR A 39 58.668 17.200 4.161 1.00 0.00 H new ATOM 0 HA THR A 39 56.834 18.512 5.875 1.00 0.00 H new ATOM 0 HB THR A 39 56.382 16.384 3.726 1.00 0.00 H new ATOM 0 HG1 THR A 39 57.076 17.975 2.500 1.00 0.00 H new ATOM 0 HG21 THR A 39 54.120 17.374 3.540 1.00 0.00 H new ATOM 0 HG22 THR A 39 54.399 16.708 5.167 1.00 0.00 H new ATOM 0 HG23 THR A 39 54.486 18.465 4.897 1.00 0.00 H new ATOM 1060 N GLU A 40 56.858 15.232 6.251 1.00 0.00 N ATOM 1061 CA GLU A 40 56.384 14.167 7.193 1.00 0.00 C ATOM 1062 C GLU A 40 57.480 13.757 8.187 1.00 0.00 C ATOM 1063 O GLU A 40 57.193 13.139 9.194 1.00 0.00 O ATOM 1064 CB GLU A 40 55.973 12.948 6.366 1.00 0.00 C ATOM 1065 CG GLU A 40 54.793 13.316 5.467 1.00 0.00 C ATOM 1066 CD GLU A 40 54.387 12.097 4.635 1.00 0.00 C ATOM 1067 OE1 GLU A 40 55.069 11.090 4.723 1.00 0.00 O ATOM 1068 OE2 GLU A 40 53.405 12.195 3.918 1.00 0.00 O ATOM 0 H GLU A 40 57.424 14.900 5.470 1.00 0.00 H new ATOM 0 HA GLU A 40 55.544 14.557 7.769 1.00 0.00 H new ATOM 0 HB2 GLU A 40 56.812 12.606 5.760 1.00 0.00 H new ATOM 0 HB3 GLU A 40 55.699 12.124 7.025 1.00 0.00 H new ATOM 0 HG2 GLU A 40 53.952 13.653 6.073 1.00 0.00 H new ATOM 0 HG3 GLU A 40 55.065 14.143 4.811 1.00 0.00 H new ATOM 1075 N LEU A 41 58.727 14.074 7.924 1.00 0.00 N ATOM 1076 CA LEU A 41 59.823 13.671 8.872 1.00 0.00 C ATOM 1077 C LEU A 41 60.792 14.836 9.091 1.00 0.00 C ATOM 1078 O LEU A 41 61.978 14.723 8.851 1.00 0.00 O ATOM 1079 CB LEU A 41 60.578 12.472 8.286 1.00 0.00 C ATOM 1080 CG LEU A 41 59.645 11.248 8.215 1.00 0.00 C ATOM 1081 CD1 LEU A 41 60.320 10.129 7.408 1.00 0.00 C ATOM 1082 CD2 LEU A 41 59.327 10.733 9.634 1.00 0.00 C ATOM 0 H LEU A 41 59.034 14.591 7.100 1.00 0.00 H new ATOM 0 HA LEU A 41 59.385 13.398 9.832 1.00 0.00 H new ATOM 0 HB2 LEU A 41 60.948 12.716 7.290 1.00 0.00 H new ATOM 0 HB3 LEU A 41 61.447 12.242 8.902 1.00 0.00 H new ATOM 0 HG LEU A 41 58.716 11.545 7.727 1.00 0.00 H new ATOM 0 HD11 LEU A 41 59.658 9.265 7.360 1.00 0.00 H new ATOM 0 HD12 LEU A 41 60.528 10.483 6.398 1.00 0.00 H new ATOM 0 HD13 LEU A 41 61.254 9.844 7.892 1.00 0.00 H new ATOM 0 HD21 LEU A 41 58.667 9.868 9.568 1.00 0.00 H new ATOM 0 HD22 LEU A 41 60.253 10.446 10.133 1.00 0.00 H new ATOM 0 HD23 LEU A 41 58.836 11.521 10.206 1.00 0.00 H new ATOM 1094 N SER A 42 60.297 15.954 9.546 1.00 0.00 N ATOM 1095 CA SER A 42 61.192 17.123 9.785 1.00 0.00 C ATOM 1096 C SER A 42 62.106 16.850 10.983 1.00 0.00 C ATOM 1097 O SER A 42 63.275 17.183 10.978 1.00 0.00 O ATOM 1098 CB SER A 42 60.337 18.353 10.103 1.00 0.00 C ATOM 1099 OG SER A 42 59.668 18.150 11.339 1.00 0.00 O ATOM 0 H SER A 42 59.312 16.109 9.763 1.00 0.00 H new ATOM 0 HA SER A 42 61.795 17.294 8.893 1.00 0.00 H new ATOM 0 HB2 SER A 42 60.964 19.243 10.157 1.00 0.00 H new ATOM 0 HB3 SER A 42 59.612 18.522 9.307 1.00 0.00 H new ATOM 0 HG SER A 42 59.121 18.936 11.548 1.00 0.00 H new ATOM 1105 N SER A 43 61.566 16.278 12.026 1.00 0.00 N ATOM 1106 CA SER A 43 62.383 16.020 13.248 1.00 0.00 C ATOM 1107 C SER A 43 63.388 14.879 13.037 1.00 0.00 C ATOM 1108 O SER A 43 64.527 14.971 13.448 1.00 0.00 O ATOM 1109 CB SER A 43 61.459 15.670 14.415 1.00 0.00 C ATOM 1110 OG SER A 43 62.248 15.330 15.548 1.00 0.00 O ATOM 0 H SER A 43 60.593 15.978 12.085 1.00 0.00 H new ATOM 0 HA SER A 43 62.947 16.927 13.467 1.00 0.00 H new ATOM 0 HB2 SER A 43 60.811 16.515 14.648 1.00 0.00 H new ATOM 0 HB3 SER A 43 60.811 14.836 14.144 1.00 0.00 H new ATOM 0 HG SER A 43 61.661 15.106 16.300 1.00 0.00 H new ATOM 1116 N PHE A 44 62.988 13.794 12.427 1.00 0.00 N ATOM 1117 CA PHE A 44 63.949 12.664 12.239 1.00 0.00 C ATOM 1118 C PHE A 44 64.848 12.902 11.029 1.00 0.00 C ATOM 1119 O PHE A 44 65.751 13.700 11.116 1.00 0.00 O ATOM 1120 CB PHE A 44 63.199 11.320 12.103 1.00 0.00 C ATOM 1121 CG PHE A 44 64.188 10.155 12.107 1.00 0.00 C ATOM 1122 CD1 PHE A 44 65.064 9.969 13.197 1.00 0.00 C ATOM 1123 CD2 PHE A 44 64.234 9.250 11.024 1.00 0.00 C ATOM 1124 CE1 PHE A 44 65.966 8.898 13.200 1.00 0.00 C ATOM 1125 CE2 PHE A 44 65.140 8.183 11.038 1.00 0.00 C ATOM 1126 CZ PHE A 44 66.004 8.007 12.124 1.00 0.00 C ATOM 0 H PHE A 44 62.051 13.641 12.055 1.00 0.00 H new ATOM 0 HA PHE A 44 64.582 12.615 13.125 1.00 0.00 H new ATOM 0 HB2 PHE A 44 62.491 11.207 12.924 1.00 0.00 H new ATOM 0 HB3 PHE A 44 62.620 11.311 11.179 1.00 0.00 H new ATOM 0 HD1 PHE A 44 65.039 10.654 14.031 1.00 0.00 H new ATOM 0 HD2 PHE A 44 63.569 9.381 10.183 1.00 0.00 H new ATOM 0 HE1 PHE A 44 66.635 8.760 14.037 1.00 0.00 H new ATOM 0 HE2 PHE A 44 65.172 7.493 10.208 1.00 0.00 H new ATOM 0 HZ PHE A 44 66.701 7.182 12.131 1.00 0.00 H new ATOM 1136 N LEU A 45 64.611 12.205 9.935 1.00 0.00 N ATOM 1137 CA LEU A 45 65.405 12.380 8.650 1.00 0.00 C ATOM 1138 C LEU A 45 66.325 13.623 8.782 1.00 0.00 C ATOM 1139 O LEU A 45 65.755 14.657 9.092 1.00 0.00 O ATOM 1140 CB LEU A 45 64.475 12.486 7.417 1.00 0.00 C ATOM 1141 CG LEU A 45 64.787 11.353 6.388 1.00 0.00 C ATOM 1142 CD1 LEU A 45 66.313 11.171 6.186 1.00 0.00 C ATOM 1143 CD2 LEU A 45 64.173 10.024 6.867 1.00 0.00 C ATOM 0 H LEU A 45 63.878 11.498 9.871 1.00 0.00 H new ATOM 0 HA LEU A 45 66.025 11.497 8.494 1.00 0.00 H new ATOM 0 HB2 LEU A 45 63.434 12.419 7.734 1.00 0.00 H new ATOM 0 HB3 LEU A 45 64.602 13.459 6.943 1.00 0.00 H new ATOM 0 HG LEU A 45 64.348 11.643 5.433 1.00 0.00 H new ATOM 0 HD11 LEU A 45 66.492 10.375 5.464 1.00 0.00 H new ATOM 0 HD12 LEU A 45 66.744 12.101 5.815 1.00 0.00 H new ATOM 0 HD13 LEU A 45 66.777 10.909 7.137 1.00 0.00 H new ATOM 0 HD21 LEU A 45 64.395 9.239 6.144 1.00 0.00 H new ATOM 0 HD22 LEU A 45 64.596 9.756 7.835 1.00 0.00 H new ATOM 0 HD23 LEU A 45 63.093 10.135 6.961 1.00 0.00 H new ATOM 1155 N ASP A 46 67.611 13.701 8.537 1.00 0.00 N ATOM 1156 CA ASP A 46 68.253 15.072 8.695 1.00 0.00 C ATOM 1157 C ASP A 46 68.229 15.833 7.352 1.00 0.00 C ATOM 1158 O ASP A 46 68.928 15.494 6.422 1.00 0.00 O ATOM 1159 CB ASP A 46 69.688 14.913 9.196 1.00 0.00 C ATOM 1160 CG ASP A 46 70.497 14.110 8.192 1.00 0.00 C ATOM 1161 OD1 ASP A 46 69.922 13.684 7.208 1.00 0.00 O ATOM 1162 OD2 ASP A 46 71.682 13.933 8.426 1.00 0.00 O ATOM 0 H ASP A 46 68.223 12.936 8.252 1.00 0.00 H new ATOM 0 HA ASP A 46 67.686 15.650 9.425 1.00 0.00 H new ATOM 0 HB2 ASP A 46 70.142 15.893 9.343 1.00 0.00 H new ATOM 0 HB3 ASP A 46 69.692 14.412 10.164 1.00 0.00 H new ATOM 1167 N VAL A 47 67.433 16.874 7.237 1.00 0.00 N ATOM 1168 CA VAL A 47 67.393 17.640 5.944 1.00 0.00 C ATOM 1169 C VAL A 47 67.186 19.135 6.205 1.00 0.00 C ATOM 1170 O VAL A 47 67.772 19.967 5.540 1.00 0.00 O ATOM 1171 CB VAL A 47 66.243 17.135 5.060 1.00 0.00 C ATOM 1172 CG1 VAL A 47 66.332 15.618 4.900 1.00 0.00 C ATOM 1173 CG2 VAL A 47 64.895 17.499 5.691 1.00 0.00 C ATOM 0 H VAL A 47 66.817 17.223 7.971 1.00 0.00 H new ATOM 0 HA VAL A 47 68.346 17.487 5.438 1.00 0.00 H new ATOM 0 HB VAL A 47 66.324 17.608 4.081 1.00 0.00 H new ATOM 0 HG11 VAL A 47 65.512 15.270 4.272 1.00 0.00 H new ATOM 0 HG12 VAL A 47 67.282 15.356 4.435 1.00 0.00 H new ATOM 0 HG13 VAL A 47 66.265 15.144 5.879 1.00 0.00 H new ATOM 0 HG21 VAL A 47 64.086 17.136 5.056 1.00 0.00 H new ATOM 0 HG22 VAL A 47 64.818 17.038 6.676 1.00 0.00 H new ATOM 0 HG23 VAL A 47 64.820 18.582 5.790 1.00 0.00 H new ATOM 1183 N GLN A 48 66.330 19.492 7.134 1.00 0.00 N ATOM 1184 CA GLN A 48 66.062 20.943 7.390 1.00 0.00 C ATOM 1185 C GLN A 48 66.898 21.473 8.562 1.00 0.00 C ATOM 1186 O GLN A 48 67.463 22.546 8.493 1.00 0.00 O ATOM 1187 CB GLN A 48 64.555 21.118 7.688 1.00 0.00 C ATOM 1188 CG GLN A 48 64.034 22.436 7.100 1.00 0.00 C ATOM 1189 CD GLN A 48 64.754 23.618 7.757 1.00 0.00 C ATOM 1190 OE1 GLN A 48 64.980 23.597 9.043 1.00 0.00 O flip ATOM 1191 NE2 GLN A 48 65.119 24.568 7.094 1.00 0.00 N flip ATOM 0 H GLN A 48 65.808 18.844 7.723 1.00 0.00 H new ATOM 0 HA GLN A 48 66.344 21.516 6.507 1.00 0.00 H new ATOM 0 HB2 GLN A 48 63.997 20.281 7.268 1.00 0.00 H new ATOM 0 HB3 GLN A 48 64.388 21.104 8.765 1.00 0.00 H new ATOM 0 HG2 GLN A 48 64.196 22.453 6.022 1.00 0.00 H new ATOM 0 HG3 GLN A 48 62.959 22.517 7.262 1.00 0.00 H new ATOM 0 HE21 GLN A 48 64.943 24.586 6.089 1.00 0.00 H new ATOM 0 HE22 GLN A 48 65.601 25.347 7.542 1.00 0.00 H new ATOM 1200 N LYS A 49 66.982 20.743 9.631 1.00 0.00 N ATOM 1201 CA LYS A 49 67.782 21.224 10.792 1.00 0.00 C ATOM 1202 C LYS A 49 69.242 21.260 10.377 1.00 0.00 C ATOM 1203 O LYS A 49 70.061 21.925 10.977 1.00 0.00 O ATOM 1204 CB LYS A 49 67.603 20.277 11.971 1.00 0.00 C ATOM 1205 CG LYS A 49 66.151 20.339 12.446 1.00 0.00 C ATOM 1206 CD LYS A 49 65.961 19.422 13.661 1.00 0.00 C ATOM 1207 CE LYS A 49 65.938 17.951 13.225 1.00 0.00 C ATOM 1208 NZ LYS A 49 65.462 17.114 14.360 1.00 0.00 N ATOM 0 H LYS A 49 66.534 19.835 9.756 1.00 0.00 H new ATOM 0 HA LYS A 49 67.451 22.218 11.092 1.00 0.00 H new ATOM 0 HB2 LYS A 49 67.860 19.259 11.678 1.00 0.00 H new ATOM 0 HB3 LYS A 49 68.276 20.555 12.782 1.00 0.00 H new ATOM 0 HG2 LYS A 49 65.888 21.364 12.708 1.00 0.00 H new ATOM 0 HG3 LYS A 49 65.482 20.034 11.641 1.00 0.00 H new ATOM 0 HD2 LYS A 49 66.768 19.583 14.376 1.00 0.00 H new ATOM 0 HD3 LYS A 49 65.030 19.671 14.170 1.00 0.00 H new ATOM 0 HE2 LYS A 49 65.282 17.824 12.364 1.00 0.00 H new ATOM 0 HE3 LYS A 49 66.934 17.635 12.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 65.282 16.146 14.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 66.188 17.094 15.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 64.583 17.517 14.744 1.00 0.00 H new ATOM 1222 N ASP A 50 69.564 20.548 9.338 1.00 0.00 N ATOM 1223 CA ASP A 50 70.962 20.527 8.840 1.00 0.00 C ATOM 1224 C ASP A 50 70.919 20.541 7.310 1.00 0.00 C ATOM 1225 O ASP A 50 70.903 19.514 6.663 1.00 0.00 O ATOM 1226 CB ASP A 50 71.654 19.264 9.356 1.00 0.00 C ATOM 1227 CG ASP A 50 73.148 19.342 9.061 1.00 0.00 C ATOM 1228 OD1 ASP A 50 73.536 20.226 8.320 1.00 0.00 O ATOM 1229 OD2 ASP A 50 73.881 18.517 9.585 1.00 0.00 O ATOM 0 H ASP A 50 68.910 19.973 8.807 1.00 0.00 H new ATOM 0 HA ASP A 50 71.521 21.394 9.193 1.00 0.00 H new ATOM 0 HB2 ASP A 50 71.490 19.160 10.429 1.00 0.00 H new ATOM 0 HB3 ASP A 50 71.225 18.382 8.881 1.00 0.00 H new ATOM 1234 N ALA A 51 70.885 21.713 6.730 1.00 0.00 N ATOM 1235 CA ALA A 51 70.822 21.823 5.244 1.00 0.00 C ATOM 1236 C ALA A 51 72.056 21.148 4.641 1.00 0.00 C ATOM 1237 O ALA A 51 71.982 20.485 3.626 1.00 0.00 O ATOM 1238 CB ALA A 51 70.778 23.299 4.857 1.00 0.00 C ATOM 0 H ALA A 51 70.898 22.604 7.227 1.00 0.00 H new ATOM 0 HA ALA A 51 69.928 21.330 4.863 1.00 0.00 H new ATOM 0 HB1 ALA A 51 70.732 23.389 3.772 1.00 0.00 H new ATOM 0 HB2 ALA A 51 69.896 23.765 5.298 1.00 0.00 H new ATOM 0 HB3 ALA A 51 71.674 23.798 5.225 1.00 0.00 H new ATOM 1244 N ASP A 52 73.179 21.275 5.287 1.00 0.00 N ATOM 1245 CA ASP A 52 74.408 20.599 4.793 1.00 0.00 C ATOM 1246 C ASP A 52 74.143 19.102 4.762 1.00 0.00 C ATOM 1247 O ASP A 52 74.563 18.412 3.863 1.00 0.00 O ATOM 1248 CB ASP A 52 75.560 20.861 5.766 1.00 0.00 C ATOM 1249 CG ASP A 52 75.980 22.330 5.686 1.00 0.00 C ATOM 1250 OD1 ASP A 52 75.664 22.964 4.692 1.00 0.00 O ATOM 1251 OD2 ASP A 52 76.610 22.796 6.621 1.00 0.00 O ATOM 0 H ASP A 52 73.299 21.821 6.140 1.00 0.00 H new ATOM 0 HA ASP A 52 74.667 20.974 3.803 1.00 0.00 H new ATOM 0 HB2 ASP A 52 75.253 20.616 6.783 1.00 0.00 H new ATOM 0 HB3 ASP A 52 76.406 20.217 5.525 1.00 0.00 H new ATOM 1256 N ALA A 53 73.468 18.590 5.744 1.00 0.00 N ATOM 1257 CA ALA A 53 73.220 17.126 5.765 1.00 0.00 C ATOM 1258 C ALA A 53 72.489 16.715 4.487 1.00 0.00 C ATOM 1259 O ALA A 53 72.777 15.688 3.909 1.00 0.00 O ATOM 1260 CB ALA A 53 72.373 16.745 6.977 1.00 0.00 C ATOM 0 H ALA A 53 73.079 19.114 6.528 1.00 0.00 H new ATOM 0 HA ALA A 53 74.178 16.609 5.827 1.00 0.00 H new ATOM 0 HB1 ALA A 53 72.201 15.669 6.977 1.00 0.00 H new ATOM 0 HB2 ALA A 53 72.896 17.029 7.890 1.00 0.00 H new ATOM 0 HB3 ALA A 53 71.416 17.265 6.930 1.00 0.00 H new ATOM 1266 N VAL A 54 71.552 17.497 4.031 1.00 0.00 N ATOM 1267 CA VAL A 54 70.836 17.110 2.787 1.00 0.00 C ATOM 1268 C VAL A 54 71.823 17.131 1.623 1.00 0.00 C ATOM 1269 O VAL A 54 71.750 16.323 0.737 1.00 0.00 O ATOM 1270 CB VAL A 54 69.631 18.062 2.528 1.00 0.00 C ATOM 1271 CG1 VAL A 54 69.935 19.097 1.422 1.00 0.00 C ATOM 1272 CG2 VAL A 54 68.407 17.242 2.096 1.00 0.00 C ATOM 0 H VAL A 54 71.255 18.374 4.458 1.00 0.00 H new ATOM 0 HA VAL A 54 70.433 16.103 2.892 1.00 0.00 H new ATOM 0 HB VAL A 54 69.437 18.595 3.459 1.00 0.00 H new ATOM 0 HG11 VAL A 54 69.066 19.739 1.276 1.00 0.00 H new ATOM 0 HG12 VAL A 54 70.790 19.705 1.718 1.00 0.00 H new ATOM 0 HG13 VAL A 54 70.163 18.578 0.491 1.00 0.00 H new ATOM 0 HG21 VAL A 54 67.566 17.911 1.916 1.00 0.00 H new ATOM 0 HG22 VAL A 54 68.639 16.696 1.181 1.00 0.00 H new ATOM 0 HG23 VAL A 54 68.146 16.535 2.884 1.00 0.00 H new ATOM 1282 N ASP A 55 72.720 18.073 1.594 1.00 0.00 N ATOM 1283 CA ASP A 55 73.667 18.133 0.445 1.00 0.00 C ATOM 1284 C ASP A 55 74.475 16.829 0.382 1.00 0.00 C ATOM 1285 O ASP A 55 74.729 16.296 -0.677 1.00 0.00 O ATOM 1286 CB ASP A 55 74.599 19.338 0.603 1.00 0.00 C ATOM 1287 CG ASP A 55 75.569 19.408 -0.581 1.00 0.00 C ATOM 1288 OD1 ASP A 55 75.704 18.416 -1.276 1.00 0.00 O ATOM 1289 OD2 ASP A 55 76.160 20.458 -0.772 1.00 0.00 O ATOM 0 H ASP A 55 72.840 18.795 2.304 1.00 0.00 H new ATOM 0 HA ASP A 55 73.110 18.248 -0.485 1.00 0.00 H new ATOM 0 HB2 ASP A 55 74.014 20.256 0.659 1.00 0.00 H new ATOM 0 HB3 ASP A 55 75.156 19.257 1.536 1.00 0.00 H new ATOM 1294 N LYS A 56 74.878 16.316 1.515 1.00 0.00 N ATOM 1295 CA LYS A 56 75.662 15.044 1.544 1.00 0.00 C ATOM 1296 C LYS A 56 74.791 13.893 1.016 1.00 0.00 C ATOM 1297 O LYS A 56 75.254 13.013 0.319 1.00 0.00 O ATOM 1298 CB LYS A 56 76.081 14.747 3.000 1.00 0.00 C ATOM 1299 CG LYS A 56 77.427 15.412 3.323 1.00 0.00 C ATOM 1300 CD LYS A 56 77.301 16.930 3.251 1.00 0.00 C ATOM 1301 CE LYS A 56 78.633 17.571 3.643 1.00 0.00 C ATOM 1302 NZ LYS A 56 78.527 19.050 3.518 1.00 0.00 N ATOM 0 H LYS A 56 74.696 16.727 2.430 1.00 0.00 H new ATOM 0 HA LYS A 56 76.548 15.141 0.917 1.00 0.00 H new ATOM 0 HB2 LYS A 56 75.316 15.111 3.686 1.00 0.00 H new ATOM 0 HB3 LYS A 56 76.156 13.670 3.150 1.00 0.00 H new ATOM 0 HG2 LYS A 56 77.757 15.115 4.318 1.00 0.00 H new ATOM 0 HG3 LYS A 56 78.187 15.070 2.620 1.00 0.00 H new ATOM 0 HD2 LYS A 56 77.021 17.235 2.243 1.00 0.00 H new ATOM 0 HD3 LYS A 56 76.510 17.272 3.919 1.00 0.00 H new ATOM 0 HE2 LYS A 56 78.892 17.299 4.666 1.00 0.00 H new ATOM 0 HE3 LYS A 56 79.431 17.197 3.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 79.478 19.459 3.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 77.955 19.288 2.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 78.074 19.439 4.370 1.00 0.00 H new ATOM 1316 N ILE A 57 73.544 13.888 1.384 1.00 0.00 N ATOM 1317 CA ILE A 57 72.613 12.799 0.963 1.00 0.00 C ATOM 1318 C ILE A 57 72.340 12.839 -0.554 1.00 0.00 C ATOM 1319 O ILE A 57 72.555 11.881 -1.258 1.00 0.00 O ATOM 1320 CB ILE A 57 71.305 13.016 1.743 1.00 0.00 C ATOM 1321 CG1 ILE A 57 71.497 12.574 3.211 1.00 0.00 C ATOM 1322 CG2 ILE A 57 70.154 12.231 1.107 1.00 0.00 C ATOM 1323 CD1 ILE A 57 70.493 13.301 4.112 1.00 0.00 C ATOM 0 H ILE A 57 73.118 14.606 1.971 1.00 0.00 H new ATOM 0 HA ILE A 57 73.052 11.824 1.175 1.00 0.00 H new ATOM 0 HB ILE A 57 71.053 14.076 1.712 1.00 0.00 H new ATOM 0 HG12 ILE A 57 71.360 11.496 3.296 1.00 0.00 H new ATOM 0 HG13 ILE A 57 72.514 12.793 3.535 1.00 0.00 H new ATOM 0 HG21 ILE A 57 69.240 12.400 1.676 1.00 0.00 H new ATOM 0 HG22 ILE A 57 70.009 12.566 0.080 1.00 0.00 H new ATOM 0 HG23 ILE A 57 70.393 11.167 1.112 1.00 0.00 H new ATOM 0 HD11 ILE A 57 70.635 12.984 5.145 1.00 0.00 H new ATOM 0 HD12 ILE A 57 70.650 14.377 4.038 1.00 0.00 H new ATOM 0 HD13 ILE A 57 69.478 13.060 3.795 1.00 0.00 H new ATOM 1335 N MET A 58 71.875 13.944 -1.045 1.00 0.00 N ATOM 1336 CA MET A 58 71.562 14.081 -2.499 1.00 0.00 C ATOM 1337 C MET A 58 72.825 13.850 -3.327 1.00 0.00 C ATOM 1338 O MET A 58 72.792 13.204 -4.355 1.00 0.00 O ATOM 1339 CB MET A 58 70.970 15.490 -2.718 1.00 0.00 C ATOM 1340 CG MET A 58 71.199 16.011 -4.143 1.00 0.00 C ATOM 1341 SD MET A 58 70.387 14.918 -5.338 1.00 0.00 S ATOM 1342 CE MET A 58 69.267 16.151 -6.043 1.00 0.00 C ATOM 0 H MET A 58 71.692 14.782 -0.492 1.00 0.00 H new ATOM 0 HA MET A 58 70.835 13.335 -2.822 1.00 0.00 H new ATOM 0 HB2 MET A 58 69.900 15.467 -2.511 1.00 0.00 H new ATOM 0 HB3 MET A 58 71.417 16.183 -2.005 1.00 0.00 H new ATOM 0 HG2 MET A 58 70.805 17.023 -4.237 1.00 0.00 H new ATOM 0 HG3 MET A 58 72.267 16.064 -4.353 1.00 0.00 H new ATOM 0 HE1 MET A 58 68.596 15.669 -6.754 1.00 0.00 H new ATOM 0 HE2 MET A 58 68.682 16.609 -5.246 1.00 0.00 H new ATOM 0 HE3 MET A 58 69.847 16.919 -6.555 1.00 0.00 H new ATOM 1352 N LYS A 59 73.932 14.332 -2.881 1.00 0.00 N ATOM 1353 CA LYS A 59 75.183 14.090 -3.649 1.00 0.00 C ATOM 1354 C LYS A 59 75.379 12.580 -3.710 1.00 0.00 C ATOM 1355 O LYS A 59 75.752 12.018 -4.719 1.00 0.00 O ATOM 1356 CB LYS A 59 76.364 14.758 -2.944 1.00 0.00 C ATOM 1357 CG LYS A 59 77.657 14.542 -3.754 1.00 0.00 C ATOM 1358 CD LYS A 59 77.621 15.355 -5.081 1.00 0.00 C ATOM 1359 CE LYS A 59 77.542 14.410 -6.290 1.00 0.00 C ATOM 1360 NZ LYS A 59 78.855 13.725 -6.469 1.00 0.00 N ATOM 0 H LYS A 59 74.036 14.880 -2.027 1.00 0.00 H new ATOM 0 HA LYS A 59 75.119 14.509 -4.653 1.00 0.00 H new ATOM 0 HB2 LYS A 59 76.172 15.825 -2.829 1.00 0.00 H new ATOM 0 HB3 LYS A 59 76.480 14.345 -1.942 1.00 0.00 H new ATOM 0 HG2 LYS A 59 78.519 14.846 -3.160 1.00 0.00 H new ATOM 0 HG3 LYS A 59 77.780 13.482 -3.975 1.00 0.00 H new ATOM 0 HD2 LYS A 59 76.762 16.026 -5.080 1.00 0.00 H new ATOM 0 HD3 LYS A 59 78.512 15.978 -5.157 1.00 0.00 H new ATOM 0 HE2 LYS A 59 76.753 13.674 -6.139 1.00 0.00 H new ATOM 0 HE3 LYS A 59 77.287 14.972 -7.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 78.855 13.204 -7.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 79.617 14.432 -6.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 79.009 13.060 -5.684 1.00 0.00 H new ATOM 1374 N GLU A 60 75.107 11.930 -2.620 1.00 0.00 N ATOM 1375 CA GLU A 60 75.240 10.454 -2.565 1.00 0.00 C ATOM 1376 C GLU A 60 74.220 9.846 -3.531 1.00 0.00 C ATOM 1377 O GLU A 60 74.410 8.771 -4.066 1.00 0.00 O ATOM 1378 CB GLU A 60 74.959 9.968 -1.139 1.00 0.00 C ATOM 1379 CG GLU A 60 75.378 8.510 -1.013 1.00 0.00 C ATOM 1380 CD GLU A 60 75.081 8.011 0.405 1.00 0.00 C ATOM 1381 OE1 GLU A 60 74.566 8.791 1.189 1.00 0.00 O ATOM 1382 OE2 GLU A 60 75.364 6.856 0.678 1.00 0.00 O ATOM 0 H GLU A 60 74.794 12.365 -1.752 1.00 0.00 H new ATOM 0 HA GLU A 60 76.249 10.152 -2.847 1.00 0.00 H new ATOM 0 HB2 GLU A 60 75.505 10.579 -0.420 1.00 0.00 H new ATOM 0 HB3 GLU A 60 73.899 10.075 -0.908 1.00 0.00 H new ATOM 0 HG2 GLU A 60 74.842 7.903 -1.743 1.00 0.00 H new ATOM 0 HG3 GLU A 60 76.441 8.406 -1.231 1.00 0.00 H new ATOM 1389 N LEU A 61 73.127 10.534 -3.747 1.00 0.00 N ATOM 1390 CA LEU A 61 72.076 10.011 -4.672 1.00 0.00 C ATOM 1391 C LEU A 61 72.375 10.416 -6.097 1.00 0.00 C ATOM 1392 O LEU A 61 72.016 9.719 -7.027 1.00 0.00 O ATOM 1393 CB LEU A 61 70.713 10.593 -4.314 1.00 0.00 C ATOM 1394 CG LEU A 61 70.303 10.289 -2.858 1.00 0.00 C ATOM 1395 CD1 LEU A 61 68.773 10.278 -2.774 1.00 0.00 C ATOM 1396 CD2 LEU A 61 70.855 8.937 -2.364 1.00 0.00 C ATOM 0 H LEU A 61 72.917 11.437 -3.322 1.00 0.00 H new ATOM 0 HA LEU A 61 72.068 8.925 -4.575 1.00 0.00 H new ATOM 0 HB2 LEU A 61 70.732 11.672 -4.465 1.00 0.00 H new ATOM 0 HB3 LEU A 61 69.960 10.190 -4.991 1.00 0.00 H new ATOM 0 HG LEU A 61 70.725 11.063 -2.217 1.00 0.00 H new ATOM 0 HD11 LEU A 61 68.466 10.064 -1.750 1.00 0.00 H new ATOM 0 HD12 LEU A 61 68.385 11.252 -3.073 1.00 0.00 H new ATOM 0 HD13 LEU A 61 68.378 9.510 -3.439 1.00 0.00 H new ATOM 0 HD21 LEU A 61 70.539 8.769 -1.334 1.00 0.00 H new ATOM 0 HD22 LEU A 61 70.473 8.135 -2.996 1.00 0.00 H new ATOM 0 HD23 LEU A 61 71.944 8.949 -2.412 1.00 0.00 H new ATOM 1408 N ASP A 62 73.015 11.526 -6.300 1.00 0.00 N ATOM 1409 CA ASP A 62 73.315 11.924 -7.691 1.00 0.00 C ATOM 1410 C ASP A 62 74.381 10.969 -8.205 1.00 0.00 C ATOM 1411 O ASP A 62 75.406 11.372 -8.716 1.00 0.00 O ATOM 1412 CB ASP A 62 73.822 13.374 -7.728 1.00 0.00 C ATOM 1413 CG ASP A 62 73.592 13.973 -9.121 1.00 0.00 C ATOM 1414 OD1 ASP A 62 72.562 13.681 -9.710 1.00 0.00 O ATOM 1415 OD2 ASP A 62 74.448 14.715 -9.572 1.00 0.00 O ATOM 0 H ASP A 62 73.339 12.165 -5.574 1.00 0.00 H new ATOM 0 HA ASP A 62 72.423 11.874 -8.315 1.00 0.00 H new ATOM 0 HB2 ASP A 62 73.303 13.969 -6.977 1.00 0.00 H new ATOM 0 HB3 ASP A 62 74.883 13.404 -7.481 1.00 0.00 H new ATOM 1420 N GLU A 63 74.147 9.695 -8.041 1.00 0.00 N ATOM 1421 CA GLU A 63 75.148 8.692 -8.490 1.00 0.00 C ATOM 1422 C GLU A 63 75.365 8.853 -9.989 1.00 0.00 C ATOM 1423 O GLU A 63 76.475 8.795 -10.478 1.00 0.00 O ATOM 1424 CB GLU A 63 74.645 7.280 -8.190 1.00 0.00 C ATOM 1425 CG GLU A 63 74.618 7.057 -6.677 1.00 0.00 C ATOM 1426 CD GLU A 63 74.115 5.642 -6.382 1.00 0.00 C ATOM 1427 OE1 GLU A 63 73.656 4.992 -7.306 1.00 0.00 O ATOM 1428 OE2 GLU A 63 74.200 5.234 -5.236 1.00 0.00 O ATOM 0 H GLU A 63 73.305 9.308 -7.615 1.00 0.00 H new ATOM 0 HA GLU A 63 76.087 8.848 -7.959 1.00 0.00 H new ATOM 0 HB2 GLU A 63 73.647 7.142 -8.606 1.00 0.00 H new ATOM 0 HB3 GLU A 63 75.293 6.543 -8.665 1.00 0.00 H new ATOM 0 HG2 GLU A 63 75.616 7.195 -6.260 1.00 0.00 H new ATOM 0 HG3 GLU A 63 73.969 7.792 -6.201 1.00 0.00 H new ATOM 1435 N ASN A 64 74.313 9.095 -10.722 1.00 0.00 N ATOM 1436 CA ASN A 64 74.480 9.298 -12.180 1.00 0.00 C ATOM 1437 C ASN A 64 75.173 10.643 -12.337 1.00 0.00 C ATOM 1438 O ASN A 64 75.793 10.935 -13.343 1.00 0.00 O ATOM 1439 CB ASN A 64 73.112 9.318 -12.866 1.00 0.00 C ATOM 1440 CG ASN A 64 73.296 9.384 -14.383 1.00 0.00 C ATOM 1441 OD1 ASN A 64 73.048 10.406 -14.991 1.00 0.00 O ATOM 1442 ND2 ASN A 64 73.717 8.326 -15.025 1.00 0.00 N ATOM 0 H ASN A 64 73.356 9.160 -10.375 1.00 0.00 H new ATOM 0 HA ASN A 64 75.061 8.496 -12.636 1.00 0.00 H new ATOM 0 HB2 ASN A 64 72.547 8.426 -12.597 1.00 0.00 H new ATOM 0 HB3 ASN A 64 72.535 10.176 -12.522 1.00 0.00 H new ATOM 0 HD21 ASN A 64 73.838 8.358 -16.037 1.00 0.00 H new ATOM 0 HD22 ASN A 64 73.925 7.468 -14.514 1.00 0.00 H new ATOM 1449 N GLY A 65 75.100 11.445 -11.305 1.00 0.00 N ATOM 1450 CA GLY A 65 75.778 12.761 -11.319 1.00 0.00 C ATOM 1451 C GLY A 65 74.910 13.802 -12.000 1.00 0.00 C ATOM 1452 O GLY A 65 75.423 14.715 -12.618 1.00 0.00 O ATOM 0 H GLY A 65 74.591 11.234 -10.446 1.00 0.00 H new ATOM 0 HA2 GLY A 65 75.997 13.074 -10.298 1.00 0.00 H new ATOM 0 HA3 GLY A 65 76.732 12.679 -11.839 1.00 0.00 H new ATOM 1456 N ASP A 66 73.598 13.702 -11.895 1.00 0.00 N ATOM 1457 CA ASP A 66 72.740 14.737 -12.554 1.00 0.00 C ATOM 1458 C ASP A 66 72.459 15.814 -11.500 1.00 0.00 C ATOM 1459 O ASP A 66 73.362 16.370 -10.910 1.00 0.00 O ATOM 1460 CB ASP A 66 71.426 14.099 -13.023 1.00 0.00 C ATOM 1461 CG ASP A 66 71.711 12.765 -13.709 1.00 0.00 C ATOM 1462 OD1 ASP A 66 72.549 12.741 -14.594 1.00 0.00 O ATOM 1463 OD2 ASP A 66 71.079 11.790 -13.335 1.00 0.00 O ATOM 0 H ASP A 66 73.100 12.967 -11.394 1.00 0.00 H new ATOM 0 HA ASP A 66 73.235 15.166 -13.425 1.00 0.00 H new ATOM 0 HB2 ASP A 66 70.762 13.946 -12.172 1.00 0.00 H new ATOM 0 HB3 ASP A 66 70.912 14.769 -13.712 1.00 0.00 H new ATOM 1468 N GLY A 67 71.211 16.085 -11.240 1.00 0.00 N ATOM 1469 CA GLY A 67 70.833 17.091 -10.205 1.00 0.00 C ATOM 1470 C GLY A 67 69.382 16.798 -9.803 1.00 0.00 C ATOM 1471 O GLY A 67 68.647 17.652 -9.273 1.00 0.00 O ATOM 0 H GLY A 67 70.421 15.644 -11.710 1.00 0.00 H new ATOM 0 HA2 GLY A 67 71.494 17.022 -9.341 1.00 0.00 H new ATOM 0 HA3 GLY A 67 70.927 18.103 -10.599 1.00 0.00 H new ATOM 1475 N GLU A 68 68.952 15.571 -10.040 1.00 0.00 N ATOM 1476 CA GLU A 68 67.565 15.156 -9.706 1.00 0.00 C ATOM 1477 C GLU A 68 67.662 13.806 -8.983 1.00 0.00 C ATOM 1478 O GLU A 68 68.736 13.236 -8.890 1.00 0.00 O ATOM 1479 CB GLU A 68 66.795 14.982 -11.022 1.00 0.00 C ATOM 1480 CG GLU A 68 66.382 16.350 -11.576 1.00 0.00 C ATOM 1481 CD GLU A 68 65.620 16.161 -12.887 1.00 0.00 C ATOM 1482 OE1 GLU A 68 66.268 15.998 -13.906 1.00 0.00 O ATOM 1483 OE2 GLU A 68 64.401 16.188 -12.851 1.00 0.00 O ATOM 0 H GLU A 68 69.524 14.837 -10.458 1.00 0.00 H new ATOM 0 HA GLU A 68 67.057 15.889 -9.079 1.00 0.00 H new ATOM 0 HB2 GLU A 68 67.416 14.459 -11.749 1.00 0.00 H new ATOM 0 HB3 GLU A 68 65.911 14.366 -10.856 1.00 0.00 H new ATOM 0 HG2 GLU A 68 65.757 16.874 -10.852 1.00 0.00 H new ATOM 0 HG3 GLU A 68 67.264 16.968 -11.742 1.00 0.00 H new ATOM 1490 N VAL A 69 66.575 13.271 -8.496 1.00 0.00 N ATOM 1491 CA VAL A 69 66.634 11.944 -7.805 1.00 0.00 C ATOM 1492 C VAL A 69 65.579 11.038 -8.431 1.00 0.00 C ATOM 1493 O VAL A 69 64.434 11.407 -8.569 1.00 0.00 O ATOM 1494 CB VAL A 69 66.364 12.123 -6.307 1.00 0.00 C ATOM 1495 CG1 VAL A 69 66.745 10.856 -5.553 1.00 0.00 C ATOM 1496 CG2 VAL A 69 67.198 13.290 -5.778 1.00 0.00 C ATOM 0 H VAL A 69 65.648 13.693 -8.545 1.00 0.00 H new ATOM 0 HA VAL A 69 67.622 11.499 -7.920 1.00 0.00 H new ATOM 0 HB VAL A 69 65.303 12.325 -6.158 1.00 0.00 H new ATOM 0 HG11 VAL A 69 66.550 10.993 -4.489 1.00 0.00 H new ATOM 0 HG12 VAL A 69 66.154 10.019 -5.926 1.00 0.00 H new ATOM 0 HG13 VAL A 69 67.804 10.648 -5.703 1.00 0.00 H new ATOM 0 HG21 VAL A 69 67.008 13.420 -4.713 1.00 0.00 H new ATOM 0 HG22 VAL A 69 68.256 13.082 -5.935 1.00 0.00 H new ATOM 0 HG23 VAL A 69 66.925 14.202 -6.309 1.00 0.00 H new ATOM 1506 N ASP A 70 65.954 9.849 -8.811 1.00 0.00 N ATOM 1507 CA ASP A 70 64.973 8.913 -9.429 1.00 0.00 C ATOM 1508 C ASP A 70 64.439 7.973 -8.346 1.00 0.00 C ATOM 1509 O ASP A 70 64.964 7.914 -7.251 1.00 0.00 O ATOM 1510 CB ASP A 70 65.669 8.082 -10.509 1.00 0.00 C ATOM 1511 CG ASP A 70 66.124 8.996 -11.647 1.00 0.00 C ATOM 1512 OD1 ASP A 70 65.620 10.102 -11.725 1.00 0.00 O ATOM 1513 OD2 ASP A 70 66.968 8.572 -12.420 1.00 0.00 O ATOM 0 H ASP A 70 66.902 9.483 -8.720 1.00 0.00 H new ATOM 0 HA ASP A 70 64.155 9.479 -9.875 1.00 0.00 H new ATOM 0 HB2 ASP A 70 66.526 7.560 -10.084 1.00 0.00 H new ATOM 0 HB3 ASP A 70 64.989 7.321 -10.891 1.00 0.00 H new ATOM 1518 N PHE A 71 63.409 7.234 -8.640 1.00 0.00 N ATOM 1519 CA PHE A 71 62.853 6.294 -7.623 1.00 0.00 C ATOM 1520 C PHE A 71 63.967 5.312 -7.230 1.00 0.00 C ATOM 1521 O PHE A 71 64.039 4.842 -6.123 1.00 0.00 O ATOM 1522 CB PHE A 71 61.658 5.533 -8.243 1.00 0.00 C ATOM 1523 CG PHE A 71 60.583 5.205 -7.213 1.00 0.00 C ATOM 1524 CD1 PHE A 71 60.900 4.987 -5.863 1.00 0.00 C ATOM 1525 CD2 PHE A 71 59.250 5.100 -7.634 1.00 0.00 C ATOM 1526 CE1 PHE A 71 59.896 4.667 -4.950 1.00 0.00 C ATOM 1527 CE2 PHE A 71 58.246 4.782 -6.712 1.00 0.00 C ATOM 1528 CZ PHE A 71 58.572 4.565 -5.370 1.00 0.00 C ATOM 0 H PHE A 71 62.926 7.238 -9.539 1.00 0.00 H new ATOM 0 HA PHE A 71 62.506 6.830 -6.740 1.00 0.00 H new ATOM 0 HB2 PHE A 71 61.222 6.134 -9.041 1.00 0.00 H new ATOM 0 HB3 PHE A 71 62.015 4.609 -8.699 1.00 0.00 H new ATOM 0 HD1 PHE A 71 61.924 5.067 -5.531 1.00 0.00 H new ATOM 0 HD2 PHE A 71 58.997 5.265 -8.671 1.00 0.00 H new ATOM 0 HE1 PHE A 71 60.146 4.498 -3.913 1.00 0.00 H new ATOM 0 HE2 PHE A 71 57.219 4.704 -7.037 1.00 0.00 H new ATOM 0 HZ PHE A 71 57.797 4.318 -4.659 1.00 0.00 H new ATOM 1538 N GLN A 72 64.837 4.992 -8.138 1.00 0.00 N ATOM 1539 CA GLN A 72 65.937 4.046 -7.800 1.00 0.00 C ATOM 1540 C GLN A 72 66.990 4.755 -6.931 1.00 0.00 C ATOM 1541 O GLN A 72 67.648 4.142 -6.113 1.00 0.00 O ATOM 1542 CB GLN A 72 66.574 3.532 -9.092 1.00 0.00 C ATOM 1543 CG GLN A 72 67.704 2.561 -8.761 1.00 0.00 C ATOM 1544 CD GLN A 72 68.179 1.881 -10.046 1.00 0.00 C ATOM 1545 OE1 GLN A 72 67.552 2.006 -11.079 1.00 0.00 O ATOM 1546 NE2 GLN A 72 69.266 1.161 -10.027 1.00 0.00 N ATOM 0 H GLN A 72 64.838 5.340 -9.097 1.00 0.00 H new ATOM 0 HA GLN A 72 65.535 3.203 -7.238 1.00 0.00 H new ATOM 0 HB2 GLN A 72 65.823 3.035 -9.706 1.00 0.00 H new ATOM 0 HB3 GLN A 72 66.960 4.368 -9.676 1.00 0.00 H new ATOM 0 HG2 GLN A 72 68.531 3.094 -8.291 1.00 0.00 H new ATOM 0 HG3 GLN A 72 67.359 1.814 -8.047 1.00 0.00 H new ATOM 0 HE21 GLN A 72 69.793 1.056 -9.160 1.00 0.00 H new ATOM 0 HE22 GLN A 72 69.589 0.703 -10.879 1.00 0.00 H new ATOM 1555 N GLU A 73 67.135 6.045 -7.098 1.00 0.00 N ATOM 1556 CA GLU A 73 68.125 6.806 -6.296 1.00 0.00 C ATOM 1557 C GLU A 73 67.512 7.167 -4.943 1.00 0.00 C ATOM 1558 O GLU A 73 68.170 7.196 -3.923 1.00 0.00 O ATOM 1559 CB GLU A 73 68.487 8.085 -7.053 1.00 0.00 C ATOM 1560 CG GLU A 73 69.290 7.737 -8.311 1.00 0.00 C ATOM 1561 CD GLU A 73 69.649 9.030 -9.057 1.00 0.00 C ATOM 1562 OE1 GLU A 73 69.415 10.093 -8.508 1.00 0.00 O ATOM 1563 OE2 GLU A 73 70.156 8.936 -10.164 1.00 0.00 O ATOM 0 H GLU A 73 66.602 6.604 -7.764 1.00 0.00 H new ATOM 0 HA GLU A 73 69.019 6.204 -6.134 1.00 0.00 H new ATOM 0 HB2 GLU A 73 67.580 8.624 -7.327 1.00 0.00 H new ATOM 0 HB3 GLU A 73 69.069 8.746 -6.411 1.00 0.00 H new ATOM 0 HG2 GLU A 73 70.197 7.196 -8.040 1.00 0.00 H new ATOM 0 HG3 GLU A 73 68.708 7.080 -8.958 1.00 0.00 H new ATOM 1570 N PHE A 74 66.254 7.471 -4.941 1.00 0.00 N ATOM 1571 CA PHE A 74 65.581 7.861 -3.676 1.00 0.00 C ATOM 1572 C PHE A 74 65.331 6.638 -2.789 1.00 0.00 C ATOM 1573 O PHE A 74 65.519 6.664 -1.592 1.00 0.00 O ATOM 1574 CB PHE A 74 64.234 8.506 -4.029 1.00 0.00 C ATOM 1575 CG PHE A 74 63.880 9.535 -2.989 1.00 0.00 C ATOM 1576 CD1 PHE A 74 63.656 9.149 -1.661 1.00 0.00 C ATOM 1577 CD2 PHE A 74 63.796 10.878 -3.349 1.00 0.00 C ATOM 1578 CE1 PHE A 74 63.345 10.113 -0.701 1.00 0.00 C ATOM 1579 CE2 PHE A 74 63.489 11.833 -2.395 1.00 0.00 C ATOM 1580 CZ PHE A 74 63.261 11.458 -1.068 1.00 0.00 C ATOM 0 H PHE A 74 65.655 7.467 -5.766 1.00 0.00 H new ATOM 0 HA PHE A 74 66.219 8.557 -3.131 1.00 0.00 H new ATOM 0 HB2 PHE A 74 64.289 8.972 -5.013 1.00 0.00 H new ATOM 0 HB3 PHE A 74 63.457 7.744 -4.081 1.00 0.00 H new ATOM 0 HD1 PHE A 74 63.724 8.108 -1.381 1.00 0.00 H new ATOM 0 HD2 PHE A 74 63.970 11.174 -4.373 1.00 0.00 H new ATOM 0 HE1 PHE A 74 63.170 9.820 0.323 1.00 0.00 H new ATOM 0 HE2 PHE A 74 63.425 12.873 -2.678 1.00 0.00 H new ATOM 0 HZ PHE A 74 63.020 12.207 -0.328 1.00 0.00 H new ATOM 1590 N VAL A 75 64.868 5.585 -3.377 1.00 0.00 N ATOM 1591 CA VAL A 75 64.542 4.367 -2.599 1.00 0.00 C ATOM 1592 C VAL A 75 65.792 3.851 -1.889 1.00 0.00 C ATOM 1593 O VAL A 75 65.738 3.439 -0.748 1.00 0.00 O ATOM 1594 CB VAL A 75 63.977 3.303 -3.540 1.00 0.00 C ATOM 1595 CG1 VAL A 75 65.096 2.733 -4.421 1.00 0.00 C ATOM 1596 CG2 VAL A 75 63.316 2.189 -2.722 1.00 0.00 C ATOM 0 H VAL A 75 64.698 5.512 -4.380 1.00 0.00 H new ATOM 0 HA VAL A 75 63.794 4.604 -1.843 1.00 0.00 H new ATOM 0 HB VAL A 75 63.226 3.756 -4.187 1.00 0.00 H new ATOM 0 HG11 VAL A 75 64.684 1.976 -5.088 1.00 0.00 H new ATOM 0 HG12 VAL A 75 65.538 3.535 -5.012 1.00 0.00 H new ATOM 0 HG13 VAL A 75 65.862 2.282 -3.790 1.00 0.00 H new ATOM 0 HG21 VAL A 75 62.914 1.432 -3.396 1.00 0.00 H new ATOM 0 HG22 VAL A 75 64.056 1.733 -2.064 1.00 0.00 H new ATOM 0 HG23 VAL A 75 62.507 2.608 -2.124 1.00 0.00 H new ATOM 1606 N VAL A 76 66.917 3.888 -2.536 1.00 0.00 N ATOM 1607 CA VAL A 76 68.150 3.417 -1.847 1.00 0.00 C ATOM 1608 C VAL A 76 68.415 4.299 -0.619 1.00 0.00 C ATOM 1609 O VAL A 76 68.990 3.861 0.354 1.00 0.00 O ATOM 1610 CB VAL A 76 69.351 3.496 -2.783 1.00 0.00 C ATOM 1611 CG1 VAL A 76 69.253 2.401 -3.846 1.00 0.00 C ATOM 1612 CG2 VAL A 76 69.377 4.855 -3.461 1.00 0.00 C ATOM 0 H VAL A 76 67.040 4.217 -3.494 1.00 0.00 H new ATOM 0 HA VAL A 76 68.005 2.380 -1.543 1.00 0.00 H new ATOM 0 HB VAL A 76 70.265 3.357 -2.205 1.00 0.00 H new ATOM 0 HG11 VAL A 76 70.114 2.462 -4.512 1.00 0.00 H new ATOM 0 HG12 VAL A 76 69.237 1.424 -3.362 1.00 0.00 H new ATOM 0 HG13 VAL A 76 68.338 2.535 -4.423 1.00 0.00 H new ATOM 0 HG21 VAL A 76 70.236 4.911 -4.130 1.00 0.00 H new ATOM 0 HG22 VAL A 76 68.460 4.993 -4.034 1.00 0.00 H new ATOM 0 HG23 VAL A 76 69.454 5.637 -2.706 1.00 0.00 H new ATOM 1622 N LEU A 77 68.030 5.553 -0.677 1.00 0.00 N ATOM 1623 CA LEU A 77 68.282 6.489 0.473 1.00 0.00 C ATOM 1624 C LEU A 77 67.411 6.143 1.689 1.00 0.00 C ATOM 1625 O LEU A 77 67.912 5.880 2.759 1.00 0.00 O ATOM 1626 CB LEU A 77 67.928 7.919 0.010 1.00 0.00 C ATOM 1627 CG LEU A 77 68.275 9.035 1.055 1.00 0.00 C ATOM 1628 CD1 LEU A 77 67.045 9.368 1.925 1.00 0.00 C ATOM 1629 CD2 LEU A 77 69.466 8.650 1.956 1.00 0.00 C ATOM 0 H LEU A 77 67.550 5.972 -1.473 1.00 0.00 H new ATOM 0 HA LEU A 77 69.328 6.404 0.768 1.00 0.00 H new ATOM 0 HB2 LEU A 77 68.457 8.130 -0.920 1.00 0.00 H new ATOM 0 HB3 LEU A 77 66.862 7.964 -0.213 1.00 0.00 H new ATOM 0 HG LEU A 77 68.566 9.917 0.485 1.00 0.00 H new ATOM 0 HD11 LEU A 77 67.307 10.145 2.644 1.00 0.00 H new ATOM 0 HD12 LEU A 77 66.234 9.721 1.288 1.00 0.00 H new ATOM 0 HD13 LEU A 77 66.724 8.473 2.459 1.00 0.00 H new ATOM 0 HD21 LEU A 77 69.665 9.457 2.661 1.00 0.00 H new ATOM 0 HD22 LEU A 77 69.227 7.739 2.505 1.00 0.00 H new ATOM 0 HD23 LEU A 77 70.349 8.481 1.340 1.00 0.00 H new ATOM 1641 N VAL A 78 66.118 6.142 1.531 1.00 0.00 N ATOM 1642 CA VAL A 78 65.203 5.832 2.680 1.00 0.00 C ATOM 1643 C VAL A 78 65.509 4.450 3.232 1.00 0.00 C ATOM 1644 O VAL A 78 65.354 4.188 4.405 1.00 0.00 O ATOM 1645 CB VAL A 78 63.747 5.862 2.201 1.00 0.00 C ATOM 1646 CG1 VAL A 78 63.362 7.293 1.820 1.00 0.00 C ATOM 1647 CG2 VAL A 78 63.580 4.940 0.985 1.00 0.00 C ATOM 0 H VAL A 78 65.645 6.344 0.650 1.00 0.00 H new ATOM 0 HA VAL A 78 65.355 6.578 3.460 1.00 0.00 H new ATOM 0 HB VAL A 78 63.097 5.515 3.004 1.00 0.00 H new ATOM 0 HG11 VAL A 78 62.327 7.313 1.480 1.00 0.00 H new ATOM 0 HG12 VAL A 78 63.471 7.943 2.688 1.00 0.00 H new ATOM 0 HG13 VAL A 78 64.014 7.644 1.020 1.00 0.00 H new ATOM 0 HG21 VAL A 78 62.543 4.965 0.649 1.00 0.00 H new ATOM 0 HG22 VAL A 78 64.231 5.279 0.179 1.00 0.00 H new ATOM 0 HG23 VAL A 78 63.847 3.920 1.262 1.00 0.00 H new ATOM 1657 N ALA A 79 65.943 3.578 2.393 1.00 0.00 N ATOM 1658 CA ALA A 79 66.289 2.194 2.806 1.00 0.00 C ATOM 1659 C ALA A 79 67.587 2.173 3.633 1.00 0.00 C ATOM 1660 O ALA A 79 67.736 1.414 4.579 1.00 0.00 O ATOM 1661 CB ALA A 79 66.508 1.395 1.512 1.00 0.00 C ATOM 0 H ALA A 79 66.080 3.766 1.400 1.00 0.00 H new ATOM 0 HA ALA A 79 65.494 1.773 3.422 1.00 0.00 H new ATOM 0 HB1 ALA A 79 66.766 0.365 1.759 1.00 0.00 H new ATOM 0 HB2 ALA A 79 65.594 1.407 0.918 1.00 0.00 H new ATOM 0 HB3 ALA A 79 67.319 1.845 0.939 1.00 0.00 H new ATOM 1667 N ALA A 80 68.543 2.957 3.240 1.00 0.00 N ATOM 1668 CA ALA A 80 69.860 2.954 3.929 1.00 0.00 C ATOM 1669 C ALA A 80 69.854 3.725 5.259 1.00 0.00 C ATOM 1670 O ALA A 80 70.649 3.435 6.131 1.00 0.00 O ATOM 1671 CB ALA A 80 70.897 3.539 2.980 1.00 0.00 C ATOM 0 H ALA A 80 68.469 3.610 2.460 1.00 0.00 H new ATOM 0 HA ALA A 80 70.103 1.923 4.186 1.00 0.00 H new ATOM 0 HB1 ALA A 80 71.872 3.546 3.467 1.00 0.00 H new ATOM 0 HB2 ALA A 80 70.947 2.932 2.076 1.00 0.00 H new ATOM 0 HB3 ALA A 80 70.615 4.559 2.717 1.00 0.00 H new ATOM 1677 N LEU A 81 69.003 4.701 5.450 1.00 0.00 N ATOM 1678 CA LEU A 81 69.032 5.439 6.757 1.00 0.00 C ATOM 1679 C LEU A 81 68.185 4.699 7.812 1.00 0.00 C ATOM 1680 O LEU A 81 68.571 4.585 8.955 1.00 0.00 O ATOM 1681 CB LEU A 81 68.548 6.872 6.540 1.00 0.00 C ATOM 1682 CG LEU A 81 67.102 6.892 5.980 1.00 0.00 C ATOM 1683 CD1 LEU A 81 66.099 7.121 7.116 1.00 0.00 C ATOM 1684 CD2 LEU A 81 66.970 8.026 4.950 1.00 0.00 C ATOM 0 H LEU A 81 68.304 5.016 4.778 1.00 0.00 H new ATOM 0 HA LEU A 81 70.053 5.478 7.136 1.00 0.00 H new ATOM 0 HB2 LEU A 81 68.584 7.418 7.482 1.00 0.00 H new ATOM 0 HB3 LEU A 81 69.217 7.385 5.848 1.00 0.00 H new ATOM 0 HG LEU A 81 66.891 5.933 5.506 1.00 0.00 H new ATOM 0 HD11 LEU A 81 65.087 7.133 6.711 1.00 0.00 H new ATOM 0 HD12 LEU A 81 66.188 6.317 7.847 1.00 0.00 H new ATOM 0 HD13 LEU A 81 66.308 8.076 7.599 1.00 0.00 H new ATOM 0 HD21 LEU A 81 65.954 8.042 4.555 1.00 0.00 H new ATOM 0 HD22 LEU A 81 67.188 8.980 5.430 1.00 0.00 H new ATOM 0 HD23 LEU A 81 67.674 7.861 4.134 1.00 0.00 H new ATOM 1696 N THR A 82 67.053 4.164 7.424 1.00 0.00 N ATOM 1697 CA THR A 82 66.193 3.389 8.384 1.00 0.00 C ATOM 1698 C THR A 82 67.029 2.284 9.040 1.00 0.00 C ATOM 1699 O THR A 82 67.081 2.164 10.250 1.00 0.00 O ATOM 1700 CB THR A 82 65.029 2.757 7.611 1.00 0.00 C ATOM 1701 OG1 THR A 82 64.366 1.822 8.449 1.00 0.00 O ATOM 1702 CG2 THR A 82 65.527 2.038 6.359 1.00 0.00 C ATOM 0 H THR A 82 66.682 4.230 6.476 1.00 0.00 H new ATOM 0 HA THR A 82 65.807 4.055 9.155 1.00 0.00 H new ATOM 0 HB THR A 82 64.346 3.550 7.308 1.00 0.00 H new ATOM 0 HG1 THR A 82 63.620 1.416 7.960 1.00 0.00 H new ATOM 0 HG21 THR A 82 64.681 1.599 5.830 1.00 0.00 H new ATOM 0 HG22 THR A 82 66.032 2.750 5.707 1.00 0.00 H new ATOM 0 HG23 THR A 82 66.224 1.250 6.645 1.00 0.00 H new ATOM 1710 N VAL A 83 67.726 1.513 8.251 1.00 0.00 N ATOM 1711 CA VAL A 83 68.619 0.454 8.819 1.00 0.00 C ATOM 1712 C VAL A 83 69.595 1.104 9.793 1.00 0.00 C ATOM 1713 O VAL A 83 69.900 0.575 10.849 1.00 0.00 O ATOM 1714 CB VAL A 83 69.430 -0.173 7.671 1.00 0.00 C ATOM 1715 CG1 VAL A 83 68.510 -1.050 6.824 1.00 0.00 C ATOM 1716 CG2 VAL A 83 70.038 0.902 6.776 1.00 0.00 C ATOM 0 H VAL A 83 67.718 1.569 7.233 1.00 0.00 H new ATOM 0 HA VAL A 83 68.023 -0.304 9.327 1.00 0.00 H new ATOM 0 HB VAL A 83 70.235 -0.765 8.106 1.00 0.00 H new ATOM 0 HG11 VAL A 83 69.081 -1.496 6.010 1.00 0.00 H new ATOM 0 HG12 VAL A 83 68.087 -1.839 7.445 1.00 0.00 H new ATOM 0 HG13 VAL A 83 67.705 -0.441 6.412 1.00 0.00 H new ATOM 0 HG21 VAL A 83 70.605 0.430 5.974 1.00 0.00 H new ATOM 0 HG22 VAL A 83 69.242 1.512 6.348 1.00 0.00 H new ATOM 0 HG23 VAL A 83 70.702 1.534 7.366 1.00 0.00 H new ATOM 1726 N ALA A 84 70.087 2.253 9.439 1.00 0.00 N ATOM 1727 CA ALA A 84 71.046 2.961 10.319 1.00 0.00 C ATOM 1728 C ALA A 84 70.354 3.368 11.617 1.00 0.00 C ATOM 1729 O ALA A 84 70.995 3.612 12.615 1.00 0.00 O ATOM 1730 CB ALA A 84 71.593 4.199 9.599 1.00 0.00 C ATOM 0 H ALA A 84 69.863 2.736 8.569 1.00 0.00 H new ATOM 0 HA ALA A 84 71.876 2.296 10.557 1.00 0.00 H new ATOM 0 HB1 ALA A 84 72.298 4.717 10.250 1.00 0.00 H new ATOM 0 HB2 ALA A 84 72.101 3.893 8.684 1.00 0.00 H new ATOM 0 HB3 ALA A 84 70.770 4.869 9.350 1.00 0.00 H new ATOM 1736 N CYS A 85 69.053 3.479 11.605 1.00 0.00 N ATOM 1737 CA CYS A 85 68.338 3.908 12.844 1.00 0.00 C ATOM 1738 C CYS A 85 68.398 2.812 13.907 1.00 0.00 C ATOM 1739 O CYS A 85 68.570 3.090 15.076 1.00 0.00 O ATOM 1740 CB CYS A 85 66.884 4.234 12.512 1.00 0.00 C ATOM 1741 SG CYS A 85 66.106 5.050 13.929 1.00 0.00 S ATOM 0 H CYS A 85 68.457 3.293 10.798 1.00 0.00 H new ATOM 0 HA CYS A 85 68.827 4.798 13.240 1.00 0.00 H new ATOM 0 HB2 CYS A 85 66.837 4.881 11.636 1.00 0.00 H new ATOM 0 HB3 CYS A 85 66.343 3.321 12.264 1.00 0.00 H new ATOM 0 HG CYS A 85 65.899 6.302 13.649 1.00 0.00 H new ATOM 1747 N ASN A 86 68.259 1.574 13.531 1.00 0.00 N ATOM 1748 CA ASN A 86 68.316 0.493 14.558 1.00 0.00 C ATOM 1749 C ASN A 86 69.728 0.426 15.149 1.00 0.00 C ATOM 1750 O ASN A 86 69.908 0.234 16.335 1.00 0.00 O ATOM 1751 CB ASN A 86 67.959 -0.853 13.921 1.00 0.00 C ATOM 1752 CG ASN A 86 68.846 -1.098 12.698 1.00 0.00 C ATOM 1753 OD1 ASN A 86 70.117 -1.347 12.865 1.00 0.00 O flip ATOM 1754 ND2 ASN A 86 68.377 -1.067 11.577 1.00 0.00 N flip ATOM 0 H ASN A 86 68.110 1.263 12.571 1.00 0.00 H new ATOM 0 HA ASN A 86 67.599 0.711 15.350 1.00 0.00 H new ATOM 0 HB2 ASN A 86 68.093 -1.656 14.646 1.00 0.00 H new ATOM 0 HB3 ASN A 86 66.909 -0.860 13.628 1.00 0.00 H new ATOM 0 HD21 ASN A 86 67.384 -0.873 11.445 1.00 0.00 H new ATOM 0 HD22 ASN A 86 68.976 -1.235 10.769 1.00 0.00 H new ATOM 1761 N ASN A 87 70.727 0.575 14.324 1.00 0.00 N ATOM 1762 CA ASN A 87 72.139 0.518 14.818 1.00 0.00 C ATOM 1763 C ASN A 87 72.434 1.695 15.756 1.00 0.00 C ATOM 1764 O ASN A 87 73.169 1.567 16.715 1.00 0.00 O ATOM 1765 CB ASN A 87 73.101 0.581 13.632 1.00 0.00 C ATOM 1766 CG ASN A 87 74.538 0.505 14.146 1.00 0.00 C ATOM 1767 OD1 ASN A 87 75.244 1.495 14.161 1.00 0.00 O ATOM 1768 ND2 ASN A 87 75.003 -0.638 14.570 1.00 0.00 N ATOM 0 H ASN A 87 70.629 0.735 13.321 1.00 0.00 H new ATOM 0 HA ASN A 87 72.273 -0.416 15.363 1.00 0.00 H new ATOM 0 HB2 ASN A 87 72.904 -0.242 12.945 1.00 0.00 H new ATOM 0 HB3 ASN A 87 72.950 1.505 13.075 1.00 0.00 H new ATOM 0 HD21 ASN A 87 75.961 -0.703 14.915 1.00 0.00 H new ATOM 0 HD22 ASN A 87 74.409 -1.467 14.556 1.00 0.00 H new ATOM 1775 N PHE A 88 71.903 2.847 15.458 1.00 0.00 N ATOM 1776 CA PHE A 88 72.179 4.057 16.292 1.00 0.00 C ATOM 1777 C PHE A 88 71.165 4.162 17.435 1.00 0.00 C ATOM 1778 O PHE A 88 71.279 5.007 18.299 1.00 0.00 O ATOM 1779 CB PHE A 88 72.075 5.294 15.391 1.00 0.00 C ATOM 1780 CG PHE A 88 72.727 6.490 16.051 1.00 0.00 C ATOM 1781 CD1 PHE A 88 74.105 6.481 16.313 1.00 0.00 C ATOM 1782 CD2 PHE A 88 71.960 7.615 16.391 1.00 0.00 C ATOM 1783 CE1 PHE A 88 74.712 7.592 16.912 1.00 0.00 C ATOM 1784 CE2 PHE A 88 72.568 8.723 16.992 1.00 0.00 C ATOM 1785 CZ PHE A 88 73.943 8.711 17.252 1.00 0.00 C ATOM 0 H PHE A 88 71.283 3.007 14.664 1.00 0.00 H new ATOM 0 HA PHE A 88 73.176 3.985 16.727 1.00 0.00 H new ATOM 0 HB2 PHE A 88 72.555 5.094 14.433 1.00 0.00 H new ATOM 0 HB3 PHE A 88 71.027 5.512 15.184 1.00 0.00 H new ATOM 0 HD1 PHE A 88 74.698 5.617 16.053 1.00 0.00 H new ATOM 0 HD2 PHE A 88 70.899 7.626 16.189 1.00 0.00 H new ATOM 0 HE1 PHE A 88 75.773 7.585 17.112 1.00 0.00 H new ATOM 0 HE2 PHE A 88 71.976 9.587 17.255 1.00 0.00 H new ATOM 0 HZ PHE A 88 74.412 9.566 17.716 1.00 0.00 H new ATOM 1795 N PHE A 89 70.169 3.317 17.446 1.00 0.00 N ATOM 1796 CA PHE A 89 69.145 3.372 18.534 1.00 0.00 C ATOM 1797 C PHE A 89 69.512 2.381 19.644 1.00 0.00 C ATOM 1798 O PHE A 89 69.044 2.485 20.760 1.00 0.00 O ATOM 1799 CB PHE A 89 67.779 3.010 17.946 1.00 0.00 C ATOM 1800 CG PHE A 89 66.718 3.073 19.021 1.00 0.00 C ATOM 1801 CD1 PHE A 89 66.422 1.935 19.780 1.00 0.00 C ATOM 1802 CD2 PHE A 89 66.026 4.268 19.251 1.00 0.00 C ATOM 1803 CE1 PHE A 89 65.434 1.992 20.771 1.00 0.00 C ATOM 1804 CE2 PHE A 89 65.040 4.328 20.242 1.00 0.00 C ATOM 1805 CZ PHE A 89 64.743 3.189 21.002 1.00 0.00 C ATOM 0 H PHE A 89 70.019 2.589 16.748 1.00 0.00 H new ATOM 0 HA PHE A 89 69.110 4.376 18.957 1.00 0.00 H new ATOM 0 HB2 PHE A 89 67.529 3.696 17.137 1.00 0.00 H new ATOM 0 HB3 PHE A 89 67.813 2.009 17.516 1.00 0.00 H new ATOM 0 HD1 PHE A 89 66.955 1.013 19.602 1.00 0.00 H new ATOM 0 HD2 PHE A 89 66.253 5.145 18.663 1.00 0.00 H new ATOM 0 HE1 PHE A 89 65.205 1.114 21.357 1.00 0.00 H new ATOM 0 HE2 PHE A 89 64.509 5.251 20.421 1.00 0.00 H new ATOM 0 HZ PHE A 89 63.981 3.234 21.766 1.00 0.00 H new ATOM 1815 N TRP A 90 70.338 1.410 19.342 1.00 0.00 N ATOM 1816 CA TRP A 90 70.725 0.400 20.378 1.00 0.00 C ATOM 1817 C TRP A 90 71.944 0.884 21.175 1.00 0.00 C ATOM 1818 O TRP A 90 72.253 0.352 22.222 1.00 0.00 O ATOM 1819 CB TRP A 90 71.065 -0.924 19.687 1.00 0.00 C ATOM 1820 CG TRP A 90 71.586 -1.897 20.696 1.00 0.00 C ATOM 1821 CD1 TRP A 90 70.821 -2.677 21.496 1.00 0.00 C ATOM 1822 CD2 TRP A 90 72.971 -2.202 21.032 1.00 0.00 C ATOM 1823 NE1 TRP A 90 71.650 -3.442 22.299 1.00 0.00 N ATOM 1824 CE2 TRP A 90 72.983 -3.186 22.049 1.00 0.00 C ATOM 1825 CE3 TRP A 90 74.204 -1.726 20.554 1.00 0.00 C ATOM 1826 CZ2 TRP A 90 74.178 -3.678 22.576 1.00 0.00 C ATOM 1827 CZ3 TRP A 90 75.410 -2.218 21.082 1.00 0.00 C ATOM 1828 CH2 TRP A 90 75.396 -3.193 22.091 1.00 0.00 C ATOM 0 H TRP A 90 70.761 1.272 18.424 1.00 0.00 H new ATOM 0 HA TRP A 90 69.890 0.262 21.065 1.00 0.00 H new ATOM 0 HB2 TRP A 90 70.178 -1.330 19.200 1.00 0.00 H new ATOM 0 HB3 TRP A 90 71.809 -0.759 18.908 1.00 0.00 H new ATOM 0 HD1 TRP A 90 69.741 -2.699 21.506 1.00 0.00 H new ATOM 0 HE1 TRP A 90 71.316 -4.113 22.991 1.00 0.00 H new ATOM 0 HE3 TRP A 90 74.225 -0.977 19.776 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 74.162 -4.428 23.353 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 76.352 -1.844 20.709 1.00 0.00 H new ATOM 0 HH2 TRP A 90 76.326 -3.568 22.493 1.00 0.00 H new ATOM 1889 N SER B 2 53.605 10.150 8.216 1.00 0.00 N ATOM 1890 CA SER B 2 52.374 9.373 7.851 1.00 0.00 C ATOM 1891 C SER B 2 52.753 8.138 7.024 1.00 0.00 C ATOM 1892 O SER B 2 53.194 7.143 7.562 1.00 0.00 O ATOM 1893 CB SER B 2 51.427 10.264 7.049 1.00 0.00 C ATOM 1894 OG SER B 2 52.076 10.684 5.856 1.00 0.00 O ATOM 0 HA SER B 2 51.877 9.044 8.763 1.00 0.00 H new ATOM 0 HB2 SER B 2 50.514 9.720 6.808 1.00 0.00 H new ATOM 0 HB3 SER B 2 51.134 11.130 7.642 1.00 0.00 H new ATOM 0 HG SER B 2 51.471 11.255 5.338 1.00 0.00 H new ATOM 1900 N GLU B 3 52.536 8.158 5.734 1.00 0.00 N ATOM 1901 CA GLU B 3 52.829 6.944 4.914 1.00 0.00 C ATOM 1902 C GLU B 3 54.307 6.545 5.005 1.00 0.00 C ATOM 1903 O GLU B 3 54.630 5.378 5.110 1.00 0.00 O ATOM 1904 CB GLU B 3 52.489 7.234 3.449 1.00 0.00 C ATOM 1905 CG GLU B 3 50.972 7.355 3.288 1.00 0.00 C ATOM 1906 CD GLU B 3 50.636 7.661 1.828 1.00 0.00 C ATOM 1907 OE1 GLU B 3 50.576 6.726 1.046 1.00 0.00 O ATOM 1908 OE2 GLU B 3 50.441 8.825 1.516 1.00 0.00 O ATOM 0 H GLU B 3 52.171 8.957 5.215 1.00 0.00 H new ATOM 0 HA GLU B 3 52.225 6.123 5.300 1.00 0.00 H new ATOM 0 HB2 GLU B 3 52.974 8.156 3.128 1.00 0.00 H new ATOM 0 HB3 GLU B 3 52.870 6.436 2.812 1.00 0.00 H new ATOM 0 HG2 GLU B 3 50.488 6.429 3.597 1.00 0.00 H new ATOM 0 HG3 GLU B 3 50.589 8.145 3.934 1.00 0.00 H new ATOM 1915 N LEU B 4 55.209 7.484 4.941 1.00 0.00 N ATOM 1916 CA LEU B 4 56.652 7.107 4.997 1.00 0.00 C ATOM 1917 C LEU B 4 57.044 6.603 6.386 1.00 0.00 C ATOM 1918 O LEU B 4 57.794 5.654 6.512 1.00 0.00 O ATOM 1919 CB LEU B 4 57.529 8.309 4.612 1.00 0.00 C ATOM 1920 CG LEU B 4 57.601 8.433 3.086 1.00 0.00 C ATOM 1921 CD1 LEU B 4 58.247 9.776 2.713 1.00 0.00 C ATOM 1922 CD2 LEU B 4 58.429 7.263 2.498 1.00 0.00 C ATOM 0 H LEU B 4 55.016 8.482 4.854 1.00 0.00 H new ATOM 0 HA LEU B 4 56.812 6.298 4.285 1.00 0.00 H new ATOM 0 HB2 LEU B 4 57.118 9.223 5.041 1.00 0.00 H new ATOM 0 HB3 LEU B 4 58.531 8.186 5.024 1.00 0.00 H new ATOM 0 HG LEU B 4 56.594 8.391 2.672 1.00 0.00 H new ATOM 0 HD11 LEU B 4 58.299 9.866 1.628 1.00 0.00 H new ATOM 0 HD12 LEU B 4 57.648 10.592 3.116 1.00 0.00 H new ATOM 0 HD13 LEU B 4 59.253 9.824 3.130 1.00 0.00 H new ATOM 0 HD21 LEU B 4 58.475 7.359 1.413 1.00 0.00 H new ATOM 0 HD22 LEU B 4 59.439 7.290 2.908 1.00 0.00 H new ATOM 0 HD23 LEU B 4 57.957 6.316 2.759 1.00 0.00 H new ATOM 1934 N GLU B 5 56.576 7.219 7.429 1.00 0.00 N ATOM 1935 CA GLU B 5 56.981 6.740 8.777 1.00 0.00 C ATOM 1936 C GLU B 5 56.392 5.351 9.019 1.00 0.00 C ATOM 1937 O GLU B 5 57.001 4.495 9.627 1.00 0.00 O ATOM 1938 CB GLU B 5 56.512 7.724 9.854 1.00 0.00 C ATOM 1939 CG GLU B 5 56.959 7.242 11.242 1.00 0.00 C ATOM 1940 CD GLU B 5 56.005 6.157 11.746 1.00 0.00 C ATOM 1941 OE1 GLU B 5 54.809 6.314 11.558 1.00 0.00 O ATOM 1942 OE2 GLU B 5 56.483 5.192 12.315 1.00 0.00 O ATOM 0 H GLU B 5 55.943 8.018 7.412 1.00 0.00 H new ATOM 0 HA GLU B 5 58.068 6.678 8.828 1.00 0.00 H new ATOM 0 HB2 GLU B 5 56.921 8.714 9.655 1.00 0.00 H new ATOM 0 HB3 GLU B 5 55.426 7.816 9.825 1.00 0.00 H new ATOM 0 HG2 GLU B 5 57.975 6.851 11.191 1.00 0.00 H new ATOM 0 HG3 GLU B 5 56.974 8.079 11.940 1.00 0.00 H new ATOM 1949 N THR B 6 55.206 5.128 8.543 1.00 0.00 N ATOM 1950 CA THR B 6 54.557 3.803 8.726 1.00 0.00 C ATOM 1951 C THR B 6 55.405 2.703 8.084 1.00 0.00 C ATOM 1952 O THR B 6 55.636 1.660 8.657 1.00 0.00 O ATOM 1953 CB THR B 6 53.205 3.839 8.015 1.00 0.00 C ATOM 1954 OG1 THR B 6 52.395 4.853 8.593 1.00 0.00 O ATOM 1955 CG2 THR B 6 52.520 2.482 8.157 1.00 0.00 C ATOM 0 H THR B 6 54.651 5.812 8.029 1.00 0.00 H new ATOM 0 HA THR B 6 54.445 3.596 9.790 1.00 0.00 H new ATOM 0 HB THR B 6 53.352 4.057 6.957 1.00 0.00 H new ATOM 0 HG1 THR B 6 52.412 5.650 8.023 1.00 0.00 H new ATOM 0 HG21 THR B 6 51.555 2.507 7.650 1.00 0.00 H new ATOM 0 HG22 THR B 6 53.146 1.710 7.709 1.00 0.00 H new ATOM 0 HG23 THR B 6 52.369 2.259 9.213 1.00 0.00 H new ATOM 1963 N ALA B 7 55.831 2.930 6.873 1.00 0.00 N ATOM 1964 CA ALA B 7 56.631 1.920 6.124 1.00 0.00 C ATOM 1965 C ALA B 7 58.044 1.732 6.689 1.00 0.00 C ATOM 1966 O ALA B 7 58.630 0.682 6.526 1.00 0.00 O ATOM 1967 CB ALA B 7 56.746 2.388 4.672 1.00 0.00 C ATOM 0 H ALA B 7 55.654 3.793 6.359 1.00 0.00 H new ATOM 0 HA ALA B 7 56.119 0.962 6.211 1.00 0.00 H new ATOM 0 HB1 ALA B 7 57.328 1.664 4.102 1.00 0.00 H new ATOM 0 HB2 ALA B 7 55.750 2.475 4.238 1.00 0.00 H new ATOM 0 HB3 ALA B 7 57.242 3.358 4.641 1.00 0.00 H new ATOM 1973 N MET B 8 58.627 2.712 7.319 1.00 0.00 N ATOM 1974 CA MET B 8 60.017 2.498 7.817 1.00 0.00 C ATOM 1975 C MET B 8 59.991 1.611 9.062 1.00 0.00 C ATOM 1976 O MET B 8 60.781 0.696 9.204 1.00 0.00 O ATOM 1977 CB MET B 8 60.694 3.861 8.081 1.00 0.00 C ATOM 1978 CG MET B 8 60.330 4.413 9.462 1.00 0.00 C ATOM 1979 SD MET B 8 61.362 3.623 10.728 1.00 0.00 S ATOM 1980 CE MET B 8 62.955 4.340 10.246 1.00 0.00 C ATOM 0 H MET B 8 58.218 3.627 7.508 1.00 0.00 H new ATOM 0 HA MET B 8 60.609 1.981 7.062 1.00 0.00 H new ATOM 0 HB2 MET B 8 61.776 3.751 8.006 1.00 0.00 H new ATOM 0 HB3 MET B 8 60.392 4.573 7.313 1.00 0.00 H new ATOM 0 HG2 MET B 8 60.476 5.493 9.482 1.00 0.00 H new ATOM 0 HG3 MET B 8 59.276 4.229 9.671 1.00 0.00 H new ATOM 0 HE1 MET B 8 63.675 3.541 10.070 1.00 0.00 H new ATOM 0 HE2 MET B 8 62.830 4.923 9.334 1.00 0.00 H new ATOM 0 HE3 MET B 8 63.319 4.988 11.044 1.00 0.00 H new ATOM 1990 N GLU B 9 59.101 1.881 9.971 1.00 0.00 N ATOM 1991 CA GLU B 9 59.033 1.075 11.212 1.00 0.00 C ATOM 1992 C GLU B 9 58.487 -0.327 10.928 1.00 0.00 C ATOM 1993 O GLU B 9 58.897 -1.288 11.543 1.00 0.00 O ATOM 1994 CB GLU B 9 58.150 1.792 12.223 1.00 0.00 C ATOM 1995 CG GLU B 9 58.857 3.046 12.728 1.00 0.00 C ATOM 1996 CD GLU B 9 58.015 3.706 13.819 1.00 0.00 C ATOM 1997 OE1 GLU B 9 56.941 3.198 14.102 1.00 0.00 O ATOM 1998 OE2 GLU B 9 58.457 4.709 14.355 1.00 0.00 O ATOM 0 H GLU B 9 58.414 2.632 9.905 1.00 0.00 H new ATOM 0 HA GLU B 9 60.039 0.963 11.617 1.00 0.00 H new ATOM 0 HB2 GLU B 9 57.199 2.060 11.763 1.00 0.00 H new ATOM 0 HB3 GLU B 9 57.925 1.129 13.058 1.00 0.00 H new ATOM 0 HG2 GLU B 9 59.841 2.788 13.120 1.00 0.00 H new ATOM 0 HG3 GLU B 9 59.015 3.743 11.905 1.00 0.00 H new ATOM 2005 N THR B 10 57.547 -0.464 10.029 1.00 0.00 N ATOM 2006 CA THR B 10 56.998 -1.821 9.775 1.00 0.00 C ATOM 2007 C THR B 10 58.116 -2.752 9.278 1.00 0.00 C ATOM 2008 O THR B 10 58.350 -3.774 9.871 1.00 0.00 O ATOM 2009 CB THR B 10 55.796 -1.740 8.814 1.00 0.00 C ATOM 2010 OG1 THR B 10 54.826 -2.702 9.204 1.00 0.00 O ATOM 2011 CG2 THR B 10 56.202 -1.997 7.364 1.00 0.00 C ATOM 0 H THR B 10 57.145 0.290 9.472 1.00 0.00 H new ATOM 0 HA THR B 10 56.620 -2.252 10.702 1.00 0.00 H new ATOM 0 HB THR B 10 55.388 -0.731 8.871 1.00 0.00 H new ATOM 0 HG1 THR B 10 55.247 -3.378 9.775 1.00 0.00 H new ATOM 0 HG21 THR B 10 55.323 -1.930 6.723 1.00 0.00 H new ATOM 0 HG22 THR B 10 56.935 -1.252 7.054 1.00 0.00 H new ATOM 0 HG23 THR B 10 56.638 -2.992 7.279 1.00 0.00 H new ATOM 2019 N LEU B 11 58.829 -2.419 8.228 1.00 0.00 N ATOM 2020 CA LEU B 11 59.933 -3.318 7.767 1.00 0.00 C ATOM 2021 C LEU B 11 60.782 -3.698 8.985 1.00 0.00 C ATOM 2022 O LEU B 11 61.182 -4.825 9.146 1.00 0.00 O ATOM 2023 CB LEU B 11 60.801 -2.568 6.731 1.00 0.00 C ATOM 2024 CG LEU B 11 60.302 -2.848 5.302 1.00 0.00 C ATOM 2025 CD1 LEU B 11 58.846 -2.414 5.160 1.00 0.00 C ATOM 2026 CD2 LEU B 11 61.151 -2.063 4.299 1.00 0.00 C ATOM 0 H LEU B 11 58.696 -1.572 7.675 1.00 0.00 H new ATOM 0 HA LEU B 11 59.528 -4.217 7.303 1.00 0.00 H new ATOM 0 HB2 LEU B 11 60.770 -1.497 6.930 1.00 0.00 H new ATOM 0 HB3 LEU B 11 61.841 -2.879 6.826 1.00 0.00 H new ATOM 0 HG LEU B 11 60.384 -3.917 5.105 1.00 0.00 H new ATOM 0 HD11 LEU B 11 58.503 -2.617 4.145 1.00 0.00 H new ATOM 0 HD12 LEU B 11 58.230 -2.968 5.868 1.00 0.00 H new ATOM 0 HD13 LEU B 11 58.763 -1.347 5.365 1.00 0.00 H new ATOM 0 HD21 LEU B 11 60.797 -2.262 3.288 1.00 0.00 H new ATOM 0 HD22 LEU B 11 61.069 -0.997 4.509 1.00 0.00 H new ATOM 0 HD23 LEU B 11 62.193 -2.370 4.385 1.00 0.00 H new ATOM 2038 N ILE B 12 61.026 -2.778 9.860 1.00 0.00 N ATOM 2039 CA ILE B 12 61.817 -3.108 11.076 1.00 0.00 C ATOM 2040 C ILE B 12 61.045 -4.139 11.925 1.00 0.00 C ATOM 2041 O ILE B 12 61.629 -4.924 12.645 1.00 0.00 O ATOM 2042 CB ILE B 12 62.085 -1.807 11.846 1.00 0.00 C ATOM 2043 CG1 ILE B 12 63.042 -0.931 11.023 1.00 0.00 C ATOM 2044 CG2 ILE B 12 62.730 -2.105 13.190 1.00 0.00 C ATOM 2045 CD1 ILE B 12 63.104 0.487 11.602 1.00 0.00 C ATOM 0 H ILE B 12 60.715 -1.809 9.792 1.00 0.00 H new ATOM 0 HA ILE B 12 62.775 -3.556 10.814 1.00 0.00 H new ATOM 0 HB ILE B 12 61.138 -1.293 12.012 1.00 0.00 H new ATOM 0 HG12 ILE B 12 64.038 -1.373 11.021 1.00 0.00 H new ATOM 0 HG13 ILE B 12 62.708 -0.892 9.986 1.00 0.00 H new ATOM 0 HG21 ILE B 12 62.912 -1.171 13.721 1.00 0.00 H new ATOM 0 HG22 ILE B 12 62.065 -2.735 13.781 1.00 0.00 H new ATOM 0 HG23 ILE B 12 63.676 -2.624 13.033 1.00 0.00 H new ATOM 0 HD11 ILE B 12 63.786 1.094 11.007 1.00 0.00 H new ATOM 0 HD12 ILE B 12 62.109 0.933 11.580 1.00 0.00 H new ATOM 0 HD13 ILE B 12 63.460 0.444 12.631 1.00 0.00 H new ATOM 2057 N ASN B 13 59.739 -4.142 11.843 1.00 0.00 N ATOM 2058 CA ASN B 13 58.910 -5.116 12.632 1.00 0.00 C ATOM 2059 C ASN B 13 58.941 -6.532 12.018 1.00 0.00 C ATOM 2060 O ASN B 13 59.256 -7.501 12.679 1.00 0.00 O ATOM 2061 CB ASN B 13 57.458 -4.630 12.612 1.00 0.00 C ATOM 2062 CG ASN B 13 56.629 -5.463 13.594 1.00 0.00 C ATOM 2063 OD1 ASN B 13 57.078 -6.483 14.077 1.00 0.00 O ATOM 2064 ND2 ASN B 13 55.425 -5.068 13.913 1.00 0.00 N ATOM 0 H ASN B 13 59.201 -3.504 11.256 1.00 0.00 H new ATOM 0 HA ASN B 13 59.316 -5.168 13.642 1.00 0.00 H new ATOM 0 HB2 ASN B 13 57.412 -3.575 12.884 1.00 0.00 H new ATOM 0 HB3 ASN B 13 57.047 -4.718 11.606 1.00 0.00 H new ATOM 0 HD21 ASN B 13 54.865 -5.616 14.566 1.00 0.00 H new ATOM 0 HD22 ASN B 13 55.045 -4.212 13.509 1.00 0.00 H new ATOM 2071 N VAL B 14 58.577 -6.649 10.769 1.00 0.00 N ATOM 2072 CA VAL B 14 58.533 -7.973 10.096 1.00 0.00 C ATOM 2073 C VAL B 14 59.934 -8.596 10.052 1.00 0.00 C ATOM 2074 O VAL B 14 60.116 -9.763 10.342 1.00 0.00 O ATOM 2075 CB VAL B 14 57.967 -7.756 8.680 1.00 0.00 C ATOM 2076 CG1 VAL B 14 59.058 -7.251 7.730 1.00 0.00 C ATOM 2077 CG2 VAL B 14 57.349 -9.056 8.138 1.00 0.00 C ATOM 0 H VAL B 14 58.303 -5.864 10.178 1.00 0.00 H new ATOM 0 HA VAL B 14 57.895 -8.666 10.644 1.00 0.00 H new ATOM 0 HB VAL B 14 57.185 -6.999 8.741 1.00 0.00 H new ATOM 0 HG11 VAL B 14 58.636 -7.105 6.736 1.00 0.00 H new ATOM 0 HG12 VAL B 14 59.453 -6.304 8.099 1.00 0.00 H new ATOM 0 HG13 VAL B 14 59.863 -7.984 7.678 1.00 0.00 H new ATOM 0 HG21 VAL B 14 56.955 -8.882 7.137 1.00 0.00 H new ATOM 0 HG22 VAL B 14 58.113 -9.833 8.097 1.00 0.00 H new ATOM 0 HG23 VAL B 14 56.541 -9.376 8.795 1.00 0.00 H new ATOM 2087 N PHE B 15 60.921 -7.831 9.677 1.00 0.00 N ATOM 2088 CA PHE B 15 62.307 -8.383 9.600 1.00 0.00 C ATOM 2089 C PHE B 15 62.743 -8.893 10.982 1.00 0.00 C ATOM 2090 O PHE B 15 63.366 -9.920 11.088 1.00 0.00 O ATOM 2091 CB PHE B 15 63.296 -7.305 9.098 1.00 0.00 C ATOM 2092 CG PHE B 15 63.251 -7.145 7.589 1.00 0.00 C ATOM 2093 CD1 PHE B 15 63.460 -8.249 6.747 1.00 0.00 C ATOM 2094 CD2 PHE B 15 63.020 -5.879 7.026 1.00 0.00 C ATOM 2095 CE1 PHE B 15 63.427 -8.082 5.359 1.00 0.00 C ATOM 2096 CE2 PHE B 15 62.989 -5.719 5.642 1.00 0.00 C ATOM 2097 CZ PHE B 15 63.189 -6.819 4.807 1.00 0.00 C ATOM 0 H PHE B 15 60.830 -6.848 9.420 1.00 0.00 H new ATOM 0 HA PHE B 15 62.312 -9.212 8.893 1.00 0.00 H new ATOM 0 HB2 PHE B 15 63.062 -6.351 9.570 1.00 0.00 H new ATOM 0 HB3 PHE B 15 64.308 -7.572 9.404 1.00 0.00 H new ATOM 0 HD1 PHE B 15 63.646 -9.225 7.170 1.00 0.00 H new ATOM 0 HD2 PHE B 15 62.866 -5.025 7.669 1.00 0.00 H new ATOM 0 HE1 PHE B 15 63.586 -8.931 4.711 1.00 0.00 H new ATOM 0 HE2 PHE B 15 62.810 -4.743 5.215 1.00 0.00 H new ATOM 0 HZ PHE B 15 63.160 -6.695 3.735 1.00 0.00 H new ATOM 2107 N HIS B 16 62.430 -8.215 12.039 1.00 0.00 N ATOM 2108 CA HIS B 16 62.851 -8.726 13.377 1.00 0.00 C ATOM 2109 C HIS B 16 62.230 -10.112 13.623 1.00 0.00 C ATOM 2110 O HIS B 16 62.841 -10.979 14.220 1.00 0.00 O ATOM 2111 CB HIS B 16 62.379 -7.758 14.476 1.00 0.00 C ATOM 2112 CG HIS B 16 63.308 -6.572 14.581 1.00 0.00 C ATOM 2113 ND1 HIS B 16 62.840 -5.301 14.886 1.00 0.00 N ATOM 2114 CD2 HIS B 16 64.677 -6.447 14.466 1.00 0.00 C ATOM 2115 CE1 HIS B 16 63.903 -4.479 14.949 1.00 0.00 C ATOM 2116 NE2 HIS B 16 65.041 -5.126 14.699 1.00 0.00 N ATOM 0 H HIS B 16 61.908 -7.339 12.045 1.00 0.00 H new ATOM 0 HA HIS B 16 63.938 -8.803 13.401 1.00 0.00 H new ATOM 0 HB2 HIS B 16 61.368 -7.415 14.255 1.00 0.00 H new ATOM 0 HB3 HIS B 16 62.337 -8.279 15.433 1.00 0.00 H new ATOM 0 HD2 HIS B 16 65.360 -7.250 14.231 1.00 0.00 H new ATOM 0 HE1 HIS B 16 63.842 -3.425 15.174 1.00 0.00 H new ATOM 0 HE2 HIS B 16 65.982 -4.734 14.682 1.00 0.00 H new ATOM 2125 N ALA B 17 61.013 -10.305 13.209 1.00 0.00 N ATOM 2126 CA ALA B 17 60.315 -11.603 13.457 1.00 0.00 C ATOM 2127 C ALA B 17 61.036 -12.822 12.853 1.00 0.00 C ATOM 2128 O ALA B 17 61.325 -13.779 13.543 1.00 0.00 O ATOM 2129 CB ALA B 17 58.924 -11.520 12.828 1.00 0.00 C ATOM 0 H ALA B 17 60.461 -9.613 12.702 1.00 0.00 H new ATOM 0 HA ALA B 17 60.287 -11.749 14.537 1.00 0.00 H new ATOM 0 HB1 ALA B 17 58.393 -12.457 12.995 1.00 0.00 H new ATOM 0 HB2 ALA B 17 58.367 -10.701 13.283 1.00 0.00 H new ATOM 0 HB3 ALA B 17 59.019 -11.343 11.757 1.00 0.00 H new ATOM 2135 N HIS B 18 61.289 -12.825 11.571 1.00 0.00 N ATOM 2136 CA HIS B 18 61.939 -14.023 10.942 1.00 0.00 C ATOM 2137 C HIS B 18 63.462 -13.997 11.110 1.00 0.00 C ATOM 2138 O HIS B 18 64.091 -15.005 11.362 1.00 0.00 O ATOM 2139 CB HIS B 18 61.599 -14.042 9.450 1.00 0.00 C ATOM 2140 CG HIS B 18 60.141 -14.364 9.273 1.00 0.00 C ATOM 2141 ND1 HIS B 18 59.681 -15.665 9.123 1.00 0.00 N ATOM 2142 CD2 HIS B 18 59.025 -13.564 9.228 1.00 0.00 C ATOM 2143 CE1 HIS B 18 58.342 -15.609 8.997 1.00 0.00 C ATOM 2144 NE2 HIS B 18 57.894 -14.354 9.055 1.00 0.00 N ATOM 0 H HIS B 18 61.077 -12.058 10.932 1.00 0.00 H new ATOM 0 HA HIS B 18 61.562 -14.917 11.439 1.00 0.00 H new ATOM 0 HB2 HIS B 18 61.826 -13.075 9.002 1.00 0.00 H new ATOM 0 HB3 HIS B 18 62.211 -14.783 8.936 1.00 0.00 H new ATOM 0 HD2 HIS B 18 59.026 -12.487 9.314 1.00 0.00 H new ATOM 0 HE1 HIS B 18 57.708 -16.474 8.865 1.00 0.00 H new ATOM 0 HE2 HIS B 18 56.926 -14.040 8.987 1.00 0.00 H new ATOM 2153 N SER B 19 64.052 -12.857 10.939 1.00 0.00 N ATOM 2154 CA SER B 19 65.535 -12.708 11.037 1.00 0.00 C ATOM 2155 C SER B 19 66.093 -13.091 12.411 1.00 0.00 C ATOM 2156 O SER B 19 67.208 -13.564 12.512 1.00 0.00 O ATOM 2157 CB SER B 19 65.878 -11.238 10.800 1.00 0.00 C ATOM 2158 OG SER B 19 65.718 -10.520 12.016 1.00 0.00 O ATOM 0 H SER B 19 63.558 -11.990 10.728 1.00 0.00 H new ATOM 0 HA SER B 19 65.976 -13.377 10.298 1.00 0.00 H new ATOM 0 HB2 SER B 19 66.903 -11.144 10.440 1.00 0.00 H new ATOM 0 HB3 SER B 19 65.230 -10.821 10.029 1.00 0.00 H new ATOM 0 HG SER B 19 64.833 -10.099 12.033 1.00 0.00 H new ATOM 2164 N GLY B 20 65.368 -12.855 13.475 1.00 0.00 N ATOM 2165 CA GLY B 20 65.910 -13.166 14.836 1.00 0.00 C ATOM 2166 C GLY B 20 65.333 -14.471 15.367 1.00 0.00 C ATOM 2167 O GLY B 20 65.502 -14.791 16.527 1.00 0.00 O ATOM 0 H GLY B 20 64.427 -12.462 13.462 1.00 0.00 H new ATOM 0 HA2 GLY B 20 66.997 -13.236 14.791 1.00 0.00 H new ATOM 0 HA3 GLY B 20 65.671 -12.353 15.521 1.00 0.00 H new ATOM 2171 N LYS B 21 64.645 -15.226 14.546 1.00 0.00 N ATOM 2172 CA LYS B 21 64.048 -16.515 15.034 1.00 0.00 C ATOM 2173 C LYS B 21 64.555 -17.677 14.188 1.00 0.00 C ATOM 2174 O LYS B 21 65.342 -18.482 14.646 1.00 0.00 O ATOM 2175 CB LYS B 21 62.525 -16.415 14.963 1.00 0.00 C ATOM 2176 CG LYS B 21 61.887 -17.614 15.672 1.00 0.00 C ATOM 2177 CD LYS B 21 60.386 -17.363 15.874 1.00 0.00 C ATOM 2178 CE LYS B 21 59.627 -17.594 14.565 1.00 0.00 C ATOM 2179 NZ LYS B 21 59.890 -18.977 14.073 1.00 0.00 N ATOM 0 H LYS B 21 64.470 -15.010 13.565 1.00 0.00 H new ATOM 0 HA LYS B 21 64.345 -16.695 16.067 1.00 0.00 H new ATOM 0 HB2 LYS B 21 62.191 -15.487 15.428 1.00 0.00 H new ATOM 0 HB3 LYS B 21 62.203 -16.384 13.922 1.00 0.00 H new ATOM 0 HG2 LYS B 21 62.037 -18.518 15.082 1.00 0.00 H new ATOM 0 HG3 LYS B 21 62.370 -17.777 16.635 1.00 0.00 H new ATOM 0 HD2 LYS B 21 60.000 -18.027 16.648 1.00 0.00 H new ATOM 0 HD3 LYS B 21 60.225 -16.342 16.220 1.00 0.00 H new ATOM 0 HE2 LYS B 21 58.558 -17.450 14.722 1.00 0.00 H new ATOM 0 HE3 LYS B 21 59.940 -16.865 13.817 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 60.363 -18.932 13.148 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 60.501 -19.476 14.751 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 58.990 -19.488 13.977 1.00 0.00 H new ATOM 2193 N GLU B 22 64.132 -17.784 12.971 1.00 0.00 N ATOM 2194 CA GLU B 22 64.621 -18.912 12.134 1.00 0.00 C ATOM 2195 C GLU B 22 66.035 -18.595 11.630 1.00 0.00 C ATOM 2196 O GLU B 22 66.317 -18.696 10.453 1.00 0.00 O ATOM 2197 CB GLU B 22 63.674 -19.122 10.946 1.00 0.00 C ATOM 2198 CG GLU B 22 62.365 -19.755 11.435 1.00 0.00 C ATOM 2199 CD GLU B 22 62.624 -21.200 11.871 1.00 0.00 C ATOM 2200 OE1 GLU B 22 63.554 -21.798 11.355 1.00 0.00 O ATOM 2201 OE2 GLU B 22 61.885 -21.686 12.712 1.00 0.00 O ATOM 0 H GLU B 22 63.475 -17.149 12.517 1.00 0.00 H new ATOM 0 HA GLU B 22 64.648 -19.825 12.729 1.00 0.00 H new ATOM 0 HB2 GLU B 22 63.469 -18.169 10.459 1.00 0.00 H new ATOM 0 HB3 GLU B 22 64.145 -19.765 10.202 1.00 0.00 H new ATOM 0 HG2 GLU B 22 61.960 -19.180 12.268 1.00 0.00 H new ATOM 0 HG3 GLU B 22 61.619 -19.732 10.640 1.00 0.00 H new ATOM 2208 N GLY B 23 66.936 -18.220 12.515 1.00 0.00 N ATOM 2209 CA GLY B 23 68.327 -17.915 12.059 1.00 0.00 C ATOM 2210 C GLY B 23 69.158 -17.260 13.169 1.00 0.00 C ATOM 2211 O GLY B 23 69.061 -17.603 14.331 1.00 0.00 O ATOM 0 H GLY B 23 66.768 -18.115 13.516 1.00 0.00 H new ATOM 0 HA2 GLY B 23 68.814 -18.835 11.735 1.00 0.00 H new ATOM 0 HA3 GLY B 23 68.289 -17.253 11.194 1.00 0.00 H new ATOM 2215 N ASP B 24 69.989 -16.318 12.795 1.00 0.00 N ATOM 2216 CA ASP B 24 70.863 -15.620 13.790 1.00 0.00 C ATOM 2217 C ASP B 24 70.107 -14.485 14.479 1.00 0.00 C ATOM 2218 O ASP B 24 69.120 -13.981 13.984 1.00 0.00 O ATOM 2219 CB ASP B 24 72.080 -15.038 13.073 1.00 0.00 C ATOM 2220 CG ASP B 24 73.012 -16.166 12.627 1.00 0.00 C ATOM 2221 OD1 ASP B 24 72.896 -17.254 13.165 1.00 0.00 O ATOM 2222 OD2 ASP B 24 73.834 -15.917 11.761 1.00 0.00 O ATOM 0 H ASP B 24 70.100 -15.999 11.832 1.00 0.00 H new ATOM 0 HA ASP B 24 71.174 -16.345 14.543 1.00 0.00 H new ATOM 0 HB2 ASP B 24 71.760 -14.456 12.209 1.00 0.00 H new ATOM 0 HB3 ASP B 24 72.612 -14.356 13.737 1.00 0.00 H new ATOM 2227 N LYS B 25 70.568 -14.096 15.636 1.00 0.00 N ATOM 2228 CA LYS B 25 69.892 -13.009 16.399 1.00 0.00 C ATOM 2229 C LYS B 25 69.695 -11.767 15.527 1.00 0.00 C ATOM 2230 O LYS B 25 68.585 -11.308 15.347 1.00 0.00 O ATOM 2231 CB LYS B 25 70.764 -12.612 17.592 1.00 0.00 C ATOM 2232 CG LYS B 25 70.986 -13.808 18.523 1.00 0.00 C ATOM 2233 CD LYS B 25 69.763 -14.018 19.426 1.00 0.00 C ATOM 2234 CE LYS B 25 70.065 -15.114 20.448 1.00 0.00 C ATOM 2235 NZ LYS B 25 69.901 -16.451 19.808 1.00 0.00 N ATOM 0 H LYS B 25 71.393 -14.489 16.090 1.00 0.00 H new ATOM 0 HA LYS B 25 68.921 -13.380 16.727 1.00 0.00 H new ATOM 0 HB2 LYS B 25 71.724 -12.237 17.238 1.00 0.00 H new ATOM 0 HB3 LYS B 25 70.288 -11.800 18.142 1.00 0.00 H new ATOM 0 HG2 LYS B 25 71.169 -14.706 17.934 1.00 0.00 H new ATOM 0 HG3 LYS B 25 71.873 -13.641 19.134 1.00 0.00 H new ATOM 0 HD2 LYS B 25 69.511 -13.089 19.937 1.00 0.00 H new ATOM 0 HD3 LYS B 25 68.897 -14.295 18.825 1.00 0.00 H new ATOM 0 HE2 LYS B 25 71.081 -15.003 20.827 1.00 0.00 H new ATOM 0 HE3 LYS B 25 69.395 -15.024 21.303 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 70.107 -17.196 20.504 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 68.924 -16.555 19.467 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 70.558 -16.535 19.006 1.00 0.00 H new ATOM 2249 N TYR B 26 70.763 -11.188 15.022 1.00 0.00 N ATOM 2250 CA TYR B 26 70.636 -9.930 14.197 1.00 0.00 C ATOM 2251 C TYR B 26 71.063 -10.152 12.740 1.00 0.00 C ATOM 2252 O TYR B 26 71.458 -9.222 12.065 1.00 0.00 O ATOM 2253 CB TYR B 26 71.531 -8.847 14.801 1.00 0.00 C ATOM 2254 CG TYR B 26 71.039 -8.498 16.183 1.00 0.00 C ATOM 2255 CD1 TYR B 26 70.064 -7.508 16.347 1.00 0.00 C ATOM 2256 CD2 TYR B 26 71.560 -9.162 17.299 1.00 0.00 C ATOM 2257 CE1 TYR B 26 69.607 -7.183 17.630 1.00 0.00 C ATOM 2258 CE2 TYR B 26 71.104 -8.837 18.581 1.00 0.00 C ATOM 2259 CZ TYR B 26 70.127 -7.848 18.747 1.00 0.00 C ATOM 2260 OH TYR B 26 69.675 -7.530 20.012 1.00 0.00 O ATOM 0 H TYR B 26 71.717 -11.528 15.143 1.00 0.00 H new ATOM 0 HA TYR B 26 69.588 -9.632 14.206 1.00 0.00 H new ATOM 0 HB2 TYR B 26 72.562 -9.198 14.849 1.00 0.00 H new ATOM 0 HB3 TYR B 26 71.525 -7.960 14.167 1.00 0.00 H new ATOM 0 HD1 TYR B 26 69.664 -6.995 15.485 1.00 0.00 H new ATOM 0 HD2 TYR B 26 72.314 -9.925 17.171 1.00 0.00 H new ATOM 0 HE1 TYR B 26 68.854 -6.420 17.758 1.00 0.00 H new ATOM 0 HE2 TYR B 26 71.506 -9.349 19.443 1.00 0.00 H new ATOM 0 HH TYR B 26 70.138 -8.085 20.674 1.00 0.00 H new ATOM 2270 N LYS B 27 70.978 -11.353 12.235 1.00 0.00 N ATOM 2271 CA LYS B 27 71.368 -11.592 10.815 1.00 0.00 C ATOM 2272 C LYS B 27 70.376 -12.570 10.199 1.00 0.00 C ATOM 2273 O LYS B 27 69.832 -13.437 10.852 1.00 0.00 O ATOM 2274 CB LYS B 27 72.808 -12.142 10.751 1.00 0.00 C ATOM 2275 CG LYS B 27 73.549 -11.503 9.574 1.00 0.00 C ATOM 2276 CD LYS B 27 74.931 -12.131 9.441 1.00 0.00 C ATOM 2277 CE LYS B 27 75.811 -11.260 8.550 1.00 0.00 C ATOM 2278 NZ LYS B 27 77.196 -11.811 8.544 1.00 0.00 N ATOM 0 H LYS B 27 70.656 -12.177 12.742 1.00 0.00 H new ATOM 0 HA LYS B 27 71.345 -10.659 10.252 1.00 0.00 H new ATOM 0 HB2 LYS B 27 73.332 -11.928 11.683 1.00 0.00 H new ATOM 0 HB3 LYS B 27 72.790 -13.226 10.637 1.00 0.00 H new ATOM 0 HG2 LYS B 27 72.983 -11.646 8.654 1.00 0.00 H new ATOM 0 HG3 LYS B 27 73.640 -10.428 9.728 1.00 0.00 H new ATOM 0 HD2 LYS B 27 75.388 -12.239 10.425 1.00 0.00 H new ATOM 0 HD3 LYS B 27 74.846 -13.132 9.017 1.00 0.00 H new ATOM 0 HE2 LYS B 27 75.412 -11.235 7.536 1.00 0.00 H new ATOM 0 HE3 LYS B 27 75.816 -10.233 8.915 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 77.802 -11.221 7.938 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 77.573 -11.813 9.513 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 77.181 -12.784 8.177 1.00 0.00 H new ATOM 2292 N LEU B 28 70.117 -12.390 8.943 1.00 0.00 N ATOM 2293 CA LEU B 28 69.135 -13.241 8.226 1.00 0.00 C ATOM 2294 C LEU B 28 69.860 -14.410 7.544 1.00 0.00 C ATOM 2295 O LEU B 28 71.056 -14.409 7.415 1.00 0.00 O ATOM 2296 CB LEU B 28 68.443 -12.337 7.193 1.00 0.00 C ATOM 2297 CG LEU B 28 66.984 -12.793 6.907 1.00 0.00 C ATOM 2298 CD1 LEU B 28 66.011 -11.628 7.077 1.00 0.00 C ATOM 2299 CD2 LEU B 28 66.869 -13.305 5.474 1.00 0.00 C ATOM 0 H LEU B 28 70.555 -11.671 8.367 1.00 0.00 H new ATOM 0 HA LEU B 28 68.400 -13.671 8.906 1.00 0.00 H new ATOM 0 HB2 LEU B 28 68.437 -11.309 7.556 1.00 0.00 H new ATOM 0 HB3 LEU B 28 69.014 -12.344 6.265 1.00 0.00 H new ATOM 0 HG LEU B 28 66.736 -13.584 7.614 1.00 0.00 H new ATOM 0 HD11 LEU B 28 64.996 -11.969 6.872 1.00 0.00 H new ATOM 0 HD12 LEU B 28 66.068 -11.252 8.099 1.00 0.00 H new ATOM 0 HD13 LEU B 28 66.273 -10.831 6.382 1.00 0.00 H new ATOM 0 HD21 LEU B 28 65.844 -13.622 5.282 1.00 0.00 H new ATOM 0 HD22 LEU B 28 67.138 -12.508 4.780 1.00 0.00 H new ATOM 0 HD23 LEU B 28 67.543 -14.150 5.335 1.00 0.00 H new ATOM 2311 N SER B 29 69.138 -15.416 7.122 1.00 0.00 N ATOM 2312 CA SER B 29 69.779 -16.597 6.452 1.00 0.00 C ATOM 2313 C SER B 29 69.051 -16.959 5.162 1.00 0.00 C ATOM 2314 O SER B 29 67.920 -16.571 4.939 1.00 0.00 O ATOM 2315 CB SER B 29 69.770 -17.792 7.400 1.00 0.00 C ATOM 2316 OG SER B 29 70.615 -17.516 8.511 1.00 0.00 O ATOM 0 H SER B 29 68.124 -15.474 7.212 1.00 0.00 H new ATOM 0 HA SER B 29 70.806 -16.333 6.202 1.00 0.00 H new ATOM 0 HB2 SER B 29 68.754 -17.992 7.742 1.00 0.00 H new ATOM 0 HB3 SER B 29 70.114 -18.686 6.880 1.00 0.00 H new ATOM 0 HG SER B 29 70.611 -18.281 9.123 1.00 0.00 H new ATOM 2322 N LYS B 30 69.699 -17.716 4.310 1.00 0.00 N ATOM 2323 CA LYS B 30 69.046 -18.120 3.023 1.00 0.00 C ATOM 2324 C LYS B 30 67.620 -18.642 3.260 1.00 0.00 C ATOM 2325 O LYS B 30 66.743 -18.401 2.461 1.00 0.00 O ATOM 2326 CB LYS B 30 69.894 -19.222 2.364 1.00 0.00 C ATOM 2327 CG LYS B 30 69.294 -19.676 1.014 1.00 0.00 C ATOM 2328 CD LYS B 30 69.784 -18.769 -0.115 1.00 0.00 C ATOM 2329 CE LYS B 30 69.234 -19.278 -1.448 1.00 0.00 C ATOM 2330 NZ LYS B 30 69.926 -20.542 -1.821 1.00 0.00 N ATOM 0 H LYS B 30 70.646 -18.070 4.448 1.00 0.00 H new ATOM 0 HA LYS B 30 68.980 -17.247 2.374 1.00 0.00 H new ATOM 0 HB2 LYS B 30 70.908 -18.855 2.206 1.00 0.00 H new ATOM 0 HB3 LYS B 30 69.965 -20.077 3.036 1.00 0.00 H new ATOM 0 HG2 LYS B 30 69.579 -20.708 0.810 1.00 0.00 H new ATOM 0 HG3 LYS B 30 68.205 -19.650 1.065 1.00 0.00 H new ATOM 0 HD2 LYS B 30 69.457 -17.744 0.059 1.00 0.00 H new ATOM 0 HD3 LYS B 30 70.874 -18.756 -0.139 1.00 0.00 H new ATOM 0 HE2 LYS B 30 68.160 -19.448 -1.369 1.00 0.00 H new ATOM 0 HE3 LYS B 30 69.381 -18.528 -2.225 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 69.775 -20.735 -2.832 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 70.945 -20.448 -1.635 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 69.542 -21.327 -1.257 1.00 0.00 H new ATOM 2344 N LYS B 31 67.356 -19.372 4.305 1.00 0.00 N ATOM 2345 CA LYS B 31 65.960 -19.892 4.485 1.00 0.00 C ATOM 2346 C LYS B 31 65.054 -18.798 5.068 1.00 0.00 C ATOM 2347 O LYS B 31 63.857 -18.798 4.868 1.00 0.00 O ATOM 2348 CB LYS B 31 65.989 -21.128 5.398 1.00 0.00 C ATOM 2349 CG LYS B 31 64.637 -21.313 6.095 1.00 0.00 C ATOM 2350 CD LYS B 31 64.580 -22.679 6.753 1.00 0.00 C ATOM 2351 CE LYS B 31 65.757 -22.850 7.720 1.00 0.00 C ATOM 2352 NZ LYS B 31 65.421 -23.897 8.723 1.00 0.00 N ATOM 0 H LYS B 31 68.024 -19.631 5.031 1.00 0.00 H new ATOM 0 HA LYS B 31 65.553 -20.181 3.516 1.00 0.00 H new ATOM 0 HB2 LYS B 31 66.227 -22.015 4.811 1.00 0.00 H new ATOM 0 HB3 LYS B 31 66.777 -21.018 6.143 1.00 0.00 H new ATOM 0 HG2 LYS B 31 64.493 -20.533 6.843 1.00 0.00 H new ATOM 0 HG3 LYS B 31 63.828 -21.214 5.371 1.00 0.00 H new ATOM 0 HD2 LYS B 31 63.639 -22.793 7.291 1.00 0.00 H new ATOM 0 HD3 LYS B 31 64.609 -23.459 5.992 1.00 0.00 H new ATOM 0 HE2 LYS B 31 66.656 -23.131 7.171 1.00 0.00 H new ATOM 0 HE3 LYS B 31 65.971 -21.906 8.221 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 66.218 -24.016 9.381 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 64.574 -23.610 9.253 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 65.237 -24.797 8.236 1.00 0.00 H new ATOM 2366 N GLU B 32 65.607 -17.889 5.793 1.00 0.00 N ATOM 2367 CA GLU B 32 64.769 -16.818 6.394 1.00 0.00 C ATOM 2368 C GLU B 32 64.239 -15.884 5.300 1.00 0.00 C ATOM 2369 O GLU B 32 63.107 -15.455 5.341 1.00 0.00 O ATOM 2370 CB GLU B 32 65.606 -16.016 7.363 1.00 0.00 C ATOM 2371 CG GLU B 32 65.946 -16.875 8.575 1.00 0.00 C ATOM 2372 CD GLU B 32 66.791 -16.060 9.546 1.00 0.00 C ATOM 2373 OE1 GLU B 32 67.976 -15.915 9.291 1.00 0.00 O ATOM 2374 OE2 GLU B 32 66.248 -15.609 10.540 1.00 0.00 O ATOM 0 H GLU B 32 66.604 -17.833 6.001 1.00 0.00 H new ATOM 0 HA GLU B 32 63.927 -17.276 6.914 1.00 0.00 H new ATOM 0 HB2 GLU B 32 66.521 -15.678 6.876 1.00 0.00 H new ATOM 0 HB3 GLU B 32 65.063 -15.124 7.677 1.00 0.00 H new ATOM 0 HG2 GLU B 32 65.032 -17.212 9.064 1.00 0.00 H new ATOM 0 HG3 GLU B 32 66.489 -17.767 8.263 1.00 0.00 H new ATOM 2381 N LEU B 33 65.053 -15.558 4.325 1.00 0.00 N ATOM 2382 CA LEU B 33 64.569 -14.644 3.239 1.00 0.00 C ATOM 2383 C LEU B 33 63.485 -15.313 2.412 1.00 0.00 C ATOM 2384 O LEU B 33 62.513 -14.702 2.018 1.00 0.00 O ATOM 2385 CB LEU B 33 65.743 -14.219 2.322 1.00 0.00 C ATOM 2386 CG LEU B 33 66.322 -15.374 1.486 1.00 0.00 C ATOM 2387 CD1 LEU B 33 65.719 -15.409 0.074 1.00 0.00 C ATOM 2388 CD2 LEU B 33 67.826 -15.151 1.328 1.00 0.00 C ATOM 0 H LEU B 33 66.017 -15.878 4.233 1.00 0.00 H new ATOM 0 HA LEU B 33 64.149 -13.756 3.711 1.00 0.00 H new ATOM 0 HB2 LEU B 33 65.402 -13.431 1.650 1.00 0.00 H new ATOM 0 HB3 LEU B 33 66.536 -13.793 2.936 1.00 0.00 H new ATOM 0 HG LEU B 33 66.092 -16.308 1.999 1.00 0.00 H new ATOM 0 HD11 LEU B 33 66.152 -16.238 -0.486 1.00 0.00 H new ATOM 0 HD12 LEU B 33 64.639 -15.542 0.143 1.00 0.00 H new ATOM 0 HD13 LEU B 33 65.937 -14.472 -0.438 1.00 0.00 H new ATOM 0 HD21 LEU B 33 68.254 -15.961 0.737 1.00 0.00 H new ATOM 0 HD22 LEU B 33 68.002 -14.201 0.823 1.00 0.00 H new ATOM 0 HD23 LEU B 33 68.296 -15.131 2.311 1.00 0.00 H new ATOM 2400 N LYS B 34 63.665 -16.569 2.118 1.00 0.00 N ATOM 2401 CA LYS B 34 62.654 -17.290 1.276 1.00 0.00 C ATOM 2402 C LYS B 34 61.259 -17.299 1.925 1.00 0.00 C ATOM 2403 O LYS B 34 60.265 -17.172 1.243 1.00 0.00 O ATOM 2404 CB LYS B 34 63.093 -18.745 1.049 1.00 0.00 C ATOM 2405 CG LYS B 34 64.336 -18.798 0.135 1.00 0.00 C ATOM 2406 CD LYS B 34 64.360 -20.108 -0.667 1.00 0.00 C ATOM 2407 CE LYS B 34 63.303 -20.086 -1.789 1.00 0.00 C ATOM 2408 NZ LYS B 34 63.748 -20.982 -2.895 1.00 0.00 N ATOM 0 H LYS B 34 64.461 -17.131 2.419 1.00 0.00 H new ATOM 0 HA LYS B 34 62.594 -16.754 0.329 1.00 0.00 H new ATOM 0 HB2 LYS B 34 63.317 -19.217 2.006 1.00 0.00 H new ATOM 0 HB3 LYS B 34 62.278 -19.311 0.598 1.00 0.00 H new ATOM 0 HG2 LYS B 34 64.330 -17.948 -0.547 1.00 0.00 H new ATOM 0 HG3 LYS B 34 65.241 -18.717 0.737 1.00 0.00 H new ATOM 0 HD2 LYS B 34 65.350 -20.257 -1.098 1.00 0.00 H new ATOM 0 HD3 LYS B 34 64.172 -20.950 -0.001 1.00 0.00 H new ATOM 0 HE2 LYS B 34 62.338 -20.415 -1.403 1.00 0.00 H new ATOM 0 HE3 LYS B 34 63.168 -19.070 -2.159 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 64.042 -20.407 -3.710 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 64.549 -21.561 -2.572 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 62.963 -21.604 -3.175 1.00 0.00 H new ATOM 2422 N ASP B 35 61.163 -17.481 3.213 1.00 0.00 N ATOM 2423 CA ASP B 35 59.819 -17.533 3.863 1.00 0.00 C ATOM 2424 C ASP B 35 59.260 -16.128 4.102 1.00 0.00 C ATOM 2425 O ASP B 35 58.069 -15.910 4.024 1.00 0.00 O ATOM 2426 CB ASP B 35 59.923 -18.291 5.191 1.00 0.00 C ATOM 2427 CG ASP B 35 60.625 -17.427 6.244 1.00 0.00 C ATOM 2428 OD1 ASP B 35 60.081 -16.393 6.593 1.00 0.00 O ATOM 2429 OD2 ASP B 35 61.692 -17.816 6.683 1.00 0.00 O ATOM 0 H ASP B 35 61.955 -17.596 3.845 1.00 0.00 H new ATOM 0 HA ASP B 35 59.134 -18.054 3.195 1.00 0.00 H new ATOM 0 HB2 ASP B 35 58.927 -18.564 5.540 1.00 0.00 H new ATOM 0 HB3 ASP B 35 60.476 -19.219 5.045 1.00 0.00 H new ATOM 2434 N LEU B 36 60.092 -15.172 4.390 1.00 0.00 N ATOM 2435 CA LEU B 36 59.580 -13.793 4.628 1.00 0.00 C ATOM 2436 C LEU B 36 58.892 -13.283 3.355 1.00 0.00 C ATOM 2437 O LEU B 36 57.777 -12.804 3.381 1.00 0.00 O ATOM 2438 CB LEU B 36 60.778 -12.896 4.957 1.00 0.00 C ATOM 2439 CG LEU B 36 60.330 -11.453 5.252 1.00 0.00 C ATOM 2440 CD1 LEU B 36 59.621 -11.377 6.611 1.00 0.00 C ATOM 2441 CD2 LEU B 36 61.567 -10.563 5.273 1.00 0.00 C ATOM 0 H LEU B 36 61.103 -15.282 4.471 1.00 0.00 H new ATOM 0 HA LEU B 36 58.863 -13.785 5.449 1.00 0.00 H new ATOM 0 HB2 LEU B 36 61.310 -13.298 5.819 1.00 0.00 H new ATOM 0 HB3 LEU B 36 61.478 -12.898 4.121 1.00 0.00 H new ATOM 0 HG LEU B 36 59.633 -11.122 4.482 1.00 0.00 H new ATOM 0 HD11 LEU B 36 59.311 -10.350 6.803 1.00 0.00 H new ATOM 0 HD12 LEU B 36 58.744 -12.024 6.601 1.00 0.00 H new ATOM 0 HD13 LEU B 36 60.303 -11.703 7.396 1.00 0.00 H new ATOM 0 HD21 LEU B 36 61.272 -9.535 5.481 1.00 0.00 H new ATOM 0 HD22 LEU B 36 62.250 -10.908 6.049 1.00 0.00 H new ATOM 0 HD23 LEU B 36 62.065 -10.609 4.304 1.00 0.00 H new ATOM 2453 N LEU B 37 59.576 -13.373 2.248 1.00 0.00 N ATOM 2454 CA LEU B 37 59.019 -12.892 0.951 1.00 0.00 C ATOM 2455 C LEU B 37 57.881 -13.793 0.469 1.00 0.00 C ATOM 2456 O LEU B 37 56.882 -13.341 -0.055 1.00 0.00 O ATOM 2457 CB LEU B 37 60.139 -12.959 -0.089 1.00 0.00 C ATOM 2458 CG LEU B 37 61.309 -12.072 0.352 1.00 0.00 C ATOM 2459 CD1 LEU B 37 62.439 -12.177 -0.677 1.00 0.00 C ATOM 2460 CD2 LEU B 37 60.855 -10.601 0.479 1.00 0.00 C ATOM 0 H LEU B 37 60.515 -13.767 2.186 1.00 0.00 H new ATOM 0 HA LEU B 37 58.636 -11.880 1.084 1.00 0.00 H new ATOM 0 HB2 LEU B 37 60.476 -13.989 -0.209 1.00 0.00 H new ATOM 0 HB3 LEU B 37 59.767 -12.631 -1.060 1.00 0.00 H new ATOM 0 HG LEU B 37 61.664 -12.411 1.325 1.00 0.00 H new ATOM 0 HD11 LEU B 37 63.273 -11.547 -0.367 1.00 0.00 H new ATOM 0 HD12 LEU B 37 62.772 -13.212 -0.747 1.00 0.00 H new ATOM 0 HD13 LEU B 37 62.077 -11.846 -1.650 1.00 0.00 H new ATOM 0 HD21 LEU B 37 61.698 -9.986 0.793 1.00 0.00 H new ATOM 0 HD22 LEU B 37 60.488 -10.249 -0.485 1.00 0.00 H new ATOM 0 HD23 LEU B 37 60.058 -10.529 1.219 1.00 0.00 H new ATOM 2472 N GLN B 38 58.063 -15.078 0.612 1.00 0.00 N ATOM 2473 CA GLN B 38 57.052 -16.067 0.140 1.00 0.00 C ATOM 2474 C GLN B 38 55.778 -16.026 0.986 1.00 0.00 C ATOM 2475 O GLN B 38 54.683 -16.200 0.499 1.00 0.00 O ATOM 2476 CB GLN B 38 57.677 -17.458 0.281 1.00 0.00 C ATOM 2477 CG GLN B 38 56.690 -18.544 -0.162 1.00 0.00 C ATOM 2478 CD GLN B 38 55.703 -18.857 0.970 1.00 0.00 C ATOM 2479 OE1 GLN B 38 56.065 -18.842 2.129 1.00 0.00 O ATOM 2480 NE2 GLN B 38 54.462 -19.138 0.680 1.00 0.00 N ATOM 0 H GLN B 38 58.888 -15.492 1.046 1.00 0.00 H new ATOM 0 HA GLN B 38 56.781 -15.833 -0.890 1.00 0.00 H new ATOM 0 HB2 GLN B 38 58.584 -17.517 -0.320 1.00 0.00 H new ATOM 0 HB3 GLN B 38 57.970 -17.627 1.317 1.00 0.00 H new ATOM 0 HG2 GLN B 38 56.147 -18.213 -1.047 1.00 0.00 H new ATOM 0 HG3 GLN B 38 57.233 -19.447 -0.441 1.00 0.00 H new ATOM 0 HE21 GLN B 38 54.156 -19.151 -0.293 1.00 0.00 H new ATOM 0 HE22 GLN B 38 53.798 -19.344 1.426 1.00 0.00 H new ATOM 2489 N THR B 39 55.936 -15.881 2.273 1.00 0.00 N ATOM 2490 CA THR B 39 54.752 -15.918 3.176 1.00 0.00 C ATOM 2491 C THR B 39 53.749 -14.818 2.833 1.00 0.00 C ATOM 2492 O THR B 39 52.565 -15.071 2.732 1.00 0.00 O ATOM 2493 CB THR B 39 55.214 -15.751 4.626 1.00 0.00 C ATOM 2494 OG1 THR B 39 56.105 -16.806 4.961 1.00 0.00 O ATOM 2495 CG2 THR B 39 54.005 -15.780 5.566 1.00 0.00 C ATOM 0 H THR B 39 56.833 -15.739 2.738 1.00 0.00 H new ATOM 0 HA THR B 39 54.256 -16.880 3.045 1.00 0.00 H new ATOM 0 HB THR B 39 55.724 -14.794 4.733 1.00 0.00 H new ATOM 0 HG1 THR B 39 56.942 -16.698 4.463 1.00 0.00 H new ATOM 0 HG21 THR B 39 54.342 -15.661 6.596 1.00 0.00 H new ATOM 0 HG22 THR B 39 53.325 -14.967 5.310 1.00 0.00 H new ATOM 0 HG23 THR B 39 53.486 -16.733 5.462 1.00 0.00 H new ATOM 2503 N GLU B 40 54.192 -13.592 2.700 1.00 0.00 N ATOM 2504 CA GLU B 40 53.231 -12.476 2.418 1.00 0.00 C ATOM 2505 C GLU B 40 53.214 -12.104 0.932 1.00 0.00 C ATOM 2506 O GLU B 40 52.302 -11.441 0.477 1.00 0.00 O ATOM 2507 CB GLU B 40 53.658 -11.258 3.238 1.00 0.00 C ATOM 2508 CG GLU B 40 53.585 -11.595 4.726 1.00 0.00 C ATOM 2509 CD GLU B 40 54.011 -10.376 5.547 1.00 0.00 C ATOM 2510 OE1 GLU B 40 54.442 -9.403 4.950 1.00 0.00 O ATOM 2511 OE2 GLU B 40 53.909 -10.440 6.762 1.00 0.00 O ATOM 0 H GLU B 40 55.171 -13.315 2.774 1.00 0.00 H new ATOM 0 HA GLU B 40 52.227 -12.802 2.689 1.00 0.00 H new ATOM 0 HB2 GLU B 40 54.673 -10.964 2.970 1.00 0.00 H new ATOM 0 HB3 GLU B 40 53.011 -10.410 3.014 1.00 0.00 H new ATOM 0 HG2 GLU B 40 52.570 -11.890 4.993 1.00 0.00 H new ATOM 0 HG3 GLU B 40 54.233 -12.442 4.950 1.00 0.00 H new ATOM 2518 N LEU B 41 54.205 -12.499 0.166 1.00 0.00 N ATOM 2519 CA LEU B 41 54.219 -12.134 -1.294 1.00 0.00 C ATOM 2520 C LEU B 41 54.608 -13.350 -2.144 1.00 0.00 C ATOM 2521 O LEU B 41 55.564 -13.314 -2.894 1.00 0.00 O ATOM 2522 CB LEU B 41 55.229 -11.001 -1.519 1.00 0.00 C ATOM 2523 CG LEU B 41 54.761 -9.726 -0.790 1.00 0.00 C ATOM 2524 CD1 LEU B 41 55.879 -8.677 -0.814 1.00 0.00 C ATOM 2525 CD2 LEU B 41 53.504 -9.151 -1.472 1.00 0.00 C ATOM 0 H LEU B 41 55.000 -13.054 0.483 1.00 0.00 H new ATOM 0 HA LEU B 41 53.223 -11.806 -1.591 1.00 0.00 H new ATOM 0 HB2 LEU B 41 56.211 -11.300 -1.152 1.00 0.00 H new ATOM 0 HB3 LEU B 41 55.334 -10.802 -2.586 1.00 0.00 H new ATOM 0 HG LEU B 41 54.520 -9.981 0.242 1.00 0.00 H new ATOM 0 HD11 LEU B 41 55.545 -7.777 -0.298 1.00 0.00 H new ATOM 0 HD12 LEU B 41 56.762 -9.075 -0.314 1.00 0.00 H new ATOM 0 HD13 LEU B 41 56.126 -8.432 -1.847 1.00 0.00 H new ATOM 0 HD21 LEU B 41 53.185 -8.251 -0.947 1.00 0.00 H new ATOM 0 HD22 LEU B 41 53.733 -8.904 -2.509 1.00 0.00 H new ATOM 0 HD23 LEU B 41 52.704 -9.891 -1.444 1.00 0.00 H new ATOM 2537 N SER B 42 53.874 -14.424 -2.039 1.00 0.00 N ATOM 2538 CA SER B 42 54.202 -15.634 -2.846 1.00 0.00 C ATOM 2539 C SER B 42 53.904 -15.378 -4.328 1.00 0.00 C ATOM 2540 O SER B 42 54.650 -15.774 -5.201 1.00 0.00 O ATOM 2541 CB SER B 42 53.331 -16.804 -2.377 1.00 0.00 C ATOM 2542 OG SER B 42 51.968 -16.509 -2.648 1.00 0.00 O ATOM 0 H SER B 42 53.061 -14.516 -1.429 1.00 0.00 H new ATOM 0 HA SER B 42 55.259 -15.865 -2.718 1.00 0.00 H new ATOM 0 HB2 SER B 42 53.626 -17.720 -2.888 1.00 0.00 H new ATOM 0 HB3 SER B 42 53.474 -16.974 -1.310 1.00 0.00 H new ATOM 0 HG SER B 42 51.407 -17.255 -2.351 1.00 0.00 H new ATOM 2548 N SER B 43 52.796 -14.749 -4.614 1.00 0.00 N ATOM 2549 CA SER B 43 52.416 -14.500 -6.036 1.00 0.00 C ATOM 2550 C SER B 43 53.293 -13.421 -6.687 1.00 0.00 C ATOM 2551 O SER B 43 53.700 -13.558 -7.823 1.00 0.00 O ATOM 2552 CB SER B 43 50.953 -14.062 -6.096 1.00 0.00 C ATOM 2553 OG SER B 43 50.615 -13.742 -7.439 1.00 0.00 O ATOM 0 H SER B 43 52.135 -14.395 -3.922 1.00 0.00 H new ATOM 0 HA SER B 43 52.564 -15.428 -6.588 1.00 0.00 H new ATOM 0 HB2 SER B 43 50.307 -14.858 -5.726 1.00 0.00 H new ATOM 0 HB3 SER B 43 50.793 -13.197 -5.452 1.00 0.00 H new ATOM 0 HG SER B 43 49.677 -13.462 -7.482 1.00 0.00 H new ATOM 2559 N PHE B 44 53.571 -12.336 -6.008 1.00 0.00 N ATOM 2560 CA PHE B 44 54.394 -11.261 -6.646 1.00 0.00 C ATOM 2561 C PHE B 44 55.891 -11.545 -6.553 1.00 0.00 C ATOM 2562 O PHE B 44 56.435 -12.158 -7.447 1.00 0.00 O ATOM 2563 CB PHE B 44 54.089 -9.889 -6.017 1.00 0.00 C ATOM 2564 CG PHE B 44 54.791 -8.783 -6.798 1.00 0.00 C ATOM 2565 CD1 PHE B 44 54.524 -8.603 -8.170 1.00 0.00 C ATOM 2566 CD2 PHE B 44 55.716 -7.930 -6.158 1.00 0.00 C ATOM 2567 CE1 PHE B 44 55.171 -7.589 -8.886 1.00 0.00 C ATOM 2568 CE2 PHE B 44 56.359 -6.920 -6.885 1.00 0.00 C ATOM 2569 CZ PHE B 44 56.087 -6.751 -8.246 1.00 0.00 C ATOM 0 H PHE B 44 53.269 -12.148 -5.052 1.00 0.00 H new ATOM 0 HA PHE B 44 54.120 -11.245 -7.701 1.00 0.00 H new ATOM 0 HB2 PHE B 44 53.013 -9.714 -6.012 1.00 0.00 H new ATOM 0 HB3 PHE B 44 54.419 -9.876 -4.978 1.00 0.00 H new ATOM 0 HD1 PHE B 44 53.818 -9.249 -8.670 1.00 0.00 H new ATOM 0 HD2 PHE B 44 55.928 -8.056 -5.107 1.00 0.00 H new ATOM 0 HE1 PHE B 44 54.961 -7.454 -9.937 1.00 0.00 H new ATOM 0 HE2 PHE B 44 57.067 -6.270 -6.393 1.00 0.00 H new ATOM 0 HZ PHE B 44 56.586 -5.972 -8.803 1.00 0.00 H new ATOM 2579 N LEU B 45 56.574 -11.053 -5.535 1.00 0.00 N ATOM 2580 CA LEU B 45 58.080 -11.201 -5.453 1.00 0.00 C ATOM 2581 C LEU B 45 58.467 -12.531 -6.139 1.00 0.00 C ATOM 2582 O LEU B 45 57.785 -13.501 -5.880 1.00 0.00 O ATOM 2583 CB LEU B 45 58.457 -11.256 -3.941 1.00 0.00 C ATOM 2584 CG LEU B 45 59.469 -10.151 -3.556 1.00 0.00 C ATOM 2585 CD1 LEU B 45 60.616 -10.069 -4.584 1.00 0.00 C ATOM 2586 CD2 LEU B 45 58.758 -8.791 -3.455 1.00 0.00 C ATOM 0 H LEU B 45 56.154 -10.552 -4.752 1.00 0.00 H new ATOM 0 HA LEU B 45 58.599 -10.376 -5.941 1.00 0.00 H new ATOM 0 HB2 LEU B 45 57.555 -11.148 -3.338 1.00 0.00 H new ATOM 0 HB3 LEU B 45 58.881 -12.233 -3.708 1.00 0.00 H new ATOM 0 HG LEU B 45 59.895 -10.406 -2.586 1.00 0.00 H new ATOM 0 HD11 LEU B 45 61.313 -9.284 -4.290 1.00 0.00 H new ATOM 0 HD12 LEU B 45 61.140 -11.024 -4.622 1.00 0.00 H new ATOM 0 HD13 LEU B 45 60.207 -9.840 -5.568 1.00 0.00 H new ATOM 0 HD21 LEU B 45 59.481 -8.022 -3.183 1.00 0.00 H new ATOM 0 HD22 LEU B 45 58.308 -8.543 -4.417 1.00 0.00 H new ATOM 0 HD23 LEU B 45 57.980 -8.843 -2.693 1.00 0.00 H new ATOM 2598 N ASP B 46 59.482 -12.687 -6.967 1.00 0.00 N ATOM 2599 CA ASP B 46 59.711 -14.068 -7.533 1.00 0.00 C ATOM 2600 C ASP B 46 60.677 -14.850 -6.631 1.00 0.00 C ATOM 2601 O ASP B 46 61.855 -14.565 -6.570 1.00 0.00 O ATOM 2602 CB ASP B 46 60.276 -13.963 -8.954 1.00 0.00 C ATOM 2603 CG ASP B 46 61.605 -13.217 -8.947 1.00 0.00 C ATOM 2604 OD1 ASP B 46 61.991 -12.739 -7.894 1.00 0.00 O ATOM 2605 OD2 ASP B 46 62.210 -13.131 -10.003 1.00 0.00 O ATOM 0 H ASP B 46 60.133 -11.960 -7.265 1.00 0.00 H new ATOM 0 HA ASP B 46 58.761 -14.600 -7.572 1.00 0.00 H new ATOM 0 HB2 ASP B 46 60.414 -14.960 -9.371 1.00 0.00 H new ATOM 0 HB3 ASP B 46 59.565 -13.445 -9.597 1.00 0.00 H new ATOM 2610 N VAL B 47 60.197 -15.843 -5.924 1.00 0.00 N ATOM 2611 CA VAL B 47 61.109 -16.630 -5.037 1.00 0.00 C ATOM 2612 C VAL B 47 60.687 -18.100 -5.011 1.00 0.00 C ATOM 2613 O VAL B 47 61.520 -18.984 -5.001 1.00 0.00 O ATOM 2614 CB VAL B 47 61.061 -16.081 -3.605 1.00 0.00 C ATOM 2615 CG1 VAL B 47 61.337 -14.581 -3.605 1.00 0.00 C ATOM 2616 CG2 VAL B 47 59.685 -16.334 -2.987 1.00 0.00 C ATOM 0 H VAL B 47 59.222 -16.141 -5.922 1.00 0.00 H new ATOM 0 HA VAL B 47 62.121 -16.545 -5.432 1.00 0.00 H new ATOM 0 HB VAL B 47 61.824 -16.592 -3.018 1.00 0.00 H new ATOM 0 HG11 VAL B 47 61.300 -14.204 -2.583 1.00 0.00 H new ATOM 0 HG12 VAL B 47 62.325 -14.393 -4.026 1.00 0.00 H new ATOM 0 HG13 VAL B 47 60.584 -14.072 -4.207 1.00 0.00 H new ATOM 0 HG21 VAL B 47 59.664 -15.940 -1.971 1.00 0.00 H new ATOM 0 HG22 VAL B 47 58.921 -15.837 -3.585 1.00 0.00 H new ATOM 0 HG23 VAL B 47 59.488 -17.406 -2.964 1.00 0.00 H new ATOM 2626 N GLN B 48 59.405 -18.375 -4.965 1.00 0.00 N ATOM 2627 CA GLN B 48 58.946 -19.802 -4.893 1.00 0.00 C ATOM 2628 C GLN B 48 58.566 -20.345 -6.277 1.00 0.00 C ATOM 2629 O GLN B 48 58.918 -21.451 -6.637 1.00 0.00 O ATOM 2630 CB GLN B 48 57.730 -19.878 -3.939 1.00 0.00 C ATOM 2631 CG GLN B 48 57.760 -21.176 -3.120 1.00 0.00 C ATOM 2632 CD GLN B 48 57.654 -22.380 -4.060 1.00 0.00 C ATOM 2633 OE1 GLN B 48 56.816 -22.341 -5.058 1.00 0.00 O flip ATOM 2634 NE2 GLN B 48 58.342 -23.365 -3.884 1.00 0.00 N flip ATOM 0 H GLN B 48 58.660 -17.679 -4.974 1.00 0.00 H new ATOM 0 HA GLN B 48 59.764 -20.418 -4.518 1.00 0.00 H new ATOM 0 HB2 GLN B 48 57.734 -19.019 -3.268 1.00 0.00 H new ATOM 0 HB3 GLN B 48 56.806 -19.828 -4.515 1.00 0.00 H new ATOM 0 HG2 GLN B 48 58.683 -21.233 -2.543 1.00 0.00 H new ATOM 0 HG3 GLN B 48 56.937 -21.186 -2.406 1.00 0.00 H new ATOM 0 HE21 GLN B 48 58.998 -23.396 -3.103 1.00 0.00 H new ATOM 0 HE22 GLN B 48 58.264 -24.161 -4.517 1.00 0.00 H new ATOM 2643 N LYS B 49 57.853 -19.585 -7.050 1.00 0.00 N ATOM 2644 CA LYS B 49 57.458 -20.071 -8.400 1.00 0.00 C ATOM 2645 C LYS B 49 58.714 -20.205 -9.239 1.00 0.00 C ATOM 2646 O LYS B 49 58.747 -20.904 -10.233 1.00 0.00 O ATOM 2647 CB LYS B 49 56.504 -19.084 -9.053 1.00 0.00 C ATOM 2648 CG LYS B 49 55.194 -19.070 -8.267 1.00 0.00 C ATOM 2649 CD LYS B 49 54.201 -18.104 -8.923 1.00 0.00 C ATOM 2650 CE LYS B 49 54.630 -16.653 -8.681 1.00 0.00 C ATOM 2651 NZ LYS B 49 53.492 -15.746 -8.998 1.00 0.00 N ATOM 0 H LYS B 49 57.525 -18.649 -6.809 1.00 0.00 H new ATOM 0 HA LYS B 49 56.953 -21.033 -8.318 1.00 0.00 H new ATOM 0 HB2 LYS B 49 56.945 -18.087 -9.069 1.00 0.00 H new ATOM 0 HB3 LYS B 49 56.319 -19.367 -10.089 1.00 0.00 H new ATOM 0 HG2 LYS B 49 54.770 -20.073 -8.233 1.00 0.00 H new ATOM 0 HG3 LYS B 49 55.381 -18.768 -7.237 1.00 0.00 H new ATOM 0 HD2 LYS B 49 54.146 -18.300 -9.994 1.00 0.00 H new ATOM 0 HD3 LYS B 49 53.203 -18.267 -8.517 1.00 0.00 H new ATOM 0 HE2 LYS B 49 54.938 -16.521 -7.644 1.00 0.00 H new ATOM 0 HE3 LYS B 49 55.491 -16.407 -9.303 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 53.695 -14.794 -8.632 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 53.361 -15.701 -10.029 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 52.624 -16.109 -8.554 1.00 0.00 H new ATOM 2665 N ASP B 50 59.754 -19.546 -8.829 1.00 0.00 N ATOM 2666 CA ASP B 50 61.039 -19.623 -9.568 1.00 0.00 C ATOM 2667 C ASP B 50 62.171 -19.684 -8.540 1.00 0.00 C ATOM 2668 O ASP B 50 62.715 -18.678 -8.131 1.00 0.00 O ATOM 2669 CB ASP B 50 61.174 -18.388 -10.458 1.00 0.00 C ATOM 2670 CG ASP B 50 62.359 -18.569 -11.400 1.00 0.00 C ATOM 2671 OD1 ASP B 50 63.120 -19.496 -11.190 1.00 0.00 O ATOM 2672 OD2 ASP B 50 62.485 -17.776 -12.318 1.00 0.00 O ATOM 0 H ASP B 50 59.770 -18.949 -8.002 1.00 0.00 H new ATOM 0 HA ASP B 50 61.080 -20.509 -10.202 1.00 0.00 H new ATOM 0 HB2 ASP B 50 60.259 -18.238 -11.031 1.00 0.00 H new ATOM 0 HB3 ASP B 50 61.316 -17.498 -9.845 1.00 0.00 H new ATOM 2677 N ALA B 51 62.516 -20.870 -8.110 1.00 0.00 N ATOM 2678 CA ALA B 51 63.598 -21.029 -7.094 1.00 0.00 C ATOM 2679 C ALA B 51 64.896 -20.445 -7.652 1.00 0.00 C ATOM 2680 O ALA B 51 65.661 -19.814 -6.948 1.00 0.00 O ATOM 2681 CB ALA B 51 63.768 -22.514 -6.785 1.00 0.00 C ATOM 0 H ALA B 51 62.090 -21.743 -8.422 1.00 0.00 H new ATOM 0 HA ALA B 51 63.341 -20.501 -6.175 1.00 0.00 H new ATOM 0 HB1 ALA B 51 64.556 -22.643 -6.043 1.00 0.00 H new ATOM 0 HB2 ALA B 51 62.832 -22.914 -6.394 1.00 0.00 H new ATOM 0 HB3 ALA B 51 64.037 -23.047 -7.697 1.00 0.00 H new ATOM 2687 N ASP B 52 65.123 -20.611 -8.921 1.00 0.00 N ATOM 2688 CA ASP B 52 66.337 -20.022 -9.549 1.00 0.00 C ATOM 2689 C ASP B 52 66.283 -18.515 -9.363 1.00 0.00 C ATOM 2690 O ASP B 52 67.279 -17.878 -9.116 1.00 0.00 O ATOM 2691 CB ASP B 52 66.325 -20.313 -11.054 1.00 0.00 C ATOM 2692 CG ASP B 52 66.573 -21.808 -11.288 1.00 0.00 C ATOM 2693 OD1 ASP B 52 67.083 -22.451 -10.385 1.00 0.00 O ATOM 2694 OD2 ASP B 52 66.248 -22.284 -12.364 1.00 0.00 O ATOM 0 H ASP B 52 64.518 -21.132 -9.555 1.00 0.00 H new ATOM 0 HA ASP B 52 67.232 -20.445 -9.093 1.00 0.00 H new ATOM 0 HB2 ASP B 52 65.367 -20.021 -11.484 1.00 0.00 H new ATOM 0 HB3 ASP B 52 67.093 -19.723 -11.555 1.00 0.00 H new ATOM 2699 N ALA B 53 65.128 -17.936 -9.501 1.00 0.00 N ATOM 2700 CA ALA B 53 65.045 -16.462 -9.363 1.00 0.00 C ATOM 2701 C ALA B 53 65.574 -16.055 -7.991 1.00 0.00 C ATOM 2702 O ALA B 53 66.274 -15.072 -7.863 1.00 0.00 O ATOM 2703 CB ALA B 53 63.602 -15.991 -9.512 1.00 0.00 C ATOM 0 H ALA B 53 64.249 -18.412 -9.701 1.00 0.00 H new ATOM 0 HA ALA B 53 65.646 -15.999 -10.146 1.00 0.00 H new ATOM 0 HB1 ALA B 53 63.561 -14.907 -9.408 1.00 0.00 H new ATOM 0 HB2 ALA B 53 63.226 -16.276 -10.495 1.00 0.00 H new ATOM 0 HB3 ALA B 53 62.987 -16.453 -8.740 1.00 0.00 H new ATOM 2709 N VAL B 54 65.252 -16.784 -6.962 1.00 0.00 N ATOM 2710 CA VAL B 54 65.760 -16.397 -5.620 1.00 0.00 C ATOM 2711 C VAL B 54 67.285 -16.510 -5.611 1.00 0.00 C ATOM 2712 O VAL B 54 67.958 -15.725 -5.001 1.00 0.00 O ATOM 2713 CB VAL B 54 65.120 -17.284 -4.511 1.00 0.00 C ATOM 2714 CG1 VAL B 54 66.096 -18.359 -3.993 1.00 0.00 C ATOM 2715 CG2 VAL B 54 64.701 -16.411 -3.319 1.00 0.00 C ATOM 0 H VAL B 54 64.667 -17.619 -6.990 1.00 0.00 H new ATOM 0 HA VAL B 54 65.481 -15.365 -5.409 1.00 0.00 H new ATOM 0 HB VAL B 54 64.257 -17.777 -4.959 1.00 0.00 H new ATOM 0 HG11 VAL B 54 65.607 -18.953 -3.221 1.00 0.00 H new ATOM 0 HG12 VAL B 54 66.393 -19.008 -4.817 1.00 0.00 H new ATOM 0 HG13 VAL B 54 66.979 -17.877 -3.574 1.00 0.00 H new ATOM 0 HG21 VAL B 54 64.254 -17.038 -2.548 1.00 0.00 H new ATOM 0 HG22 VAL B 54 65.577 -15.905 -2.913 1.00 0.00 H new ATOM 0 HG23 VAL B 54 63.974 -15.669 -3.649 1.00 0.00 H new ATOM 2725 N ASP B 55 67.834 -17.501 -6.248 1.00 0.00 N ATOM 2726 CA ASP B 55 69.316 -17.651 -6.225 1.00 0.00 C ATOM 2727 C ASP B 55 69.963 -16.397 -6.831 1.00 0.00 C ATOM 2728 O ASP B 55 70.965 -15.912 -6.356 1.00 0.00 O ATOM 2729 CB ASP B 55 69.726 -18.898 -7.017 1.00 0.00 C ATOM 2730 CG ASP B 55 71.248 -19.067 -6.972 1.00 0.00 C ATOM 2731 OD1 ASP B 55 71.923 -18.104 -6.647 1.00 0.00 O ATOM 2732 OD2 ASP B 55 71.712 -20.157 -7.265 1.00 0.00 O ATOM 0 H ASP B 55 67.329 -18.209 -6.780 1.00 0.00 H new ATOM 0 HA ASP B 55 69.656 -17.766 -5.196 1.00 0.00 H new ATOM 0 HB2 ASP B 55 69.241 -19.780 -6.600 1.00 0.00 H new ATOM 0 HB3 ASP B 55 69.392 -18.809 -8.051 1.00 0.00 H new ATOM 2737 N LYS B 56 69.392 -15.875 -7.884 1.00 0.00 N ATOM 2738 CA LYS B 56 69.955 -14.649 -8.530 1.00 0.00 C ATOM 2739 C LYS B 56 69.864 -13.464 -7.557 1.00 0.00 C ATOM 2740 O LYS B 56 70.746 -12.635 -7.480 1.00 0.00 O ATOM 2741 CB LYS B 56 69.133 -14.335 -9.798 1.00 0.00 C ATOM 2742 CG LYS B 56 69.714 -15.062 -11.019 1.00 0.00 C ATOM 2743 CD LYS B 56 69.593 -16.573 -10.842 1.00 0.00 C ATOM 2744 CE LYS B 56 70.156 -17.278 -12.080 1.00 0.00 C ATOM 2745 NZ LYS B 56 70.043 -18.752 -11.904 1.00 0.00 N ATOM 0 H LYS B 56 68.553 -16.247 -8.329 1.00 0.00 H new ATOM 0 HA LYS B 56 70.999 -14.817 -8.793 1.00 0.00 H new ATOM 0 HB2 LYS B 56 68.096 -14.637 -9.649 1.00 0.00 H new ATOM 0 HB3 LYS B 56 69.129 -13.260 -9.977 1.00 0.00 H new ATOM 0 HG2 LYS B 56 69.187 -14.751 -11.921 1.00 0.00 H new ATOM 0 HG3 LYS B 56 70.760 -14.787 -11.151 1.00 0.00 H new ATOM 0 HD2 LYS B 56 70.135 -16.890 -9.951 1.00 0.00 H new ATOM 0 HD3 LYS B 56 68.549 -16.850 -10.695 1.00 0.00 H new ATOM 0 HE2 LYS B 56 69.611 -16.964 -12.970 1.00 0.00 H new ATOM 0 HE3 LYS B 56 71.199 -16.997 -12.229 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 70.716 -19.230 -12.537 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 70.258 -19.001 -10.918 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 69.076 -19.056 -12.135 1.00 0.00 H new ATOM 2759 N ILE B 57 68.778 -13.375 -6.845 1.00 0.00 N ATOM 2760 CA ILE B 57 68.562 -12.248 -5.891 1.00 0.00 C ATOM 2761 C ILE B 57 69.532 -12.320 -4.697 1.00 0.00 C ATOM 2762 O ILE B 57 70.259 -11.393 -4.420 1.00 0.00 O ATOM 2763 CB ILE B 57 67.110 -12.372 -5.400 1.00 0.00 C ATOM 2764 CG1 ILE B 57 66.155 -11.915 -6.519 1.00 0.00 C ATOM 2765 CG2 ILE B 57 66.889 -11.531 -4.140 1.00 0.00 C ATOM 2766 CD1 ILE B 57 64.765 -12.524 -6.305 1.00 0.00 C ATOM 0 H ILE B 57 68.013 -14.049 -6.883 1.00 0.00 H new ATOM 0 HA ILE B 57 68.746 -11.293 -6.384 1.00 0.00 H new ATOM 0 HB ILE B 57 66.908 -13.413 -5.150 1.00 0.00 H new ATOM 0 HG12 ILE B 57 66.087 -10.827 -6.528 1.00 0.00 H new ATOM 0 HG13 ILE B 57 66.548 -12.218 -7.490 1.00 0.00 H new ATOM 0 HG21 ILE B 57 65.855 -11.634 -3.811 1.00 0.00 H new ATOM 0 HG22 ILE B 57 67.557 -11.875 -3.351 1.00 0.00 H new ATOM 0 HG23 ILE B 57 67.097 -10.484 -4.360 1.00 0.00 H new ATOM 0 HD11 ILE B 57 64.097 -12.195 -7.101 1.00 0.00 H new ATOM 0 HD12 ILE B 57 64.838 -13.611 -6.319 1.00 0.00 H new ATOM 0 HD13 ILE B 57 64.370 -12.199 -5.342 1.00 0.00 H new ATOM 2778 N MET B 58 69.540 -13.412 -3.998 1.00 0.00 N ATOM 2779 CA MET B 58 70.434 -13.575 -2.813 1.00 0.00 C ATOM 2780 C MET B 58 71.894 -13.436 -3.241 1.00 0.00 C ATOM 2781 O MET B 58 72.694 -12.823 -2.561 1.00 0.00 O ATOM 2782 CB MET B 58 70.137 -14.955 -2.190 1.00 0.00 C ATOM 2783 CG MET B 58 71.339 -15.527 -1.423 1.00 0.00 C ATOM 2784 SD MET B 58 71.782 -14.420 -0.057 1.00 0.00 S ATOM 2785 CE MET B 58 71.500 -15.599 1.285 1.00 0.00 C ATOM 0 H MET B 58 68.953 -14.221 -4.198 1.00 0.00 H new ATOM 0 HA MET B 58 70.251 -12.802 -2.067 1.00 0.00 H new ATOM 0 HB2 MET B 58 69.287 -14.869 -1.514 1.00 0.00 H new ATOM 0 HB3 MET B 58 69.849 -15.651 -2.978 1.00 0.00 H new ATOM 0 HG2 MET B 58 71.097 -16.517 -1.037 1.00 0.00 H new ATOM 0 HG3 MET B 58 72.188 -15.646 -2.096 1.00 0.00 H new ATOM 0 HE1 MET B 58 71.647 -15.101 2.244 1.00 0.00 H new ATOM 0 HE2 MET B 58 70.480 -15.980 1.227 1.00 0.00 H new ATOM 0 HE3 MET B 58 72.202 -16.428 1.195 1.00 0.00 H new ATOM 2795 N LYS B 59 72.242 -13.967 -4.360 1.00 0.00 N ATOM 2796 CA LYS B 59 73.652 -13.823 -4.817 1.00 0.00 C ATOM 2797 C LYS B 59 73.918 -12.329 -4.965 1.00 0.00 C ATOM 2798 O LYS B 59 74.961 -11.821 -4.604 1.00 0.00 O ATOM 2799 CB LYS B 59 73.841 -14.534 -6.159 1.00 0.00 C ATOM 2800 CG LYS B 59 75.308 -14.426 -6.615 1.00 0.00 C ATOM 2801 CD LYS B 59 76.237 -15.282 -5.705 1.00 0.00 C ATOM 2802 CE LYS B 59 77.170 -14.382 -4.883 1.00 0.00 C ATOM 2803 NZ LYS B 59 78.198 -13.783 -5.779 1.00 0.00 N ATOM 0 H LYS B 59 71.627 -14.492 -4.981 1.00 0.00 H new ATOM 0 HA LYS B 59 74.345 -14.270 -4.104 1.00 0.00 H new ATOM 0 HB2 LYS B 59 73.557 -15.582 -6.067 1.00 0.00 H new ATOM 0 HB3 LYS B 59 73.186 -14.091 -6.909 1.00 0.00 H new ATOM 0 HG2 LYS B 59 75.397 -14.760 -7.649 1.00 0.00 H new ATOM 0 HG3 LYS B 59 75.626 -13.384 -6.588 1.00 0.00 H new ATOM 0 HD2 LYS B 59 75.634 -15.896 -5.036 1.00 0.00 H new ATOM 0 HD3 LYS B 59 76.827 -15.963 -6.318 1.00 0.00 H new ATOM 0 HE2 LYS B 59 76.596 -13.595 -4.394 1.00 0.00 H new ATOM 0 HE3 LYS B 59 77.652 -14.962 -4.096 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 78.945 -13.342 -5.205 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 78.614 -14.526 -6.376 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 77.754 -13.062 -6.383 1.00 0.00 H new ATOM 2817 N GLU B 60 72.951 -11.631 -5.484 1.00 0.00 N ATOM 2818 CA GLU B 60 73.085 -10.166 -5.661 1.00 0.00 C ATOM 2819 C GLU B 60 73.169 -9.519 -4.274 1.00 0.00 C ATOM 2820 O GLU B 60 73.741 -8.462 -4.101 1.00 0.00 O ATOM 2821 CB GLU B 60 71.860 -9.632 -6.410 1.00 0.00 C ATOM 2822 CG GLU B 60 72.114 -8.192 -6.836 1.00 0.00 C ATOM 2823 CD GLU B 60 70.867 -7.632 -7.525 1.00 0.00 C ATOM 2824 OE1 GLU B 60 69.886 -8.353 -7.612 1.00 0.00 O ATOM 2825 OE2 GLU B 60 70.911 -6.489 -7.949 1.00 0.00 O ATOM 0 H GLU B 60 72.062 -12.021 -5.797 1.00 0.00 H new ATOM 0 HA GLU B 60 73.981 -9.932 -6.236 1.00 0.00 H new ATOM 0 HB2 GLU B 60 71.657 -10.251 -7.284 1.00 0.00 H new ATOM 0 HB3 GLU B 60 70.979 -9.683 -5.771 1.00 0.00 H new ATOM 0 HG2 GLU B 60 72.365 -7.584 -5.967 1.00 0.00 H new ATOM 0 HG3 GLU B 60 72.967 -8.148 -7.513 1.00 0.00 H new ATOM 2832 N LEU B 61 72.610 -10.164 -3.281 1.00 0.00 N ATOM 2833 CA LEU B 61 72.657 -9.606 -1.894 1.00 0.00 C ATOM 2834 C LEU B 61 73.911 -10.068 -1.185 1.00 0.00 C ATOM 2835 O LEU B 61 74.425 -9.381 -0.325 1.00 0.00 O ATOM 2836 CB LEU B 61 71.473 -10.109 -1.078 1.00 0.00 C ATOM 2837 CG LEU B 61 70.115 -9.739 -1.710 1.00 0.00 C ATOM 2838 CD1 LEU B 61 69.072 -9.634 -0.587 1.00 0.00 C ATOM 2839 CD2 LEU B 61 70.170 -8.410 -2.498 1.00 0.00 C ATOM 0 H LEU B 61 72.122 -11.055 -3.371 1.00 0.00 H new ATOM 0 HA LEU B 61 72.635 -8.519 -1.977 1.00 0.00 H new ATOM 0 HB2 LEU B 61 71.540 -11.192 -0.978 1.00 0.00 H new ATOM 0 HB3 LEU B 61 71.527 -9.692 -0.072 1.00 0.00 H new ATOM 0 HG LEU B 61 69.847 -10.518 -2.424 1.00 0.00 H new ATOM 0 HD11 LEU B 61 68.103 -9.373 -1.013 1.00 0.00 H new ATOM 0 HD12 LEU B 61 68.995 -10.591 -0.071 1.00 0.00 H new ATOM 0 HD13 LEU B 61 69.376 -8.863 0.121 1.00 0.00 H new ATOM 0 HD21 LEU B 61 69.188 -8.197 -2.922 1.00 0.00 H new ATOM 0 HD22 LEU B 61 70.459 -7.601 -1.827 1.00 0.00 H new ATOM 0 HD23 LEU B 61 70.902 -8.493 -3.302 1.00 0.00 H new ATOM 2851 N ASP B 62 74.415 -11.220 -1.513 1.00 0.00 N ATOM 2852 CA ASP B 62 75.640 -11.674 -0.826 1.00 0.00 C ATOM 2853 C ASP B 62 76.778 -10.799 -1.331 1.00 0.00 C ATOM 2854 O ASP B 62 77.804 -11.276 -1.773 1.00 0.00 O ATOM 2855 CB ASP B 62 75.902 -13.154 -1.149 1.00 0.00 C ATOM 2856 CG ASP B 62 76.780 -13.775 -0.056 1.00 0.00 C ATOM 2857 OD1 ASP B 62 76.578 -13.439 1.103 1.00 0.00 O ATOM 2858 OD2 ASP B 62 77.635 -14.575 -0.395 1.00 0.00 O ATOM 0 H ASP B 62 74.037 -11.855 -2.216 1.00 0.00 H new ATOM 0 HA ASP B 62 75.545 -11.588 0.256 1.00 0.00 H new ATOM 0 HB2 ASP B 62 74.957 -13.693 -1.220 1.00 0.00 H new ATOM 0 HB3 ASP B 62 76.393 -13.243 -2.118 1.00 0.00 H new ATOM 2863 N GLU B 63 76.581 -9.506 -1.287 1.00 0.00 N ATOM 2864 CA GLU B 63 77.632 -8.577 -1.783 1.00 0.00 C ATOM 2865 C GLU B 63 78.900 -8.797 -0.970 1.00 0.00 C ATOM 2866 O GLU B 63 79.994 -8.820 -1.498 1.00 0.00 O ATOM 2867 CB GLU B 63 77.164 -7.129 -1.633 1.00 0.00 C ATOM 2868 CG GLU B 63 76.010 -6.862 -2.598 1.00 0.00 C ATOM 2869 CD GLU B 63 75.542 -5.413 -2.447 1.00 0.00 C ATOM 2870 OE1 GLU B 63 75.985 -4.763 -1.512 1.00 0.00 O ATOM 2871 OE2 GLU B 63 74.754 -4.976 -3.269 1.00 0.00 O ATOM 0 H GLU B 63 75.738 -9.057 -0.929 1.00 0.00 H new ATOM 0 HA GLU B 63 77.828 -8.771 -2.837 1.00 0.00 H new ATOM 0 HB2 GLU B 63 76.844 -6.944 -0.608 1.00 0.00 H new ATOM 0 HB3 GLU B 63 77.989 -6.446 -1.838 1.00 0.00 H new ATOM 0 HG2 GLU B 63 76.330 -7.047 -3.624 1.00 0.00 H new ATOM 0 HG3 GLU B 63 75.185 -7.545 -2.393 1.00 0.00 H new ATOM 2878 N ASN B 64 78.763 -8.996 0.314 1.00 0.00 N ATOM 2879 CA ASN B 64 79.963 -9.253 1.142 1.00 0.00 C ATOM 2880 C ASN B 64 80.449 -10.639 0.749 1.00 0.00 C ATOM 2881 O ASN B 64 81.594 -10.997 0.934 1.00 0.00 O ATOM 2882 CB ASN B 64 79.595 -9.219 2.627 1.00 0.00 C ATOM 2883 CG ASN B 64 80.864 -9.336 3.475 1.00 0.00 C ATOM 2884 OD1 ASN B 64 81.112 -10.360 4.079 1.00 0.00 O ATOM 2885 ND2 ASN B 64 81.683 -8.320 3.548 1.00 0.00 N ATOM 0 H ASN B 64 77.876 -8.991 0.817 1.00 0.00 H new ATOM 0 HA ASN B 64 80.734 -8.499 0.981 1.00 0.00 H new ATOM 0 HB2 ASN B 64 79.074 -8.291 2.861 1.00 0.00 H new ATOM 0 HB3 ASN B 64 78.913 -10.036 2.861 1.00 0.00 H new ATOM 0 HD21 ASN B 64 82.530 -8.387 4.112 1.00 0.00 H new ATOM 0 HD22 ASN B 64 81.475 -7.460 3.041 1.00 0.00 H new ATOM 2892 N GLY B 65 79.567 -11.404 0.155 1.00 0.00 N ATOM 2893 CA GLY B 65 79.935 -12.758 -0.322 1.00 0.00 C ATOM 2894 C GLY B 65 79.831 -13.766 0.809 1.00 0.00 C ATOM 2895 O GLY B 65 80.577 -14.724 0.844 1.00 0.00 O ATOM 0 H GLY B 65 78.598 -11.138 -0.018 1.00 0.00 H new ATOM 0 HA2 GLY B 65 79.279 -13.052 -1.141 1.00 0.00 H new ATOM 0 HA3 GLY B 65 80.951 -12.748 -0.716 1.00 0.00 H new ATOM 2899 N ASP B 66 78.911 -13.589 1.735 1.00 0.00 N ATOM 2900 CA ASP B 66 78.795 -14.590 2.841 1.00 0.00 C ATOM 2901 C ASP B 66 77.748 -15.617 2.401 1.00 0.00 C ATOM 2902 O ASP B 66 77.846 -16.204 1.342 1.00 0.00 O ATOM 2903 CB ASP B 66 78.337 -13.891 4.128 1.00 0.00 C ATOM 2904 CG ASP B 66 79.125 -12.599 4.324 1.00 0.00 C ATOM 2905 OD1 ASP B 66 80.342 -12.650 4.254 1.00 0.00 O ATOM 2906 OD2 ASP B 66 78.493 -11.579 4.546 1.00 0.00 O ATOM 0 H ASP B 66 78.251 -12.812 1.771 1.00 0.00 H new ATOM 0 HA ASP B 66 79.753 -15.071 3.040 1.00 0.00 H new ATOM 0 HB2 ASP B 66 77.270 -13.672 4.074 1.00 0.00 H new ATOM 0 HB3 ASP B 66 78.484 -14.551 4.983 1.00 0.00 H new ATOM 2911 N GLY B 67 76.728 -15.808 3.188 1.00 0.00 N ATOM 2912 CA GLY B 67 75.636 -16.759 2.826 1.00 0.00 C ATOM 2913 C GLY B 67 74.407 -16.367 3.656 1.00 0.00 C ATOM 2914 O GLY B 67 73.477 -17.161 3.892 1.00 0.00 O ATOM 0 H GLY B 67 76.601 -15.337 4.084 1.00 0.00 H new ATOM 0 HA2 GLY B 67 75.415 -16.705 1.760 1.00 0.00 H new ATOM 0 HA3 GLY B 67 75.933 -17.786 3.038 1.00 0.00 H new ATOM 2918 N GLU B 68 74.378 -15.125 4.107 1.00 0.00 N ATOM 2919 CA GLU B 68 73.249 -14.624 4.931 1.00 0.00 C ATOM 2920 C GLU B 68 72.843 -13.263 4.351 1.00 0.00 C ATOM 2921 O GLU B 68 73.499 -12.760 3.456 1.00 0.00 O ATOM 2922 CB GLU B 68 73.757 -14.443 6.368 1.00 0.00 C ATOM 2923 CG GLU B 68 73.844 -15.801 7.074 1.00 0.00 C ATOM 2924 CD GLU B 68 74.348 -15.603 8.503 1.00 0.00 C ATOM 2925 OE1 GLU B 68 75.551 -15.508 8.677 1.00 0.00 O ATOM 2926 OE2 GLU B 68 73.522 -15.552 9.400 1.00 0.00 O ATOM 0 H GLU B 68 75.109 -14.436 3.928 1.00 0.00 H new ATOM 0 HA GLU B 68 72.401 -15.309 4.928 1.00 0.00 H new ATOM 0 HB2 GLU B 68 74.737 -13.967 6.358 1.00 0.00 H new ATOM 0 HB3 GLU B 68 73.087 -13.781 6.918 1.00 0.00 H new ATOM 0 HG2 GLU B 68 72.865 -16.280 7.086 1.00 0.00 H new ATOM 0 HG3 GLU B 68 74.516 -16.464 6.529 1.00 0.00 H new ATOM 2933 N VAL B 69 71.803 -12.648 4.850 1.00 0.00 N ATOM 2934 CA VAL B 69 71.395 -11.306 4.320 1.00 0.00 C ATOM 2935 C VAL B 69 71.243 -10.358 5.504 1.00 0.00 C ATOM 2936 O VAL B 69 70.585 -10.663 6.474 1.00 0.00 O ATOM 2937 CB VAL B 69 70.074 -11.428 3.553 1.00 0.00 C ATOM 2938 CG1 VAL B 69 69.819 -10.159 2.749 1.00 0.00 C ATOM 2939 CG2 VAL B 69 70.156 -12.622 2.598 1.00 0.00 C ATOM 0 H VAL B 69 71.217 -13.013 5.601 1.00 0.00 H new ATOM 0 HA VAL B 69 72.148 -10.921 3.632 1.00 0.00 H new ATOM 0 HB VAL B 69 69.259 -11.572 4.262 1.00 0.00 H new ATOM 0 HG11 VAL B 69 68.878 -10.255 2.207 1.00 0.00 H new ATOM 0 HG12 VAL B 69 69.764 -9.305 3.424 1.00 0.00 H new ATOM 0 HG13 VAL B 69 70.633 -10.008 2.040 1.00 0.00 H new ATOM 0 HG21 VAL B 69 69.219 -12.714 2.049 1.00 0.00 H new ATOM 0 HG22 VAL B 69 70.975 -12.470 1.895 1.00 0.00 H new ATOM 0 HG23 VAL B 69 70.333 -13.533 3.169 1.00 0.00 H new ATOM 2949 N ASP B 70 71.846 -9.205 5.433 1.00 0.00 N ATOM 2950 CA ASP B 70 71.742 -8.231 6.555 1.00 0.00 C ATOM 2951 C ASP B 70 70.629 -7.233 6.235 1.00 0.00 C ATOM 2952 O ASP B 70 70.138 -7.172 5.126 1.00 0.00 O ATOM 2953 CB ASP B 70 73.067 -7.476 6.697 1.00 0.00 C ATOM 2954 CG ASP B 70 74.168 -8.445 7.129 1.00 0.00 C ATOM 2955 OD1 ASP B 70 73.833 -9.519 7.597 1.00 0.00 O ATOM 2956 OD2 ASP B 70 75.328 -8.095 6.984 1.00 0.00 O ATOM 0 H ASP B 70 72.410 -8.893 4.642 1.00 0.00 H new ATOM 0 HA ASP B 70 71.521 -8.756 7.484 1.00 0.00 H new ATOM 0 HB2 ASP B 70 73.333 -7.007 5.750 1.00 0.00 H new ATOM 0 HB3 ASP B 70 72.964 -6.676 7.431 1.00 0.00 H new ATOM 2961 N PHE B 71 70.233 -6.443 7.193 1.00 0.00 N ATOM 2962 CA PHE B 71 69.157 -5.446 6.934 1.00 0.00 C ATOM 2963 C PHE B 71 69.638 -4.513 5.811 1.00 0.00 C ATOM 2964 O PHE B 71 68.873 -4.013 5.026 1.00 0.00 O ATOM 2965 CB PHE B 71 68.897 -4.640 8.229 1.00 0.00 C ATOM 2966 CG PHE B 71 67.439 -4.214 8.365 1.00 0.00 C ATOM 2967 CD1 PHE B 71 66.631 -3.979 7.238 1.00 0.00 C ATOM 2968 CD2 PHE B 71 66.902 -4.031 9.646 1.00 0.00 C ATOM 2969 CE1 PHE B 71 65.307 -3.568 7.397 1.00 0.00 C ATOM 2970 CE2 PHE B 71 65.571 -3.621 9.801 1.00 0.00 C ATOM 2971 CZ PHE B 71 64.776 -3.389 8.673 1.00 0.00 C ATOM 0 H PHE B 71 70.607 -6.444 8.142 1.00 0.00 H new ATOM 0 HA PHE B 71 68.230 -5.936 6.635 1.00 0.00 H new ATOM 0 HB2 PHE B 71 69.179 -5.243 9.092 1.00 0.00 H new ATOM 0 HB3 PHE B 71 69.534 -3.755 8.237 1.00 0.00 H new ATOM 0 HD1 PHE B 71 67.037 -4.117 6.247 1.00 0.00 H new ATOM 0 HD2 PHE B 71 67.516 -4.207 10.517 1.00 0.00 H new ATOM 0 HE1 PHE B 71 64.692 -3.388 6.528 1.00 0.00 H new ATOM 0 HE2 PHE B 71 65.159 -3.484 10.790 1.00 0.00 H new ATOM 0 HZ PHE B 71 63.751 -3.071 8.791 1.00 0.00 H new ATOM 2981 N GLN B 72 70.910 -4.273 5.730 1.00 0.00 N ATOM 2982 CA GLN B 72 71.423 -3.383 4.650 1.00 0.00 C ATOM 2983 C GLN B 72 71.402 -4.129 3.301 1.00 0.00 C ATOM 2984 O GLN B 72 71.247 -3.531 2.250 1.00 0.00 O ATOM 2985 CB GLN B 72 72.846 -2.945 4.992 1.00 0.00 C ATOM 2986 CG GLN B 72 73.383 -2.029 3.893 1.00 0.00 C ATOM 2987 CD GLN B 72 74.711 -1.422 4.347 1.00 0.00 C ATOM 2988 OE1 GLN B 72 75.087 -1.547 5.495 1.00 0.00 O ATOM 2989 NE2 GLN B 72 75.446 -0.773 3.487 1.00 0.00 N ATOM 0 H GLN B 72 71.618 -4.650 6.360 1.00 0.00 H new ATOM 0 HA GLN B 72 70.787 -2.502 4.569 1.00 0.00 H new ATOM 0 HB2 GLN B 72 72.856 -2.424 5.949 1.00 0.00 H new ATOM 0 HB3 GLN B 72 73.490 -3.818 5.097 1.00 0.00 H new ATOM 0 HG2 GLN B 72 73.524 -2.592 2.970 1.00 0.00 H new ATOM 0 HG3 GLN B 72 72.663 -1.239 3.678 1.00 0.00 H new ATOM 0 HE21 GLN B 72 75.130 -0.668 2.523 1.00 0.00 H new ATOM 0 HE22 GLN B 72 76.337 -0.370 3.779 1.00 0.00 H new ATOM 2998 N GLU B 73 71.543 -5.432 3.333 1.00 0.00 N ATOM 2999 CA GLU B 73 71.529 -6.226 2.078 1.00 0.00 C ATOM 3000 C GLU B 73 70.084 -6.513 1.674 1.00 0.00 C ATOM 3001 O GLU B 73 69.733 -6.560 0.509 1.00 0.00 O ATOM 3002 CB GLU B 73 72.257 -7.548 2.322 1.00 0.00 C ATOM 3003 CG GLU B 73 73.749 -7.285 2.533 1.00 0.00 C ATOM 3004 CD GLU B 73 74.475 -8.615 2.770 1.00 0.00 C ATOM 3005 OE1 GLU B 73 73.844 -9.647 2.615 1.00 0.00 O ATOM 3006 OE2 GLU B 73 75.650 -8.580 3.094 1.00 0.00 O ATOM 0 H GLU B 73 71.668 -5.978 4.185 1.00 0.00 H new ATOM 0 HA GLU B 73 72.024 -5.669 1.282 1.00 0.00 H new ATOM 0 HB2 GLU B 73 71.839 -8.048 3.196 1.00 0.00 H new ATOM 0 HB3 GLU B 73 72.112 -8.216 1.473 1.00 0.00 H new ATOM 0 HG2 GLU B 73 74.167 -6.781 1.662 1.00 0.00 H new ATOM 0 HG3 GLU B 73 73.895 -6.622 3.386 1.00 0.00 H new ATOM 3013 N PHE B 74 69.244 -6.730 2.639 1.00 0.00 N ATOM 3014 CA PHE B 74 67.827 -7.044 2.336 1.00 0.00 C ATOM 3015 C PHE B 74 67.066 -5.782 1.919 1.00 0.00 C ATOM 3016 O PHE B 74 66.280 -5.782 0.998 1.00 0.00 O ATOM 3017 CB PHE B 74 67.184 -7.620 3.605 1.00 0.00 C ATOM 3018 CG PHE B 74 66.104 -8.598 3.222 1.00 0.00 C ATOM 3019 CD1 PHE B 74 64.977 -8.157 2.521 1.00 0.00 C ATOM 3020 CD2 PHE B 74 66.241 -9.944 3.549 1.00 0.00 C ATOM 3021 CE1 PHE B 74 63.985 -9.066 2.153 1.00 0.00 C ATOM 3022 CE2 PHE B 74 65.257 -10.850 3.183 1.00 0.00 C ATOM 3023 CZ PHE B 74 64.124 -10.417 2.485 1.00 0.00 C ATOM 0 H PHE B 74 69.479 -6.703 3.631 1.00 0.00 H new ATOM 0 HA PHE B 74 67.784 -7.759 1.514 1.00 0.00 H new ATOM 0 HB2 PHE B 74 67.939 -8.116 4.215 1.00 0.00 H new ATOM 0 HB3 PHE B 74 66.764 -6.816 4.209 1.00 0.00 H new ATOM 0 HD1 PHE B 74 64.875 -7.113 2.265 1.00 0.00 H new ATOM 0 HD2 PHE B 74 67.114 -10.283 4.088 1.00 0.00 H new ATOM 0 HE1 PHE B 74 63.113 -8.727 1.614 1.00 0.00 H new ATOM 0 HE2 PHE B 74 65.365 -11.894 3.438 1.00 0.00 H new ATOM 0 HZ PHE B 74 63.359 -11.125 2.203 1.00 0.00 H new ATOM 3033 N VAL B 75 67.271 -4.725 2.630 1.00 0.00 N ATOM 3034 CA VAL B 75 66.543 -3.467 2.341 1.00 0.00 C ATOM 3035 C VAL B 75 66.850 -3.003 0.920 1.00 0.00 C ATOM 3036 O VAL B 75 65.978 -2.557 0.206 1.00 0.00 O ATOM 3037 CB VAL B 75 66.960 -2.403 3.354 1.00 0.00 C ATOM 3038 CG1 VAL B 75 68.388 -1.937 3.048 1.00 0.00 C ATOM 3039 CG2 VAL B 75 65.984 -1.223 3.294 1.00 0.00 C ATOM 0 H VAL B 75 67.922 -4.674 3.413 1.00 0.00 H new ATOM 0 HA VAL B 75 65.469 -3.636 2.422 1.00 0.00 H new ATOM 0 HB VAL B 75 66.936 -2.823 4.359 1.00 0.00 H new ATOM 0 HG11 VAL B 75 68.686 -1.178 3.771 1.00 0.00 H new ATOM 0 HG12 VAL B 75 69.069 -2.786 3.112 1.00 0.00 H new ATOM 0 HG13 VAL B 75 68.426 -1.516 2.043 1.00 0.00 H new ATOM 0 HG21 VAL B 75 66.284 -0.465 4.018 1.00 0.00 H new ATOM 0 HG22 VAL B 75 65.995 -0.792 2.293 1.00 0.00 H new ATOM 0 HG23 VAL B 75 64.978 -1.571 3.529 1.00 0.00 H new ATOM 3049 N VAL B 76 68.069 -3.122 0.488 1.00 0.00 N ATOM 3050 CA VAL B 76 68.373 -2.701 -0.909 1.00 0.00 C ATOM 3051 C VAL B 76 67.559 -3.558 -1.891 1.00 0.00 C ATOM 3052 O VAL B 76 67.221 -3.124 -2.973 1.00 0.00 O ATOM 3053 CB VAL B 76 69.858 -2.882 -1.202 1.00 0.00 C ATOM 3054 CG1 VAL B 76 70.663 -1.819 -0.451 1.00 0.00 C ATOM 3055 CG2 VAL B 76 70.300 -4.263 -0.744 1.00 0.00 C ATOM 0 H VAL B 76 68.856 -3.484 1.026 1.00 0.00 H new ATOM 0 HA VAL B 76 68.109 -1.650 -1.025 1.00 0.00 H new ATOM 0 HB VAL B 76 70.029 -2.779 -2.273 1.00 0.00 H new ATOM 0 HG11 VAL B 76 71.724 -1.950 -0.662 1.00 0.00 H new ATOM 0 HG12 VAL B 76 70.348 -0.827 -0.776 1.00 0.00 H new ATOM 0 HG13 VAL B 76 70.490 -1.921 0.620 1.00 0.00 H new ATOM 0 HG21 VAL B 76 71.362 -4.393 -0.953 1.00 0.00 H new ATOM 0 HG22 VAL B 76 70.126 -4.364 0.327 1.00 0.00 H new ATOM 0 HG23 VAL B 76 69.729 -5.023 -1.277 1.00 0.00 H new ATOM 3065 N LEU B 77 67.277 -4.788 -1.531 1.00 0.00 N ATOM 3066 CA LEU B 77 66.511 -5.702 -2.449 1.00 0.00 C ATOM 3067 C LEU B 77 65.045 -5.272 -2.587 1.00 0.00 C ATOM 3068 O LEU B 77 64.572 -5.007 -3.668 1.00 0.00 O ATOM 3069 CB LEU B 77 66.552 -7.116 -1.839 1.00 0.00 C ATOM 3070 CG LEU B 77 65.917 -8.227 -2.743 1.00 0.00 C ATOM 3071 CD1 LEU B 77 64.443 -8.462 -2.353 1.00 0.00 C ATOM 3072 CD2 LEU B 77 66.013 -7.894 -4.246 1.00 0.00 C ATOM 0 H LEU B 77 67.544 -5.203 -0.638 1.00 0.00 H new ATOM 0 HA LEU B 77 66.965 -5.669 -3.439 1.00 0.00 H new ATOM 0 HB2 LEU B 77 67.589 -7.380 -1.633 1.00 0.00 H new ATOM 0 HB3 LEU B 77 66.031 -7.101 -0.882 1.00 0.00 H new ATOM 0 HG LEU B 77 66.492 -9.137 -2.573 1.00 0.00 H new ATOM 0 HD11 LEU B 77 64.017 -9.237 -2.991 1.00 0.00 H new ATOM 0 HD12 LEU B 77 64.388 -8.779 -1.311 1.00 0.00 H new ATOM 0 HD13 LEU B 77 63.881 -7.537 -2.481 1.00 0.00 H new ATOM 0 HD21 LEU B 77 65.558 -8.697 -4.826 1.00 0.00 H new ATOM 0 HD22 LEU B 77 65.489 -6.960 -4.446 1.00 0.00 H new ATOM 0 HD23 LEU B 77 67.060 -7.790 -4.529 1.00 0.00 H new ATOM 3084 N VAL B 78 64.330 -5.201 -1.501 1.00 0.00 N ATOM 3085 CA VAL B 78 62.884 -4.805 -1.566 1.00 0.00 C ATOM 3086 C VAL B 78 62.749 -3.431 -2.193 1.00 0.00 C ATOM 3087 O VAL B 78 61.775 -3.123 -2.846 1.00 0.00 O ATOM 3088 CB VAL B 78 62.297 -4.760 -0.154 1.00 0.00 C ATOM 3089 CG1 VAL B 78 62.227 -6.176 0.420 1.00 0.00 C ATOM 3090 CG2 VAL B 78 63.180 -3.889 0.735 1.00 0.00 C ATOM 0 H VAL B 78 64.680 -5.400 -0.564 1.00 0.00 H new ATOM 0 HA VAL B 78 62.348 -5.538 -2.169 1.00 0.00 H new ATOM 0 HB VAL B 78 61.292 -4.339 -0.192 1.00 0.00 H new ATOM 0 HG11 VAL B 78 61.808 -6.141 1.426 1.00 0.00 H new ATOM 0 HG12 VAL B 78 61.593 -6.795 -0.215 1.00 0.00 H new ATOM 0 HG13 VAL B 78 63.229 -6.603 0.459 1.00 0.00 H new ATOM 0 HG21 VAL B 78 62.763 -3.856 1.741 1.00 0.00 H new ATOM 0 HG22 VAL B 78 64.185 -4.309 0.772 1.00 0.00 H new ATOM 0 HG23 VAL B 78 63.223 -2.879 0.327 1.00 0.00 H new ATOM 3100 N ALA B 79 63.722 -2.612 -1.996 1.00 0.00 N ATOM 3101 CA ALA B 79 63.712 -1.241 -2.562 1.00 0.00 C ATOM 3102 C ALA B 79 63.922 -1.272 -4.087 1.00 0.00 C ATOM 3103 O ALA B 79 63.343 -0.496 -4.830 1.00 0.00 O ATOM 3104 CB ALA B 79 64.885 -0.488 -1.912 1.00 0.00 C ATOM 0 H ALA B 79 64.554 -2.836 -1.450 1.00 0.00 H new ATOM 0 HA ALA B 79 62.754 -0.760 -2.365 1.00 0.00 H new ATOM 0 HB1 ALA B 79 64.921 0.531 -2.297 1.00 0.00 H new ATOM 0 HB2 ALA B 79 64.747 -0.463 -0.831 1.00 0.00 H new ATOM 0 HB3 ALA B 79 65.819 -0.998 -2.147 1.00 0.00 H new ATOM 3110 N ALA B 80 64.793 -2.123 -4.539 1.00 0.00 N ATOM 3111 CA ALA B 80 65.120 -2.179 -5.991 1.00 0.00 C ATOM 3112 C ALA B 80 64.053 -2.909 -6.823 1.00 0.00 C ATOM 3113 O ALA B 80 63.918 -2.642 -8.000 1.00 0.00 O ATOM 3114 CB ALA B 80 66.477 -2.861 -6.154 1.00 0.00 C ATOM 0 H ALA B 80 65.300 -2.792 -3.959 1.00 0.00 H new ATOM 0 HA ALA B 80 65.149 -1.157 -6.369 1.00 0.00 H new ATOM 0 HB1 ALA B 80 66.734 -2.911 -7.212 1.00 0.00 H new ATOM 0 HB2 ALA B 80 67.238 -2.289 -5.623 1.00 0.00 H new ATOM 0 HB3 ALA B 80 66.429 -3.870 -5.744 1.00 0.00 H new ATOM 3120 N LEU B 81 63.298 -3.828 -6.271 1.00 0.00 N ATOM 3121 CA LEU B 81 62.275 -4.528 -7.121 1.00 0.00 C ATOM 3122 C LEU B 81 60.973 -3.702 -7.176 1.00 0.00 C ATOM 3123 O LEU B 81 60.364 -3.566 -8.209 1.00 0.00 O ATOM 3124 CB LEU B 81 62.038 -5.931 -6.578 1.00 0.00 C ATOM 3125 CG LEU B 81 61.542 -5.884 -5.116 1.00 0.00 C ATOM 3126 CD1 LEU B 81 60.016 -6.017 -5.078 1.00 0.00 C ATOM 3127 CD2 LEU B 81 62.175 -7.043 -4.327 1.00 0.00 C ATOM 0 H LEU B 81 63.340 -4.121 -5.295 1.00 0.00 H new ATOM 0 HA LEU B 81 62.643 -4.620 -8.143 1.00 0.00 H new ATOM 0 HB2 LEU B 81 61.304 -6.445 -7.198 1.00 0.00 H new ATOM 0 HB3 LEU B 81 62.962 -6.507 -6.634 1.00 0.00 H new ATOM 0 HG LEU B 81 61.830 -4.932 -4.669 1.00 0.00 H new ATOM 0 HD11 LEU B 81 59.673 -5.983 -4.044 1.00 0.00 H new ATOM 0 HD12 LEU B 81 59.565 -5.197 -5.637 1.00 0.00 H new ATOM 0 HD13 LEU B 81 59.722 -6.966 -5.527 1.00 0.00 H new ATOM 0 HD21 LEU B 81 61.827 -7.013 -3.294 1.00 0.00 H new ATOM 0 HD22 LEU B 81 61.887 -7.992 -4.780 1.00 0.00 H new ATOM 0 HD23 LEU B 81 63.261 -6.947 -4.347 1.00 0.00 H new ATOM 3139 N THR B 82 60.567 -3.119 -6.078 1.00 0.00 N ATOM 3140 CA THR B 82 59.327 -2.266 -6.075 1.00 0.00 C ATOM 3141 C THR B 82 59.442 -1.193 -7.167 1.00 0.00 C ATOM 3142 O THR B 82 58.566 -1.040 -7.998 1.00 0.00 O ATOM 3143 CB THR B 82 59.192 -1.591 -4.703 1.00 0.00 C ATOM 3144 OG1 THR B 82 58.181 -0.597 -4.771 1.00 0.00 O ATOM 3145 CG2 THR B 82 60.505 -0.938 -4.280 1.00 0.00 C ATOM 0 H THR B 82 61.039 -3.194 -5.177 1.00 0.00 H new ATOM 0 HA THR B 82 58.451 -2.884 -6.270 1.00 0.00 H new ATOM 0 HB THR B 82 58.931 -2.352 -3.968 1.00 0.00 H new ATOM 0 HG1 THR B 82 58.089 -0.163 -3.897 1.00 0.00 H new ATOM 0 HG21 THR B 82 60.380 -0.468 -3.305 1.00 0.00 H new ATOM 0 HG22 THR B 82 61.286 -1.696 -4.220 1.00 0.00 H new ATOM 0 HG23 THR B 82 60.789 -0.183 -5.013 1.00 0.00 H new ATOM 3153 N VAL B 83 60.540 -0.490 -7.203 1.00 0.00 N ATOM 3154 CA VAL B 83 60.753 0.531 -8.276 1.00 0.00 C ATOM 3155 C VAL B 83 60.609 -0.143 -9.640 1.00 0.00 C ATOM 3156 O VAL B 83 60.034 0.399 -10.567 1.00 0.00 O ATOM 3157 CB VAL B 83 62.185 1.078 -8.148 1.00 0.00 C ATOM 3158 CG1 VAL B 83 62.275 1.953 -6.896 1.00 0.00 C ATOM 3159 CG2 VAL B 83 63.195 -0.058 -8.018 1.00 0.00 C ATOM 0 H VAL B 83 61.305 -0.577 -6.534 1.00 0.00 H new ATOM 0 HA VAL B 83 60.025 1.336 -8.179 1.00 0.00 H new ATOM 0 HB VAL B 83 62.414 1.655 -9.044 1.00 0.00 H new ATOM 0 HG11 VAL B 83 63.287 2.345 -6.798 1.00 0.00 H new ATOM 0 HG12 VAL B 83 61.572 2.782 -6.980 1.00 0.00 H new ATOM 0 HG13 VAL B 83 62.030 1.357 -6.017 1.00 0.00 H new ATOM 0 HG21 VAL B 83 64.199 0.356 -7.929 1.00 0.00 H new ATOM 0 HG22 VAL B 83 62.966 -0.649 -7.131 1.00 0.00 H new ATOM 0 HG23 VAL B 83 63.142 -0.695 -8.901 1.00 0.00 H new ATOM 3169 N ALA B 84 61.128 -1.330 -9.762 1.00 0.00 N ATOM 3170 CA ALA B 84 61.033 -2.059 -11.051 1.00 0.00 C ATOM 3171 C ALA B 84 59.573 -2.393 -11.345 1.00 0.00 C ATOM 3172 O ALA B 84 59.213 -2.647 -12.471 1.00 0.00 O ATOM 3173 CB ALA B 84 61.866 -3.343 -10.998 1.00 0.00 C ATOM 0 H ALA B 84 61.617 -1.829 -9.018 1.00 0.00 H new ATOM 0 HA ALA B 84 61.424 -1.425 -11.847 1.00 0.00 H new ATOM 0 HB1 ALA B 84 61.787 -3.868 -11.950 1.00 0.00 H new ATOM 0 HB2 ALA B 84 62.909 -3.092 -10.807 1.00 0.00 H new ATOM 0 HB3 ALA B 84 61.495 -3.984 -10.199 1.00 0.00 H new ATOM 3179 N CYS B 85 58.738 -2.433 -10.345 1.00 0.00 N ATOM 3180 CA CYS B 85 57.314 -2.787 -10.599 1.00 0.00 C ATOM 3181 C CYS B 85 56.608 -1.661 -11.361 1.00 0.00 C ATOM 3182 O CYS B 85 55.818 -1.913 -12.247 1.00 0.00 O ATOM 3183 CB CYS B 85 56.607 -3.032 -9.271 1.00 0.00 C ATOM 3184 SG CYS B 85 54.974 -3.754 -9.578 1.00 0.00 S ATOM 0 H CYS B 85 58.976 -2.238 -9.372 1.00 0.00 H new ATOM 0 HA CYS B 85 57.279 -3.692 -11.206 1.00 0.00 H new ATOM 0 HB2 CYS B 85 57.201 -3.702 -8.649 1.00 0.00 H new ATOM 0 HB3 CYS B 85 56.505 -2.095 -8.723 1.00 0.00 H new ATOM 0 HG CYS B 85 54.966 -4.993 -9.184 1.00 0.00 H new ATOM 3190 N ASN B 86 56.875 -0.425 -11.038 1.00 0.00 N ATOM 3191 CA ASN B 86 56.197 0.681 -11.774 1.00 0.00 C ATOM 3192 C ASN B 86 56.669 0.685 -13.233 1.00 0.00 C ATOM 3193 O ASN B 86 55.896 0.901 -14.146 1.00 0.00 O ATOM 3194 CB ASN B 86 56.530 2.024 -11.120 1.00 0.00 C ATOM 3195 CG ASN B 86 58.046 2.192 -11.017 1.00 0.00 C ATOM 3196 OD1 ASN B 86 58.744 2.381 -12.102 1.00 0.00 O flip ATOM 3197 ND2 ASN B 86 58.600 2.152 -9.935 1.00 0.00 N flip ATOM 0 H ASN B 86 57.524 -0.135 -10.307 1.00 0.00 H new ATOM 0 HA ASN B 86 55.118 0.528 -11.740 1.00 0.00 H new ATOM 0 HB2 ASN B 86 56.104 2.839 -11.706 1.00 0.00 H new ATOM 0 HB3 ASN B 86 56.082 2.076 -10.128 1.00 0.00 H new ATOM 0 HD21 ASN B 86 58.053 2.004 -9.087 1.00 0.00 H new ATOM 0 HD22 ASN B 86 59.612 2.266 -9.876 1.00 0.00 H new ATOM 3204 N ASN B 87 57.934 0.452 -13.455 1.00 0.00 N ATOM 3205 CA ASN B 87 58.470 0.444 -14.850 1.00 0.00 C ATOM 3206 C ASN B 87 57.881 -0.722 -15.655 1.00 0.00 C ATOM 3207 O ASN B 87 57.634 -0.610 -16.839 1.00 0.00 O ATOM 3208 CB ASN B 87 59.992 0.302 -14.812 1.00 0.00 C ATOM 3209 CG ASN B 87 60.533 0.297 -16.242 1.00 0.00 C ATOM 3210 OD1 ASN B 87 60.927 -0.733 -16.753 1.00 0.00 O ATOM 3211 ND2 ASN B 87 60.560 1.413 -16.916 1.00 0.00 N ATOM 0 H ASN B 87 58.624 0.266 -12.728 1.00 0.00 H new ATOM 0 HA ASN B 87 58.190 1.382 -15.330 1.00 0.00 H new ATOM 0 HB2 ASN B 87 60.432 1.124 -14.247 1.00 0.00 H new ATOM 0 HB3 ASN B 87 60.270 -0.620 -14.302 1.00 0.00 H new ATOM 0 HD21 ASN B 87 60.912 1.422 -17.873 1.00 0.00 H new ATOM 0 HD22 ASN B 87 60.229 2.277 -16.486 1.00 0.00 H new ATOM 3218 N PHE B 88 57.692 -1.850 -15.027 1.00 0.00 N ATOM 3219 CA PHE B 88 57.163 -3.049 -15.748 1.00 0.00 C ATOM 3220 C PHE B 88 55.631 -3.061 -15.718 1.00 0.00 C ATOM 3221 O PHE B 88 54.997 -3.883 -16.348 1.00 0.00 O ATOM 3222 CB PHE B 88 57.706 -4.305 -15.051 1.00 0.00 C ATOM 3223 CG PHE B 88 57.557 -5.517 -15.945 1.00 0.00 C ATOM 3224 CD1 PHE B 88 58.247 -5.578 -17.162 1.00 0.00 C ATOM 3225 CD2 PHE B 88 56.738 -6.589 -15.550 1.00 0.00 C ATOM 3226 CE1 PHE B 88 58.118 -6.703 -17.985 1.00 0.00 C ATOM 3227 CE2 PHE B 88 56.611 -7.712 -16.376 1.00 0.00 C ATOM 3228 CZ PHE B 88 57.301 -7.769 -17.592 1.00 0.00 C ATOM 0 H PHE B 88 57.882 -1.996 -14.036 1.00 0.00 H new ATOM 0 HA PHE B 88 57.482 -3.023 -16.790 1.00 0.00 H new ATOM 0 HB2 PHE B 88 58.756 -4.161 -14.797 1.00 0.00 H new ATOM 0 HB3 PHE B 88 57.171 -4.468 -14.116 1.00 0.00 H new ATOM 0 HD1 PHE B 88 58.879 -4.757 -17.466 1.00 0.00 H new ATOM 0 HD2 PHE B 88 56.207 -6.546 -14.610 1.00 0.00 H new ATOM 0 HE1 PHE B 88 58.649 -6.748 -18.924 1.00 0.00 H new ATOM 0 HE2 PHE B 88 55.980 -8.535 -16.075 1.00 0.00 H new ATOM 0 HZ PHE B 88 57.203 -8.636 -18.228 1.00 0.00 H new ATOM 3238 N PHE B 89 55.029 -2.162 -14.989 1.00 0.00 N ATOM 3239 CA PHE B 89 53.538 -2.122 -14.917 1.00 0.00 C ATOM 3240 C PHE B 89 52.996 -1.120 -15.943 1.00 0.00 C ATOM 3241 O PHE B 89 51.839 -1.164 -16.311 1.00 0.00 O ATOM 3242 CB PHE B 89 53.123 -1.695 -13.507 1.00 0.00 C ATOM 3243 CG PHE B 89 51.616 -1.661 -13.399 1.00 0.00 C ATOM 3244 CD1 PHE B 89 50.916 -0.488 -13.702 1.00 0.00 C ATOM 3245 CD2 PHE B 89 50.923 -2.804 -12.986 1.00 0.00 C ATOM 3246 CE1 PHE B 89 49.520 -0.459 -13.593 1.00 0.00 C ATOM 3247 CE2 PHE B 89 49.528 -2.777 -12.879 1.00 0.00 C ATOM 3248 CZ PHE B 89 48.826 -1.604 -13.182 1.00 0.00 C ATOM 0 H PHE B 89 55.507 -1.449 -14.437 1.00 0.00 H new ATOM 0 HA PHE B 89 53.131 -3.108 -15.139 1.00 0.00 H new ATOM 0 HB2 PHE B 89 53.533 -2.389 -12.773 1.00 0.00 H new ATOM 0 HB3 PHE B 89 53.534 -0.711 -13.280 1.00 0.00 H new ATOM 0 HD1 PHE B 89 51.452 0.394 -14.020 1.00 0.00 H new ATOM 0 HD2 PHE B 89 51.465 -3.708 -12.750 1.00 0.00 H new ATOM 0 HE1 PHE B 89 48.979 0.446 -13.826 1.00 0.00 H new ATOM 0 HE2 PHE B 89 48.993 -3.660 -12.563 1.00 0.00 H new ATOM 0 HZ PHE B 89 47.749 -1.582 -13.099 1.00 0.00 H new ATOM 3258 N TRP B 90 53.818 -0.209 -16.400 1.00 0.00 N ATOM 3259 CA TRP B 90 53.343 0.806 -17.392 1.00 0.00 C ATOM 3260 C TRP B 90 53.497 0.276 -18.824 1.00 0.00 C ATOM 3261 O TRP B 90 52.930 0.821 -19.750 1.00 0.00 O ATOM 3262 CB TRP B 90 54.168 2.088 -17.236 1.00 0.00 C ATOM 3263 CG TRP B 90 53.794 3.061 -18.312 1.00 0.00 C ATOM 3264 CD1 TRP B 90 52.738 3.905 -18.269 1.00 0.00 C ATOM 3265 CD2 TRP B 90 54.454 3.295 -19.589 1.00 0.00 C ATOM 3266 NE1 TRP B 90 52.710 4.644 -19.439 1.00 0.00 N ATOM 3267 CE2 TRP B 90 53.748 4.303 -20.283 1.00 0.00 C ATOM 3268 CE3 TRP B 90 55.588 2.735 -20.205 1.00 0.00 C ATOM 3269 CZ2 TRP B 90 54.153 4.741 -21.545 1.00 0.00 C ATOM 3270 CZ3 TRP B 90 55.997 3.173 -21.473 1.00 0.00 C ATOM 3271 CH2 TRP B 90 55.282 4.174 -22.143 1.00 0.00 C ATOM 0 H TRP B 90 54.798 -0.124 -16.130 1.00 0.00 H new ATOM 0 HA TRP B 90 52.289 1.012 -17.206 1.00 0.00 H new ATOM 0 HB2 TRP B 90 53.991 2.529 -16.255 1.00 0.00 H new ATOM 0 HB3 TRP B 90 55.232 1.857 -17.294 1.00 0.00 H new ATOM 0 HD1 TRP B 90 52.033 3.989 -17.455 1.00 0.00 H new ATOM 0 HE1 TRP B 90 52.009 5.353 -19.652 1.00 0.00 H new ATOM 0 HE3 TRP B 90 56.147 1.963 -19.698 1.00 0.00 H new ATOM 0 HZ2 TRP B 90 53.597 5.513 -22.056 1.00 0.00 H new ATOM 0 HZ3 TRP B 90 56.869 2.736 -21.936 1.00 0.00 H new ATOM 0 HH2 TRP B 90 55.602 4.507 -23.119 1.00 0.00 H new