USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 559 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 20 SER OG : rot 180:sc= 0 USER MOD Set 1.2: B 24 LYS NZ :NH3+ -176:sc= 1.93 (180deg=1.92) USER MOD Set 2.1: A2085 GLN : amide:sc= 0.726 K(o=2.5,f=0.98) USER MOD Set 2.2: A2086 GLN : amide:sc= 0.327 K(o=2.5,f=-1) USER MOD Set 2.3: A2089 ASN : amide:sc= 1.44 K(o=2.5,f=-0.76) USER MOD Set 3.1: A2080 SER OG : rot 180:sc= 0.274 USER MOD Set 3.2: A2082 GLN : amide:sc= -0.522 K(o=-0.25,f=-2.4!) USER MOD Single : A2064 SER OG : rot 180:sc= 0 USER MOD Single : A2066 SER OG : rot 180:sc= 0.00058 USER MOD Single : A2069 GLN : amide:sc= 0.561 K(o=0.56,f=-0.035) USER MOD Single : A2074 THR OG1 : rot 79:sc= 1.18 USER MOD Single : A2076 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2077 SER OG : rot 76:sc= 0.00332 USER MOD Single : A2079 SER OG : rot 180:sc= 0 USER MOD Single : A2083 GLN : amide:sc= 0.743 K(o=0.74,f=-0.23) USER MOD Single : A2084 GLN : amide:sc= -0.0282 K(o=-0.028,f=-2.9!) USER MOD Single : A2092 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2093 SER OG : rot 180:sc= 0 USER MOD Single : A2094 ASN : amide:sc= 0.848 K(o=0.85,f=-2.4!) USER MOD Single : A2096 GLN : amide:sc= -1.46 X(o=-1.5,f=-0.98) USER MOD Single : A2098 MET CE :methyl -167:sc= 0 (180deg=-0.164) USER MOD Single : A2103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2104 GLN : amide:sc= -0.671 X(o=-0.67,f=-0.93) USER MOD Single : A2106 THR OG1 : rot 180:sc= 0 USER MOD Single : A2108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 THR OG1 : rot -31:sc= 0.294 USER MOD Single : B 44 MET CE :methyl -158:sc= -0.583 (180deg=-1.51!) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 52 GLN : amide:sc= -0.471 X(o=-0.47,f=-0.49) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 64 N ILE A2063 5.616 -4.061 -16.441 1.00 0.00 N ATOM 65 CA ILE A2063 6.314 -5.345 -16.558 1.00 0.00 C ATOM 66 C ILE A2063 5.735 -6.126 -17.752 1.00 0.00 C ATOM 67 O ILE A2063 4.554 -5.960 -18.080 1.00 0.00 O ATOM 68 CB ILE A2063 6.175 -6.164 -15.251 1.00 0.00 C ATOM 69 CG1 ILE A2063 4.690 -6.468 -14.903 1.00 0.00 C ATOM 70 CG2 ILE A2063 6.942 -5.455 -14.124 1.00 0.00 C ATOM 71 CD1 ILE A2063 4.366 -6.642 -13.416 1.00 0.00 C ATOM 0 HA ILE A2063 7.376 -5.164 -16.725 1.00 0.00 H new ATOM 0 HB ILE A2063 6.627 -7.146 -15.391 1.00 0.00 H new ATOM 0 HG12 ILE A2063 4.074 -5.659 -15.296 1.00 0.00 H new ATOM 0 HG13 ILE A2063 4.395 -7.377 -15.427 1.00 0.00 H new ATOM 0 HG21 ILE A2063 6.846 -6.029 -13.202 1.00 0.00 H new ATOM 0 HG22 ILE A2063 7.995 -5.376 -14.395 1.00 0.00 H new ATOM 0 HG23 ILE A2063 6.529 -4.457 -13.975 1.00 0.00 H new ATOM 0 HD11 ILE A2063 3.303 -6.850 -13.297 1.00 0.00 H new ATOM 0 HD12 ILE A2063 4.945 -7.472 -13.012 1.00 0.00 H new ATOM 0 HD13 ILE A2063 4.619 -5.728 -12.879 1.00 0.00 H new ATOM 83 N SER A2064 6.540 -6.982 -18.388 1.00 0.00 N ATOM 84 CA SER A2064 6.129 -7.786 -19.556 1.00 0.00 C ATOM 85 C SER A2064 6.768 -9.184 -19.553 1.00 0.00 C ATOM 86 O SER A2064 7.907 -9.325 -19.095 1.00 0.00 O ATOM 87 CB SER A2064 6.539 -7.077 -20.858 1.00 0.00 C ATOM 88 OG SER A2064 5.854 -5.844 -21.019 1.00 0.00 O ATOM 0 H SER A2064 7.508 -7.142 -18.108 1.00 0.00 H new ATOM 0 HA SER A2064 5.046 -7.894 -19.496 1.00 0.00 H new ATOM 0 HB2 SER A2064 7.614 -6.899 -20.853 1.00 0.00 H new ATOM 0 HB3 SER A2064 6.327 -7.725 -21.708 1.00 0.00 H new ATOM 0 HG SER A2064 6.138 -5.418 -21.855 1.00 0.00 H new ATOM 94 N PRO A2065 6.090 -10.224 -20.087 1.00 0.00 N ATOM 95 CA PRO A2065 6.628 -11.589 -20.145 1.00 0.00 C ATOM 96 C PRO A2065 7.854 -11.716 -21.064 1.00 0.00 C ATOM 97 O PRO A2065 8.686 -12.607 -20.870 1.00 0.00 O ATOM 98 CB PRO A2065 5.465 -12.469 -20.621 1.00 0.00 C ATOM 99 CG PRO A2065 4.588 -11.508 -21.420 1.00 0.00 C ATOM 100 CD PRO A2065 4.756 -10.184 -20.675 1.00 0.00 C ATOM 0 HA PRO A2065 6.996 -11.897 -19.167 1.00 0.00 H new ATOM 0 HB2 PRO A2065 5.815 -13.297 -21.237 1.00 0.00 H new ATOM 0 HB3 PRO A2065 4.922 -12.903 -19.782 1.00 0.00 H new ATOM 0 HG2 PRO A2065 4.915 -11.431 -22.457 1.00 0.00 H new ATOM 0 HG3 PRO A2065 3.547 -11.832 -21.437 1.00 0.00 H new ATOM 0 HD2 PRO A2065 4.654 -9.338 -21.354 1.00 0.00 H new ATOM 0 HD3 PRO A2065 3.993 -10.069 -19.905 1.00 0.00 H new ATOM 108 N SER A2066 7.989 -10.812 -22.039 1.00 0.00 N ATOM 109 CA SER A2066 9.108 -10.736 -22.986 1.00 0.00 C ATOM 110 C SER A2066 10.460 -10.514 -22.304 1.00 0.00 C ATOM 111 O SER A2066 11.460 -11.089 -22.736 1.00 0.00 O ATOM 112 CB SER A2066 8.849 -9.618 -24.003 1.00 0.00 C ATOM 113 OG SER A2066 8.507 -8.409 -23.337 1.00 0.00 O ATOM 0 H SER A2066 7.294 -10.083 -22.197 1.00 0.00 H new ATOM 0 HA SER A2066 9.164 -11.702 -23.488 1.00 0.00 H new ATOM 0 HB2 SER A2066 9.737 -9.464 -24.617 1.00 0.00 H new ATOM 0 HB3 SER A2066 8.043 -9.910 -24.676 1.00 0.00 H new ATOM 0 HG SER A2066 8.346 -7.705 -23.999 1.00 0.00 H new ATOM 119 N ALA A2067 10.499 -9.745 -21.210 1.00 0.00 N ATOM 120 CA ALA A2067 11.716 -9.495 -20.437 1.00 0.00 C ATOM 121 C ALA A2067 12.350 -10.801 -19.924 1.00 0.00 C ATOM 122 O ALA A2067 13.570 -10.955 -19.947 1.00 0.00 O ATOM 123 CB ALA A2067 11.367 -8.553 -19.280 1.00 0.00 C ATOM 0 H ALA A2067 9.676 -9.274 -20.834 1.00 0.00 H new ATOM 0 HA ALA A2067 12.462 -9.030 -21.082 1.00 0.00 H new ATOM 0 HB1 ALA A2067 12.262 -8.354 -18.690 1.00 0.00 H new ATOM 0 HB2 ALA A2067 10.979 -7.616 -19.678 1.00 0.00 H new ATOM 0 HB3 ALA A2067 10.612 -9.019 -18.647 1.00 0.00 H new ATOM 129 N LEU A2068 11.524 -11.765 -19.505 1.00 0.00 N ATOM 130 CA LEU A2068 11.982 -13.069 -19.023 1.00 0.00 C ATOM 131 C LEU A2068 12.504 -13.947 -20.174 1.00 0.00 C ATOM 132 O LEU A2068 13.446 -14.714 -19.983 1.00 0.00 O ATOM 133 CB LEU A2068 10.858 -13.762 -18.221 1.00 0.00 C ATOM 134 CG LEU A2068 10.338 -13.041 -16.954 1.00 0.00 C ATOM 135 CD1 LEU A2068 11.409 -12.257 -16.190 1.00 0.00 C ATOM 136 CD2 LEU A2068 9.174 -12.099 -17.262 1.00 0.00 C ATOM 0 H LEU A2068 10.510 -11.660 -19.491 1.00 0.00 H new ATOM 0 HA LEU A2068 12.826 -12.915 -18.351 1.00 0.00 H new ATOM 0 HB2 LEU A2068 10.012 -13.917 -18.891 1.00 0.00 H new ATOM 0 HB3 LEU A2068 11.215 -14.748 -17.925 1.00 0.00 H new ATOM 0 HG LEU A2068 10.001 -13.856 -16.313 1.00 0.00 H new ATOM 0 HD11 LEU A2068 10.960 -11.783 -15.317 1.00 0.00 H new ATOM 0 HD12 LEU A2068 12.198 -12.937 -15.868 1.00 0.00 H new ATOM 0 HD13 LEU A2068 11.833 -11.492 -16.840 1.00 0.00 H new ATOM 0 HD21 LEU A2068 8.843 -11.616 -16.342 1.00 0.00 H new ATOM 0 HD22 LEU A2068 9.499 -11.340 -17.974 1.00 0.00 H new ATOM 0 HD23 LEU A2068 8.349 -12.668 -17.690 1.00 0.00 H new ATOM 148 N GLN A2069 11.957 -13.803 -21.387 1.00 0.00 N ATOM 149 CA GLN A2069 12.452 -14.530 -22.565 1.00 0.00 C ATOM 150 C GLN A2069 13.800 -13.944 -23.024 1.00 0.00 C ATOM 151 O GLN A2069 14.727 -14.681 -23.363 1.00 0.00 O ATOM 152 CB GLN A2069 11.436 -14.506 -23.724 1.00 0.00 C ATOM 153 CG GLN A2069 9.963 -14.735 -23.337 1.00 0.00 C ATOM 154 CD GLN A2069 9.731 -15.849 -22.316 1.00 0.00 C ATOM 155 OE1 GLN A2069 10.080 -17.005 -22.515 1.00 0.00 O ATOM 156 NE2 GLN A2069 9.135 -15.537 -21.183 1.00 0.00 N ATOM 0 H GLN A2069 11.167 -13.187 -21.580 1.00 0.00 H new ATOM 0 HA GLN A2069 12.593 -15.571 -22.274 1.00 0.00 H new ATOM 0 HB2 GLN A2069 11.513 -13.543 -24.228 1.00 0.00 H new ATOM 0 HB3 GLN A2069 11.723 -15.268 -24.448 1.00 0.00 H new ATOM 0 HG2 GLN A2069 9.559 -13.805 -22.936 1.00 0.00 H new ATOM 0 HG3 GLN A2069 9.397 -14.966 -24.240 1.00 0.00 H new ATOM 0 HE21 GLN A2069 8.841 -14.576 -21.009 1.00 0.00 H new ATOM 0 HE22 GLN A2069 8.968 -16.257 -20.480 1.00 0.00 H new ATOM 165 N ASP A2070 13.932 -12.613 -22.993 1.00 0.00 N ATOM 166 CA ASP A2070 15.171 -11.905 -23.333 1.00 0.00 C ATOM 167 C ASP A2070 16.286 -12.204 -22.317 1.00 0.00 C ATOM 168 O ASP A2070 17.444 -12.362 -22.704 1.00 0.00 O ATOM 169 CB ASP A2070 14.910 -10.396 -23.455 1.00 0.00 C ATOM 170 CG ASP A2070 14.046 -10.023 -24.673 1.00 0.00 C ATOM 171 OD1 ASP A2070 14.037 -10.781 -25.674 1.00 0.00 O ATOM 172 OD2 ASP A2070 13.418 -8.937 -24.656 1.00 0.00 O ATOM 0 H ASP A2070 13.170 -11.989 -22.727 1.00 0.00 H new ATOM 0 HA ASP A2070 15.516 -12.268 -24.301 1.00 0.00 H new ATOM 0 HB2 ASP A2070 14.417 -10.045 -22.548 1.00 0.00 H new ATOM 0 HB3 ASP A2070 15.864 -9.874 -23.522 1.00 0.00 H new ATOM 177 N LEU A2071 15.944 -12.352 -21.032 1.00 0.00 N ATOM 178 CA LEU A2071 16.874 -12.763 -19.976 1.00 0.00 C ATOM 179 C LEU A2071 17.489 -14.124 -20.344 1.00 0.00 C ATOM 180 O LEU A2071 18.713 -14.257 -20.354 1.00 0.00 O ATOM 181 CB LEU A2071 16.099 -12.770 -18.643 1.00 0.00 C ATOM 182 CG LEU A2071 16.862 -13.160 -17.361 1.00 0.00 C ATOM 183 CD1 LEU A2071 15.960 -12.828 -16.167 1.00 0.00 C ATOM 184 CD2 LEU A2071 17.200 -14.653 -17.262 1.00 0.00 C ATOM 0 H LEU A2071 14.997 -12.186 -20.692 1.00 0.00 H new ATOM 0 HA LEU A2071 17.710 -12.072 -19.868 1.00 0.00 H new ATOM 0 HB2 LEU A2071 15.684 -11.773 -18.494 1.00 0.00 H new ATOM 0 HB3 LEU A2071 15.257 -13.453 -18.751 1.00 0.00 H new ATOM 0 HG LEU A2071 17.803 -12.611 -17.374 1.00 0.00 H new ATOM 0 HD11 LEU A2071 16.470 -13.092 -15.241 1.00 0.00 H new ATOM 0 HD12 LEU A2071 15.736 -11.761 -16.166 1.00 0.00 H new ATOM 0 HD13 LEU A2071 15.032 -13.394 -16.244 1.00 0.00 H new ATOM 0 HD21 LEU A2071 17.736 -14.844 -16.332 1.00 0.00 H new ATOM 0 HD22 LEU A2071 16.279 -15.236 -17.276 1.00 0.00 H new ATOM 0 HD23 LEU A2071 17.825 -14.941 -18.107 1.00 0.00 H new ATOM 196 N LEU A2072 16.657 -15.113 -20.702 1.00 0.00 N ATOM 197 CA LEU A2072 17.119 -16.441 -21.119 1.00 0.00 C ATOM 198 C LEU A2072 17.985 -16.396 -22.388 1.00 0.00 C ATOM 199 O LEU A2072 19.052 -17.016 -22.404 1.00 0.00 O ATOM 200 CB LEU A2072 15.924 -17.389 -21.331 1.00 0.00 C ATOM 201 CG LEU A2072 15.148 -17.796 -20.065 1.00 0.00 C ATOM 202 CD1 LEU A2072 13.993 -18.706 -20.490 1.00 0.00 C ATOM 203 CD2 LEU A2072 16.014 -18.553 -19.054 1.00 0.00 C ATOM 0 H LEU A2072 15.642 -15.012 -20.710 1.00 0.00 H new ATOM 0 HA LEU A2072 17.746 -16.820 -20.312 1.00 0.00 H new ATOM 0 HB2 LEU A2072 15.228 -16.914 -22.022 1.00 0.00 H new ATOM 0 HB3 LEU A2072 16.287 -18.295 -21.817 1.00 0.00 H new ATOM 0 HG LEU A2072 14.800 -16.885 -19.579 1.00 0.00 H new ATOM 0 HD11 LEU A2072 13.426 -19.009 -19.610 1.00 0.00 H new ATOM 0 HD12 LEU A2072 13.339 -18.167 -21.175 1.00 0.00 H new ATOM 0 HD13 LEU A2072 14.391 -19.590 -20.988 1.00 0.00 H new ATOM 0 HD21 LEU A2072 15.413 -18.813 -18.183 1.00 0.00 H new ATOM 0 HD22 LEU A2072 16.399 -19.463 -19.514 1.00 0.00 H new ATOM 0 HD23 LEU A2072 16.847 -17.922 -18.744 1.00 0.00 H new ATOM 215 N ARG A2073 17.577 -15.665 -23.443 1.00 0.00 N ATOM 216 CA ARG A2073 18.381 -15.577 -24.682 1.00 0.00 C ATOM 217 C ARG A2073 19.754 -14.944 -24.416 1.00 0.00 C ATOM 218 O ARG A2073 20.760 -15.416 -24.941 1.00 0.00 O ATOM 219 CB ARG A2073 17.597 -14.920 -25.844 1.00 0.00 C ATOM 220 CG ARG A2073 17.817 -13.407 -26.040 1.00 0.00 C ATOM 221 CD ARG A2073 17.103 -12.838 -27.273 1.00 0.00 C ATOM 222 NE ARG A2073 15.652 -12.665 -27.066 1.00 0.00 N ATOM 223 CZ ARG A2073 14.653 -13.276 -27.669 1.00 0.00 C ATOM 224 NH1 ARG A2073 14.815 -14.241 -28.531 1.00 0.00 N ATOM 225 NH2 ARG A2073 13.446 -12.885 -27.394 1.00 0.00 N ATOM 0 H ARG A2073 16.707 -15.132 -23.465 1.00 0.00 H new ATOM 0 HA ARG A2073 18.584 -16.593 -25.022 1.00 0.00 H new ATOM 0 HB2 ARG A2073 17.866 -15.429 -26.770 1.00 0.00 H new ATOM 0 HB3 ARG A2073 16.533 -15.094 -25.682 1.00 0.00 H new ATOM 0 HG2 ARG A2073 17.468 -12.879 -25.152 1.00 0.00 H new ATOM 0 HG3 ARG A2073 18.886 -13.212 -26.127 1.00 0.00 H new ATOM 0 HD2 ARG A2073 17.546 -11.876 -27.531 1.00 0.00 H new ATOM 0 HD3 ARG A2073 17.267 -13.503 -28.121 1.00 0.00 H new ATOM 0 HE ARG A2073 15.387 -11.979 -26.360 1.00 0.00 H new ATOM 0 HH11 ARG A2073 15.754 -14.559 -28.769 1.00 0.00 H new ATOM 0 HH12 ARG A2073 14.003 -14.677 -28.967 1.00 0.00 H new ATOM 0 HH21 ARG A2073 13.295 -12.127 -26.729 1.00 0.00 H new ATOM 0 HH22 ARG A2073 12.649 -13.336 -27.843 1.00 0.00 H new ATOM 239 N THR A2074 19.797 -13.913 -23.567 1.00 0.00 N ATOM 240 CA THR A2074 21.035 -13.220 -23.172 1.00 0.00 C ATOM 241 C THR A2074 21.936 -14.140 -22.341 1.00 0.00 C ATOM 242 O THR A2074 23.136 -14.221 -22.597 1.00 0.00 O ATOM 243 CB THR A2074 20.717 -11.938 -22.386 1.00 0.00 C ATOM 244 OG1 THR A2074 19.860 -11.100 -23.132 1.00 0.00 O ATOM 245 CG2 THR A2074 21.964 -11.109 -22.097 1.00 0.00 C ATOM 0 H THR A2074 18.962 -13.528 -23.126 1.00 0.00 H new ATOM 0 HA THR A2074 21.568 -12.946 -24.082 1.00 0.00 H new ATOM 0 HB THR A2074 20.259 -12.270 -21.454 1.00 0.00 H new ATOM 0 HG1 THR A2074 18.941 -11.435 -23.072 1.00 0.00 H new ATOM 0 HG21 THR A2074 21.685 -10.214 -21.540 1.00 0.00 H new ATOM 0 HG22 THR A2074 22.665 -11.700 -21.507 1.00 0.00 H new ATOM 0 HG23 THR A2074 22.434 -10.819 -23.037 1.00 0.00 H new ATOM 253 N LEU A2075 21.366 -14.871 -21.375 1.00 0.00 N ATOM 254 CA LEU A2075 22.080 -15.833 -20.527 1.00 0.00 C ATOM 255 C LEU A2075 22.733 -16.964 -21.351 1.00 0.00 C ATOM 256 O LEU A2075 23.859 -17.367 -21.057 1.00 0.00 O ATOM 257 CB LEU A2075 21.077 -16.386 -19.496 1.00 0.00 C ATOM 258 CG LEU A2075 21.611 -17.511 -18.591 1.00 0.00 C ATOM 259 CD1 LEU A2075 22.820 -17.076 -17.762 1.00 0.00 C ATOM 260 CD2 LEU A2075 20.494 -17.968 -17.657 1.00 0.00 C ATOM 0 H LEU A2075 20.372 -14.808 -21.156 1.00 0.00 H new ATOM 0 HA LEU A2075 22.903 -15.331 -20.018 1.00 0.00 H new ATOM 0 HB2 LEU A2075 20.741 -15.564 -18.864 1.00 0.00 H new ATOM 0 HB3 LEU A2075 20.202 -16.757 -20.029 1.00 0.00 H new ATOM 0 HG LEU A2075 21.939 -18.326 -19.236 1.00 0.00 H new ATOM 0 HD11 LEU A2075 23.155 -17.908 -17.143 1.00 0.00 H new ATOM 0 HD12 LEU A2075 23.627 -16.771 -18.428 1.00 0.00 H new ATOM 0 HD13 LEU A2075 22.541 -16.238 -17.124 1.00 0.00 H new ATOM 0 HD21 LEU A2075 20.863 -18.765 -17.012 1.00 0.00 H new ATOM 0 HD22 LEU A2075 20.165 -17.128 -17.045 1.00 0.00 H new ATOM 0 HD23 LEU A2075 19.655 -18.337 -18.247 1.00 0.00 H new ATOM 272 N LYS A2076 22.038 -17.480 -22.379 1.00 0.00 N ATOM 273 CA LYS A2076 22.540 -18.556 -23.258 1.00 0.00 C ATOM 274 C LYS A2076 23.753 -18.160 -24.117 1.00 0.00 C ATOM 275 O LYS A2076 24.587 -19.019 -24.413 1.00 0.00 O ATOM 276 CB LYS A2076 21.408 -19.072 -24.167 1.00 0.00 C ATOM 277 CG LYS A2076 20.461 -20.089 -23.507 1.00 0.00 C ATOM 278 CD LYS A2076 21.180 -21.384 -23.073 1.00 0.00 C ATOM 279 CE LYS A2076 20.327 -22.647 -23.274 1.00 0.00 C ATOM 280 NZ LYS A2076 19.100 -22.664 -22.436 1.00 0.00 N ATOM 0 H LYS A2076 21.102 -17.160 -22.628 1.00 0.00 H new ATOM 0 HA LYS A2076 22.886 -19.343 -22.588 1.00 0.00 H new ATOM 0 HB2 LYS A2076 20.821 -18.220 -24.511 1.00 0.00 H new ATOM 0 HB3 LYS A2076 21.852 -19.531 -25.051 1.00 0.00 H new ATOM 0 HG2 LYS A2076 19.993 -19.630 -22.636 1.00 0.00 H new ATOM 0 HG3 LYS A2076 19.661 -20.339 -24.204 1.00 0.00 H new ATOM 0 HD2 LYS A2076 22.106 -21.485 -23.639 1.00 0.00 H new ATOM 0 HD3 LYS A2076 21.456 -21.304 -22.022 1.00 0.00 H new ATOM 0 HE2 LYS A2076 20.043 -22.723 -24.324 1.00 0.00 H new ATOM 0 HE3 LYS A2076 20.930 -23.525 -23.042 1.00 0.00 H new ATOM 0 HZ1 LYS A2076 18.568 -23.539 -22.617 1.00 0.00 H new ATOM 0 HZ2 LYS A2076 19.365 -22.621 -21.431 1.00 0.00 H new ATOM 0 HZ3 LYS A2076 18.506 -21.843 -22.673 1.00 0.00 H new ATOM 294 N SER A2077 23.863 -16.893 -24.517 1.00 0.00 N ATOM 295 CA SER A2077 24.989 -16.367 -25.312 1.00 0.00 C ATOM 296 C SER A2077 26.328 -16.435 -24.543 1.00 0.00 C ATOM 297 O SER A2077 26.317 -16.492 -23.308 1.00 0.00 O ATOM 298 CB SER A2077 24.683 -14.919 -25.706 1.00 0.00 C ATOM 299 OG SER A2077 23.607 -14.878 -26.628 1.00 0.00 O ATOM 0 H SER A2077 23.163 -16.185 -24.297 1.00 0.00 H new ATOM 0 HA SER A2077 25.099 -16.989 -26.201 1.00 0.00 H new ATOM 0 HB2 SER A2077 24.433 -14.338 -24.818 1.00 0.00 H new ATOM 0 HB3 SER A2077 25.568 -14.460 -26.148 1.00 0.00 H new ATOM 0 HG SER A2077 22.764 -15.035 -26.154 1.00 0.00 H new ATOM 305 N PRO A2078 27.497 -16.419 -25.222 1.00 0.00 N ATOM 306 CA PRO A2078 28.799 -16.485 -24.552 1.00 0.00 C ATOM 307 C PRO A2078 29.036 -15.276 -23.635 1.00 0.00 C ATOM 308 O PRO A2078 28.603 -14.153 -23.913 1.00 0.00 O ATOM 309 CB PRO A2078 29.847 -16.599 -25.663 1.00 0.00 C ATOM 310 CG PRO A2078 29.154 -15.928 -26.842 1.00 0.00 C ATOM 311 CD PRO A2078 27.693 -16.342 -26.664 1.00 0.00 C ATOM 0 HA PRO A2078 28.855 -17.346 -23.887 1.00 0.00 H new ATOM 0 HB2 PRO A2078 30.776 -16.094 -25.398 1.00 0.00 H new ATOM 0 HB3 PRO A2078 30.099 -17.637 -25.878 1.00 0.00 H new ATOM 0 HG2 PRO A2078 29.272 -14.845 -26.816 1.00 0.00 H new ATOM 0 HG3 PRO A2078 29.557 -16.270 -27.795 1.00 0.00 H new ATOM 0 HD2 PRO A2078 27.019 -15.615 -27.116 1.00 0.00 H new ATOM 0 HD3 PRO A2078 27.493 -17.301 -27.141 1.00 0.00 H new ATOM 319 N SER A2079 29.722 -15.525 -22.521 1.00 0.00 N ATOM 320 CA SER A2079 29.991 -14.532 -21.473 1.00 0.00 C ATOM 321 C SER A2079 30.905 -13.384 -21.925 1.00 0.00 C ATOM 322 O SER A2079 31.952 -13.600 -22.542 1.00 0.00 O ATOM 323 CB SER A2079 30.595 -15.225 -20.247 1.00 0.00 C ATOM 324 OG SER A2079 30.625 -14.327 -19.150 1.00 0.00 O ATOM 0 H SER A2079 30.117 -16.442 -22.314 1.00 0.00 H new ATOM 0 HA SER A2079 29.031 -14.079 -21.225 1.00 0.00 H new ATOM 0 HB2 SER A2079 30.007 -16.106 -19.990 1.00 0.00 H new ATOM 0 HB3 SER A2079 31.604 -15.570 -20.474 1.00 0.00 H new ATOM 0 HG SER A2079 31.011 -14.777 -18.369 1.00 0.00 H new ATOM 330 N SER A2080 30.510 -12.158 -21.577 1.00 0.00 N ATOM 331 CA SER A2080 31.226 -10.899 -21.826 1.00 0.00 C ATOM 332 C SER A2080 30.634 -9.780 -20.953 1.00 0.00 C ATOM 333 O SER A2080 29.475 -9.895 -20.529 1.00 0.00 O ATOM 334 CB SER A2080 31.130 -10.497 -23.309 1.00 0.00 C ATOM 335 OG SER A2080 29.813 -10.111 -23.667 1.00 0.00 O ATOM 0 H SER A2080 29.630 -12.005 -21.084 1.00 0.00 H new ATOM 0 HA SER A2080 32.276 -11.047 -21.572 1.00 0.00 H new ATOM 0 HB2 SER A2080 31.816 -9.674 -23.507 1.00 0.00 H new ATOM 0 HB3 SER A2080 31.446 -11.333 -23.933 1.00 0.00 H new ATOM 0 HG SER A2080 29.791 -9.861 -24.614 1.00 0.00 H new ATOM 341 N PRO A2081 31.367 -8.675 -20.698 1.00 0.00 N ATOM 342 CA PRO A2081 30.823 -7.518 -19.980 1.00 0.00 C ATOM 343 C PRO A2081 29.526 -7.003 -20.628 1.00 0.00 C ATOM 344 O PRO A2081 28.593 -6.597 -19.938 1.00 0.00 O ATOM 345 CB PRO A2081 31.920 -6.446 -20.017 1.00 0.00 C ATOM 346 CG PRO A2081 33.204 -7.239 -20.250 1.00 0.00 C ATOM 347 CD PRO A2081 32.744 -8.420 -21.100 1.00 0.00 C ATOM 0 HA PRO A2081 30.557 -7.785 -18.957 1.00 0.00 H new ATOM 0 HB2 PRO A2081 31.746 -5.724 -20.815 1.00 0.00 H new ATOM 0 HB3 PRO A2081 31.961 -5.885 -19.083 1.00 0.00 H new ATOM 0 HG2 PRO A2081 33.956 -6.642 -20.766 1.00 0.00 H new ATOM 0 HG3 PRO A2081 33.648 -7.569 -19.311 1.00 0.00 H new ATOM 0 HD2 PRO A2081 32.806 -8.186 -22.163 1.00 0.00 H new ATOM 0 HD3 PRO A2081 33.371 -9.295 -20.929 1.00 0.00 H new ATOM 355 N GLN A2082 29.451 -7.071 -21.963 1.00 0.00 N ATOM 356 CA GLN A2082 28.284 -6.683 -22.762 1.00 0.00 C ATOM 357 C GLN A2082 27.084 -7.614 -22.505 1.00 0.00 C ATOM 358 O GLN A2082 25.955 -7.140 -22.373 1.00 0.00 O ATOM 359 CB GLN A2082 28.655 -6.680 -24.258 1.00 0.00 C ATOM 360 CG GLN A2082 29.641 -5.564 -24.660 1.00 0.00 C ATOM 361 CD GLN A2082 31.069 -5.758 -24.139 1.00 0.00 C ATOM 362 OE1 GLN A2082 31.584 -6.862 -24.029 1.00 0.00 O ATOM 363 NE2 GLN A2082 31.759 -4.701 -23.767 1.00 0.00 N ATOM 0 H GLN A2082 30.226 -7.408 -22.534 1.00 0.00 H new ATOM 0 HA GLN A2082 27.986 -5.678 -22.462 1.00 0.00 H new ATOM 0 HB2 GLN A2082 29.091 -7.645 -24.515 1.00 0.00 H new ATOM 0 HB3 GLN A2082 27.744 -6.575 -24.847 1.00 0.00 H new ATOM 0 HG2 GLN A2082 29.671 -5.498 -25.748 1.00 0.00 H new ATOM 0 HG3 GLN A2082 29.260 -4.611 -24.293 1.00 0.00 H new ATOM 0 HE21 GLN A2082 31.350 -3.770 -23.850 1.00 0.00 H new ATOM 0 HE22 GLN A2082 32.703 -4.813 -23.396 1.00 0.00 H new ATOM 372 N GLN A2083 27.317 -8.927 -22.383 1.00 0.00 N ATOM 373 CA GLN A2083 26.271 -9.908 -22.072 1.00 0.00 C ATOM 374 C GLN A2083 25.668 -9.647 -20.683 1.00 0.00 C ATOM 375 O GLN A2083 24.448 -9.582 -20.530 1.00 0.00 O ATOM 376 CB GLN A2083 26.845 -11.337 -22.163 1.00 0.00 C ATOM 377 CG GLN A2083 25.882 -12.276 -22.891 1.00 0.00 C ATOM 378 CD GLN A2083 25.809 -11.953 -24.383 1.00 0.00 C ATOM 379 OE1 GLN A2083 24.864 -11.352 -24.875 1.00 0.00 O ATOM 380 NE2 GLN A2083 26.802 -12.333 -25.157 1.00 0.00 N ATOM 0 H GLN A2083 28.242 -9.340 -22.498 1.00 0.00 H new ATOM 0 HA GLN A2083 25.470 -9.806 -22.804 1.00 0.00 H new ATOM 0 HB2 GLN A2083 27.801 -11.315 -22.687 1.00 0.00 H new ATOM 0 HB3 GLN A2083 27.040 -11.718 -21.160 1.00 0.00 H new ATOM 0 HG2 GLN A2083 26.206 -13.308 -22.756 1.00 0.00 H new ATOM 0 HG3 GLN A2083 24.888 -12.194 -22.450 1.00 0.00 H new ATOM 0 HE21 GLN A2083 27.596 -12.835 -24.759 1.00 0.00 H new ATOM 0 HE22 GLN A2083 26.778 -12.126 -26.155 1.00 0.00 H new ATOM 389 N GLN A2084 26.530 -9.436 -19.682 1.00 0.00 N ATOM 390 CA GLN A2084 26.119 -9.083 -18.318 1.00 0.00 C ATOM 391 C GLN A2084 25.318 -7.767 -18.323 1.00 0.00 C ATOM 392 O GLN A2084 24.235 -7.696 -17.738 1.00 0.00 O ATOM 393 CB GLN A2084 27.368 -8.989 -17.420 1.00 0.00 C ATOM 394 CG GLN A2084 27.028 -8.757 -15.939 1.00 0.00 C ATOM 395 CD GLN A2084 28.289 -8.557 -15.100 1.00 0.00 C ATOM 396 OE1 GLN A2084 28.950 -9.498 -14.682 1.00 0.00 O ATOM 397 NE2 GLN A2084 28.693 -7.330 -14.841 1.00 0.00 N ATOM 0 H GLN A2084 27.541 -9.506 -19.797 1.00 0.00 H new ATOM 0 HA GLN A2084 25.465 -9.857 -17.917 1.00 0.00 H new ATOM 0 HB2 GLN A2084 27.946 -9.908 -17.514 1.00 0.00 H new ATOM 0 HB3 GLN A2084 28.002 -8.176 -17.773 1.00 0.00 H new ATOM 0 HG2 GLN A2084 26.385 -7.882 -15.845 1.00 0.00 H new ATOM 0 HG3 GLN A2084 26.466 -9.609 -15.556 1.00 0.00 H new ATOM 0 HE21 GLN A2084 28.155 -6.533 -15.181 1.00 0.00 H new ATOM 0 HE22 GLN A2084 29.544 -7.177 -14.300 1.00 0.00 H new ATOM 406 N GLN A2085 25.817 -6.738 -19.022 1.00 0.00 N ATOM 407 CA GLN A2085 25.149 -5.441 -19.155 1.00 0.00 C ATOM 408 C GLN A2085 23.744 -5.569 -19.759 1.00 0.00 C ATOM 409 O GLN A2085 22.835 -4.889 -19.292 1.00 0.00 O ATOM 410 CB GLN A2085 26.032 -4.477 -19.968 1.00 0.00 C ATOM 411 CG GLN A2085 25.490 -3.037 -20.000 1.00 0.00 C ATOM 412 CD GLN A2085 25.413 -2.403 -18.611 1.00 0.00 C ATOM 413 OE1 GLN A2085 26.402 -2.259 -17.906 1.00 0.00 O ATOM 414 NE2 GLN A2085 24.244 -2.005 -18.155 1.00 0.00 N ATOM 0 H GLN A2085 26.708 -6.786 -19.516 1.00 0.00 H new ATOM 0 HA GLN A2085 25.012 -5.029 -18.155 1.00 0.00 H new ATOM 0 HB2 GLN A2085 27.036 -4.471 -19.545 1.00 0.00 H new ATOM 0 HB3 GLN A2085 26.119 -4.848 -20.989 1.00 0.00 H new ATOM 0 HG2 GLN A2085 26.129 -2.427 -20.638 1.00 0.00 H new ATOM 0 HG3 GLN A2085 24.497 -3.037 -20.450 1.00 0.00 H new ATOM 0 HE21 GLN A2085 23.408 -2.117 -18.728 1.00 0.00 H new ATOM 0 HE22 GLN A2085 24.174 -1.585 -17.228 1.00 0.00 H new ATOM 423 N GLN A2086 23.523 -6.445 -20.747 1.00 0.00 N ATOM 424 CA GLN A2086 22.181 -6.643 -21.307 1.00 0.00 C ATOM 425 C GLN A2086 21.188 -7.176 -20.268 1.00 0.00 C ATOM 426 O GLN A2086 20.063 -6.681 -20.218 1.00 0.00 O ATOM 427 CB GLN A2086 22.207 -7.536 -22.558 1.00 0.00 C ATOM 428 CG GLN A2086 22.355 -6.727 -23.854 1.00 0.00 C ATOM 429 CD GLN A2086 21.182 -5.768 -24.079 1.00 0.00 C ATOM 430 OE1 GLN A2086 21.250 -4.577 -23.799 1.00 0.00 O ATOM 431 NE2 GLN A2086 20.052 -6.247 -24.552 1.00 0.00 N ATOM 0 H GLN A2086 24.249 -7.023 -21.172 1.00 0.00 H new ATOM 0 HA GLN A2086 21.829 -5.658 -21.612 1.00 0.00 H new ATOM 0 HB2 GLN A2086 23.033 -8.243 -22.479 1.00 0.00 H new ATOM 0 HB3 GLN A2086 21.289 -8.122 -22.602 1.00 0.00 H new ATOM 0 HG2 GLN A2086 23.285 -6.159 -23.821 1.00 0.00 H new ATOM 0 HG3 GLN A2086 22.430 -7.411 -24.700 1.00 0.00 H new ATOM 0 HE21 GLN A2086 19.977 -7.236 -24.790 1.00 0.00 H new ATOM 0 HE22 GLN A2086 19.250 -5.630 -24.680 1.00 0.00 H new ATOM 440 N VAL A2087 21.576 -8.116 -19.396 1.00 0.00 N ATOM 441 CA VAL A2087 20.671 -8.582 -18.326 1.00 0.00 C ATOM 442 C VAL A2087 20.391 -7.445 -17.339 1.00 0.00 C ATOM 443 O VAL A2087 19.239 -7.254 -16.952 1.00 0.00 O ATOM 444 CB VAL A2087 21.184 -9.843 -17.611 1.00 0.00 C ATOM 445 CG1 VAL A2087 20.171 -10.328 -16.562 1.00 0.00 C ATOM 446 CG2 VAL A2087 21.383 -10.975 -18.626 1.00 0.00 C ATOM 0 H VAL A2087 22.492 -8.564 -19.405 1.00 0.00 H new ATOM 0 HA VAL A2087 19.733 -8.874 -18.799 1.00 0.00 H new ATOM 0 HB VAL A2087 22.126 -9.588 -17.126 1.00 0.00 H new ATOM 0 HG11 VAL A2087 20.556 -11.221 -16.070 1.00 0.00 H new ATOM 0 HG12 VAL A2087 20.012 -9.545 -15.821 1.00 0.00 H new ATOM 0 HG13 VAL A2087 19.225 -10.563 -17.051 1.00 0.00 H new ATOM 0 HG21 VAL A2087 21.747 -11.865 -18.112 1.00 0.00 H new ATOM 0 HG22 VAL A2087 20.433 -11.199 -19.112 1.00 0.00 H new ATOM 0 HG23 VAL A2087 22.111 -10.667 -19.377 1.00 0.00 H new ATOM 456 N LEU A2088 21.398 -6.631 -16.989 1.00 0.00 N ATOM 457 CA LEU A2088 21.192 -5.446 -16.145 1.00 0.00 C ATOM 458 C LEU A2088 20.207 -4.468 -16.813 1.00 0.00 C ATOM 459 O LEU A2088 19.308 -3.961 -16.145 1.00 0.00 O ATOM 460 CB LEU A2088 22.531 -4.749 -15.833 1.00 0.00 C ATOM 461 CG LEU A2088 23.530 -5.569 -14.996 1.00 0.00 C ATOM 462 CD1 LEU A2088 24.834 -4.784 -14.850 1.00 0.00 C ATOM 463 CD2 LEU A2088 23.006 -5.882 -13.593 1.00 0.00 C ATOM 0 H LEU A2088 22.366 -6.773 -17.279 1.00 0.00 H new ATOM 0 HA LEU A2088 20.759 -5.775 -15.200 1.00 0.00 H new ATOM 0 HB2 LEU A2088 23.009 -4.481 -16.775 1.00 0.00 H new ATOM 0 HB3 LEU A2088 22.321 -3.818 -15.306 1.00 0.00 H new ATOM 0 HG LEU A2088 23.685 -6.511 -15.521 1.00 0.00 H new ATOM 0 HD11 LEU A2088 25.543 -5.363 -14.258 1.00 0.00 H new ATOM 0 HD12 LEU A2088 25.256 -4.593 -15.837 1.00 0.00 H new ATOM 0 HD13 LEU A2088 24.634 -3.836 -14.351 1.00 0.00 H new ATOM 0 HD21 LEU A2088 23.751 -6.462 -13.047 1.00 0.00 H new ATOM 0 HD22 LEU A2088 22.810 -4.951 -13.062 1.00 0.00 H new ATOM 0 HD23 LEU A2088 22.083 -6.457 -13.669 1.00 0.00 H new ATOM 475 N ASN A2089 20.324 -4.238 -18.127 1.00 0.00 N ATOM 476 CA ASN A2089 19.416 -3.373 -18.892 1.00 0.00 C ATOM 477 C ASN A2089 17.972 -3.914 -18.845 1.00 0.00 C ATOM 478 O ASN A2089 17.041 -3.177 -18.520 1.00 0.00 O ATOM 479 CB ASN A2089 19.904 -3.236 -20.352 1.00 0.00 C ATOM 480 CG ASN A2089 21.245 -2.537 -20.530 1.00 0.00 C ATOM 481 OD1 ASN A2089 21.764 -1.856 -19.654 1.00 0.00 O ATOM 482 ND2 ASN A2089 21.860 -2.680 -21.682 1.00 0.00 N ATOM 0 H ASN A2089 21.062 -4.653 -18.696 1.00 0.00 H new ATOM 0 HA ASN A2089 19.418 -2.384 -18.435 1.00 0.00 H new ATOM 0 HB2 ASN A2089 19.972 -4.232 -20.789 1.00 0.00 H new ATOM 0 HB3 ASN A2089 19.151 -2.689 -20.919 1.00 0.00 H new ATOM 0 HD21 ASN A2089 22.760 -2.226 -21.839 1.00 0.00 H new ATOM 0 HD22 ASN A2089 21.438 -3.245 -22.419 1.00 0.00 H new ATOM 489 N ILE A2090 17.790 -5.209 -19.135 1.00 0.00 N ATOM 490 CA ILE A2090 16.496 -5.916 -19.109 1.00 0.00 C ATOM 491 C ILE A2090 15.835 -5.809 -17.722 1.00 0.00 C ATOM 492 O ILE A2090 14.653 -5.466 -17.622 1.00 0.00 O ATOM 493 CB ILE A2090 16.716 -7.388 -19.550 1.00 0.00 C ATOM 494 CG1 ILE A2090 17.043 -7.454 -21.063 1.00 0.00 C ATOM 495 CG2 ILE A2090 15.503 -8.287 -19.246 1.00 0.00 C ATOM 496 CD1 ILE A2090 17.748 -8.749 -21.493 1.00 0.00 C ATOM 0 H ILE A2090 18.564 -5.817 -19.404 1.00 0.00 H new ATOM 0 HA ILE A2090 15.805 -5.448 -19.810 1.00 0.00 H new ATOM 0 HB ILE A2090 17.558 -7.765 -18.970 1.00 0.00 H new ATOM 0 HG12 ILE A2090 16.117 -7.351 -21.629 1.00 0.00 H new ATOM 0 HG13 ILE A2090 17.674 -6.605 -21.326 1.00 0.00 H new ATOM 0 HG21 ILE A2090 15.713 -9.305 -19.575 1.00 0.00 H new ATOM 0 HG22 ILE A2090 15.309 -8.286 -18.173 1.00 0.00 H new ATOM 0 HG23 ILE A2090 14.628 -7.908 -19.774 1.00 0.00 H new ATOM 0 HD11 ILE A2090 17.943 -8.719 -22.565 1.00 0.00 H new ATOM 0 HD12 ILE A2090 18.691 -8.845 -20.955 1.00 0.00 H new ATOM 0 HD13 ILE A2090 17.111 -9.603 -21.264 1.00 0.00 H new ATOM 508 N LEU A2091 16.591 -6.065 -16.649 1.00 0.00 N ATOM 509 CA LEU A2091 16.103 -5.991 -15.269 1.00 0.00 C ATOM 510 C LEU A2091 15.778 -4.553 -14.827 1.00 0.00 C ATOM 511 O LEU A2091 14.698 -4.319 -14.283 1.00 0.00 O ATOM 512 CB LEU A2091 17.137 -6.638 -14.332 1.00 0.00 C ATOM 513 CG LEU A2091 17.267 -8.171 -14.443 1.00 0.00 C ATOM 514 CD1 LEU A2091 18.381 -8.649 -13.508 1.00 0.00 C ATOM 515 CD2 LEU A2091 15.984 -8.914 -14.058 1.00 0.00 C ATOM 0 H LEU A2091 17.573 -6.333 -16.716 1.00 0.00 H new ATOM 0 HA LEU A2091 15.163 -6.540 -15.215 1.00 0.00 H new ATOM 0 HB2 LEU A2091 18.112 -6.193 -14.532 1.00 0.00 H new ATOM 0 HB3 LEU A2091 16.877 -6.386 -13.304 1.00 0.00 H new ATOM 0 HG LEU A2091 17.484 -8.391 -15.488 1.00 0.00 H new ATOM 0 HD11 LEU A2091 18.478 -9.732 -13.582 1.00 0.00 H new ATOM 0 HD12 LEU A2091 19.322 -8.180 -13.794 1.00 0.00 H new ATOM 0 HD13 LEU A2091 18.137 -8.376 -12.481 1.00 0.00 H new ATOM 0 HD21 LEU A2091 16.142 -9.988 -14.158 1.00 0.00 H new ATOM 0 HD22 LEU A2091 15.724 -8.680 -13.026 1.00 0.00 H new ATOM 0 HD23 LEU A2091 15.172 -8.604 -14.716 1.00 0.00 H new ATOM 527 N LYS A2092 16.655 -3.571 -15.083 1.00 0.00 N ATOM 528 CA LYS A2092 16.412 -2.150 -14.746 1.00 0.00 C ATOM 529 C LYS A2092 15.230 -1.542 -15.518 1.00 0.00 C ATOM 530 O LYS A2092 14.627 -0.580 -15.045 1.00 0.00 O ATOM 531 CB LYS A2092 17.692 -1.321 -14.916 1.00 0.00 C ATOM 532 CG LYS A2092 18.714 -1.665 -13.812 1.00 0.00 C ATOM 533 CD LYS A2092 19.915 -0.710 -13.798 1.00 0.00 C ATOM 534 CE LYS A2092 19.493 0.668 -13.270 1.00 0.00 C ATOM 535 NZ LYS A2092 20.634 1.621 -13.239 1.00 0.00 N ATOM 0 H LYS A2092 17.557 -3.735 -15.531 1.00 0.00 H new ATOM 0 HA LYS A2092 16.125 -2.120 -13.695 1.00 0.00 H new ATOM 0 HB2 LYS A2092 18.129 -1.514 -15.896 1.00 0.00 H new ATOM 0 HB3 LYS A2092 17.451 -0.259 -14.878 1.00 0.00 H new ATOM 0 HG2 LYS A2092 18.219 -1.633 -12.842 1.00 0.00 H new ATOM 0 HG3 LYS A2092 19.068 -2.686 -13.956 1.00 0.00 H new ATOM 0 HD2 LYS A2092 20.707 -1.120 -13.172 1.00 0.00 H new ATOM 0 HD3 LYS A2092 20.323 -0.612 -14.804 1.00 0.00 H new ATOM 0 HE2 LYS A2092 18.700 1.071 -13.900 1.00 0.00 H new ATOM 0 HE3 LYS A2092 19.081 0.562 -12.267 1.00 0.00 H new ATOM 0 HZ1 LYS A2092 20.309 2.540 -12.877 1.00 0.00 H new ATOM 0 HZ2 LYS A2092 21.381 1.249 -12.618 1.00 0.00 H new ATOM 0 HZ3 LYS A2092 21.012 1.742 -14.200 1.00 0.00 H new ATOM 549 N SER A2093 14.865 -2.118 -16.668 1.00 0.00 N ATOM 550 CA SER A2093 13.692 -1.735 -17.473 1.00 0.00 C ATOM 551 C SER A2093 12.372 -2.314 -16.906 1.00 0.00 C ATOM 552 O SER A2093 11.282 -1.866 -17.264 1.00 0.00 O ATOM 553 CB SER A2093 13.920 -2.205 -18.919 1.00 0.00 C ATOM 554 OG SER A2093 12.951 -1.689 -19.817 1.00 0.00 O ATOM 0 H SER A2093 15.392 -2.888 -17.080 1.00 0.00 H new ATOM 0 HA SER A2093 13.586 -0.651 -17.441 1.00 0.00 H new ATOM 0 HB2 SER A2093 14.913 -1.897 -19.245 1.00 0.00 H new ATOM 0 HB3 SER A2093 13.897 -3.294 -18.951 1.00 0.00 H new ATOM 0 HG SER A2093 13.138 -2.014 -20.722 1.00 0.00 H new ATOM 560 N ASN A2094 12.459 -3.282 -15.979 1.00 0.00 N ATOM 561 CA ASN A2094 11.345 -3.962 -15.301 1.00 0.00 C ATOM 562 C ASN A2094 11.620 -4.001 -13.771 1.00 0.00 C ATOM 563 O ASN A2094 11.781 -5.080 -13.192 1.00 0.00 O ATOM 564 CB ASN A2094 11.184 -5.367 -15.921 1.00 0.00 C ATOM 565 CG ASN A2094 10.839 -5.337 -17.402 1.00 0.00 C ATOM 566 OD1 ASN A2094 9.681 -5.330 -17.793 1.00 0.00 O ATOM 567 ND2 ASN A2094 11.825 -5.344 -18.272 1.00 0.00 N ATOM 0 H ASN A2094 13.364 -3.631 -15.664 1.00 0.00 H new ATOM 0 HA ASN A2094 10.405 -3.427 -15.438 1.00 0.00 H new ATOM 0 HB2 ASN A2094 12.110 -5.926 -15.782 1.00 0.00 H new ATOM 0 HB3 ASN A2094 10.403 -5.906 -15.384 1.00 0.00 H new ATOM 0 HD21 ASN A2094 11.623 -5.344 -19.272 1.00 0.00 H new ATOM 0 HD22 ASN A2094 12.792 -5.350 -17.947 1.00 0.00 H new ATOM 574 N PRO A2095 11.732 -2.834 -13.099 1.00 0.00 N ATOM 575 CA PRO A2095 12.161 -2.752 -11.699 1.00 0.00 C ATOM 576 C PRO A2095 11.229 -3.401 -10.669 1.00 0.00 C ATOM 577 O PRO A2095 11.715 -3.827 -9.625 1.00 0.00 O ATOM 578 CB PRO A2095 12.371 -1.259 -11.416 1.00 0.00 C ATOM 579 CG PRO A2095 11.470 -0.561 -12.433 1.00 0.00 C ATOM 580 CD PRO A2095 11.528 -1.494 -13.637 1.00 0.00 C ATOM 0 HA PRO A2095 13.071 -3.341 -11.582 1.00 0.00 H new ATOM 0 HB2 PRO A2095 12.092 -1.003 -10.394 1.00 0.00 H new ATOM 0 HB3 PRO A2095 13.415 -0.971 -11.543 1.00 0.00 H new ATOM 0 HG2 PRO A2095 10.452 -0.446 -12.059 1.00 0.00 H new ATOM 0 HG3 PRO A2095 11.834 0.437 -12.677 1.00 0.00 H new ATOM 0 HD2 PRO A2095 10.605 -1.442 -14.215 1.00 0.00 H new ATOM 0 HD3 PRO A2095 12.341 -1.215 -14.308 1.00 0.00 H new ATOM 588 N GLN A2096 9.921 -3.499 -10.930 1.00 0.00 N ATOM 589 CA GLN A2096 8.935 -4.065 -9.992 1.00 0.00 C ATOM 590 C GLN A2096 9.323 -5.461 -9.472 1.00 0.00 C ATOM 591 O GLN A2096 9.311 -5.697 -8.261 1.00 0.00 O ATOM 592 CB GLN A2096 7.549 -4.141 -10.660 1.00 0.00 C ATOM 593 CG GLN A2096 6.807 -2.803 -10.811 1.00 0.00 C ATOM 594 CD GLN A2096 7.558 -1.753 -11.626 1.00 0.00 C ATOM 595 OE1 GLN A2096 7.929 -0.699 -11.130 1.00 0.00 O ATOM 596 NE2 GLN A2096 7.835 -1.992 -12.892 1.00 0.00 N ATOM 0 H GLN A2096 9.508 -3.185 -11.808 1.00 0.00 H new ATOM 0 HA GLN A2096 8.910 -3.394 -9.133 1.00 0.00 H new ATOM 0 HB2 GLN A2096 7.667 -4.584 -11.649 1.00 0.00 H new ATOM 0 HB3 GLN A2096 6.923 -4.819 -10.080 1.00 0.00 H new ATOM 0 HG2 GLN A2096 5.841 -2.988 -11.282 1.00 0.00 H new ATOM 0 HG3 GLN A2096 6.606 -2.399 -9.819 1.00 0.00 H new ATOM 0 HE21 GLN A2096 7.534 -2.866 -13.324 1.00 0.00 H new ATOM 0 HE22 GLN A2096 8.350 -1.303 -13.440 1.00 0.00 H new ATOM 605 N LEU A2097 9.679 -6.382 -10.379 1.00 0.00 N ATOM 606 CA LEU A2097 10.064 -7.753 -10.019 1.00 0.00 C ATOM 607 C LEU A2097 11.526 -7.886 -9.556 1.00 0.00 C ATOM 608 O LEU A2097 11.806 -8.688 -8.663 1.00 0.00 O ATOM 609 CB LEU A2097 9.642 -8.752 -11.123 1.00 0.00 C ATOM 610 CG LEU A2097 9.950 -8.442 -12.607 1.00 0.00 C ATOM 611 CD1 LEU A2097 11.431 -8.530 -12.973 1.00 0.00 C ATOM 612 CD2 LEU A2097 9.208 -9.446 -13.491 1.00 0.00 C ATOM 0 H LEU A2097 9.708 -6.197 -11.382 1.00 0.00 H new ATOM 0 HA LEU A2097 9.501 -8.026 -9.127 1.00 0.00 H new ATOM 0 HB2 LEU A2097 10.107 -9.709 -10.889 1.00 0.00 H new ATOM 0 HB3 LEU A2097 8.564 -8.892 -11.038 1.00 0.00 H new ATOM 0 HG LEU A2097 9.629 -7.413 -12.767 1.00 0.00 H new ATOM 0 HD11 LEU A2097 11.559 -8.298 -14.030 1.00 0.00 H new ATOM 0 HD12 LEU A2097 11.997 -7.816 -12.374 1.00 0.00 H new ATOM 0 HD13 LEU A2097 11.795 -9.538 -12.776 1.00 0.00 H new ATOM 0 HD21 LEU A2097 9.420 -9.234 -14.539 1.00 0.00 H new ATOM 0 HD22 LEU A2097 9.539 -10.456 -13.251 1.00 0.00 H new ATOM 0 HD23 LEU A2097 8.136 -9.364 -13.314 1.00 0.00 H new ATOM 624 N MET A2098 12.452 -7.078 -10.088 1.00 0.00 N ATOM 625 CA MET A2098 13.861 -7.121 -9.679 1.00 0.00 C ATOM 626 C MET A2098 14.076 -6.533 -8.282 1.00 0.00 C ATOM 627 O MET A2098 14.754 -7.150 -7.462 1.00 0.00 O ATOM 628 CB MET A2098 14.743 -6.407 -10.716 1.00 0.00 C ATOM 629 CG MET A2098 16.236 -6.502 -10.348 1.00 0.00 C ATOM 630 SD MET A2098 16.902 -5.284 -9.177 1.00 0.00 S ATOM 631 CE MET A2098 16.780 -3.781 -10.176 1.00 0.00 C ATOM 0 H MET A2098 12.249 -6.383 -10.806 1.00 0.00 H new ATOM 0 HA MET A2098 14.155 -8.170 -9.630 1.00 0.00 H new ATOM 0 HB2 MET A2098 14.581 -6.849 -11.699 1.00 0.00 H new ATOM 0 HB3 MET A2098 14.450 -5.359 -10.785 1.00 0.00 H new ATOM 0 HG2 MET A2098 16.416 -7.495 -9.936 1.00 0.00 H new ATOM 0 HG3 MET A2098 16.813 -6.430 -11.270 1.00 0.00 H new ATOM 0 HE1 MET A2098 17.353 -2.983 -9.704 1.00 0.00 H new ATOM 0 HE2 MET A2098 17.178 -3.973 -11.173 1.00 0.00 H new ATOM 0 HE3 MET A2098 15.735 -3.480 -10.254 1.00 0.00 H new ATOM 641 N ALA A2099 13.498 -5.364 -7.988 1.00 0.00 N ATOM 642 CA ALA A2099 13.656 -4.700 -6.696 1.00 0.00 C ATOM 643 C ALA A2099 13.146 -5.554 -5.521 1.00 0.00 C ATOM 644 O ALA A2099 13.787 -5.598 -4.468 1.00 0.00 O ATOM 645 CB ALA A2099 12.988 -3.329 -6.764 1.00 0.00 C ATOM 0 H ALA A2099 12.906 -4.853 -8.643 1.00 0.00 H new ATOM 0 HA ALA A2099 14.719 -4.565 -6.495 1.00 0.00 H new ATOM 0 HB1 ALA A2099 13.099 -2.822 -5.805 1.00 0.00 H new ATOM 0 HB2 ALA A2099 13.459 -2.733 -7.546 1.00 0.00 H new ATOM 0 HB3 ALA A2099 11.929 -3.451 -6.990 1.00 0.00 H new ATOM 651 N ALA A2100 12.034 -6.277 -5.708 1.00 0.00 N ATOM 652 CA ALA A2100 11.498 -7.193 -4.701 1.00 0.00 C ATOM 653 C ALA A2100 12.464 -8.369 -4.438 1.00 0.00 C ATOM 654 O ALA A2100 12.697 -8.755 -3.292 1.00 0.00 O ATOM 655 CB ALA A2100 10.130 -7.693 -5.181 1.00 0.00 C ATOM 0 H ALA A2100 11.482 -6.241 -6.565 1.00 0.00 H new ATOM 0 HA ALA A2100 11.384 -6.667 -3.753 1.00 0.00 H new ATOM 0 HB1 ALA A2100 9.713 -8.378 -4.443 1.00 0.00 H new ATOM 0 HB2 ALA A2100 9.457 -6.845 -5.309 1.00 0.00 H new ATOM 0 HB3 ALA A2100 10.246 -8.212 -6.133 1.00 0.00 H new ATOM 661 N PHE A2101 13.055 -8.917 -5.505 1.00 0.00 N ATOM 662 CA PHE A2101 14.024 -10.010 -5.448 1.00 0.00 C ATOM 663 C PHE A2101 15.358 -9.592 -4.802 1.00 0.00 C ATOM 664 O PHE A2101 15.815 -10.244 -3.860 1.00 0.00 O ATOM 665 CB PHE A2101 14.230 -10.513 -6.890 1.00 0.00 C ATOM 666 CG PHE A2101 15.546 -11.219 -7.157 1.00 0.00 C ATOM 667 CD1 PHE A2101 15.706 -12.568 -6.793 1.00 0.00 C ATOM 668 CD2 PHE A2101 16.614 -10.515 -7.755 1.00 0.00 C ATOM 669 CE1 PHE A2101 16.932 -13.218 -7.027 1.00 0.00 C ATOM 670 CE2 PHE A2101 17.841 -11.163 -7.976 1.00 0.00 C ATOM 671 CZ PHE A2101 17.994 -12.515 -7.621 1.00 0.00 C ATOM 0 H PHE A2101 12.866 -8.602 -6.456 1.00 0.00 H new ATOM 0 HA PHE A2101 13.637 -10.805 -4.811 1.00 0.00 H new ATOM 0 HB2 PHE A2101 13.416 -11.194 -7.138 1.00 0.00 H new ATOM 0 HB3 PHE A2101 14.151 -9.662 -7.567 1.00 0.00 H new ATOM 0 HD1 PHE A2101 14.889 -13.105 -6.334 1.00 0.00 H new ATOM 0 HD2 PHE A2101 16.488 -9.481 -8.042 1.00 0.00 H new ATOM 0 HE1 PHE A2101 17.056 -14.255 -6.751 1.00 0.00 H new ATOM 0 HE2 PHE A2101 18.666 -10.623 -8.418 1.00 0.00 H new ATOM 0 HZ PHE A2101 18.933 -13.016 -7.806 1.00 0.00 H new ATOM 681 N ILE A2102 15.989 -8.512 -5.281 1.00 0.00 N ATOM 682 CA ILE A2102 17.310 -8.071 -4.808 1.00 0.00 C ATOM 683 C ILE A2102 17.319 -7.693 -3.328 1.00 0.00 C ATOM 684 O ILE A2102 18.244 -8.078 -2.615 1.00 0.00 O ATOM 685 CB ILE A2102 17.894 -6.969 -5.723 1.00 0.00 C ATOM 686 CG1 ILE A2102 19.438 -6.889 -5.634 1.00 0.00 C ATOM 687 CG2 ILE A2102 17.220 -5.602 -5.528 1.00 0.00 C ATOM 688 CD1 ILE A2102 20.038 -6.011 -4.523 1.00 0.00 C ATOM 0 H ILE A2102 15.597 -7.916 -6.010 1.00 0.00 H new ATOM 0 HA ILE A2102 17.979 -8.929 -4.880 1.00 0.00 H new ATOM 0 HB ILE A2102 17.656 -7.270 -6.743 1.00 0.00 H new ATOM 0 HG12 ILE A2102 19.821 -7.902 -5.507 1.00 0.00 H new ATOM 0 HG13 ILE A2102 19.812 -6.524 -6.591 1.00 0.00 H new ATOM 0 HG21 ILE A2102 17.675 -4.873 -6.199 1.00 0.00 H new ATOM 0 HG22 ILE A2102 16.156 -5.686 -5.751 1.00 0.00 H new ATOM 0 HG23 ILE A2102 17.350 -5.276 -4.496 1.00 0.00 H new ATOM 0 HD11 ILE A2102 21.126 -6.047 -4.578 1.00 0.00 H new ATOM 0 HD12 ILE A2102 19.702 -4.982 -4.651 1.00 0.00 H new ATOM 0 HD13 ILE A2102 19.711 -6.381 -3.551 1.00 0.00 H new ATOM 700 N LYS A2103 16.291 -6.993 -2.832 1.00 0.00 N ATOM 701 CA LYS A2103 16.197 -6.576 -1.420 1.00 0.00 C ATOM 702 C LYS A2103 16.199 -7.746 -0.420 1.00 0.00 C ATOM 703 O LYS A2103 16.546 -7.542 0.742 1.00 0.00 O ATOM 704 CB LYS A2103 15.000 -5.628 -1.243 1.00 0.00 C ATOM 705 CG LYS A2103 15.348 -4.229 -1.780 1.00 0.00 C ATOM 706 CD LYS A2103 14.175 -3.239 -1.773 1.00 0.00 C ATOM 707 CE LYS A2103 13.709 -2.835 -0.369 1.00 0.00 C ATOM 708 NZ LYS A2103 12.770 -1.685 -0.443 1.00 0.00 N ATOM 0 H LYS A2103 15.496 -6.697 -3.398 1.00 0.00 H new ATOM 0 HA LYS A2103 17.109 -6.032 -1.174 1.00 0.00 H new ATOM 0 HB2 LYS A2103 14.132 -6.023 -1.771 1.00 0.00 H new ATOM 0 HB3 LYS A2103 14.730 -5.564 -0.189 1.00 0.00 H new ATOM 0 HG2 LYS A2103 16.161 -3.815 -1.183 1.00 0.00 H new ATOM 0 HG3 LYS A2103 15.720 -4.326 -2.800 1.00 0.00 H new ATOM 0 HD2 LYS A2103 14.466 -2.342 -2.320 1.00 0.00 H new ATOM 0 HD3 LYS A2103 13.336 -3.682 -2.310 1.00 0.00 H new ATOM 0 HE2 LYS A2103 13.221 -3.680 0.116 1.00 0.00 H new ATOM 0 HE3 LYS A2103 14.570 -2.570 0.244 1.00 0.00 H new ATOM 0 HZ1 LYS A2103 12.464 -1.424 0.516 1.00 0.00 H new ATOM 0 HZ2 LYS A2103 13.248 -0.875 -0.886 1.00 0.00 H new ATOM 0 HZ3 LYS A2103 11.940 -1.950 -1.011 1.00 0.00 H new ATOM 722 N GLN A2104 15.889 -8.967 -0.871 1.00 0.00 N ATOM 723 CA GLN A2104 16.007 -10.201 -0.084 1.00 0.00 C ATOM 724 C GLN A2104 17.314 -10.931 -0.442 1.00 0.00 C ATOM 725 O GLN A2104 18.082 -11.279 0.457 1.00 0.00 O ATOM 726 CB GLN A2104 14.754 -11.067 -0.313 1.00 0.00 C ATOM 727 CG GLN A2104 14.607 -12.243 0.671 1.00 0.00 C ATOM 728 CD GLN A2104 15.568 -13.411 0.434 1.00 0.00 C ATOM 729 OE1 GLN A2104 15.888 -13.783 -0.686 1.00 0.00 O ATOM 730 NE2 GLN A2104 16.064 -14.043 1.478 1.00 0.00 N ATOM 0 H GLN A2104 15.541 -9.129 -1.816 1.00 0.00 H new ATOM 0 HA GLN A2104 16.059 -9.973 0.981 1.00 0.00 H new ATOM 0 HB2 GLN A2104 13.870 -10.433 -0.238 1.00 0.00 H new ATOM 0 HB3 GLN A2104 14.779 -11.460 -1.329 1.00 0.00 H new ATOM 0 HG2 GLN A2104 14.756 -11.870 1.684 1.00 0.00 H new ATOM 0 HG3 GLN A2104 13.585 -12.617 0.616 1.00 0.00 H new ATOM 0 HE21 GLN A2104 15.810 -13.748 2.421 1.00 0.00 H new ATOM 0 HE22 GLN A2104 16.702 -14.827 1.344 1.00 0.00 H new ATOM 739 N ARG A2105 17.603 -11.136 -1.738 1.00 0.00 N ATOM 740 CA ARG A2105 18.815 -11.822 -2.228 1.00 0.00 C ATOM 741 C ARG A2105 20.120 -11.186 -1.733 1.00 0.00 C ATOM 742 O ARG A2105 21.062 -11.915 -1.432 1.00 0.00 O ATOM 743 CB ARG A2105 18.748 -11.930 -3.768 1.00 0.00 C ATOM 744 CG ARG A2105 19.944 -12.624 -4.445 1.00 0.00 C ATOM 745 CD ARG A2105 20.209 -14.048 -3.938 1.00 0.00 C ATOM 746 NE ARG A2105 21.399 -14.635 -4.585 1.00 0.00 N ATOM 747 CZ ARG A2105 22.249 -15.496 -4.064 1.00 0.00 C ATOM 748 NH1 ARG A2105 22.100 -16.009 -2.875 1.00 0.00 N ATOM 749 NH2 ARG A2105 23.287 -15.850 -4.756 1.00 0.00 N ATOM 0 H ARG A2105 16.990 -10.824 -2.491 1.00 0.00 H new ATOM 0 HA ARG A2105 18.832 -12.826 -1.804 1.00 0.00 H new ATOM 0 HB2 ARG A2105 17.840 -12.470 -4.036 1.00 0.00 H new ATOM 0 HB3 ARG A2105 18.655 -10.925 -4.180 1.00 0.00 H new ATOM 0 HG2 ARG A2105 19.769 -12.659 -5.520 1.00 0.00 H new ATOM 0 HG3 ARG A2105 20.838 -12.021 -4.287 1.00 0.00 H new ATOM 0 HD2 ARG A2105 20.351 -14.031 -2.857 1.00 0.00 H new ATOM 0 HD3 ARG A2105 19.339 -14.674 -4.135 1.00 0.00 H new ATOM 0 HE ARG A2105 21.584 -14.341 -5.544 1.00 0.00 H new ATOM 0 HH11 ARG A2105 21.297 -15.747 -2.304 1.00 0.00 H new ATOM 0 HH12 ARG A2105 22.787 -16.672 -2.516 1.00 0.00 H new ATOM 0 HH21 ARG A2105 23.435 -15.463 -5.688 1.00 0.00 H new ATOM 0 HH22 ARG A2105 23.956 -16.516 -4.368 1.00 0.00 H new ATOM 763 N THR A2106 20.179 -9.861 -1.591 1.00 0.00 N ATOM 764 CA THR A2106 21.348 -9.109 -1.083 1.00 0.00 C ATOM 765 C THR A2106 21.874 -9.633 0.263 1.00 0.00 C ATOM 766 O THR A2106 23.081 -9.632 0.506 1.00 0.00 O ATOM 767 CB THR A2106 21.033 -7.603 -1.006 1.00 0.00 C ATOM 768 OG1 THR A2106 22.207 -6.872 -0.737 1.00 0.00 O ATOM 769 CG2 THR A2106 20.004 -7.228 0.066 1.00 0.00 C ATOM 0 H THR A2106 19.395 -9.255 -1.831 1.00 0.00 H new ATOM 0 HA THR A2106 22.152 -9.268 -1.801 1.00 0.00 H new ATOM 0 HB THR A2106 20.609 -7.355 -1.979 1.00 0.00 H new ATOM 0 HG1 THR A2106 21.994 -5.916 -0.692 1.00 0.00 H new ATOM 0 HG21 THR A2106 19.841 -6.150 0.052 1.00 0.00 H new ATOM 0 HG22 THR A2106 19.064 -7.740 -0.137 1.00 0.00 H new ATOM 0 HG23 THR A2106 20.375 -7.526 1.047 1.00 0.00 H new ATOM 777 N ALA A2107 20.986 -10.161 1.116 1.00 0.00 N ATOM 778 CA ALA A2107 21.320 -10.755 2.412 1.00 0.00 C ATOM 779 C ALA A2107 22.172 -12.048 2.318 1.00 0.00 C ATOM 780 O ALA A2107 22.690 -12.517 3.336 1.00 0.00 O ATOM 781 CB ALA A2107 19.996 -11.006 3.152 1.00 0.00 C ATOM 0 H ALA A2107 19.986 -10.186 0.915 1.00 0.00 H new ATOM 0 HA ALA A2107 21.956 -10.059 2.959 1.00 0.00 H new ATOM 0 HB1 ALA A2107 20.202 -11.450 4.126 1.00 0.00 H new ATOM 0 HB2 ALA A2107 19.470 -10.061 3.288 1.00 0.00 H new ATOM 0 HB3 ALA A2107 19.376 -11.686 2.568 1.00 0.00 H new ATOM 787 N LYS A2108 22.306 -12.635 1.117 1.00 0.00 N ATOM 788 CA LYS A2108 23.028 -13.895 0.834 1.00 0.00 C ATOM 789 C LYS A2108 23.792 -13.892 -0.510 1.00 0.00 C ATOM 790 O LYS A2108 24.317 -14.922 -0.929 1.00 0.00 O ATOM 791 CB LYS A2108 21.963 -15.014 0.897 1.00 0.00 C ATOM 792 CG LYS A2108 22.457 -16.463 1.059 1.00 0.00 C ATOM 793 CD LYS A2108 23.309 -16.677 2.318 1.00 0.00 C ATOM 794 CE LYS A2108 23.542 -18.177 2.541 1.00 0.00 C ATOM 795 NZ LYS A2108 24.364 -18.431 3.754 1.00 0.00 N ATOM 0 H LYS A2108 21.897 -12.228 0.276 1.00 0.00 H new ATOM 0 HA LYS A2108 23.817 -14.045 1.571 1.00 0.00 H new ATOM 0 HB2 LYS A2108 21.293 -14.793 1.728 1.00 0.00 H new ATOM 0 HB3 LYS A2108 21.368 -14.962 -0.015 1.00 0.00 H new ATOM 0 HG2 LYS A2108 21.596 -17.131 1.093 1.00 0.00 H new ATOM 0 HG3 LYS A2108 23.041 -16.741 0.182 1.00 0.00 H new ATOM 0 HD2 LYS A2108 24.265 -16.163 2.213 1.00 0.00 H new ATOM 0 HD3 LYS A2108 22.808 -16.245 3.184 1.00 0.00 H new ATOM 0 HE2 LYS A2108 22.582 -18.684 2.639 1.00 0.00 H new ATOM 0 HE3 LYS A2108 24.039 -18.602 1.669 1.00 0.00 H new ATOM 0 HZ1 LYS A2108 24.501 -19.455 3.873 1.00 0.00 H new ATOM 0 HZ2 LYS A2108 25.289 -17.968 3.649 1.00 0.00 H new ATOM 0 HZ3 LYS A2108 23.878 -18.048 4.589 1.00 0.00 H new ATOM 1019 N THR B 18 10.857 -22.451 -13.787 1.00 0.00 N ATOM 1020 CA THR B 18 11.894 -22.206 -12.758 1.00 0.00 C ATOM 1021 C THR B 18 12.066 -20.761 -12.254 1.00 0.00 C ATOM 1022 O THR B 18 11.452 -20.355 -11.269 1.00 0.00 O ATOM 1023 CB THR B 18 13.249 -22.786 -13.232 1.00 0.00 C ATOM 1024 OG1 THR B 18 13.677 -22.195 -14.441 1.00 0.00 O ATOM 1025 CG2 THR B 18 13.189 -24.271 -13.558 1.00 0.00 C ATOM 0 HA THR B 18 11.519 -22.727 -11.877 1.00 0.00 H new ATOM 0 HB THR B 18 13.918 -22.586 -12.395 1.00 0.00 H new ATOM 0 HG1 THR B 18 12.896 -21.946 -14.978 1.00 0.00 H new ATOM 0 HG21 THR B 18 14.172 -24.612 -13.884 1.00 0.00 H new ATOM 0 HG22 THR B 18 12.888 -24.827 -12.670 1.00 0.00 H new ATOM 0 HG23 THR B 18 12.464 -24.440 -14.354 1.00 0.00 H new ATOM 1033 N PHE B 19 12.901 -19.977 -12.926 1.00 0.00 N ATOM 1034 CA PHE B 19 13.235 -18.582 -12.668 1.00 0.00 C ATOM 1035 C PHE B 19 12.016 -17.640 -12.627 1.00 0.00 C ATOM 1036 O PHE B 19 11.927 -16.791 -11.740 1.00 0.00 O ATOM 1037 CB PHE B 19 14.247 -18.163 -13.741 1.00 0.00 C ATOM 1038 CG PHE B 19 13.667 -17.970 -15.133 1.00 0.00 C ATOM 1039 CD1 PHE B 19 12.941 -18.992 -15.796 1.00 0.00 C ATOM 1040 CD2 PHE B 19 13.818 -16.711 -15.741 1.00 0.00 C ATOM 1041 CE1 PHE B 19 12.333 -18.716 -17.033 1.00 0.00 C ATOM 1042 CE2 PHE B 19 13.236 -16.454 -16.990 1.00 0.00 C ATOM 1043 CZ PHE B 19 12.476 -17.448 -17.627 1.00 0.00 C ATOM 0 H PHE B 19 13.406 -20.334 -13.737 1.00 0.00 H new ATOM 0 HA PHE B 19 13.659 -18.497 -11.667 1.00 0.00 H new ATOM 0 HB2 PHE B 19 14.720 -17.232 -13.429 1.00 0.00 H new ATOM 0 HB3 PHE B 19 15.032 -18.917 -13.793 1.00 0.00 H new ATOM 0 HD1 PHE B 19 12.856 -19.974 -15.354 1.00 0.00 H new ATOM 0 HD2 PHE B 19 14.385 -15.938 -15.243 1.00 0.00 H new ATOM 0 HE1 PHE B 19 11.754 -19.480 -17.530 1.00 0.00 H new ATOM 0 HE2 PHE B 19 13.372 -15.492 -17.462 1.00 0.00 H new ATOM 0 HZ PHE B 19 12.001 -17.239 -18.574 1.00 0.00 H new ATOM 1053 N SER B 20 11.042 -17.819 -13.531 1.00 0.00 N ATOM 1054 CA SER B 20 9.785 -17.058 -13.554 1.00 0.00 C ATOM 1055 C SER B 20 8.930 -17.380 -12.323 1.00 0.00 C ATOM 1056 O SER B 20 8.192 -16.538 -11.809 1.00 0.00 O ATOM 1057 CB SER B 20 9.004 -17.351 -14.841 1.00 0.00 C ATOM 1058 OG SER B 20 7.811 -16.583 -14.888 1.00 0.00 O ATOM 0 H SER B 20 11.107 -18.509 -14.280 1.00 0.00 H new ATOM 0 HA SER B 20 10.030 -15.996 -13.530 1.00 0.00 H new ATOM 0 HB2 SER B 20 9.624 -17.123 -15.708 1.00 0.00 H new ATOM 0 HB3 SER B 20 8.762 -18.413 -14.892 1.00 0.00 H new ATOM 0 HG SER B 20 7.327 -16.782 -15.716 1.00 0.00 H new ATOM 1064 N ASP B 21 9.041 -18.605 -11.812 1.00 0.00 N ATOM 1065 CA ASP B 21 8.352 -19.059 -10.608 1.00 0.00 C ATOM 1066 C ASP B 21 9.002 -18.540 -9.313 1.00 0.00 C ATOM 1067 O ASP B 21 8.306 -18.415 -8.302 1.00 0.00 O ATOM 1068 CB ASP B 21 8.192 -20.590 -10.662 1.00 0.00 C ATOM 1069 CG ASP B 21 6.801 -20.991 -11.192 1.00 0.00 C ATOM 1070 OD1 ASP B 21 6.253 -20.279 -12.069 1.00 0.00 O ATOM 1071 OD2 ASP B 21 6.246 -22.006 -10.711 1.00 0.00 O ATOM 0 H ASP B 21 9.627 -19.325 -12.235 1.00 0.00 H new ATOM 0 HA ASP B 21 7.354 -18.622 -10.585 1.00 0.00 H new ATOM 0 HB2 ASP B 21 8.964 -21.016 -11.303 1.00 0.00 H new ATOM 0 HB3 ASP B 21 8.338 -21.008 -9.666 1.00 0.00 H new ATOM 1076 N LEU B 22 10.283 -18.144 -9.329 1.00 0.00 N ATOM 1077 CA LEU B 22 10.925 -17.517 -8.161 1.00 0.00 C ATOM 1078 C LEU B 22 10.344 -16.122 -7.874 1.00 0.00 C ATOM 1079 O LEU B 22 10.239 -15.742 -6.708 1.00 0.00 O ATOM 1080 CB LEU B 22 12.457 -17.423 -8.307 1.00 0.00 C ATOM 1081 CG LEU B 22 13.238 -18.750 -8.381 1.00 0.00 C ATOM 1082 CD1 LEU B 22 14.733 -18.462 -8.208 1.00 0.00 C ATOM 1083 CD2 LEU B 22 12.840 -19.747 -7.293 1.00 0.00 C ATOM 0 H LEU B 22 10.896 -18.246 -10.138 1.00 0.00 H new ATOM 0 HA LEU B 22 10.708 -18.170 -7.316 1.00 0.00 H new ATOM 0 HB2 LEU B 22 12.676 -16.851 -9.208 1.00 0.00 H new ATOM 0 HB3 LEU B 22 12.843 -16.850 -7.464 1.00 0.00 H new ATOM 0 HG LEU B 22 13.006 -19.191 -9.351 1.00 0.00 H new ATOM 0 HD11 LEU B 22 15.292 -19.396 -8.259 1.00 0.00 H new ATOM 0 HD12 LEU B 22 15.069 -17.794 -9.001 1.00 0.00 H new ATOM 0 HD13 LEU B 22 14.903 -17.990 -7.240 1.00 0.00 H new ATOM 0 HD21 LEU B 22 13.427 -20.659 -7.403 1.00 0.00 H new ATOM 0 HD22 LEU B 22 13.028 -19.310 -6.312 1.00 0.00 H new ATOM 0 HD23 LEU B 22 11.780 -19.984 -7.387 1.00 0.00 H new ATOM 1095 N TRP B 23 9.915 -15.372 -8.902 1.00 0.00 N ATOM 1096 CA TRP B 23 9.299 -14.044 -8.705 1.00 0.00 C ATOM 1097 C TRP B 23 8.012 -14.135 -7.866 1.00 0.00 C ATOM 1098 O TRP B 23 7.712 -13.253 -7.058 1.00 0.00 O ATOM 1099 CB TRP B 23 8.942 -13.377 -10.044 1.00 0.00 C ATOM 1100 CG TRP B 23 10.005 -13.255 -11.092 1.00 0.00 C ATOM 1101 CD1 TRP B 23 9.869 -13.731 -12.346 1.00 0.00 C ATOM 1102 CD2 TRP B 23 11.296 -12.563 -11.071 1.00 0.00 C ATOM 1103 NE1 TRP B 23 11.001 -13.453 -13.084 1.00 0.00 N ATOM 1104 CE2 TRP B 23 11.905 -12.713 -12.357 1.00 0.00 C ATOM 1105 CE3 TRP B 23 12.010 -11.798 -10.119 1.00 0.00 C ATOM 1106 CZ2 TRP B 23 13.147 -12.151 -12.681 1.00 0.00 C ATOM 1107 CZ3 TRP B 23 13.256 -11.221 -10.439 1.00 0.00 C ATOM 1108 CH2 TRP B 23 13.826 -11.397 -11.712 1.00 0.00 C ATOM 0 H TRP B 23 9.982 -15.660 -9.878 1.00 0.00 H new ATOM 0 HA TRP B 23 10.043 -13.445 -8.181 1.00 0.00 H new ATOM 0 HB2 TRP B 23 8.111 -13.932 -10.479 1.00 0.00 H new ATOM 0 HB3 TRP B 23 8.576 -12.374 -9.826 1.00 0.00 H new ATOM 0 HD1 TRP B 23 9.000 -14.254 -12.719 1.00 0.00 H new ATOM 0 HE1 TRP B 23 11.149 -13.757 -14.046 1.00 0.00 H new ATOM 0 HE3 TRP B 23 11.595 -11.654 -9.133 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 13.575 -12.296 -13.662 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 13.779 -10.636 -9.697 1.00 0.00 H new ATOM 0 HH2 TRP B 23 14.783 -10.953 -11.943 1.00 0.00 H new ATOM 1119 N LYS B 24 7.252 -15.221 -8.067 1.00 0.00 N ATOM 1120 CA LYS B 24 5.966 -15.517 -7.416 1.00 0.00 C ATOM 1121 C LYS B 24 6.092 -15.866 -5.927 1.00 0.00 C ATOM 1122 O LYS B 24 5.136 -15.673 -5.179 1.00 0.00 O ATOM 1123 CB LYS B 24 5.261 -16.660 -8.176 1.00 0.00 C ATOM 1124 CG LYS B 24 5.127 -16.400 -9.689 1.00 0.00 C ATOM 1125 CD LYS B 24 4.397 -17.549 -10.402 1.00 0.00 C ATOM 1126 CE LYS B 24 4.315 -17.322 -11.920 1.00 0.00 C ATOM 1127 NZ LYS B 24 5.599 -17.615 -12.608 1.00 0.00 N ATOM 0 H LYS B 24 7.530 -15.953 -8.720 1.00 0.00 H new ATOM 0 HA LYS B 24 5.372 -14.604 -7.458 1.00 0.00 H new ATOM 0 HB2 LYS B 24 5.817 -17.585 -8.022 1.00 0.00 H new ATOM 0 HB3 LYS B 24 4.268 -16.810 -7.752 1.00 0.00 H new ATOM 0 HG2 LYS B 24 4.585 -15.468 -9.851 1.00 0.00 H new ATOM 0 HG3 LYS B 24 6.118 -16.272 -10.125 1.00 0.00 H new ATOM 0 HD2 LYS B 24 4.915 -18.487 -10.203 1.00 0.00 H new ATOM 0 HD3 LYS B 24 3.391 -17.648 -9.995 1.00 0.00 H new ATOM 0 HE2 LYS B 24 3.530 -17.953 -12.337 1.00 0.00 H new ATOM 0 HE3 LYS B 24 4.029 -16.288 -12.115 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 5.513 -17.382 -13.618 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 6.358 -17.044 -12.185 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 5.826 -18.624 -12.504 1.00 0.00 H new ATOM 1141 N LEU B 25 7.253 -16.367 -5.488 1.00 0.00 N ATOM 1142 CA LEU B 25 7.509 -16.753 -4.091 1.00 0.00 C ATOM 1143 C LEU B 25 7.698 -15.557 -3.145 1.00 0.00 C ATOM 1144 O LEU B 25 7.292 -15.635 -1.984 1.00 0.00 O ATOM 1145 CB LEU B 25 8.750 -17.666 -4.026 1.00 0.00 C ATOM 1146 CG LEU B 25 8.557 -19.062 -4.650 1.00 0.00 C ATOM 1147 CD1 LEU B 25 9.899 -19.795 -4.689 1.00 0.00 C ATOM 1148 CD2 LEU B 25 7.578 -19.924 -3.849 1.00 0.00 C ATOM 0 H LEU B 25 8.054 -16.519 -6.101 1.00 0.00 H new ATOM 0 HA LEU B 25 6.620 -17.282 -3.747 1.00 0.00 H new ATOM 0 HB2 LEU B 25 9.577 -17.168 -4.532 1.00 0.00 H new ATOM 0 HB3 LEU B 25 9.041 -17.787 -2.983 1.00 0.00 H new ATOM 0 HG LEU B 25 8.154 -18.910 -5.651 1.00 0.00 H new ATOM 0 HD11 LEU B 25 9.762 -20.782 -5.130 1.00 0.00 H new ATOM 0 HD12 LEU B 25 10.608 -19.225 -5.289 1.00 0.00 H new ATOM 0 HD13 LEU B 25 10.285 -19.901 -3.675 1.00 0.00 H new ATOM 0 HD21 LEU B 25 7.475 -20.898 -4.328 1.00 0.00 H new ATOM 0 HD22 LEU B 25 7.955 -20.056 -2.835 1.00 0.00 H new ATOM 0 HD23 LEU B 25 6.606 -19.433 -3.813 1.00 0.00 H new ATOM 1408 N LEU B 43 27.326 -3.409 -4.668 1.00 0.00 N ATOM 1409 CA LEU B 43 27.083 -4.689 -5.352 1.00 0.00 C ATOM 1410 C LEU B 43 26.628 -4.529 -6.815 1.00 0.00 C ATOM 1411 O LEU B 43 26.112 -3.486 -7.214 1.00 0.00 O ATOM 1412 CB LEU B 43 26.024 -5.462 -4.531 1.00 0.00 C ATOM 1413 CG LEU B 43 24.638 -4.773 -4.488 1.00 0.00 C ATOM 1414 CD1 LEU B 43 23.651 -5.454 -5.437 1.00 0.00 C ATOM 1415 CD2 LEU B 43 24.048 -4.795 -3.080 1.00 0.00 C ATOM 0 HA LEU B 43 28.024 -5.236 -5.405 1.00 0.00 H new ATOM 0 HB2 LEU B 43 25.909 -6.461 -4.953 1.00 0.00 H new ATOM 0 HB3 LEU B 43 26.389 -5.586 -3.511 1.00 0.00 H new ATOM 0 HG LEU B 43 24.794 -3.740 -4.801 1.00 0.00 H new ATOM 0 HD11 LEU B 43 22.687 -4.948 -5.384 1.00 0.00 H new ATOM 0 HD12 LEU B 43 24.032 -5.403 -6.457 1.00 0.00 H new ATOM 0 HD13 LEU B 43 23.529 -6.498 -5.147 1.00 0.00 H new ATOM 0 HD21 LEU B 43 23.075 -4.303 -3.085 1.00 0.00 H new ATOM 0 HD22 LEU B 43 23.931 -5.827 -2.751 1.00 0.00 H new ATOM 0 HD23 LEU B 43 24.716 -4.270 -2.397 1.00 0.00 H new ATOM 1427 N MET B 44 26.774 -5.594 -7.607 1.00 0.00 N ATOM 1428 CA MET B 44 26.323 -5.681 -9.004 1.00 0.00 C ATOM 1429 C MET B 44 26.159 -7.160 -9.384 1.00 0.00 C ATOM 1430 O MET B 44 27.024 -7.971 -9.046 1.00 0.00 O ATOM 1431 CB MET B 44 27.344 -4.986 -9.927 1.00 0.00 C ATOM 1432 CG MET B 44 26.839 -4.758 -11.361 1.00 0.00 C ATOM 1433 SD MET B 44 25.999 -3.175 -11.690 1.00 0.00 S ATOM 1434 CE MET B 44 24.454 -3.335 -10.754 1.00 0.00 C ATOM 0 H MET B 44 27.225 -6.451 -7.285 1.00 0.00 H new ATOM 0 HA MET B 44 25.364 -5.177 -9.120 1.00 0.00 H new ATOM 0 HB2 MET B 44 27.616 -4.024 -9.492 1.00 0.00 H new ATOM 0 HB3 MET B 44 28.252 -5.587 -9.964 1.00 0.00 H new ATOM 0 HG2 MET B 44 27.689 -4.839 -12.038 1.00 0.00 H new ATOM 0 HG3 MET B 44 26.152 -5.566 -11.613 1.00 0.00 H new ATOM 0 HE1 MET B 44 23.708 -2.654 -11.163 1.00 0.00 H new ATOM 0 HE2 MET B 44 24.089 -4.359 -10.827 1.00 0.00 H new ATOM 0 HE3 MET B 44 24.635 -3.088 -9.708 1.00 0.00 H new ATOM 1444 N LEU B 45 25.059 -7.531 -10.051 1.00 0.00 N ATOM 1445 CA LEU B 45 24.780 -8.922 -10.435 1.00 0.00 C ATOM 1446 C LEU B 45 25.797 -9.487 -11.444 1.00 0.00 C ATOM 1447 O LEU B 45 26.129 -8.857 -12.449 1.00 0.00 O ATOM 1448 CB LEU B 45 23.344 -9.043 -10.973 1.00 0.00 C ATOM 1449 CG LEU B 45 22.273 -8.885 -9.878 1.00 0.00 C ATOM 1450 CD1 LEU B 45 20.899 -8.703 -10.518 1.00 0.00 C ATOM 1451 CD2 LEU B 45 22.226 -10.087 -8.936 1.00 0.00 C ATOM 0 H LEU B 45 24.335 -6.874 -10.341 1.00 0.00 H new ATOM 0 HA LEU B 45 24.881 -9.528 -9.535 1.00 0.00 H new ATOM 0 HB2 LEU B 45 23.185 -8.285 -11.740 1.00 0.00 H new ATOM 0 HB3 LEU B 45 23.223 -10.014 -11.454 1.00 0.00 H new ATOM 0 HG LEU B 45 22.541 -8.006 -9.292 1.00 0.00 H new ATOM 0 HD11 LEU B 45 20.146 -8.592 -9.738 1.00 0.00 H new ATOM 0 HD12 LEU B 45 20.905 -7.812 -11.146 1.00 0.00 H new ATOM 0 HD13 LEU B 45 20.663 -9.575 -11.128 1.00 0.00 H new ATOM 0 HD21 LEU B 45 21.455 -9.928 -8.182 1.00 0.00 H new ATOM 0 HD22 LEU B 45 21.996 -10.987 -9.506 1.00 0.00 H new ATOM 0 HD23 LEU B 45 23.193 -10.204 -8.447 1.00 0.00 H new ATOM 1463 N SER B 46 26.263 -10.701 -11.153 1.00 0.00 N ATOM 1464 CA SER B 46 27.232 -11.482 -11.927 1.00 0.00 C ATOM 1465 C SER B 46 26.541 -12.581 -12.756 1.00 0.00 C ATOM 1466 O SER B 46 25.391 -12.933 -12.462 1.00 0.00 O ATOM 1467 CB SER B 46 28.195 -12.126 -10.917 1.00 0.00 C ATOM 1468 OG SER B 46 27.550 -13.184 -10.222 1.00 0.00 O ATOM 0 H SER B 46 25.955 -11.198 -10.317 1.00 0.00 H new ATOM 0 HA SER B 46 27.756 -10.832 -12.628 1.00 0.00 H new ATOM 0 HB2 SER B 46 29.075 -12.507 -11.436 1.00 0.00 H new ATOM 0 HB3 SER B 46 28.543 -11.375 -10.207 1.00 0.00 H new ATOM 0 HG SER B 46 28.176 -13.586 -9.584 1.00 0.00 H new ATOM 1474 N PRO B 47 27.207 -13.183 -13.767 1.00 0.00 N ATOM 1475 CA PRO B 47 26.618 -14.284 -14.531 1.00 0.00 C ATOM 1476 C PRO B 47 26.314 -15.507 -13.648 1.00 0.00 C ATOM 1477 O PRO B 47 25.368 -16.234 -13.941 1.00 0.00 O ATOM 1478 CB PRO B 47 27.609 -14.594 -15.656 1.00 0.00 C ATOM 1479 CG PRO B 47 28.946 -14.106 -15.104 1.00 0.00 C ATOM 1480 CD PRO B 47 28.550 -12.899 -14.254 1.00 0.00 C ATOM 0 HA PRO B 47 25.648 -14.005 -14.942 1.00 0.00 H new ATOM 0 HB2 PRO B 47 27.635 -15.659 -15.885 1.00 0.00 H new ATOM 0 HB3 PRO B 47 27.343 -14.077 -16.578 1.00 0.00 H new ATOM 0 HG2 PRO B 47 29.441 -14.873 -14.509 1.00 0.00 H new ATOM 0 HG3 PRO B 47 29.635 -13.829 -15.902 1.00 0.00 H new ATOM 0 HD2 PRO B 47 29.245 -12.758 -13.426 1.00 0.00 H new ATOM 0 HD3 PRO B 47 28.567 -11.982 -14.844 1.00 0.00 H new ATOM 1488 N ASP B 48 27.049 -15.706 -12.545 1.00 0.00 N ATOM 1489 CA ASP B 48 26.803 -16.796 -11.590 1.00 0.00 C ATOM 1490 C ASP B 48 25.418 -16.692 -10.923 1.00 0.00 C ATOM 1491 O ASP B 48 24.740 -17.701 -10.727 1.00 0.00 O ATOM 1492 CB ASP B 48 27.903 -16.814 -10.525 1.00 0.00 C ATOM 1493 CG ASP B 48 27.713 -17.985 -9.547 1.00 0.00 C ATOM 1494 OD1 ASP B 48 27.792 -19.160 -9.976 1.00 0.00 O ATOM 1495 OD2 ASP B 48 27.508 -17.718 -8.339 1.00 0.00 O ATOM 0 H ASP B 48 27.837 -15.111 -12.288 1.00 0.00 H new ATOM 0 HA ASP B 48 26.818 -17.730 -12.151 1.00 0.00 H new ATOM 0 HB2 ASP B 48 28.878 -16.894 -11.007 1.00 0.00 H new ATOM 0 HB3 ASP B 48 27.895 -15.873 -9.975 1.00 0.00 H new ATOM 1500 N ASP B 49 24.967 -15.474 -10.600 1.00 0.00 N ATOM 1501 CA ASP B 49 23.639 -15.268 -10.011 1.00 0.00 C ATOM 1502 C ASP B 49 22.513 -15.419 -11.052 1.00 0.00 C ATOM 1503 O ASP B 49 21.426 -15.895 -10.722 1.00 0.00 O ATOM 1504 CB ASP B 49 23.563 -13.909 -9.305 1.00 0.00 C ATOM 1505 CG ASP B 49 22.526 -13.956 -8.176 1.00 0.00 C ATOM 1506 OD1 ASP B 49 22.827 -14.558 -7.117 1.00 0.00 O ATOM 1507 OD2 ASP B 49 21.411 -13.416 -8.340 1.00 0.00 O ATOM 0 H ASP B 49 25.502 -14.617 -10.737 1.00 0.00 H new ATOM 0 HA ASP B 49 23.488 -16.050 -9.267 1.00 0.00 H new ATOM 0 HB2 ASP B 49 24.540 -13.646 -8.900 1.00 0.00 H new ATOM 0 HB3 ASP B 49 23.296 -13.133 -10.022 1.00 0.00 H new ATOM 1512 N ILE B 50 22.780 -15.064 -12.317 1.00 0.00 N ATOM 1513 CA ILE B 50 21.820 -15.194 -13.427 1.00 0.00 C ATOM 1514 C ILE B 50 21.688 -16.671 -13.859 1.00 0.00 C ATOM 1515 O ILE B 50 20.588 -17.133 -14.151 1.00 0.00 O ATOM 1516 CB ILE B 50 22.205 -14.277 -14.616 1.00 0.00 C ATOM 1517 CG1 ILE B 50 22.430 -12.799 -14.204 1.00 0.00 C ATOM 1518 CG2 ILE B 50 21.086 -14.300 -15.680 1.00 0.00 C ATOM 1519 CD1 ILE B 50 23.232 -11.995 -15.238 1.00 0.00 C ATOM 0 H ILE B 50 23.678 -14.674 -12.603 1.00 0.00 H new ATOM 0 HA ILE B 50 20.843 -14.862 -13.075 1.00 0.00 H new ATOM 0 HB ILE B 50 23.144 -14.670 -15.006 1.00 0.00 H new ATOM 0 HG12 ILE B 50 21.463 -12.320 -14.053 1.00 0.00 H new ATOM 0 HG13 ILE B 50 22.953 -12.771 -13.248 1.00 0.00 H new ATOM 0 HG21 ILE B 50 21.363 -13.654 -16.513 1.00 0.00 H new ATOM 0 HG22 ILE B 50 20.949 -15.319 -16.042 1.00 0.00 H new ATOM 0 HG23 ILE B 50 20.156 -13.944 -15.238 1.00 0.00 H new ATOM 0 HD11 ILE B 50 23.353 -10.970 -14.888 1.00 0.00 H new ATOM 0 HD12 ILE B 50 24.213 -12.451 -15.372 1.00 0.00 H new ATOM 0 HD13 ILE B 50 22.700 -11.993 -16.189 1.00 0.00 H new ATOM 1531 N GLU B 51 22.769 -17.460 -13.865 1.00 0.00 N ATOM 1532 CA GLU B 51 22.699 -18.900 -14.184 1.00 0.00 C ATOM 1533 C GLU B 51 22.129 -19.746 -13.021 1.00 0.00 C ATOM 1534 O GLU B 51 21.933 -20.953 -13.166 1.00 0.00 O ATOM 1535 CB GLU B 51 24.054 -19.435 -14.690 1.00 0.00 C ATOM 1536 CG GLU B 51 25.098 -19.682 -13.597 1.00 0.00 C ATOM 1537 CD GLU B 51 26.446 -20.141 -14.191 1.00 0.00 C ATOM 1538 OE1 GLU B 51 27.211 -19.293 -14.712 1.00 0.00 O ATOM 1539 OE2 GLU B 51 26.754 -21.356 -14.128 1.00 0.00 O ATOM 0 H GLU B 51 23.710 -17.128 -13.652 1.00 0.00 H new ATOM 0 HA GLU B 51 21.986 -19.004 -15.002 1.00 0.00 H new ATOM 0 HB2 GLU B 51 23.882 -20.369 -15.226 1.00 0.00 H new ATOM 0 HB3 GLU B 51 24.463 -18.725 -15.409 1.00 0.00 H new ATOM 0 HG2 GLU B 51 25.246 -18.768 -13.021 1.00 0.00 H new ATOM 0 HG3 GLU B 51 24.729 -20.439 -12.905 1.00 0.00 H new ATOM 1546 N GLN B 52 21.855 -19.138 -11.861 1.00 0.00 N ATOM 1547 CA GLN B 52 21.319 -19.827 -10.685 1.00 0.00 C ATOM 1548 C GLN B 52 19.799 -20.049 -10.746 1.00 0.00 C ATOM 1549 O GLN B 52 19.342 -21.168 -10.509 1.00 0.00 O ATOM 1550 CB GLN B 52 21.774 -19.073 -9.411 1.00 0.00 C ATOM 1551 CG GLN B 52 20.867 -19.188 -8.165 1.00 0.00 C ATOM 1552 CD GLN B 52 19.674 -18.223 -8.099 1.00 0.00 C ATOM 1553 OE1 GLN B 52 18.625 -18.556 -7.566 1.00 0.00 O ATOM 1554 NE2 GLN B 52 19.745 -17.017 -8.624 1.00 0.00 N ATOM 0 H GLN B 52 22.002 -18.140 -11.712 1.00 0.00 H new ATOM 0 HA GLN B 52 21.728 -20.837 -10.660 1.00 0.00 H new ATOM 0 HB2 GLN B 52 22.767 -19.433 -9.141 1.00 0.00 H new ATOM 0 HB3 GLN B 52 21.874 -18.017 -9.660 1.00 0.00 H new ATOM 0 HG2 GLN B 52 20.485 -20.208 -8.113 1.00 0.00 H new ATOM 0 HG3 GLN B 52 21.482 -19.032 -7.279 1.00 0.00 H new ATOM 0 HE21 GLN B 52 20.605 -16.707 -9.076 1.00 0.00 H new ATOM 0 HE22 GLN B 52 18.940 -16.393 -8.578 1.00 0.00 H new ATOM 1563 N TRP B 53 18.993 -19.018 -11.029 1.00 0.00 N ATOM 1564 CA TRP B 53 17.527 -19.136 -10.954 1.00 0.00 C ATOM 1565 C TRP B 53 16.864 -20.091 -11.956 1.00 0.00 C ATOM 1566 O TRP B 53 15.789 -20.617 -11.668 1.00 0.00 O ATOM 1567 CB TRP B 53 16.861 -17.748 -10.925 1.00 0.00 C ATOM 1568 CG TRP B 53 17.271 -16.676 -11.890 1.00 0.00 C ATOM 1569 CD1 TRP B 53 17.799 -16.840 -13.123 1.00 0.00 C ATOM 1570 CD2 TRP B 53 17.182 -15.227 -11.697 1.00 0.00 C ATOM 1571 NE1 TRP B 53 18.106 -15.610 -13.667 1.00 0.00 N ATOM 1572 CE2 TRP B 53 17.764 -14.576 -12.827 1.00 0.00 C ATOM 1573 CE3 TRP B 53 16.673 -14.394 -10.675 1.00 0.00 C ATOM 1574 CZ2 TRP B 53 17.889 -13.181 -12.917 1.00 0.00 C ATOM 1575 CZ3 TRP B 53 16.755 -12.992 -10.776 1.00 0.00 C ATOM 1576 CH2 TRP B 53 17.375 -12.383 -11.882 1.00 0.00 C ATOM 0 H TRP B 53 19.327 -18.096 -11.311 1.00 0.00 H new ATOM 0 HA TRP B 53 17.345 -19.635 -10.002 1.00 0.00 H new ATOM 0 HB2 TRP B 53 15.790 -17.904 -11.057 1.00 0.00 H new ATOM 0 HB3 TRP B 53 17.003 -17.346 -9.922 1.00 0.00 H new ATOM 0 HD1 TRP B 53 17.957 -17.791 -13.610 1.00 0.00 H new ATOM 0 HE1 TRP B 53 18.536 -15.483 -14.583 1.00 0.00 H new ATOM 0 HE3 TRP B 53 16.215 -14.839 -9.804 1.00 0.00 H new ATOM 0 HZ2 TRP B 53 18.373 -12.728 -13.769 1.00 0.00 H new ATOM 0 HZ3 TRP B 53 16.336 -12.376 -9.994 1.00 0.00 H new ATOM 0 HH2 TRP B 53 17.455 -11.307 -11.935 1.00 0.00 H new ATOM 1587 N PHE B 54 17.486 -20.339 -13.112 1.00 0.00 N ATOM 1588 CA PHE B 54 16.929 -21.218 -14.154 1.00 0.00 C ATOM 1589 C PHE B 54 17.325 -22.709 -14.056 1.00 0.00 C ATOM 1590 O PHE B 54 16.773 -23.538 -14.781 1.00 0.00 O ATOM 1591 CB PHE B 54 17.203 -20.617 -15.548 1.00 0.00 C ATOM 1592 CG PHE B 54 18.513 -20.972 -16.243 1.00 0.00 C ATOM 1593 CD1 PHE B 54 19.717 -21.129 -15.528 1.00 0.00 C ATOM 1594 CD2 PHE B 54 18.523 -21.138 -17.642 1.00 0.00 C ATOM 1595 CE1 PHE B 54 20.905 -21.473 -16.199 1.00 0.00 C ATOM 1596 CE2 PHE B 54 19.716 -21.453 -18.316 1.00 0.00 C ATOM 1597 CZ PHE B 54 20.908 -21.627 -17.593 1.00 0.00 C ATOM 0 H PHE B 54 18.391 -19.937 -13.356 1.00 0.00 H new ATOM 0 HA PHE B 54 15.854 -21.247 -13.978 1.00 0.00 H new ATOM 0 HB2 PHE B 54 16.386 -20.916 -16.205 1.00 0.00 H new ATOM 0 HB3 PHE B 54 17.158 -19.532 -15.457 1.00 0.00 H new ATOM 0 HD1 PHE B 54 19.728 -20.984 -14.458 1.00 0.00 H new ATOM 0 HD2 PHE B 54 17.606 -21.022 -18.201 1.00 0.00 H new ATOM 0 HE1 PHE B 54 21.817 -21.619 -15.639 1.00 0.00 H new ATOM 0 HE2 PHE B 54 19.716 -21.561 -19.391 1.00 0.00 H new ATOM 0 HZ PHE B 54 21.823 -21.878 -18.109 1.00 0.00 H new ATOM 1607 N THR B 55 18.286 -23.063 -13.192 1.00 0.00 N ATOM 1608 CA THR B 55 18.850 -24.427 -13.080 1.00 0.00 C ATOM 1609 C THR B 55 17.979 -25.470 -12.358 1.00 0.00 C ATOM 1610 O THR B 55 18.302 -26.659 -12.374 1.00 0.00 O ATOM 1611 CB THR B 55 20.249 -24.345 -12.433 1.00 0.00 C ATOM 1612 OG1 THR B 55 21.097 -25.346 -12.960 1.00 0.00 O ATOM 1613 CG2 THR B 55 20.288 -24.453 -10.907 1.00 0.00 C ATOM 0 H THR B 55 18.705 -22.402 -12.537 1.00 0.00 H new ATOM 0 HA THR B 55 18.901 -24.800 -14.103 1.00 0.00 H new ATOM 0 HB THR B 55 20.589 -23.339 -12.681 1.00 0.00 H new ATOM 0 HG1 THR B 55 21.981 -25.280 -12.541 1.00 0.00 H new ATOM 0 HG21 THR B 55 21.320 -24.383 -10.564 1.00 0.00 H new ATOM 0 HG22 THR B 55 19.704 -23.643 -10.470 1.00 0.00 H new ATOM 0 HG23 THR B 55 19.868 -25.410 -10.599 1.00 0.00 H new