USER MOD reduce.3.24.130724 H: found=0, std=0, add=1313, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1317 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 11 GLN : amide:sc= -0.179 K(o=-0.62,f=-1.5) USER MOD Set 1.2: B 15 GLN : amide:sc= -0.445 K(o=-0.62,f=-1.5) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.0406 USER MOD Single : A 8 SER OG : rot 180:sc= 0.138 USER MOD Single : A 9 GLN : amide:sc= 1.05 K(o=1.1,f=0) USER MOD Single : A 11 GLN :FLIP amide:sc= -0.0212 F(o=-0.61,f=-0.021) USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 GLN : amide:sc= -0.0678 K(o=-0.068,f=-0.86) USER MOD Single : A 22 GLN : amide:sc= -0.11 X(o=-0.11,f=-0.11) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0.117 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 GLN : amide:sc= -0.0133 K(o=-0.013,f=-1) USER MOD Single : A 39 THR OG1 : rot 68:sc= -0.0828 USER MOD Single : A 42 THR OG1 : rot 73:sc= 0.404 USER MOD Single : A 43 SER OG : rot 81:sc= 1.24 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0.15 USER MOD Single : A 52 SER OG : rot 84:sc= 1.21 USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=-0.0036) USER MOD Single : A 56 HIS : no HD1:sc= -0.24 X(o=-0.24,f=-0.53) USER MOD Single : A 65 LYS NZ :NH3+ 176:sc= 1.09 (180deg=1.08) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=-0.081) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ -160:sc= -0.166 (180deg=-0.656) USER MOD Single : B 6 THR OG1 : rot 180:sc= 0.062 USER MOD Single : B 8 SER OG : rot 180:sc= 0.0735 USER MOD Single : B 9 GLN : amide:sc= -0.198 X(o=-0.2,f=-0.38) USER MOD Single : B 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 22 GLN : amide:sc= -1.67! C(o=-1.7!,f=-4.5!) USER MOD Single : B 23 THR OG1 : rot 64:sc= 1.29 USER MOD Single : B 35 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0242) USER MOD Single : B 37 GLN : amide:sc= 0.327 K(o=0.33,f=-3.4!) USER MOD Single : B 39 THR OG1 : rot 68:sc= 0.331 USER MOD Single : B 42 THR OG1 : rot 180:sc= 0.0283 USER MOD Single : B 43 SER OG : rot 82:sc= 1.07 USER MOD Single : B 47 THR OG1 : rot 180:sc= 0.0887 USER MOD Single : B 52 SER OG : rot 84:sc= 1.13 USER MOD Single : B 53 GLN : amide:sc= -0.668 K(o=-0.67,f=-1.5) USER MOD Single : B 56 HIS : no HD1:sc= -0.157 X(o=-0.16,f=-0.0094) USER MOD Single : B 75 THR OG1 : rot 180:sc= 0 USER MOD Single : B 81 HIS : no HD1:sc= 0 X(o=0,f=-0.046) USER MOD Single : B 82 GLN : amide:sc= -0.2 K(o=-0.2,f=-1.1) USER MOD Single : B 84 TYR OH : rot 180:sc= 0 USER MOD Single : B 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 64 N ARG A 4 -24.482 12.250 2.437 1.00 0.00 N ATOM 65 CA ARG A 4 -23.680 12.933 3.432 1.00 0.00 C ATOM 66 C ARG A 4 -22.794 11.936 4.150 1.00 0.00 C ATOM 67 O ARG A 4 -22.973 10.723 4.006 1.00 0.00 O ATOM 68 CB ARG A 4 -24.568 13.673 4.433 1.00 0.00 C ATOM 69 CG ARG A 4 -25.546 14.634 3.784 1.00 0.00 C ATOM 70 CD ARG A 4 -26.916 14.528 4.418 1.00 0.00 C ATOM 71 NE ARG A 4 -27.191 15.654 5.306 1.00 0.00 N ATOM 72 CZ ARG A 4 -27.204 15.577 6.635 1.00 0.00 C ATOM 73 NH1 ARG A 4 -27.008 14.415 7.253 1.00 0.00 N ATOM 74 NH2 ARG A 4 -27.424 16.670 7.345 1.00 0.00 N ATOM 0 HA ARG A 4 -23.054 13.669 2.928 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -25.125 12.943 5.021 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -23.935 14.226 5.128 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -25.176 15.655 3.880 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -25.618 14.420 2.718 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -27.676 14.487 3.637 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -26.985 13.597 4.980 1.00 0.00 H new ATOM 0 HE ARG A 4 -27.386 16.560 4.880 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -26.845 13.568 6.708 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -27.021 14.371 8.272 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -27.582 17.561 6.874 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -27.436 16.622 8.364 1.00 0.00 H new ATOM 88 N LEU A 5 -21.857 12.438 4.932 1.00 0.00 N ATOM 89 CA LEU A 5 -20.829 11.587 5.505 1.00 0.00 C ATOM 90 C LEU A 5 -20.586 11.871 6.977 1.00 0.00 C ATOM 91 O LEU A 5 -21.085 12.847 7.535 1.00 0.00 O ATOM 92 CB LEU A 5 -19.522 11.762 4.732 1.00 0.00 C ATOM 93 CG LEU A 5 -19.408 10.916 3.469 1.00 0.00 C ATOM 94 CD1 LEU A 5 -18.044 11.087 2.835 1.00 0.00 C ATOM 95 CD2 LEU A 5 -19.665 9.455 3.788 1.00 0.00 C ATOM 0 H LEU A 5 -21.785 13.424 5.184 1.00 0.00 H new ATOM 0 HA LEU A 5 -21.185 10.560 5.425 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -19.415 12.812 4.460 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -18.690 11.518 5.392 1.00 0.00 H new ATOM 0 HG LEU A 5 -20.162 11.254 2.758 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -17.982 10.475 1.935 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -17.893 12.134 2.573 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -17.273 10.775 3.540 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -19.580 8.863 2.877 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -18.932 9.107 4.516 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -20.668 9.344 4.201 1.00 0.00 H new ATOM 107 N THR A 6 -19.830 10.979 7.595 1.00 0.00 N ATOM 108 CA THR A 6 -19.349 11.166 8.949 1.00 0.00 C ATOM 109 C THR A 6 -17.884 11.585 8.907 1.00 0.00 C ATOM 110 O THR A 6 -17.219 11.382 7.891 1.00 0.00 O ATOM 111 CB THR A 6 -19.490 9.872 9.763 1.00 0.00 C ATOM 112 OG1 THR A 6 -19.383 8.736 8.889 1.00 0.00 O ATOM 113 CG2 THR A 6 -20.825 9.836 10.492 1.00 0.00 C ATOM 0 H THR A 6 -19.533 10.102 7.168 1.00 0.00 H new ATOM 0 HA THR A 6 -19.946 11.941 9.429 1.00 0.00 H new ATOM 0 HB THR A 6 -18.691 9.840 10.504 1.00 0.00 H new ATOM 0 HG1 THR A 6 -19.472 7.912 9.412 1.00 0.00 H new ATOM 0 HG21 THR A 6 -20.903 8.910 11.062 1.00 0.00 H new ATOM 0 HG22 THR A 6 -20.892 10.687 11.170 1.00 0.00 H new ATOM 0 HG23 THR A 6 -21.637 9.885 9.767 1.00 0.00 H new ATOM 121 N GLU A 7 -17.385 12.144 10.004 1.00 0.00 N ATOM 122 CA GLU A 7 -16.016 12.658 10.062 1.00 0.00 C ATOM 123 C GLU A 7 -14.974 11.555 9.862 1.00 0.00 C ATOM 124 O GLU A 7 -13.980 11.754 9.163 1.00 0.00 O ATOM 125 CB GLU A 7 -15.778 13.350 11.401 1.00 0.00 C ATOM 126 CG GLU A 7 -16.475 14.693 11.531 1.00 0.00 C ATOM 127 CD GLU A 7 -16.186 15.363 12.855 1.00 0.00 C ATOM 128 OE1 GLU A 7 -14.997 15.512 13.200 1.00 0.00 O ATOM 129 OE2 GLU A 7 -17.144 15.738 13.558 1.00 0.00 O ATOM 0 H GLU A 7 -17.910 12.254 10.872 1.00 0.00 H new ATOM 0 HA GLU A 7 -15.902 13.372 9.246 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -16.119 12.695 12.203 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -14.706 13.493 11.540 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -16.156 15.346 10.719 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -17.551 14.554 11.424 1.00 0.00 H new ATOM 136 N SER A 8 -15.214 10.395 10.461 1.00 0.00 N ATOM 137 CA SER A 8 -14.281 9.277 10.388 1.00 0.00 C ATOM 138 C SER A 8 -14.180 8.721 8.967 1.00 0.00 C ATOM 139 O SER A 8 -13.081 8.519 8.455 1.00 0.00 O ATOM 140 CB SER A 8 -14.720 8.188 11.361 1.00 0.00 C ATOM 141 OG SER A 8 -15.834 8.622 12.126 1.00 0.00 O ATOM 0 H SER A 8 -16.054 10.203 11.007 1.00 0.00 H new ATOM 0 HA SER A 8 -13.289 9.635 10.665 1.00 0.00 H new ATOM 0 HB2 SER A 8 -14.980 7.284 10.810 1.00 0.00 H new ATOM 0 HB3 SER A 8 -13.894 7.931 12.024 1.00 0.00 H new ATOM 0 HG SER A 8 -16.104 7.911 12.744 1.00 0.00 H new ATOM 147 N GLN A 9 -15.329 8.509 8.326 1.00 0.00 N ATOM 148 CA GLN A 9 -15.364 7.964 6.968 1.00 0.00 C ATOM 149 C GLN A 9 -14.846 8.977 5.954 1.00 0.00 C ATOM 150 O GLN A 9 -14.296 8.608 4.919 1.00 0.00 O ATOM 151 CB GLN A 9 -16.783 7.539 6.603 1.00 0.00 C ATOM 152 CG GLN A 9 -17.175 6.198 7.194 1.00 0.00 C ATOM 153 CD GLN A 9 -16.939 5.043 6.241 1.00 0.00 C ATOM 154 OE1 GLN A 9 -17.846 4.627 5.519 1.00 0.00 O ATOM 155 NE2 GLN A 9 -15.726 4.511 6.233 1.00 0.00 N ATOM 0 H GLN A 9 -16.247 8.706 8.724 1.00 0.00 H new ATOM 0 HA GLN A 9 -14.712 7.091 6.941 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -17.483 8.300 6.948 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -16.873 7.491 5.518 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -16.607 6.030 8.109 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -18.228 6.223 7.473 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -15.001 4.884 6.846 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -15.517 3.728 5.614 1.00 0.00 H new ATOM 164 N PHE A 10 -15.026 10.253 6.269 1.00 0.00 N ATOM 165 CA PHE A 10 -14.528 11.343 5.439 1.00 0.00 C ATOM 166 C PHE A 10 -12.998 11.346 5.423 1.00 0.00 C ATOM 167 O PHE A 10 -12.375 11.479 4.369 1.00 0.00 O ATOM 168 CB PHE A 10 -15.070 12.670 5.988 1.00 0.00 C ATOM 169 CG PHE A 10 -14.501 13.906 5.353 1.00 0.00 C ATOM 170 CD1 PHE A 10 -14.864 14.271 4.068 1.00 0.00 C ATOM 171 CD2 PHE A 10 -13.622 14.715 6.053 1.00 0.00 C ATOM 172 CE1 PHE A 10 -14.358 15.418 3.494 1.00 0.00 C ATOM 173 CE2 PHE A 10 -13.112 15.861 5.482 1.00 0.00 C ATOM 174 CZ PHE A 10 -13.482 16.213 4.201 1.00 0.00 C ATOM 0 H PHE A 10 -15.521 10.562 7.106 1.00 0.00 H new ATOM 0 HA PHE A 10 -14.870 11.210 4.413 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -16.153 12.682 5.862 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -14.874 12.708 7.060 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -15.550 13.651 3.510 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -13.333 14.445 7.058 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -14.648 15.693 2.491 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -12.424 16.482 6.037 1.00 0.00 H new ATOM 0 HZ PHE A 10 -13.085 17.112 3.752 1.00 0.00 H new ATOM 184 N GLN A 11 -12.404 11.175 6.600 1.00 0.00 N ATOM 185 CA GLN A 11 -10.958 11.159 6.736 1.00 0.00 C ATOM 186 C GLN A 11 -10.360 9.872 6.183 1.00 0.00 C ATOM 187 O GLN A 11 -9.208 9.851 5.751 1.00 0.00 O ATOM 188 CB GLN A 11 -10.569 11.329 8.196 1.00 0.00 C ATOM 189 CG GLN A 11 -10.077 12.728 8.511 1.00 0.00 C ATOM 190 CD GLN A 11 -8.566 12.882 8.413 1.00 0.00 C ATOM 191 OE1 GLN A 11 -7.916 12.025 7.638 1.00 0.00 O flip ATOM 192 NE2 GLN A 11 -7.986 13.778 9.025 1.00 0.00 N flip ATOM 0 H GLN A 11 -12.909 11.045 7.477 1.00 0.00 H new ATOM 0 HA GLN A 11 -10.558 11.991 6.156 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -11.429 11.100 8.826 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -9.790 10.609 8.446 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -10.550 13.433 7.827 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -10.396 12.998 9.518 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -8.517 14.421 9.613 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -6.974 13.878 8.944 1.00 0.00 H new ATOM 201 N GLU A 12 -11.147 8.809 6.208 1.00 0.00 N ATOM 202 CA GLU A 12 -10.739 7.530 5.641 1.00 0.00 C ATOM 203 C GLU A 12 -10.719 7.601 4.115 1.00 0.00 C ATOM 204 O GLU A 12 -9.866 6.993 3.469 1.00 0.00 O ATOM 205 CB GLU A 12 -11.685 6.419 6.099 1.00 0.00 C ATOM 206 CG GLU A 12 -11.245 5.739 7.385 1.00 0.00 C ATOM 207 CD GLU A 12 -12.327 4.862 7.984 1.00 0.00 C ATOM 208 OE1 GLU A 12 -13.519 5.212 7.870 1.00 0.00 O ATOM 209 OE2 GLU A 12 -11.987 3.819 8.581 1.00 0.00 O ATOM 0 H GLU A 12 -12.081 8.805 6.618 1.00 0.00 H new ATOM 0 HA GLU A 12 -9.732 7.305 5.994 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -12.682 6.837 6.241 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -11.763 5.671 5.310 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -10.361 5.133 7.187 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -10.955 6.498 8.111 1.00 0.00 H new ATOM 216 N ALA A 13 -11.655 8.362 3.555 1.00 0.00 N ATOM 217 CA ALA A 13 -11.769 8.526 2.110 1.00 0.00 C ATOM 218 C ALA A 13 -10.571 9.278 1.535 1.00 0.00 C ATOM 219 O ALA A 13 -10.026 8.887 0.507 1.00 0.00 O ATOM 220 CB ALA A 13 -13.058 9.255 1.766 1.00 0.00 C ATOM 0 H ALA A 13 -12.353 8.880 4.088 1.00 0.00 H new ATOM 0 HA ALA A 13 -11.786 7.533 1.662 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -13.133 9.372 0.685 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -13.910 8.679 2.128 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -13.057 10.238 2.238 1.00 0.00 H new ATOM 226 N ILE A 14 -10.154 10.343 2.217 1.00 0.00 N ATOM 227 CA ILE A 14 -9.049 11.177 1.737 1.00 0.00 C ATOM 228 C ILE A 14 -7.685 10.573 2.082 1.00 0.00 C ATOM 229 O ILE A 14 -6.648 11.061 1.630 1.00 0.00 O ATOM 230 CB ILE A 14 -9.126 12.615 2.301 1.00 0.00 C ATOM 231 CG1 ILE A 14 -9.240 12.596 3.826 1.00 0.00 C ATOM 232 CG2 ILE A 14 -10.301 13.364 1.686 1.00 0.00 C ATOM 233 CD1 ILE A 14 -8.607 13.793 4.503 1.00 0.00 C ATOM 0 H ILE A 14 -10.561 10.650 3.100 1.00 0.00 H new ATOM 0 HA ILE A 14 -9.152 11.217 0.653 1.00 0.00 H new ATOM 0 HB ILE A 14 -8.206 13.136 2.037 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -10.294 12.550 4.101 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -8.772 11.687 4.204 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -10.342 14.374 2.093 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -10.175 13.413 0.604 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -11.228 12.841 1.920 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -8.729 13.707 5.583 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -7.545 13.829 4.259 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -9.091 14.706 4.155 1.00 0.00 H new ATOM 245 N GLN A 15 -7.693 9.507 2.872 1.00 0.00 N ATOM 246 CA GLN A 15 -6.465 8.845 3.291 1.00 0.00 C ATOM 247 C GLN A 15 -5.851 8.057 2.142 1.00 0.00 C ATOM 248 O GLN A 15 -6.461 7.122 1.619 1.00 0.00 O ATOM 249 CB GLN A 15 -6.746 7.915 4.462 1.00 0.00 C ATOM 250 CG GLN A 15 -5.576 7.763 5.418 1.00 0.00 C ATOM 251 CD GLN A 15 -6.014 7.688 6.866 1.00 0.00 C ATOM 252 OE1 GLN A 15 -5.616 8.513 7.690 1.00 0.00 O ATOM 253 NE2 GLN A 15 -6.830 6.697 7.188 1.00 0.00 N ATOM 0 H GLN A 15 -8.544 9.080 3.238 1.00 0.00 H new ATOM 0 HA GLN A 15 -5.755 9.612 3.601 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -7.608 8.291 5.014 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -7.018 6.932 4.076 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -5.018 6.862 5.164 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -4.896 8.605 5.291 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -7.135 6.036 6.474 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -7.153 6.595 8.150 1.00 0.00 H new ATOM 262 N GLY A 16 -4.644 8.442 1.756 1.00 0.00 N ATOM 263 CA GLY A 16 -3.966 7.793 0.652 1.00 0.00 C ATOM 264 C GLY A 16 -4.209 8.503 -0.663 1.00 0.00 C ATOM 265 O GLY A 16 -3.723 8.072 -1.707 1.00 0.00 O ATOM 0 H GLY A 16 -4.118 9.199 2.192 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.895 7.761 0.853 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -4.307 6.761 0.574 1.00 0.00 H new ATOM 269 N LEU A 17 -4.974 9.586 -0.612 1.00 0.00 N ATOM 270 CA LEU A 17 -5.277 10.366 -1.799 1.00 0.00 C ATOM 271 C LEU A 17 -4.511 11.680 -1.788 1.00 0.00 C ATOM 272 O LEU A 17 -4.124 12.174 -0.729 1.00 0.00 O ATOM 273 CB LEU A 17 -6.782 10.644 -1.883 1.00 0.00 C ATOM 274 CG LEU A 17 -7.583 9.672 -2.752 1.00 0.00 C ATOM 275 CD1 LEU A 17 -6.841 9.384 -4.042 1.00 0.00 C ATOM 276 CD2 LEU A 17 -7.861 8.380 -1.997 1.00 0.00 C ATOM 0 H LEU A 17 -5.397 9.943 0.245 1.00 0.00 H new ATOM 0 HA LEU A 17 -4.971 9.790 -2.672 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -7.194 10.626 -0.874 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -6.927 11.653 -2.269 1.00 0.00 H new ATOM 0 HG LEU A 17 -8.538 10.136 -2.997 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -7.423 8.691 -4.650 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -6.693 10.313 -4.592 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -5.872 8.940 -3.813 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -8.432 7.703 -2.633 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -6.917 7.910 -1.721 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -8.434 8.601 -1.096 1.00 0.00 H new ATOM 288 N GLU A 18 -4.297 12.244 -2.970 1.00 0.00 N ATOM 289 CA GLU A 18 -3.620 13.524 -3.093 1.00 0.00 C ATOM 290 C GLU A 18 -4.647 14.647 -3.061 1.00 0.00 C ATOM 291 O GLU A 18 -5.111 15.125 -4.099 1.00 0.00 O ATOM 292 CB GLU A 18 -2.789 13.597 -4.384 1.00 0.00 C ATOM 293 CG GLU A 18 -2.889 12.362 -5.270 1.00 0.00 C ATOM 294 CD GLU A 18 -3.897 12.531 -6.387 1.00 0.00 C ATOM 295 OE1 GLU A 18 -5.104 12.339 -6.138 1.00 0.00 O ATOM 296 OE2 GLU A 18 -3.485 12.861 -7.517 1.00 0.00 O ATOM 0 H GLU A 18 -4.584 11.832 -3.858 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.934 13.633 -2.253 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -3.108 14.467 -4.958 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.743 13.755 -4.120 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -1.910 12.145 -5.698 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -3.168 11.503 -4.660 1.00 0.00 H new ATOM 303 N VAL A 19 -5.013 15.049 -1.857 1.00 0.00 N ATOM 304 CA VAL A 19 -6.011 16.088 -1.667 1.00 0.00 C ATOM 305 C VAL A 19 -5.437 17.252 -0.897 1.00 0.00 C ATOM 306 O VAL A 19 -4.827 17.081 0.159 1.00 0.00 O ATOM 307 CB VAL A 19 -7.279 15.573 -0.946 1.00 0.00 C ATOM 308 CG1 VAL A 19 -8.383 15.277 -1.947 1.00 0.00 C ATOM 309 CG2 VAL A 19 -6.980 14.341 -0.102 1.00 0.00 C ATOM 0 H VAL A 19 -4.632 14.669 -0.991 1.00 0.00 H new ATOM 0 HA VAL A 19 -6.303 16.414 -2.665 1.00 0.00 H new ATOM 0 HB VAL A 19 -7.619 16.362 -0.275 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -9.266 14.916 -1.419 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -8.633 16.187 -2.492 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -8.043 14.515 -2.649 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -7.893 14.007 0.390 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -6.600 13.545 -0.742 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -6.232 14.589 0.651 1.00 0.00 H new ATOM 319 N GLY A 20 -5.624 18.432 -1.459 1.00 0.00 N ATOM 320 CA GLY A 20 -5.202 19.639 -0.807 1.00 0.00 C ATOM 321 C GLY A 20 -6.254 20.146 0.147 1.00 0.00 C ATOM 322 O GLY A 20 -7.398 19.686 0.124 1.00 0.00 O ATOM 0 H GLY A 20 -6.067 18.571 -2.367 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -4.275 19.456 -0.264 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -4.988 20.403 -1.555 1.00 0.00 H new ATOM 326 N GLN A 21 -5.863 21.105 0.964 1.00 0.00 N ATOM 327 CA GLN A 21 -6.724 21.677 2.001 1.00 0.00 C ATOM 328 C GLN A 21 -8.016 22.245 1.417 1.00 0.00 C ATOM 329 O GLN A 21 -9.076 22.111 2.019 1.00 0.00 O ATOM 330 CB GLN A 21 -5.951 22.760 2.772 1.00 0.00 C ATOM 331 CG GLN A 21 -6.818 23.665 3.639 1.00 0.00 C ATOM 332 CD GLN A 21 -6.766 23.311 5.114 1.00 0.00 C ATOM 333 OE1 GLN A 21 -6.440 22.184 5.490 1.00 0.00 O ATOM 334 NE2 GLN A 21 -7.088 24.275 5.962 1.00 0.00 N ATOM 0 H GLN A 21 -4.931 21.518 0.932 1.00 0.00 H new ATOM 0 HA GLN A 21 -7.009 20.879 2.687 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -5.208 22.275 3.406 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -5.407 23.377 2.057 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -6.496 24.698 3.509 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -7.850 23.607 3.294 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -7.353 25.195 5.611 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -7.071 24.097 6.966 1.00 0.00 H new ATOM 343 N GLN A 22 -7.935 22.840 0.235 1.00 0.00 N ATOM 344 CA GLN A 22 -9.100 23.461 -0.385 1.00 0.00 C ATOM 345 C GLN A 22 -10.154 22.415 -0.739 1.00 0.00 C ATOM 346 O GLN A 22 -11.345 22.626 -0.520 1.00 0.00 O ATOM 347 CB GLN A 22 -8.690 24.247 -1.634 1.00 0.00 C ATOM 348 CG GLN A 22 -8.314 25.694 -1.349 1.00 0.00 C ATOM 349 CD GLN A 22 -7.202 25.826 -0.322 1.00 0.00 C ATOM 350 OE1 GLN A 22 -6.081 25.354 -0.531 1.00 0.00 O ATOM 351 NE2 GLN A 22 -7.507 26.462 0.797 1.00 0.00 N ATOM 0 H GLN A 22 -7.078 22.906 -0.314 1.00 0.00 H new ATOM 0 HA GLN A 22 -9.535 24.153 0.336 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -7.844 23.747 -2.106 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -9.511 24.228 -2.350 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -8.003 26.173 -2.277 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -9.195 26.230 -0.994 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -8.446 26.838 0.931 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -6.803 26.577 1.526 1.00 0.00 H new ATOM 360 N THR A 23 -9.703 21.280 -1.253 1.00 0.00 N ATOM 361 CA THR A 23 -10.590 20.189 -1.617 1.00 0.00 C ATOM 362 C THR A 23 -11.221 19.547 -0.376 1.00 0.00 C ATOM 363 O THR A 23 -12.421 19.262 -0.354 1.00 0.00 O ATOM 364 CB THR A 23 -9.821 19.116 -2.414 1.00 0.00 C ATOM 365 OG1 THR A 23 -8.553 19.639 -2.841 1.00 0.00 O ATOM 366 CG2 THR A 23 -10.615 18.661 -3.626 1.00 0.00 C ATOM 0 H THR A 23 -8.716 21.091 -1.428 1.00 0.00 H new ATOM 0 HA THR A 23 -11.386 20.603 -2.236 1.00 0.00 H new ATOM 0 HB THR A 23 -9.664 18.258 -1.761 1.00 0.00 H new ATOM 0 HG1 THR A 23 -8.069 18.952 -3.345 1.00 0.00 H new ATOM 0 HG21 THR A 23 -10.049 17.904 -4.169 1.00 0.00 H new ATOM 0 HG22 THR A 23 -11.566 18.238 -3.301 1.00 0.00 H new ATOM 0 HG23 THR A 23 -10.802 19.513 -4.280 1.00 0.00 H new ATOM 374 N ILE A 24 -10.408 19.340 0.653 1.00 0.00 N ATOM 375 CA ILE A 24 -10.859 18.687 1.878 1.00 0.00 C ATOM 376 C ILE A 24 -11.821 19.572 2.679 1.00 0.00 C ATOM 377 O ILE A 24 -12.878 19.112 3.109 1.00 0.00 O ATOM 378 CB ILE A 24 -9.661 18.283 2.770 1.00 0.00 C ATOM 379 CG1 ILE A 24 -8.657 17.460 1.959 1.00 0.00 C ATOM 380 CG2 ILE A 24 -10.132 17.494 3.986 1.00 0.00 C ATOM 381 CD1 ILE A 24 -7.318 17.282 2.642 1.00 0.00 C ATOM 0 H ILE A 24 -9.426 19.617 0.664 1.00 0.00 H new ATOM 0 HA ILE A 24 -11.395 17.789 1.572 1.00 0.00 H new ATOM 0 HB ILE A 24 -9.172 19.191 3.123 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -9.085 16.478 1.758 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -8.501 17.943 0.994 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -9.272 17.221 4.598 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -10.816 18.106 4.574 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -10.645 16.590 3.657 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -6.661 16.689 2.006 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -6.867 18.258 2.819 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -7.460 16.771 3.594 1.00 0.00 H new ATOM 393 N GLU A 25 -11.464 20.840 2.856 1.00 0.00 N ATOM 394 CA GLU A 25 -12.223 21.747 3.701 1.00 0.00 C ATOM 395 C GLU A 25 -13.612 22.048 3.141 1.00 0.00 C ATOM 396 O GLU A 25 -14.553 22.261 3.908 1.00 0.00 O ATOM 397 CB GLU A 25 -11.442 23.040 3.883 1.00 0.00 C ATOM 398 CG GLU A 25 -10.302 22.936 4.887 1.00 0.00 C ATOM 399 CD GLU A 25 -10.674 22.177 6.146 1.00 0.00 C ATOM 400 OE1 GLU A 25 -11.604 22.611 6.854 1.00 0.00 O ATOM 401 OE2 GLU A 25 -10.033 21.148 6.441 1.00 0.00 O ATOM 0 H GLU A 25 -10.645 21.263 2.419 1.00 0.00 H new ATOM 0 HA GLU A 25 -12.370 21.256 4.663 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -11.037 23.347 2.919 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -12.127 23.824 4.206 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -9.454 22.443 4.412 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -9.976 23.940 5.160 1.00 0.00 H new ATOM 408 N ILE A 26 -13.745 22.060 1.816 1.00 0.00 N ATOM 409 CA ILE A 26 -15.052 22.285 1.196 1.00 0.00 C ATOM 410 C ILE A 26 -15.959 21.077 1.430 1.00 0.00 C ATOM 411 O ILE A 26 -17.108 21.223 1.845 1.00 0.00 O ATOM 412 CB ILE A 26 -14.943 22.580 -0.324 1.00 0.00 C ATOM 413 CG1 ILE A 26 -14.326 23.963 -0.554 1.00 0.00 C ATOM 414 CG2 ILE A 26 -16.314 22.500 -0.998 1.00 0.00 C ATOM 415 CD1 ILE A 26 -13.878 24.198 -1.984 1.00 0.00 C ATOM 0 H ILE A 26 -12.978 21.919 1.159 1.00 0.00 H new ATOM 0 HA ILE A 26 -15.485 23.167 1.667 1.00 0.00 H new ATOM 0 HB ILE A 26 -14.297 21.823 -0.769 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -15.054 24.727 -0.280 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -13.471 24.085 0.111 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -16.209 22.711 -2.062 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -16.727 21.500 -0.865 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -16.984 23.232 -0.547 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -13.452 25.197 -2.072 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -13.126 23.457 -2.256 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -14.734 24.109 -2.653 1.00 0.00 H new ATOM 427 N ALA A 27 -15.413 19.886 1.204 1.00 0.00 N ATOM 428 CA ALA A 27 -16.152 18.637 1.374 1.00 0.00 C ATOM 429 C ALA A 27 -16.478 18.366 2.850 1.00 0.00 C ATOM 430 O ALA A 27 -17.371 17.582 3.160 1.00 0.00 O ATOM 431 CB ALA A 27 -15.356 17.487 0.784 1.00 0.00 C ATOM 0 H ALA A 27 -14.448 19.758 0.899 1.00 0.00 H new ATOM 0 HA ALA A 27 -17.101 18.729 0.845 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -15.910 16.557 0.913 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -15.190 17.667 -0.278 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -14.395 17.410 1.293 1.00 0.00 H new ATOM 437 N ARG A 28 -15.751 19.019 3.757 1.00 0.00 N ATOM 438 CA ARG A 28 -16.006 18.901 5.196 1.00 0.00 C ATOM 439 C ARG A 28 -17.389 19.453 5.559 1.00 0.00 C ATOM 440 O ARG A 28 -18.018 19.010 6.522 1.00 0.00 O ATOM 441 CB ARG A 28 -14.921 19.636 5.988 1.00 0.00 C ATOM 442 CG ARG A 28 -14.850 19.232 7.451 1.00 0.00 C ATOM 443 CD ARG A 28 -14.488 20.414 8.337 1.00 0.00 C ATOM 444 NE ARG A 28 -13.050 20.667 8.344 1.00 0.00 N ATOM 445 CZ ARG A 28 -12.203 20.194 9.259 1.00 0.00 C ATOM 446 NH1 ARG A 28 -12.645 19.481 10.292 1.00 0.00 N ATOM 447 NH2 ARG A 28 -10.910 20.448 9.143 1.00 0.00 N ATOM 0 H ARG A 28 -14.976 19.639 3.520 1.00 0.00 H new ATOM 0 HA ARG A 28 -15.983 17.843 5.457 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -13.954 19.448 5.522 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -15.102 20.709 5.925 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -15.810 18.822 7.764 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -14.110 18.442 7.576 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -15.012 21.304 7.988 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -14.828 20.223 9.355 1.00 0.00 H new ATOM 0 HE ARG A 28 -12.667 21.246 7.597 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -13.642 19.291 10.391 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -11.987 19.125 10.985 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -10.567 21.002 8.358 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -10.256 20.090 9.839 1.00 0.00 H new ATOM 461 N GLY A 29 -17.851 20.424 4.787 1.00 0.00 N ATOM 462 CA GLY A 29 -19.176 20.973 4.997 1.00 0.00 C ATOM 463 C GLY A 29 -20.159 20.488 3.952 1.00 0.00 C ATOM 464 O GLY A 29 -21.308 20.181 4.257 1.00 0.00 O ATOM 0 H GLY A 29 -17.331 20.844 4.016 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -19.532 20.693 5.988 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -19.126 22.062 4.972 1.00 0.00 H new ATOM 468 N VAL A 30 -19.689 20.391 2.723 1.00 0.00 N ATOM 469 CA VAL A 30 -20.517 20.031 1.589 1.00 0.00 C ATOM 470 C VAL A 30 -20.945 18.557 1.652 1.00 0.00 C ATOM 471 O VAL A 30 -22.097 18.225 1.387 1.00 0.00 O ATOM 472 CB VAL A 30 -19.738 20.355 0.289 1.00 0.00 C ATOM 473 CG1 VAL A 30 -19.984 19.355 -0.819 1.00 0.00 C ATOM 474 CG2 VAL A 30 -20.073 21.754 -0.177 1.00 0.00 C ATOM 0 H VAL A 30 -18.713 20.562 2.482 1.00 0.00 H new ATOM 0 HA VAL A 30 -21.439 20.613 1.607 1.00 0.00 H new ATOM 0 HB VAL A 30 -18.677 20.289 0.530 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -19.409 19.640 -1.700 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -19.675 18.363 -0.489 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -21.045 19.340 -1.067 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -19.522 21.975 -1.091 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -21.143 21.826 -0.372 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -19.796 22.471 0.596 1.00 0.00 H new ATOM 484 N LEU A 31 -20.020 17.689 2.037 1.00 0.00 N ATOM 485 CA LEU A 31 -20.295 16.254 2.098 1.00 0.00 C ATOM 486 C LEU A 31 -20.724 15.828 3.500 1.00 0.00 C ATOM 487 O LEU A 31 -21.842 15.364 3.688 1.00 0.00 O ATOM 488 CB LEU A 31 -19.062 15.454 1.655 1.00 0.00 C ATOM 489 CG LEU A 31 -19.306 14.346 0.620 1.00 0.00 C ATOM 490 CD1 LEU A 31 -20.477 14.683 -0.293 1.00 0.00 C ATOM 491 CD2 LEU A 31 -18.045 14.117 -0.199 1.00 0.00 C ATOM 0 H LEU A 31 -19.073 17.949 2.312 1.00 0.00 H new ATOM 0 HA LEU A 31 -21.119 16.044 1.416 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -18.331 16.151 1.244 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -18.611 15.003 2.539 1.00 0.00 H new ATOM 0 HG LEU A 31 -19.559 13.431 1.156 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -20.621 13.877 -1.013 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -21.381 14.802 0.304 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -20.268 15.611 -0.825 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -18.225 13.330 -0.931 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -17.774 15.038 -0.715 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -17.231 13.819 0.462 1.00 0.00 H new ATOM 503 N VAL A 32 -19.826 15.992 4.474 1.00 0.00 N ATOM 504 CA VAL A 32 -20.076 15.598 5.869 1.00 0.00 C ATOM 505 C VAL A 32 -21.359 16.220 6.426 1.00 0.00 C ATOM 506 O VAL A 32 -22.243 15.511 6.910 1.00 0.00 O ATOM 507 CB VAL A 32 -18.889 15.989 6.782 1.00 0.00 C ATOM 508 CG1 VAL A 32 -19.053 15.406 8.179 1.00 0.00 C ATOM 509 CG2 VAL A 32 -17.573 15.540 6.173 1.00 0.00 C ATOM 0 H VAL A 32 -18.904 16.401 4.322 1.00 0.00 H new ATOM 0 HA VAL A 32 -20.191 14.514 5.863 1.00 0.00 H new ATOM 0 HB VAL A 32 -18.880 17.076 6.868 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -18.204 15.698 8.797 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -19.973 15.783 8.625 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -19.099 14.319 8.116 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -16.752 15.825 6.831 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -17.580 14.457 6.049 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -17.441 16.015 5.201 1.00 0.00 H new ATOM 519 N ASP A 33 -21.468 17.537 6.338 1.00 0.00 N ATOM 520 CA ASP A 33 -22.630 18.240 6.867 1.00 0.00 C ATOM 521 C ASP A 33 -23.782 18.172 5.875 1.00 0.00 C ATOM 522 O ASP A 33 -24.945 18.314 6.246 1.00 0.00 O ATOM 523 CB ASP A 33 -22.287 19.700 7.165 1.00 0.00 C ATOM 524 CG ASP A 33 -22.707 20.133 8.552 1.00 0.00 C ATOM 525 OD1 ASP A 33 -21.950 19.877 9.508 1.00 0.00 O ATOM 526 OD2 ASP A 33 -23.788 20.741 8.691 1.00 0.00 O ATOM 0 H ASP A 33 -20.768 18.141 5.906 1.00 0.00 H new ATOM 0 HA ASP A 33 -22.930 17.755 7.796 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -21.212 19.845 7.055 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -22.772 20.340 6.428 1.00 0.00 H new ATOM 531 N GLY A 34 -23.442 17.952 4.609 1.00 0.00 N ATOM 532 CA GLY A 34 -24.445 17.849 3.570 1.00 0.00 C ATOM 533 C GLY A 34 -24.953 19.200 3.134 1.00 0.00 C ATOM 534 O GLY A 34 -26.110 19.339 2.731 1.00 0.00 O ATOM 0 H GLY A 34 -22.481 17.843 4.284 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -24.024 17.326 2.711 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -25.280 17.248 3.931 1.00 0.00 H new ATOM 538 N LYS A 35 -24.085 20.196 3.210 1.00 0.00 N ATOM 539 CA LYS A 35 -24.459 21.561 2.882 1.00 0.00 C ATOM 540 C LYS A 35 -24.493 21.767 1.369 1.00 0.00 C ATOM 541 O LYS A 35 -23.757 21.106 0.631 1.00 0.00 O ATOM 542 CB LYS A 35 -23.488 22.555 3.527 1.00 0.00 C ATOM 543 CG LYS A 35 -23.540 22.561 5.046 1.00 0.00 C ATOM 544 CD LYS A 35 -24.238 23.800 5.577 1.00 0.00 C ATOM 545 CE LYS A 35 -24.455 23.712 7.079 1.00 0.00 C ATOM 546 NZ LYS A 35 -23.393 24.424 7.839 1.00 0.00 N ATOM 0 H LYS A 35 -23.113 20.083 3.497 1.00 0.00 H new ATOM 0 HA LYS A 35 -25.459 21.740 3.278 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -22.473 22.317 3.208 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -23.711 23.557 3.161 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -24.062 21.671 5.396 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -22.527 22.514 5.445 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -23.642 24.683 5.345 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -25.198 23.922 5.075 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -25.427 24.137 7.330 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -24.477 22.665 7.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -23.579 24.339 8.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -22.468 24.003 7.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -23.388 25.429 7.571 1.00 0.00 H new ATOM 560 N PRO A 36 -25.371 22.667 0.883 1.00 0.00 N ATOM 561 CA PRO A 36 -25.476 22.983 -0.544 1.00 0.00 C ATOM 562 C PRO A 36 -24.219 23.662 -1.088 1.00 0.00 C ATOM 563 O PRO A 36 -23.664 24.571 -0.461 1.00 0.00 O ATOM 564 CB PRO A 36 -26.677 23.934 -0.624 1.00 0.00 C ATOM 565 CG PRO A 36 -27.401 23.763 0.665 1.00 0.00 C ATOM 566 CD PRO A 36 -26.350 23.427 1.678 1.00 0.00 C ATOM 0 HA PRO A 36 -25.594 22.081 -1.145 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -26.353 24.966 -0.759 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -27.318 23.688 -1.471 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -27.932 24.674 0.940 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -28.145 22.969 0.594 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -25.909 24.322 2.117 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -26.753 22.835 2.499 1.00 0.00 H new ATOM 574 N GLN A 37 -23.794 23.215 -2.267 1.00 0.00 N ATOM 575 CA GLN A 37 -22.563 23.689 -2.899 1.00 0.00 C ATOM 576 C GLN A 37 -22.652 25.161 -3.309 1.00 0.00 C ATOM 577 O GLN A 37 -21.646 25.874 -3.295 1.00 0.00 O ATOM 578 CB GLN A 37 -22.252 22.840 -4.132 1.00 0.00 C ATOM 579 CG GLN A 37 -21.608 21.499 -3.811 1.00 0.00 C ATOM 580 CD GLN A 37 -22.599 20.351 -3.822 1.00 0.00 C ATOM 581 OE1 GLN A 37 -22.898 19.769 -2.782 1.00 0.00 O ATOM 582 NE2 GLN A 37 -23.116 20.021 -4.994 1.00 0.00 N ATOM 0 H GLN A 37 -24.293 22.513 -2.813 1.00 0.00 H new ATOM 0 HA GLN A 37 -21.765 23.595 -2.163 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -23.176 22.666 -4.683 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -21.589 23.402 -4.790 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -20.819 21.298 -4.535 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -21.135 21.554 -2.831 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -22.841 20.530 -5.834 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -23.790 19.258 -5.058 1.00 0.00 H new ATOM 591 N ALA A 38 -23.855 25.605 -3.674 1.00 0.00 N ATOM 592 CA ALA A 38 -24.076 26.984 -4.106 1.00 0.00 C ATOM 593 C ALA A 38 -23.731 27.976 -2.998 1.00 0.00 C ATOM 594 O ALA A 38 -22.994 28.935 -3.226 1.00 0.00 O ATOM 595 CB ALA A 38 -25.519 27.171 -4.556 1.00 0.00 C ATOM 0 H ALA A 38 -24.695 25.026 -3.679 1.00 0.00 H new ATOM 0 HA ALA A 38 -23.414 27.182 -4.949 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -25.670 28.202 -4.875 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -25.731 26.499 -5.388 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -26.191 26.946 -3.728 1.00 0.00 H new ATOM 601 N THR A 39 -24.240 27.716 -1.797 1.00 0.00 N ATOM 602 CA THR A 39 -24.014 28.587 -0.651 1.00 0.00 C ATOM 603 C THR A 39 -22.542 28.629 -0.260 1.00 0.00 C ATOM 604 O THR A 39 -22.025 29.680 0.113 1.00 0.00 O ATOM 605 CB THR A 39 -24.835 28.122 0.562 1.00 0.00 C ATOM 606 OG1 THR A 39 -25.526 26.906 0.244 1.00 0.00 O ATOM 607 CG2 THR A 39 -25.833 29.189 0.980 1.00 0.00 C ATOM 0 H THR A 39 -24.817 26.900 -1.593 1.00 0.00 H new ATOM 0 HA THR A 39 -24.331 29.587 -0.948 1.00 0.00 H new ATOM 0 HB THR A 39 -24.153 27.945 1.393 1.00 0.00 H new ATOM 0 HG1 THR A 39 -24.877 26.179 0.138 1.00 0.00 H new ATOM 0 HG21 THR A 39 -26.403 28.837 1.840 1.00 0.00 H new ATOM 0 HG22 THR A 39 -25.300 30.102 1.246 1.00 0.00 H new ATOM 0 HG23 THR A 39 -26.514 29.394 0.154 1.00 0.00 H new ATOM 615 N PHE A 40 -21.869 27.487 -0.384 1.00 0.00 N ATOM 616 CA PHE A 40 -20.471 27.364 0.007 1.00 0.00 C ATOM 617 C PHE A 40 -19.585 28.241 -0.870 1.00 0.00 C ATOM 618 O PHE A 40 -18.655 28.887 -0.379 1.00 0.00 O ATOM 619 CB PHE A 40 -20.031 25.905 -0.095 1.00 0.00 C ATOM 620 CG PHE A 40 -19.425 25.365 1.167 1.00 0.00 C ATOM 621 CD1 PHE A 40 -20.230 24.991 2.232 1.00 0.00 C ATOM 622 CD2 PHE A 40 -18.051 25.229 1.291 1.00 0.00 C ATOM 623 CE1 PHE A 40 -19.676 24.491 3.396 1.00 0.00 C ATOM 624 CE2 PHE A 40 -17.492 24.730 2.453 1.00 0.00 C ATOM 625 CZ PHE A 40 -18.306 24.363 3.506 1.00 0.00 C ATOM 0 H PHE A 40 -22.276 26.628 -0.756 1.00 0.00 H new ATOM 0 HA PHE A 40 -20.369 27.699 1.039 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -20.892 25.294 -0.364 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -19.307 25.809 -0.904 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -21.302 25.091 2.151 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -17.410 25.516 0.471 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -20.314 24.201 4.218 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -16.420 24.627 2.537 1.00 0.00 H new ATOM 0 HZ PHE A 40 -17.871 23.976 4.416 1.00 0.00 H new ATOM 635 N ALA A 41 -19.902 28.274 -2.161 1.00 0.00 N ATOM 636 CA ALA A 41 -19.165 29.079 -3.123 1.00 0.00 C ATOM 637 C ALA A 41 -19.351 30.572 -2.852 1.00 0.00 C ATOM 638 O ALA A 41 -18.387 31.335 -2.855 1.00 0.00 O ATOM 639 CB ALA A 41 -19.614 28.731 -4.532 1.00 0.00 C ATOM 0 H ALA A 41 -20.674 27.745 -2.566 1.00 0.00 H new ATOM 0 HA ALA A 41 -18.103 28.856 -3.021 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -19.060 29.336 -5.250 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -19.424 27.675 -4.724 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -20.680 28.932 -4.634 1.00 0.00 H new ATOM 645 N THR A 42 -20.589 30.974 -2.585 1.00 0.00 N ATOM 646 CA THR A 42 -20.901 32.373 -2.325 1.00 0.00 C ATOM 647 C THR A 42 -20.272 32.863 -1.016 1.00 0.00 C ATOM 648 O THR A 42 -19.707 33.956 -0.968 1.00 0.00 O ATOM 649 CB THR A 42 -22.426 32.597 -2.274 1.00 0.00 C ATOM 650 OG1 THR A 42 -23.073 31.781 -3.259 1.00 0.00 O ATOM 651 CG2 THR A 42 -22.775 34.060 -2.517 1.00 0.00 C ATOM 0 H THR A 42 -21.394 30.349 -2.543 1.00 0.00 H new ATOM 0 HA THR A 42 -20.478 32.949 -3.148 1.00 0.00 H new ATOM 0 HB THR A 42 -22.775 32.319 -1.279 1.00 0.00 H new ATOM 0 HG1 THR A 42 -23.053 30.844 -2.972 1.00 0.00 H new ATOM 0 HG21 THR A 42 -23.857 34.188 -2.475 1.00 0.00 H new ATOM 0 HG22 THR A 42 -22.307 34.678 -1.751 1.00 0.00 H new ATOM 0 HG23 THR A 42 -22.412 34.362 -3.499 1.00 0.00 H new ATOM 659 N SER A 43 -20.343 32.038 0.027 1.00 0.00 N ATOM 660 CA SER A 43 -19.905 32.446 1.358 1.00 0.00 C ATOM 661 C SER A 43 -18.387 32.581 1.448 1.00 0.00 C ATOM 662 O SER A 43 -17.879 33.608 1.896 1.00 0.00 O ATOM 663 CB SER A 43 -20.396 31.450 2.411 1.00 0.00 C ATOM 664 OG SER A 43 -21.795 31.258 2.317 1.00 0.00 O ATOM 0 H SER A 43 -20.700 31.084 -0.025 1.00 0.00 H new ATOM 0 HA SER A 43 -20.340 33.427 1.550 1.00 0.00 H new ATOM 0 HB2 SER A 43 -19.885 30.496 2.280 1.00 0.00 H new ATOM 0 HB3 SER A 43 -20.142 31.814 3.407 1.00 0.00 H new ATOM 0 HG SER A 43 -21.990 30.618 1.601 1.00 0.00 H new ATOM 670 N LEU A 44 -17.667 31.557 1.004 1.00 0.00 N ATOM 671 CA LEU A 44 -16.217 31.521 1.175 1.00 0.00 C ATOM 672 C LEU A 44 -15.490 32.257 0.051 1.00 0.00 C ATOM 673 O LEU A 44 -14.283 32.479 0.129 1.00 0.00 O ATOM 674 CB LEU A 44 -15.732 30.075 1.254 1.00 0.00 C ATOM 675 CG LEU A 44 -15.472 29.553 2.665 1.00 0.00 C ATOM 676 CD1 LEU A 44 -16.529 28.529 3.051 1.00 0.00 C ATOM 677 CD2 LEU A 44 -14.078 28.951 2.758 1.00 0.00 C ATOM 0 H LEU A 44 -18.059 30.746 0.526 1.00 0.00 H new ATOM 0 HA LEU A 44 -15.985 32.034 2.108 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -16.473 29.433 0.777 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -14.813 29.985 0.675 1.00 0.00 H new ATOM 0 HG LEU A 44 -15.531 30.387 3.364 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -16.332 28.165 4.059 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -17.514 28.994 3.019 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -16.499 27.694 2.351 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -13.907 28.583 3.770 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -13.991 28.125 2.052 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -13.336 29.713 2.519 1.00 0.00 H new ATOM 689 N GLY A 45 -16.227 32.635 -0.987 1.00 0.00 N ATOM 690 CA GLY A 45 -15.631 33.360 -2.095 1.00 0.00 C ATOM 691 C GLY A 45 -14.958 32.436 -3.079 1.00 0.00 C ATOM 692 O GLY A 45 -13.940 32.785 -3.675 1.00 0.00 O ATOM 0 H GLY A 45 -17.226 32.453 -1.082 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -16.401 33.936 -2.607 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -14.902 34.074 -1.711 1.00 0.00 H new ATOM 696 N LEU A 46 -15.526 31.253 -3.242 1.00 0.00 N ATOM 697 CA LEU A 46 -14.987 30.264 -4.153 1.00 0.00 C ATOM 698 C LEU A 46 -15.784 30.244 -5.442 1.00 0.00 C ATOM 699 O LEU A 46 -16.875 30.815 -5.526 1.00 0.00 O ATOM 700 CB LEU A 46 -15.006 28.871 -3.527 1.00 0.00 C ATOM 701 CG LEU A 46 -14.634 28.816 -2.053 1.00 0.00 C ATOM 702 CD1 LEU A 46 -15.350 27.661 -1.393 1.00 0.00 C ATOM 703 CD2 LEU A 46 -13.130 28.683 -1.889 1.00 0.00 C ATOM 0 H LEU A 46 -16.368 30.955 -2.749 1.00 0.00 H new ATOM 0 HA LEU A 46 -13.954 30.539 -4.367 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -16.004 28.449 -3.649 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -14.320 28.232 -4.082 1.00 0.00 H new ATOM 0 HG LEU A 46 -14.943 29.743 -1.571 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -15.083 27.623 -0.337 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -16.427 27.797 -1.490 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -15.058 26.728 -1.875 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -12.882 28.645 -0.828 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -12.791 27.768 -2.374 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -12.637 29.541 -2.347 1.00 0.00 H new ATOM 715 N THR A 47 -15.236 29.590 -6.442 1.00 0.00 N ATOM 716 CA THR A 47 -15.941 29.384 -7.684 1.00 0.00 C ATOM 717 C THR A 47 -16.831 28.155 -7.557 1.00 0.00 C ATOM 718 O THR A 47 -16.549 27.263 -6.753 1.00 0.00 O ATOM 719 CB THR A 47 -14.945 29.198 -8.840 1.00 0.00 C ATOM 720 OG1 THR A 47 -13.616 29.073 -8.311 1.00 0.00 O ATOM 721 CG2 THR A 47 -14.999 30.372 -9.803 1.00 0.00 C ATOM 0 H THR A 47 -14.298 29.190 -6.417 1.00 0.00 H new ATOM 0 HA THR A 47 -16.556 30.258 -7.898 1.00 0.00 H new ATOM 0 HB THR A 47 -15.216 28.294 -9.385 1.00 0.00 H new ATOM 0 HG1 THR A 47 -12.981 28.953 -9.047 1.00 0.00 H new ATOM 0 HG21 THR A 47 -14.284 30.213 -10.610 1.00 0.00 H new ATOM 0 HG22 THR A 47 -16.003 30.456 -10.219 1.00 0.00 H new ATOM 0 HG23 THR A 47 -14.748 31.290 -9.272 1.00 0.00 H new ATOM 729 N ARG A 48 -17.890 28.095 -8.348 1.00 0.00 N ATOM 730 CA ARG A 48 -18.841 26.993 -8.260 1.00 0.00 C ATOM 731 C ARG A 48 -18.213 25.688 -8.732 1.00 0.00 C ATOM 732 O ARG A 48 -18.461 24.630 -8.151 1.00 0.00 O ATOM 733 CB ARG A 48 -20.096 27.310 -9.068 1.00 0.00 C ATOM 734 CG ARG A 48 -20.944 28.404 -8.444 1.00 0.00 C ATOM 735 CD ARG A 48 -22.203 27.843 -7.805 1.00 0.00 C ATOM 736 NE ARG A 48 -23.288 27.689 -8.776 1.00 0.00 N ATOM 737 CZ ARG A 48 -24.161 28.652 -9.089 1.00 0.00 C ATOM 738 NH1 ARG A 48 -24.087 29.847 -8.512 1.00 0.00 N ATOM 739 NH2 ARG A 48 -25.112 28.418 -9.986 1.00 0.00 N ATOM 0 H ARG A 48 -18.115 28.793 -9.057 1.00 0.00 H new ATOM 0 HA ARG A 48 -19.122 26.869 -7.214 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -19.807 27.612 -10.074 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -20.696 26.405 -9.167 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -20.359 28.934 -7.692 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -21.217 29.133 -9.207 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -21.981 26.876 -7.353 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -22.527 28.504 -7.001 1.00 0.00 H new ATOM 0 HE ARG A 48 -23.384 26.788 -9.244 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -23.359 30.036 -7.823 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -24.758 30.575 -8.758 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -25.176 27.504 -10.435 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -25.779 29.152 -10.226 1.00 0.00 H new ATOM 753 N GLY A 49 -17.377 25.777 -9.762 1.00 0.00 N ATOM 754 CA GLY A 49 -16.671 24.612 -10.263 1.00 0.00 C ATOM 755 C GLY A 49 -15.643 24.084 -9.275 1.00 0.00 C ATOM 756 O GLY A 49 -15.383 22.887 -9.231 1.00 0.00 O ATOM 0 H GLY A 49 -17.175 26.643 -10.262 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -17.390 23.825 -10.489 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -16.173 24.867 -11.198 1.00 0.00 H new ATOM 760 N ALA A 50 -15.077 24.982 -8.469 1.00 0.00 N ATOM 761 CA ALA A 50 -14.098 24.608 -7.452 1.00 0.00 C ATOM 762 C ALA A 50 -14.765 23.860 -6.298 1.00 0.00 C ATOM 763 O ALA A 50 -14.221 22.880 -5.788 1.00 0.00 O ATOM 764 CB ALA A 50 -13.378 25.843 -6.932 1.00 0.00 C ATOM 0 H ALA A 50 -15.283 25.980 -8.503 1.00 0.00 H new ATOM 0 HA ALA A 50 -13.369 23.942 -7.913 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -12.651 25.549 -6.175 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -12.863 26.338 -7.756 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -14.103 26.529 -6.493 1.00 0.00 H new ATOM 770 N VAL A 51 -15.945 24.332 -5.896 1.00 0.00 N ATOM 771 CA VAL A 51 -16.726 23.675 -4.851 1.00 0.00 C ATOM 772 C VAL A 51 -17.206 22.298 -5.328 1.00 0.00 C ATOM 773 O VAL A 51 -17.160 21.315 -4.584 1.00 0.00 O ATOM 774 CB VAL A 51 -17.937 24.541 -4.425 1.00 0.00 C ATOM 775 CG1 VAL A 51 -18.764 23.852 -3.349 1.00 0.00 C ATOM 776 CG2 VAL A 51 -17.463 25.896 -3.926 1.00 0.00 C ATOM 0 H VAL A 51 -16.381 25.170 -6.281 1.00 0.00 H new ATOM 0 HA VAL A 51 -16.079 23.546 -3.983 1.00 0.00 H new ATOM 0 HB VAL A 51 -18.571 24.680 -5.301 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -19.605 24.488 -3.074 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -19.137 22.901 -3.730 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -18.143 23.673 -2.472 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -18.323 26.496 -3.629 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -16.804 25.758 -3.069 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -16.921 26.407 -4.721 1.00 0.00 H new ATOM 786 N SER A 52 -17.629 22.233 -6.590 1.00 0.00 N ATOM 787 CA SER A 52 -18.089 20.987 -7.192 1.00 0.00 C ATOM 788 C SER A 52 -16.929 20.012 -7.419 1.00 0.00 C ATOM 789 O SER A 52 -17.130 18.801 -7.481 1.00 0.00 O ATOM 790 CB SER A 52 -18.802 21.276 -8.511 1.00 0.00 C ATOM 791 OG SER A 52 -19.823 22.245 -8.337 1.00 0.00 O ATOM 0 H SER A 52 -17.662 23.037 -7.217 1.00 0.00 H new ATOM 0 HA SER A 52 -18.788 20.517 -6.500 1.00 0.00 H new ATOM 0 HB2 SER A 52 -18.081 21.631 -9.248 1.00 0.00 H new ATOM 0 HB3 SER A 52 -19.233 20.355 -8.904 1.00 0.00 H new ATOM 0 HG SER A 52 -19.434 23.143 -8.387 1.00 0.00 H new ATOM 797 N GLN A 53 -15.721 20.549 -7.542 1.00 0.00 N ATOM 798 CA GLN A 53 -14.528 19.729 -7.691 1.00 0.00 C ATOM 799 C GLN A 53 -14.205 19.005 -6.388 1.00 0.00 C ATOM 800 O GLN A 53 -13.732 17.872 -6.400 1.00 0.00 O ATOM 801 CB GLN A 53 -13.341 20.590 -8.128 1.00 0.00 C ATOM 802 CG GLN A 53 -12.866 20.297 -9.541 1.00 0.00 C ATOM 803 CD GLN A 53 -11.554 20.983 -9.873 1.00 0.00 C ATOM 804 OE1 GLN A 53 -11.373 22.174 -9.609 1.00 0.00 O ATOM 805 NE2 GLN A 53 -10.630 20.234 -10.455 1.00 0.00 N ATOM 0 H GLN A 53 -15.543 21.553 -7.541 1.00 0.00 H new ATOM 0 HA GLN A 53 -14.720 18.982 -8.461 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -13.620 21.641 -8.058 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -12.514 20.433 -7.435 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -12.749 19.220 -9.665 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -13.629 20.619 -10.250 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -10.821 19.252 -10.656 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -9.727 20.639 -10.703 1.00 0.00 H new ATOM 814 N ALA A 54 -14.490 19.661 -5.268 1.00 0.00 N ATOM 815 CA ALA A 54 -14.202 19.103 -3.955 1.00 0.00 C ATOM 816 C ALA A 54 -15.180 18.000 -3.585 1.00 0.00 C ATOM 817 O ALA A 54 -14.775 16.968 -3.046 1.00 0.00 O ATOM 818 CB ALA A 54 -14.211 20.200 -2.909 1.00 0.00 C ATOM 0 H ALA A 54 -14.922 20.585 -5.246 1.00 0.00 H new ATOM 0 HA ALA A 54 -13.209 18.656 -3.992 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -13.994 19.771 -1.930 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -13.453 20.944 -3.155 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -15.192 20.675 -2.888 1.00 0.00 H new ATOM 824 N VAL A 55 -16.460 18.205 -3.889 1.00 0.00 N ATOM 825 CA VAL A 55 -17.466 17.184 -3.619 1.00 0.00 C ATOM 826 C VAL A 55 -17.232 15.973 -4.530 1.00 0.00 C ATOM 827 O VAL A 55 -17.391 14.830 -4.110 1.00 0.00 O ATOM 828 CB VAL A 55 -18.922 17.725 -3.760 1.00 0.00 C ATOM 829 CG1 VAL A 55 -19.206 18.275 -5.150 1.00 0.00 C ATOM 830 CG2 VAL A 55 -19.942 16.654 -3.394 1.00 0.00 C ATOM 0 H VAL A 55 -16.820 19.058 -4.317 1.00 0.00 H new ATOM 0 HA VAL A 55 -17.357 16.877 -2.579 1.00 0.00 H new ATOM 0 HB VAL A 55 -19.015 18.554 -3.058 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -20.233 18.639 -5.195 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -18.521 19.095 -5.364 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -19.068 17.486 -5.889 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -20.949 17.058 -3.501 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -19.823 15.797 -4.056 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -19.785 16.340 -2.362 1.00 0.00 H new ATOM 840 N HIS A 56 -16.811 16.240 -5.767 1.00 0.00 N ATOM 841 CA HIS A 56 -16.498 15.191 -6.732 1.00 0.00 C ATOM 842 C HIS A 56 -15.299 14.359 -6.280 1.00 0.00 C ATOM 843 O HIS A 56 -15.357 13.134 -6.288 1.00 0.00 O ATOM 844 CB HIS A 56 -16.205 15.800 -8.104 1.00 0.00 C ATOM 845 CG HIS A 56 -17.258 15.525 -9.133 1.00 0.00 C ATOM 846 ND1 HIS A 56 -17.975 14.349 -9.190 1.00 0.00 N ATOM 847 CD2 HIS A 56 -17.702 16.283 -10.162 1.00 0.00 C ATOM 848 CE1 HIS A 56 -18.813 14.396 -10.209 1.00 0.00 C ATOM 849 NE2 HIS A 56 -18.668 15.559 -10.813 1.00 0.00 N ATOM 0 H HIS A 56 -16.679 17.186 -6.125 1.00 0.00 H new ATOM 0 HA HIS A 56 -17.368 14.538 -6.801 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -16.092 16.879 -7.994 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -15.251 15.415 -8.464 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -17.360 17.274 -10.422 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -19.500 13.615 -10.499 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -19.190 15.870 -11.632 1.00 0.00 H new ATOM 858 N ARG A 57 -14.228 15.045 -5.872 1.00 0.00 N ATOM 859 CA ARG A 57 -12.965 14.401 -5.502 1.00 0.00 C ATOM 860 C ARG A 57 -13.124 13.448 -4.325 1.00 0.00 C ATOM 861 O ARG A 57 -12.799 12.264 -4.427 1.00 0.00 O ATOM 862 CB ARG A 57 -11.925 15.463 -5.145 1.00 0.00 C ATOM 863 CG ARG A 57 -10.549 15.186 -5.720 1.00 0.00 C ATOM 864 CD ARG A 57 -10.456 15.641 -7.162 1.00 0.00 C ATOM 865 NE ARG A 57 -9.181 15.274 -7.768 1.00 0.00 N ATOM 866 CZ ARG A 57 -9.059 14.724 -8.971 1.00 0.00 C ATOM 867 NH1 ARG A 57 -10.136 14.471 -9.708 1.00 0.00 N ATOM 868 NH2 ARG A 57 -7.857 14.427 -9.434 1.00 0.00 N ATOM 0 H ARG A 57 -14.212 16.061 -5.789 1.00 0.00 H new ATOM 0 HA ARG A 57 -12.638 13.820 -6.364 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -12.271 16.432 -5.504 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -11.848 15.534 -4.060 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -9.793 15.699 -5.125 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -10.334 14.119 -5.658 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -11.271 15.199 -7.735 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -10.583 16.723 -7.210 1.00 0.00 H new ATOM 0 HE ARG A 57 -8.330 15.451 -7.235 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -11.064 14.699 -9.351 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -10.035 14.049 -10.631 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -7.031 14.620 -8.868 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -7.756 14.004 -10.357 1.00 0.00 H new ATOM 882 N VAL A 58 -13.635 13.968 -3.215 1.00 0.00 N ATOM 883 CA VAL A 58 -13.719 13.202 -1.979 1.00 0.00 C ATOM 884 C VAL A 58 -14.759 12.088 -2.088 1.00 0.00 C ATOM 885 O VAL A 58 -14.562 10.997 -1.552 1.00 0.00 O ATOM 886 CB VAL A 58 -14.028 14.121 -0.775 1.00 0.00 C ATOM 887 CG1 VAL A 58 -14.081 13.332 0.525 1.00 0.00 C ATOM 888 CG2 VAL A 58 -12.983 15.222 -0.678 1.00 0.00 C ATOM 0 H VAL A 58 -13.998 14.919 -3.147 1.00 0.00 H new ATOM 0 HA VAL A 58 -12.746 12.739 -1.812 1.00 0.00 H new ATOM 0 HB VAL A 58 -15.009 14.569 -0.935 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -14.300 14.007 1.352 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -14.861 12.574 0.459 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -13.119 12.849 0.697 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -13.209 15.864 0.173 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -11.997 14.777 -0.545 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -12.993 15.815 -1.593 1.00 0.00 H new ATOM 898 N TRP A 59 -15.848 12.347 -2.808 1.00 0.00 N ATOM 899 CA TRP A 59 -16.872 11.321 -3.009 1.00 0.00 C ATOM 900 C TRP A 59 -16.358 10.198 -3.913 1.00 0.00 C ATOM 901 O TRP A 59 -16.685 9.032 -3.700 1.00 0.00 O ATOM 902 CB TRP A 59 -18.157 11.909 -3.590 1.00 0.00 C ATOM 903 CG TRP A 59 -19.344 11.011 -3.414 1.00 0.00 C ATOM 904 CD1 TRP A 59 -20.051 10.385 -4.399 1.00 0.00 C ATOM 905 CD2 TRP A 59 -19.960 10.631 -2.175 1.00 0.00 C ATOM 906 NE1 TRP A 59 -21.065 9.638 -3.851 1.00 0.00 N ATOM 907 CE2 TRP A 59 -21.031 9.773 -2.489 1.00 0.00 C ATOM 908 CE3 TRP A 59 -19.711 10.932 -0.835 1.00 0.00 C ATOM 909 CZ2 TRP A 59 -21.846 9.213 -1.511 1.00 0.00 C ATOM 910 CZ3 TRP A 59 -20.522 10.378 0.134 1.00 0.00 C ATOM 911 CH2 TRP A 59 -21.579 9.529 -0.207 1.00 0.00 C ATOM 0 H TRP A 59 -16.044 13.242 -3.256 1.00 0.00 H new ATOM 0 HA TRP A 59 -17.101 10.906 -2.027 1.00 0.00 H new ATOM 0 HB2 TRP A 59 -18.360 12.868 -3.112 1.00 0.00 H new ATOM 0 HB3 TRP A 59 -18.012 12.106 -4.652 1.00 0.00 H new ATOM 0 HD1 TRP A 59 -19.843 10.465 -5.456 1.00 0.00 H new ATOM 0 HE1 TRP A 59 -21.735 9.074 -4.374 1.00 0.00 H new ATOM 0 HE3 TRP A 59 -18.897 11.587 -0.561 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 -22.660 8.553 -1.771 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 -20.337 10.604 1.174 1.00 0.00 H new ATOM 0 HH2 TRP A 59 -22.198 9.114 0.575 1.00 0.00 H new ATOM 922 N ALA A 60 -15.548 10.549 -4.911 1.00 0.00 N ATOM 923 CA ALA A 60 -14.952 9.552 -5.797 1.00 0.00 C ATOM 924 C ALA A 60 -13.985 8.663 -5.029 1.00 0.00 C ATOM 925 O ALA A 60 -13.971 7.444 -5.209 1.00 0.00 O ATOM 926 CB ALA A 60 -14.243 10.222 -6.962 1.00 0.00 C ATOM 0 H ALA A 60 -15.291 11.512 -5.125 1.00 0.00 H new ATOM 0 HA ALA A 60 -15.753 8.930 -6.195 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -13.807 9.461 -7.609 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -14.959 10.815 -7.531 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -13.454 10.872 -6.583 1.00 0.00 H new ATOM 932 N ALA A 61 -13.192 9.286 -4.159 1.00 0.00 N ATOM 933 CA ALA A 61 -12.255 8.568 -3.305 1.00 0.00 C ATOM 934 C ALA A 61 -12.994 7.643 -2.343 1.00 0.00 C ATOM 935 O ALA A 61 -12.591 6.502 -2.127 1.00 0.00 O ATOM 936 CB ALA A 61 -11.391 9.555 -2.536 1.00 0.00 C ATOM 0 H ALA A 61 -13.183 10.298 -4.028 1.00 0.00 H new ATOM 0 HA ALA A 61 -11.613 7.953 -3.936 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.694 9.010 -1.900 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -10.833 10.175 -3.238 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -12.026 10.189 -1.917 1.00 0.00 H new ATOM 942 N PHE A 62 -14.095 8.146 -1.790 1.00 0.00 N ATOM 943 CA PHE A 62 -14.933 7.376 -0.884 1.00 0.00 C ATOM 944 C PHE A 62 -15.507 6.143 -1.576 1.00 0.00 C ATOM 945 O PHE A 62 -15.366 5.028 -1.082 1.00 0.00 O ATOM 946 CB PHE A 62 -16.070 8.250 -0.341 1.00 0.00 C ATOM 947 CG PHE A 62 -16.924 7.558 0.681 1.00 0.00 C ATOM 948 CD1 PHE A 62 -16.446 7.334 1.962 1.00 0.00 C ATOM 949 CD2 PHE A 62 -18.201 7.130 0.362 1.00 0.00 C ATOM 950 CE1 PHE A 62 -17.226 6.696 2.903 1.00 0.00 C ATOM 951 CE2 PHE A 62 -18.988 6.492 1.300 1.00 0.00 C ATOM 952 CZ PHE A 62 -18.498 6.273 2.572 1.00 0.00 C ATOM 0 H PHE A 62 -14.428 9.095 -1.958 1.00 0.00 H new ATOM 0 HA PHE A 62 -14.311 7.041 -0.054 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -15.645 9.150 0.102 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -16.699 8.570 -1.171 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -15.452 7.663 2.226 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -18.587 7.297 -0.633 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -16.842 6.527 3.898 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -19.984 6.165 1.039 1.00 0.00 H new ATOM 0 HZ PHE A 62 -19.109 5.771 3.308 1.00 0.00 H new ATOM 962 N GLU A 63 -16.127 6.357 -2.732 1.00 0.00 N ATOM 963 CA GLU A 63 -16.822 5.300 -3.463 1.00 0.00 C ATOM 964 C GLU A 63 -15.869 4.221 -3.967 1.00 0.00 C ATOM 965 O GLU A 63 -16.207 3.035 -3.953 1.00 0.00 O ATOM 966 CB GLU A 63 -17.580 5.907 -4.640 1.00 0.00 C ATOM 967 CG GLU A 63 -18.918 6.510 -4.250 1.00 0.00 C ATOM 968 CD GLU A 63 -20.072 5.907 -5.017 1.00 0.00 C ATOM 969 OE1 GLU A 63 -20.047 4.682 -5.274 1.00 0.00 O ATOM 970 OE2 GLU A 63 -21.006 6.652 -5.372 1.00 0.00 O ATOM 0 H GLU A 63 -16.163 7.268 -3.190 1.00 0.00 H new ATOM 0 HA GLU A 63 -17.517 4.824 -2.771 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -16.963 6.678 -5.101 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -17.743 5.137 -5.394 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -19.081 6.364 -3.182 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -18.893 7.586 -4.425 1.00 0.00 H new ATOM 977 N ASP A 64 -14.687 4.639 -4.412 1.00 0.00 N ATOM 978 CA ASP A 64 -13.683 3.717 -4.943 1.00 0.00 C ATOM 979 C ASP A 64 -13.135 2.809 -3.842 1.00 0.00 C ATOM 980 O ASP A 64 -12.970 1.604 -4.039 1.00 0.00 O ATOM 981 CB ASP A 64 -12.546 4.514 -5.603 1.00 0.00 C ATOM 982 CG ASP A 64 -11.296 3.692 -5.865 1.00 0.00 C ATOM 983 OD1 ASP A 64 -11.309 2.858 -6.796 1.00 0.00 O ATOM 984 OD2 ASP A 64 -10.294 3.890 -5.151 1.00 0.00 O ATOM 0 H ASP A 64 -14.398 5.617 -4.416 1.00 0.00 H new ATOM 0 HA ASP A 64 -14.155 3.081 -5.692 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -12.903 4.926 -6.547 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -12.288 5.358 -4.964 1.00 0.00 H new ATOM 989 N LYS A 65 -12.892 3.389 -2.672 1.00 0.00 N ATOM 990 CA LYS A 65 -12.305 2.656 -1.554 1.00 0.00 C ATOM 991 C LYS A 65 -13.356 1.868 -0.772 1.00 0.00 C ATOM 992 O LYS A 65 -13.017 0.985 0.018 1.00 0.00 O ATOM 993 CB LYS A 65 -11.588 3.624 -0.618 1.00 0.00 C ATOM 994 CG LYS A 65 -10.344 4.247 -1.222 1.00 0.00 C ATOM 995 CD LYS A 65 -9.884 5.446 -0.417 1.00 0.00 C ATOM 996 CE LYS A 65 -8.617 5.136 0.355 1.00 0.00 C ATOM 997 NZ LYS A 65 -8.879 4.950 1.806 1.00 0.00 N ATOM 0 H LYS A 65 -13.093 4.369 -2.472 1.00 0.00 H new ATOM 0 HA LYS A 65 -11.593 1.942 -1.967 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -12.278 4.417 -0.332 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -11.313 3.096 0.295 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -9.546 3.505 -1.263 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -10.549 4.552 -2.248 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -9.709 6.290 -1.085 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -10.671 5.746 0.276 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -8.158 4.233 -0.049 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -7.901 5.946 0.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -7.998 4.673 2.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -9.229 5.841 2.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -9.593 4.205 1.937 1.00 0.00 H new ATOM 1101 N ALA A 72 -10.902 -10.231 1.888 1.00 0.00 N ATOM 1102 CA ALA A 72 -9.674 -9.971 2.624 1.00 0.00 C ATOM 1103 C ALA A 72 -8.457 -10.285 1.765 1.00 0.00 C ATOM 1104 O ALA A 72 -8.416 -11.309 1.085 1.00 0.00 O ATOM 1105 CB ALA A 72 -9.641 -10.785 3.909 1.00 0.00 C ATOM 0 HA ALA A 72 -9.648 -8.913 2.883 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -8.716 -10.578 4.447 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -10.492 -10.514 4.534 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -9.691 -11.847 3.668 1.00 0.00 H new ATOM 1111 N ARG A 73 -7.480 -9.393 1.780 1.00 0.00 N ATOM 1112 CA ARG A 73 -6.250 -9.602 1.035 1.00 0.00 C ATOM 1113 C ARG A 73 -5.099 -9.890 1.987 1.00 0.00 C ATOM 1114 O ARG A 73 -4.683 -9.018 2.752 1.00 0.00 O ATOM 1115 CB ARG A 73 -5.927 -8.378 0.176 1.00 0.00 C ATOM 1116 CG ARG A 73 -5.823 -8.686 -1.307 1.00 0.00 C ATOM 1117 CD ARG A 73 -6.834 -7.887 -2.114 1.00 0.00 C ATOM 1118 NE ARG A 73 -6.372 -7.643 -3.481 1.00 0.00 N ATOM 1119 CZ ARG A 73 -5.852 -6.491 -3.906 1.00 0.00 C ATOM 1120 NH1 ARG A 73 -5.777 -5.439 -3.096 1.00 0.00 N ATOM 1121 NH2 ARG A 73 -5.419 -6.387 -5.154 1.00 0.00 N ATOM 0 H ARG A 73 -7.515 -8.517 2.301 1.00 0.00 H new ATOM 0 HA ARG A 73 -6.388 -10.461 0.378 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -6.699 -7.624 0.329 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -4.986 -7.945 0.515 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -4.816 -8.460 -1.657 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -5.985 -9.751 -1.471 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -7.782 -8.424 -2.142 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -7.022 -6.934 -1.619 1.00 0.00 H new ATOM 0 HE ARG A 73 -6.453 -8.405 -4.154 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -6.119 -5.508 -2.138 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -5.377 -4.563 -3.433 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -5.484 -7.186 -5.785 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -5.020 -5.508 -5.484 1.00 0.00 H new ATOM 1135 N VAL A 74 -4.595 -11.114 1.949 1.00 0.00 N ATOM 1136 CA VAL A 74 -3.482 -11.504 2.800 1.00 0.00 C ATOM 1137 C VAL A 74 -2.150 -11.186 2.122 1.00 0.00 C ATOM 1138 O VAL A 74 -2.046 -11.186 0.890 1.00 0.00 O ATOM 1139 CB VAL A 74 -3.537 -13.004 3.185 1.00 0.00 C ATOM 1140 CG1 VAL A 74 -4.826 -13.314 3.928 1.00 0.00 C ATOM 1141 CG2 VAL A 74 -3.396 -13.898 1.960 1.00 0.00 C ATOM 0 H VAL A 74 -4.939 -11.854 1.338 1.00 0.00 H new ATOM 0 HA VAL A 74 -3.566 -10.925 3.719 1.00 0.00 H new ATOM 0 HB VAL A 74 -2.694 -13.211 3.845 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -4.849 -14.372 4.191 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -4.876 -12.713 4.836 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -5.679 -13.080 3.291 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -3.439 -14.943 2.266 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -4.208 -13.690 1.263 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -2.441 -13.701 1.474 1.00 0.00 H new ATOM 1151 N THR A 75 -1.149 -10.879 2.931 1.00 0.00 N ATOM 1152 CA THR A 75 0.184 -10.569 2.435 1.00 0.00 C ATOM 1153 C THR A 75 1.237 -11.363 3.202 1.00 0.00 C ATOM 1154 O THR A 75 1.192 -11.443 4.430 1.00 0.00 O ATOM 1155 CB THR A 75 0.486 -9.059 2.556 1.00 0.00 C ATOM 1156 OG1 THR A 75 -0.739 -8.321 2.683 1.00 0.00 O ATOM 1157 CG2 THR A 75 1.257 -8.560 1.343 1.00 0.00 C ATOM 0 H THR A 75 -1.236 -10.837 3.946 1.00 0.00 H new ATOM 0 HA THR A 75 0.218 -10.848 1.382 1.00 0.00 H new ATOM 0 HB THR A 75 1.098 -8.906 3.445 1.00 0.00 H new ATOM 0 HG1 THR A 75 -0.538 -7.365 2.761 1.00 0.00 H new ATOM 0 HG21 THR A 75 1.457 -7.494 1.452 1.00 0.00 H new ATOM 0 HG22 THR A 75 2.200 -9.100 1.264 1.00 0.00 H new ATOM 0 HG23 THR A 75 0.666 -8.728 0.442 1.00 0.00 H new ATOM 1165 N ALA A 76 2.165 -11.967 2.469 1.00 0.00 N ATOM 1166 CA ALA A 76 3.221 -12.762 3.076 1.00 0.00 C ATOM 1167 C ALA A 76 4.522 -12.599 2.316 1.00 0.00 C ATOM 1168 O ALA A 76 4.513 -12.323 1.122 1.00 0.00 O ATOM 1169 CB ALA A 76 2.831 -14.229 3.105 1.00 0.00 C ATOM 0 H ALA A 76 2.206 -11.920 1.451 1.00 0.00 H new ATOM 0 HA ALA A 76 3.362 -12.408 4.097 1.00 0.00 H new ATOM 0 HB1 ALA A 76 3.632 -14.810 3.562 1.00 0.00 H new ATOM 0 HB2 ALA A 76 1.917 -14.351 3.686 1.00 0.00 H new ATOM 0 HB3 ALA A 76 2.663 -14.581 2.087 1.00 0.00 H new ATOM 1175 N VAL A 77 5.639 -12.763 3.011 1.00 0.00 N ATOM 1176 CA VAL A 77 6.940 -12.769 2.361 1.00 0.00 C ATOM 1177 C VAL A 77 7.147 -14.117 1.692 1.00 0.00 C ATOM 1178 O VAL A 77 7.269 -15.134 2.367 1.00 0.00 O ATOM 1179 CB VAL A 77 8.098 -12.510 3.355 1.00 0.00 C ATOM 1180 CG1 VAL A 77 9.421 -12.343 2.616 1.00 0.00 C ATOM 1181 CG2 VAL A 77 7.818 -11.288 4.215 1.00 0.00 C ATOM 0 H VAL A 77 5.670 -12.893 4.022 1.00 0.00 H new ATOM 0 HA VAL A 77 6.951 -11.961 1.629 1.00 0.00 H new ATOM 0 HB VAL A 77 8.173 -13.379 4.009 1.00 0.00 H new ATOM 0 HG11 VAL A 77 10.219 -12.162 3.336 1.00 0.00 H new ATOM 0 HG12 VAL A 77 9.640 -13.250 2.052 1.00 0.00 H new ATOM 0 HG13 VAL A 77 9.351 -11.498 1.931 1.00 0.00 H new ATOM 0 HG21 VAL A 77 8.648 -11.130 4.904 1.00 0.00 H new ATOM 0 HG22 VAL A 77 7.705 -10.412 3.576 1.00 0.00 H new ATOM 0 HG23 VAL A 77 6.901 -11.445 4.782 1.00 0.00 H new ATOM 1191 N LEU A 78 7.149 -14.113 0.366 1.00 0.00 N ATOM 1192 CA LEU A 78 7.264 -15.332 -0.420 1.00 0.00 C ATOM 1193 C LEU A 78 7.838 -15.003 -1.796 1.00 0.00 C ATOM 1194 O LEU A 78 7.613 -13.907 -2.312 1.00 0.00 O ATOM 1195 CB LEU A 78 5.892 -16.007 -0.567 1.00 0.00 C ATOM 1196 CG LEU A 78 5.664 -17.224 0.332 1.00 0.00 C ATOM 1197 CD1 LEU A 78 4.362 -17.086 1.102 1.00 0.00 C ATOM 1198 CD2 LEU A 78 5.665 -18.501 -0.490 1.00 0.00 C ATOM 0 H LEU A 78 7.071 -13.264 -0.194 1.00 0.00 H new ATOM 0 HA LEU A 78 7.934 -16.022 0.093 1.00 0.00 H new ATOM 0 HB2 LEU A 78 5.118 -15.269 -0.356 1.00 0.00 H new ATOM 0 HB3 LEU A 78 5.765 -16.314 -1.605 1.00 0.00 H new ATOM 0 HG LEU A 78 6.482 -17.276 1.051 1.00 0.00 H new ATOM 0 HD11 LEU A 78 4.219 -17.962 1.735 1.00 0.00 H new ATOM 0 HD12 LEU A 78 4.400 -16.191 1.723 1.00 0.00 H new ATOM 0 HD13 LEU A 78 3.531 -17.006 0.401 1.00 0.00 H new ATOM 0 HD21 LEU A 78 5.502 -19.356 0.166 1.00 0.00 H new ATOM 0 HD22 LEU A 78 4.869 -18.456 -1.233 1.00 0.00 H new ATOM 0 HD23 LEU A 78 6.626 -18.609 -0.994 1.00 0.00 H new ATOM 1210 N PRO A 79 8.602 -15.936 -2.399 1.00 0.00 N ATOM 1211 CA PRO A 79 9.238 -15.723 -3.705 1.00 0.00 C ATOM 1212 C PRO A 79 8.228 -15.484 -4.828 1.00 0.00 C ATOM 1213 O PRO A 79 7.137 -16.058 -4.839 1.00 0.00 O ATOM 1214 CB PRO A 79 10.012 -17.022 -3.956 1.00 0.00 C ATOM 1215 CG PRO A 79 10.138 -17.666 -2.620 1.00 0.00 C ATOM 1216 CD PRO A 79 8.918 -17.266 -1.853 1.00 0.00 C ATOM 0 HA PRO A 79 9.865 -14.832 -3.696 1.00 0.00 H new ATOM 0 HB2 PRO A 79 9.481 -17.668 -4.656 1.00 0.00 H new ATOM 0 HB3 PRO A 79 10.991 -16.819 -4.389 1.00 0.00 H new ATOM 0 HG2 PRO A 79 10.202 -18.750 -2.714 1.00 0.00 H new ATOM 0 HG3 PRO A 79 11.044 -17.336 -2.112 1.00 0.00 H new ATOM 0 HD2 PRO A 79 8.099 -17.969 -2.004 1.00 0.00 H new ATOM 0 HD3 PRO A 79 9.111 -17.226 -0.781 1.00 0.00 H new ATOM 1224 N GLU A 80 8.623 -14.647 -5.784 1.00 0.00 N ATOM 1225 CA GLU A 80 7.763 -14.259 -6.900 1.00 0.00 C ATOM 1226 C GLU A 80 7.488 -15.436 -7.842 1.00 0.00 C ATOM 1227 O GLU A 80 6.458 -15.476 -8.512 1.00 0.00 O ATOM 1228 CB GLU A 80 8.419 -13.108 -7.662 1.00 0.00 C ATOM 1229 CG GLU A 80 7.485 -12.380 -8.612 1.00 0.00 C ATOM 1230 CD GLU A 80 7.828 -12.642 -10.062 1.00 0.00 C ATOM 1231 OE1 GLU A 80 8.918 -12.224 -10.503 1.00 0.00 O ATOM 1232 OE2 GLU A 80 7.017 -13.281 -10.764 1.00 0.00 O ATOM 0 H GLU A 80 9.548 -14.218 -5.807 1.00 0.00 H new ATOM 0 HA GLU A 80 6.802 -13.937 -6.499 1.00 0.00 H new ATOM 0 HB2 GLU A 80 8.819 -12.392 -6.944 1.00 0.00 H new ATOM 0 HB3 GLU A 80 9.265 -13.497 -8.229 1.00 0.00 H new ATOM 0 HG2 GLU A 80 6.459 -12.693 -8.421 1.00 0.00 H new ATOM 0 HG3 GLU A 80 7.533 -11.309 -8.417 1.00 0.00 H new ATOM 1239 N HIS A 81 8.398 -16.406 -7.875 1.00 0.00 N ATOM 1240 CA HIS A 81 8.228 -17.577 -8.735 1.00 0.00 C ATOM 1241 C HIS A 81 7.079 -18.452 -8.239 1.00 0.00 C ATOM 1242 O HIS A 81 6.381 -19.083 -9.031 1.00 0.00 O ATOM 1243 CB HIS A 81 9.525 -18.386 -8.810 1.00 0.00 C ATOM 1244 CG HIS A 81 10.355 -18.052 -10.008 1.00 0.00 C ATOM 1245 ND1 HIS A 81 10.203 -18.673 -11.228 1.00 0.00 N ATOM 1246 CD2 HIS A 81 11.333 -17.133 -10.176 1.00 0.00 C ATOM 1247 CE1 HIS A 81 11.050 -18.150 -12.092 1.00 0.00 C ATOM 1248 NE2 HIS A 81 11.745 -17.213 -11.480 1.00 0.00 N ATOM 0 H HIS A 81 9.255 -16.407 -7.321 1.00 0.00 H new ATOM 0 HA HIS A 81 7.983 -17.227 -9.738 1.00 0.00 H new ATOM 0 HB2 HIS A 81 10.111 -18.207 -7.908 1.00 0.00 H new ATOM 0 HB3 HIS A 81 9.283 -19.449 -8.828 1.00 0.00 H new ATOM 0 HD2 HIS A 81 11.717 -16.461 -9.423 1.00 0.00 H new ATOM 0 HE1 HIS A 81 11.156 -18.441 -13.127 1.00 0.00 H new ATOM 0 HE2 HIS A 81 12.472 -16.640 -11.908 1.00 0.00 H new ATOM 1257 N GLN A 82 6.879 -18.462 -6.922 1.00 0.00 N ATOM 1258 CA GLN A 82 5.780 -19.199 -6.308 1.00 0.00 C ATOM 1259 C GLN A 82 4.437 -18.517 -6.567 1.00 0.00 C ATOM 1260 O GLN A 82 3.398 -19.175 -6.584 1.00 0.00 O ATOM 1261 CB GLN A 82 6.018 -19.355 -4.808 1.00 0.00 C ATOM 1262 CG GLN A 82 6.244 -20.797 -4.392 1.00 0.00 C ATOM 1263 CD GLN A 82 7.189 -20.932 -3.219 1.00 0.00 C ATOM 1264 OE1 GLN A 82 8.361 -20.562 -3.294 1.00 0.00 O ATOM 1265 NE2 GLN A 82 6.688 -21.476 -2.127 1.00 0.00 N ATOM 0 H GLN A 82 7.470 -17.963 -6.257 1.00 0.00 H new ATOM 0 HA GLN A 82 5.744 -20.188 -6.765 1.00 0.00 H new ATOM 0 HB2 GLN A 82 6.884 -18.759 -4.519 1.00 0.00 H new ATOM 0 HB3 GLN A 82 5.161 -18.956 -4.266 1.00 0.00 H new ATOM 0 HG2 GLN A 82 5.286 -21.249 -4.134 1.00 0.00 H new ATOM 0 HG3 GLN A 82 6.643 -21.356 -5.239 1.00 0.00 H new ATOM 0 HE21 GLN A 82 5.711 -21.769 -2.105 1.00 0.00 H new ATOM 0 HE22 GLN A 82 7.277 -21.603 -1.304 1.00 0.00 H new ATOM 1274 N ALA A 83 4.474 -17.196 -6.781 1.00 0.00 N ATOM 1275 CA ALA A 83 3.270 -16.391 -7.033 1.00 0.00 C ATOM 1276 C ALA A 83 2.506 -16.868 -8.271 1.00 0.00 C ATOM 1277 O ALA A 83 1.320 -16.574 -8.423 1.00 0.00 O ATOM 1278 CB ALA A 83 3.621 -14.917 -7.164 1.00 0.00 C ATOM 0 H ALA A 83 5.338 -16.654 -6.785 1.00 0.00 H new ATOM 0 HA ALA A 83 2.614 -16.522 -6.172 1.00 0.00 H new ATOM 0 HB1 ALA A 83 2.714 -14.342 -7.350 1.00 0.00 H new ATOM 0 HB2 ALA A 83 4.087 -14.571 -6.242 1.00 0.00 H new ATOM 0 HB3 ALA A 83 4.314 -14.780 -7.994 1.00 0.00 H new ATOM 1284 N TYR A 84 3.210 -17.573 -9.162 1.00 0.00 N ATOM 1285 CA TYR A 84 2.599 -18.214 -10.327 1.00 0.00 C ATOM 1286 C TYR A 84 1.417 -19.090 -9.904 1.00 0.00 C ATOM 1287 O TYR A 84 0.332 -19.015 -10.483 1.00 0.00 O ATOM 1288 CB TYR A 84 3.663 -19.062 -11.048 1.00 0.00 C ATOM 1289 CG TYR A 84 3.126 -20.005 -12.110 1.00 0.00 C ATOM 1290 CD1 TYR A 84 2.918 -19.566 -13.412 1.00 0.00 C ATOM 1291 CD2 TYR A 84 2.843 -21.337 -11.814 1.00 0.00 C ATOM 1292 CE1 TYR A 84 2.441 -20.423 -14.383 1.00 0.00 C ATOM 1293 CE2 TYR A 84 2.364 -22.195 -12.782 1.00 0.00 C ATOM 1294 CZ TYR A 84 2.167 -21.734 -14.063 1.00 0.00 C ATOM 1295 OH TYR A 84 1.694 -22.586 -15.031 1.00 0.00 O ATOM 0 H TYR A 84 4.218 -17.714 -9.095 1.00 0.00 H new ATOM 0 HA TYR A 84 2.222 -17.447 -11.004 1.00 0.00 H new ATOM 0 HB2 TYR A 84 4.386 -18.391 -11.512 1.00 0.00 H new ATOM 0 HB3 TYR A 84 4.203 -19.648 -10.304 1.00 0.00 H new ATOM 0 HD1 TYR A 84 3.133 -18.539 -13.668 1.00 0.00 H new ATOM 0 HD2 TYR A 84 3.001 -21.703 -10.810 1.00 0.00 H new ATOM 0 HE1 TYR A 84 2.283 -20.067 -15.390 1.00 0.00 H new ATOM 0 HE2 TYR A 84 2.145 -23.223 -12.535 1.00 0.00 H new ATOM 0 HH TYR A 84 1.552 -23.475 -14.644 1.00 0.00 H new ATOM 1305 N ILE A 85 1.633 -19.900 -8.873 1.00 0.00 N ATOM 1306 CA ILE A 85 0.610 -20.813 -8.388 1.00 0.00 C ATOM 1307 C ILE A 85 -0.339 -20.109 -7.431 1.00 0.00 C ATOM 1308 O ILE A 85 -1.506 -20.481 -7.310 1.00 0.00 O ATOM 1309 CB ILE A 85 1.211 -22.046 -7.678 1.00 0.00 C ATOM 1310 CG1 ILE A 85 2.652 -22.311 -8.131 1.00 0.00 C ATOM 1311 CG2 ILE A 85 0.341 -23.257 -7.945 1.00 0.00 C ATOM 1312 CD1 ILE A 85 3.624 -22.484 -6.983 1.00 0.00 C ATOM 0 H ILE A 85 2.512 -19.941 -8.357 1.00 0.00 H new ATOM 0 HA ILE A 85 0.064 -21.154 -9.268 1.00 0.00 H new ATOM 0 HB ILE A 85 1.238 -21.846 -6.607 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.671 -23.208 -8.751 1.00 0.00 H new ATOM 0 HG13 ILE A 85 2.985 -21.484 -8.757 1.00 0.00 H new ATOM 0 HG21 ILE A 85 0.765 -24.127 -7.444 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -0.664 -23.074 -7.565 1.00 0.00 H new ATOM 0 HG23 ILE A 85 0.295 -23.443 -9.018 1.00 0.00 H new ATOM 0 HD11 ILE A 85 4.623 -22.668 -7.377 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.634 -21.579 -6.376 1.00 0.00 H new ATOM 0 HD13 ILE A 85 3.315 -23.330 -6.369 1.00 0.00 H new ATOM 1324 N VAL A 86 0.166 -19.077 -6.767 1.00 0.00 N ATOM 1325 CA VAL A 86 -0.633 -18.303 -5.823 1.00 0.00 C ATOM 1326 C VAL A 86 -1.765 -17.564 -6.544 1.00 0.00 C ATOM 1327 O VAL A 86 -2.834 -17.348 -5.975 1.00 0.00 O ATOM 1328 CB VAL A 86 0.242 -17.303 -5.025 1.00 0.00 C ATOM 1329 CG1 VAL A 86 -0.591 -16.530 -4.013 1.00 0.00 C ATOM 1330 CG2 VAL A 86 1.377 -18.030 -4.321 1.00 0.00 C ATOM 0 H VAL A 86 1.129 -18.755 -6.865 1.00 0.00 H new ATOM 0 HA VAL A 86 -1.072 -19.005 -5.114 1.00 0.00 H new ATOM 0 HB VAL A 86 0.665 -16.591 -5.734 1.00 0.00 H new ATOM 0 HG11 VAL A 86 0.050 -15.836 -3.468 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -1.370 -15.972 -4.533 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -1.050 -17.227 -3.312 1.00 0.00 H new ATOM 0 HG21 VAL A 86 1.980 -17.312 -3.766 1.00 0.00 H new ATOM 0 HG22 VAL A 86 0.965 -18.767 -3.632 1.00 0.00 H new ATOM 0 HG23 VAL A 86 2.000 -18.533 -5.060 1.00 0.00 H new ATOM 1340 N ARG A 87 -1.531 -17.193 -7.803 1.00 0.00 N ATOM 1341 CA ARG A 87 -2.557 -16.541 -8.621 1.00 0.00 C ATOM 1342 C ARG A 87 -3.743 -17.477 -8.866 1.00 0.00 C ATOM 1343 O ARG A 87 -4.877 -17.025 -9.028 1.00 0.00 O ATOM 1344 CB ARG A 87 -1.969 -16.086 -9.960 1.00 0.00 C ATOM 1345 CG ARG A 87 -1.512 -14.632 -9.967 1.00 0.00 C ATOM 1346 CD ARG A 87 -2.667 -13.668 -9.717 1.00 0.00 C ATOM 1347 NE ARG A 87 -3.478 -13.443 -10.916 1.00 0.00 N ATOM 1348 CZ ARG A 87 -3.251 -12.474 -11.807 1.00 0.00 C ATOM 1349 NH1 ARG A 87 -2.267 -11.600 -11.629 1.00 0.00 N ATOM 1350 NH2 ARG A 87 -4.033 -12.367 -12.870 1.00 0.00 N ATOM 0 H ARG A 87 -0.640 -17.332 -8.280 1.00 0.00 H new ATOM 0 HA ARG A 87 -2.913 -15.668 -8.074 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -1.122 -16.725 -10.210 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -2.716 -16.226 -10.741 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -0.748 -14.489 -9.203 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -1.049 -14.402 -10.927 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -3.300 -14.063 -8.923 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -2.271 -12.715 -9.366 1.00 0.00 H new ATOM 0 HE ARG A 87 -4.268 -14.067 -11.081 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -1.672 -11.663 -10.803 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -2.106 -10.866 -12.318 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -4.803 -13.022 -13.005 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -3.865 -11.629 -13.554 1.00 0.00 H new ATOM 1364 N LYS A 88 -3.477 -18.781 -8.883 1.00 0.00 N ATOM 1365 CA LYS A 88 -4.526 -19.786 -9.037 1.00 0.00 C ATOM 1366 C LYS A 88 -5.271 -19.974 -7.720 1.00 0.00 C ATOM 1367 O LYS A 88 -6.494 -20.133 -7.697 1.00 0.00 O ATOM 1368 CB LYS A 88 -3.936 -21.129 -9.484 1.00 0.00 C ATOM 1369 CG LYS A 88 -2.882 -21.016 -10.572 1.00 0.00 C ATOM 1370 CD LYS A 88 -3.018 -22.129 -11.594 1.00 0.00 C ATOM 1371 CE LYS A 88 -3.586 -21.610 -12.903 1.00 0.00 C ATOM 1372 NZ LYS A 88 -4.899 -22.227 -13.223 1.00 0.00 N ATOM 0 H LYS A 88 -2.538 -19.168 -8.791 1.00 0.00 H new ATOM 0 HA LYS A 88 -5.219 -19.435 -9.802 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -3.497 -21.626 -8.619 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -4.744 -21.767 -9.842 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -2.973 -20.050 -11.069 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -1.889 -21.051 -10.124 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -2.043 -22.583 -11.773 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -3.666 -22.911 -11.199 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -3.698 -20.527 -12.846 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -2.883 -21.815 -13.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -5.252 -21.845 -14.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -4.788 -23.258 -13.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -5.578 -22.010 -12.466 1.00 0.00 H new ATOM 1386 N TRP A 89 -4.522 -19.935 -6.622 1.00 0.00 N ATOM 1387 CA TRP A 89 -5.089 -20.105 -5.287 1.00 0.00 C ATOM 1388 C TRP A 89 -5.895 -18.877 -4.874 1.00 0.00 C ATOM 1389 O TRP A 89 -6.789 -18.971 -4.035 1.00 0.00 O ATOM 1390 CB TRP A 89 -3.980 -20.377 -4.268 1.00 0.00 C ATOM 1391 CG TRP A 89 -3.235 -21.652 -4.521 1.00 0.00 C ATOM 1392 CD1 TRP A 89 -3.714 -22.777 -5.132 1.00 0.00 C ATOM 1393 CD2 TRP A 89 -1.875 -21.936 -4.171 1.00 0.00 C ATOM 1394 NE1 TRP A 89 -2.737 -23.738 -5.184 1.00 0.00 N ATOM 1395 CE2 TRP A 89 -1.599 -23.248 -4.601 1.00 0.00 C ATOM 1396 CE3 TRP A 89 -0.864 -21.209 -3.537 1.00 0.00 C ATOM 1397 CZ2 TRP A 89 -0.356 -23.846 -4.417 1.00 0.00 C ATOM 1398 CZ3 TRP A 89 0.371 -21.804 -3.357 1.00 0.00 C ATOM 1399 CH2 TRP A 89 0.615 -23.111 -3.795 1.00 0.00 C ATOM 0 H TRP A 89 -3.513 -19.786 -6.631 1.00 0.00 H new ATOM 0 HA TRP A 89 -5.763 -20.962 -5.313 1.00 0.00 H new ATOM 0 HB2 TRP A 89 -3.275 -19.545 -4.279 1.00 0.00 H new ATOM 0 HB3 TRP A 89 -4.416 -20.412 -3.269 1.00 0.00 H new ATOM 0 HD1 TRP A 89 -4.716 -22.892 -5.518 1.00 0.00 H new ATOM 0 HE1 TRP A 89 -2.841 -24.667 -5.591 1.00 0.00 H new ATOM 0 HE3 TRP A 89 -1.044 -20.201 -3.194 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 -0.165 -24.854 -4.753 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 1.161 -21.251 -2.870 1.00 0.00 H new ATOM 0 HH2 TRP A 89 1.590 -23.548 -3.638 1.00 0.00 H new ATOM 1410 N GLU A 90 -5.572 -17.734 -5.474 1.00 0.00 N ATOM 1411 CA GLU A 90 -6.311 -16.496 -5.245 1.00 0.00 C ATOM 1412 C GLU A 90 -7.697 -16.577 -5.883 1.00 0.00 C ATOM 1413 O GLU A 90 -8.685 -16.104 -5.317 1.00 0.00 O ATOM 1414 CB GLU A 90 -5.534 -15.309 -5.818 1.00 0.00 C ATOM 1415 CG GLU A 90 -6.155 -13.959 -5.499 1.00 0.00 C ATOM 1416 CD GLU A 90 -5.329 -12.791 -5.998 1.00 0.00 C ATOM 1417 OE1 GLU A 90 -4.676 -12.924 -7.054 1.00 0.00 O ATOM 1418 OE2 GLU A 90 -5.332 -11.733 -5.340 1.00 0.00 O ATOM 0 H GLU A 90 -4.795 -17.640 -6.129 1.00 0.00 H new ATOM 0 HA GLU A 90 -6.432 -16.354 -4.171 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -4.516 -15.331 -5.429 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -5.465 -15.420 -6.900 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -7.149 -13.909 -5.943 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -6.283 -13.871 -4.420 1.00 0.00 H new ATOM 1425 N ALA A 91 -7.758 -17.192 -7.062 1.00 0.00 N ATOM 1426 CA ALA A 91 -9.021 -17.400 -7.761 1.00 0.00 C ATOM 1427 C ALA A 91 -9.875 -18.425 -7.022 1.00 0.00 C ATOM 1428 O ALA A 91 -11.097 -18.294 -6.940 1.00 0.00 O ATOM 1429 CB ALA A 91 -8.761 -17.848 -9.191 1.00 0.00 C ATOM 0 H ALA A 91 -6.942 -17.556 -7.554 1.00 0.00 H new ATOM 0 HA ALA A 91 -9.567 -16.457 -7.788 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -9.711 -18.000 -9.703 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -8.186 -17.083 -9.713 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -8.199 -18.782 -9.183 1.00 0.00 H new ATOM 1435 N ASP A 92 -9.211 -19.433 -6.464 1.00 0.00 N ATOM 1436 CA ASP A 92 -9.878 -20.457 -5.663 1.00 0.00 C ATOM 1437 C ASP A 92 -10.415 -19.871 -4.358 1.00 0.00 C ATOM 1438 O ASP A 92 -11.497 -20.240 -3.906 1.00 0.00 O ATOM 1439 CB ASP A 92 -8.912 -21.608 -5.366 1.00 0.00 C ATOM 1440 CG ASP A 92 -9.558 -22.724 -4.565 1.00 0.00 C ATOM 1441 OD1 ASP A 92 -10.571 -23.290 -5.027 1.00 0.00 O ATOM 1442 OD2 ASP A 92 -9.051 -23.040 -3.470 1.00 0.00 O ATOM 0 H ASP A 92 -8.203 -19.564 -6.553 1.00 0.00 H new ATOM 0 HA ASP A 92 -10.722 -20.839 -6.237 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -8.535 -22.012 -6.306 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -8.053 -21.223 -4.817 1.00 0.00 H new ATOM 1447 N ALA A 93 -9.666 -18.944 -3.765 1.00 0.00 N ATOM 1448 CA ALA A 93 -10.087 -18.287 -2.534 1.00 0.00 C ATOM 1449 C ALA A 93 -11.253 -17.337 -2.792 1.00 0.00 C ATOM 1450 O ALA A 93 -12.107 -17.142 -1.927 1.00 0.00 O ATOM 1451 CB ALA A 93 -8.927 -17.544 -1.899 1.00 0.00 C ATOM 0 H ALA A 93 -8.762 -18.632 -4.120 1.00 0.00 H new ATOM 0 HA ALA A 93 -10.424 -19.058 -1.841 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -9.263 -17.061 -0.982 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -8.128 -18.248 -1.667 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -8.556 -16.789 -2.592 1.00 0.00 H new ATOM 1457 N LYS A 94 -11.286 -16.757 -3.990 1.00 0.00 N ATOM 1458 CA LYS A 94 -12.410 -15.930 -4.415 1.00 0.00 C ATOM 1459 C LYS A 94 -13.672 -16.780 -4.521 1.00 0.00 C ATOM 1460 O LYS A 94 -14.753 -16.361 -4.117 1.00 0.00 O ATOM 1461 CB LYS A 94 -12.104 -15.276 -5.763 1.00 0.00 C ATOM 1462 CG LYS A 94 -12.707 -13.890 -5.923 1.00 0.00 C ATOM 1463 CD LYS A 94 -13.390 -13.732 -7.270 1.00 0.00 C ATOM 1464 CE LYS A 94 -14.885 -13.981 -7.169 1.00 0.00 C ATOM 1465 NZ LYS A 94 -15.660 -12.715 -7.081 1.00 0.00 N ATOM 0 H LYS A 94 -10.544 -16.846 -4.684 1.00 0.00 H new ATOM 0 HA LYS A 94 -12.571 -15.147 -3.674 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -11.023 -15.208 -5.886 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -12.476 -15.918 -6.561 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -13.428 -13.712 -5.125 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -11.925 -13.138 -5.820 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -13.213 -12.727 -7.653 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -12.952 -14.428 -7.985 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -15.217 -14.549 -8.038 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -15.091 -14.593 -6.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -16.675 -12.933 -7.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -15.363 -12.184 -6.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -15.485 -12.141 -7.930 1.00 0.00 H new ATOM 1479 N LYS A 95 -13.507 -17.992 -5.041 1.00 0.00 N ATOM 1480 CA LYS A 95 -14.605 -18.945 -5.170 1.00 0.00 C ATOM 1481 C LYS A 95 -14.922 -19.622 -3.834 1.00 0.00 C ATOM 1482 O LYS A 95 -15.898 -20.352 -3.719 1.00 0.00 O ATOM 1483 CB LYS A 95 -14.266 -19.999 -6.220 1.00 0.00 C ATOM 1484 CG LYS A 95 -15.233 -20.017 -7.392 1.00 0.00 C ATOM 1485 CD LYS A 95 -16.374 -21.000 -7.169 1.00 0.00 C ATOM 1486 CE LYS A 95 -15.900 -22.440 -7.270 1.00 0.00 C ATOM 1487 NZ LYS A 95 -15.249 -22.726 -8.577 1.00 0.00 N ATOM 0 H LYS A 95 -12.612 -18.341 -5.384 1.00 0.00 H new ATOM 0 HA LYS A 95 -15.490 -18.392 -5.485 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -13.258 -19.818 -6.593 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -14.260 -20.982 -5.749 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -15.639 -19.017 -7.543 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -14.696 -20.284 -8.302 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -16.815 -20.830 -6.187 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -17.158 -20.822 -7.905 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -15.197 -22.647 -6.463 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -16.748 -23.111 -7.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -15.248 -23.752 -8.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -15.774 -22.250 -9.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -14.270 -22.377 -8.561 1.00 0.00 H new ATOM 1680 N ARG B 4 26.459 9.422 -7.966 1.00 0.00 N ATOM 1681 CA ARG B 4 25.468 9.919 -8.890 1.00 0.00 C ATOM 1682 C ARG B 4 24.518 8.801 -9.262 1.00 0.00 C ATOM 1683 O ARG B 4 24.770 7.633 -8.945 1.00 0.00 O ATOM 1684 CB ARG B 4 26.136 10.506 -10.135 1.00 0.00 C ATOM 1685 CG ARG B 4 27.198 11.544 -9.817 1.00 0.00 C ATOM 1686 CD ARG B 4 28.429 11.361 -10.679 1.00 0.00 C ATOM 1687 NE ARG B 4 28.673 12.517 -11.539 1.00 0.00 N ATOM 1688 CZ ARG B 4 29.868 12.848 -12.023 1.00 0.00 C ATOM 1689 NH1 ARG B 4 30.938 12.124 -11.718 1.00 0.00 N ATOM 1690 NH2 ARG B 4 29.996 13.907 -12.812 1.00 0.00 N ATOM 0 HA ARG B 4 24.902 10.718 -8.411 1.00 0.00 H new ATOM 0 HB2 ARG B 4 26.589 9.698 -10.710 1.00 0.00 H new ATOM 0 HB3 ARG B 4 25.373 10.960 -10.768 1.00 0.00 H new ATOM 0 HG2 ARG B 4 26.790 12.543 -9.971 1.00 0.00 H new ATOM 0 HG3 ARG B 4 27.475 11.472 -8.765 1.00 0.00 H new ATOM 0 HD2 ARG B 4 29.297 11.195 -10.041 1.00 0.00 H new ATOM 0 HD3 ARG B 4 28.311 10.470 -11.295 1.00 0.00 H new ATOM 0 HE ARG B 4 27.878 13.107 -11.784 1.00 0.00 H new ATOM 0 HH11 ARG B 4 30.847 11.310 -11.110 1.00 0.00 H new ATOM 0 HH12 ARG B 4 31.852 12.382 -12.091 1.00 0.00 H new ATOM 0 HH21 ARG B 4 29.178 14.469 -13.048 1.00 0.00 H new ATOM 0 HH22 ARG B 4 30.912 14.159 -13.182 1.00 0.00 H new ATOM 1704 N LEU B 5 23.444 9.145 -9.939 1.00 0.00 N ATOM 1705 CA LEU B 5 22.381 8.193 -10.189 1.00 0.00 C ATOM 1706 C LEU B 5 22.018 8.100 -11.660 1.00 0.00 C ATOM 1707 O LEU B 5 22.510 8.862 -12.490 1.00 0.00 O ATOM 1708 CB LEU B 5 21.149 8.582 -9.382 1.00 0.00 C ATOM 1709 CG LEU B 5 20.822 7.646 -8.227 1.00 0.00 C ATOM 1710 CD1 LEU B 5 19.901 8.335 -7.249 1.00 0.00 C ATOM 1711 CD2 LEU B 5 20.189 6.371 -8.743 1.00 0.00 C ATOM 0 H LEU B 5 23.283 10.075 -10.326 1.00 0.00 H new ATOM 0 HA LEU B 5 22.743 7.212 -9.882 1.00 0.00 H new ATOM 0 HB2 LEU B 5 21.293 9.588 -8.987 1.00 0.00 H new ATOM 0 HB3 LEU B 5 20.291 8.623 -10.052 1.00 0.00 H new ATOM 0 HG LEU B 5 21.747 7.385 -7.713 1.00 0.00 H new ATOM 0 HD11 LEU B 5 19.672 7.658 -6.426 1.00 0.00 H new ATOM 0 HD12 LEU B 5 20.387 9.229 -6.859 1.00 0.00 H new ATOM 0 HD13 LEU B 5 18.977 8.616 -7.755 1.00 0.00 H new ATOM 0 HD21 LEU B 5 19.961 5.713 -7.905 1.00 0.00 H new ATOM 0 HD22 LEU B 5 19.269 6.611 -9.276 1.00 0.00 H new ATOM 0 HD23 LEU B 5 20.880 5.870 -9.420 1.00 0.00 H new ATOM 1723 N THR B 6 21.164 7.140 -11.955 1.00 0.00 N ATOM 1724 CA THR B 6 20.586 6.976 -13.270 1.00 0.00 C ATOM 1725 C THR B 6 19.192 7.589 -13.279 1.00 0.00 C ATOM 1726 O THR B 6 18.564 7.699 -12.224 1.00 0.00 O ATOM 1727 CB THR B 6 20.475 5.485 -13.619 1.00 0.00 C ATOM 1728 OG1 THR B 6 20.113 4.752 -12.436 1.00 0.00 O ATOM 1729 CG2 THR B 6 21.789 4.953 -14.173 1.00 0.00 C ATOM 0 H THR B 6 20.849 6.444 -11.278 1.00 0.00 H new ATOM 0 HA THR B 6 21.224 7.470 -14.003 1.00 0.00 H new ATOM 0 HB THR B 6 19.711 5.360 -14.386 1.00 0.00 H new ATOM 0 HG1 THR B 6 20.039 3.799 -12.652 1.00 0.00 H new ATOM 0 HG21 THR B 6 21.681 3.895 -14.412 1.00 0.00 H new ATOM 0 HG22 THR B 6 22.053 5.504 -15.076 1.00 0.00 H new ATOM 0 HG23 THR B 6 22.575 5.079 -13.429 1.00 0.00 H new ATOM 1737 N GLU B 7 18.707 7.982 -14.450 1.00 0.00 N ATOM 1738 CA GLU B 7 17.355 8.529 -14.574 1.00 0.00 C ATOM 1739 C GLU B 7 16.307 7.454 -14.287 1.00 0.00 C ATOM 1740 O GLU B 7 15.178 7.760 -13.893 1.00 0.00 O ATOM 1741 CB GLU B 7 17.129 9.112 -15.972 1.00 0.00 C ATOM 1742 CG GLU B 7 18.281 9.961 -16.483 1.00 0.00 C ATOM 1743 CD GLU B 7 19.096 9.248 -17.539 1.00 0.00 C ATOM 1744 OE1 GLU B 7 19.692 8.196 -17.223 1.00 0.00 O ATOM 1745 OE2 GLU B 7 19.138 9.725 -18.689 1.00 0.00 O ATOM 0 H GLU B 7 19.225 7.934 -15.327 1.00 0.00 H new ATOM 0 HA GLU B 7 17.251 9.328 -13.840 1.00 0.00 H new ATOM 0 HB2 GLU B 7 16.956 8.294 -16.672 1.00 0.00 H new ATOM 0 HB3 GLU B 7 16.223 9.718 -15.959 1.00 0.00 H new ATOM 0 HG2 GLU B 7 17.889 10.890 -16.896 1.00 0.00 H new ATOM 0 HG3 GLU B 7 18.928 10.231 -15.649 1.00 0.00 H new ATOM 1752 N SER B 8 16.702 6.199 -14.478 1.00 0.00 N ATOM 1753 CA SER B 8 15.829 5.056 -14.261 1.00 0.00 C ATOM 1754 C SER B 8 15.496 4.884 -12.777 1.00 0.00 C ATOM 1755 O SER B 8 14.327 4.781 -12.402 1.00 0.00 O ATOM 1756 CB SER B 8 16.510 3.801 -14.803 1.00 0.00 C ATOM 1757 OG SER B 8 17.790 4.115 -15.337 1.00 0.00 O ATOM 0 H SER B 8 17.640 5.948 -14.789 1.00 0.00 H new ATOM 0 HA SER B 8 14.890 5.224 -14.789 1.00 0.00 H new ATOM 0 HB2 SER B 8 16.613 3.064 -14.006 1.00 0.00 H new ATOM 0 HB3 SER B 8 15.889 3.349 -15.576 1.00 0.00 H new ATOM 0 HG SER B 8 18.212 3.299 -15.678 1.00 0.00 H new ATOM 1763 N GLN B 9 16.525 4.888 -11.931 1.00 0.00 N ATOM 1764 CA GLN B 9 16.333 4.711 -10.495 1.00 0.00 C ATOM 1765 C GLN B 9 15.837 6.004 -9.857 1.00 0.00 C ATOM 1766 O GLN B 9 15.225 5.988 -8.788 1.00 0.00 O ATOM 1767 CB GLN B 9 17.632 4.261 -9.826 1.00 0.00 C ATOM 1768 CG GLN B 9 18.004 2.811 -10.100 1.00 0.00 C ATOM 1769 CD GLN B 9 16.912 1.833 -9.706 1.00 0.00 C ATOM 1770 OE1 GLN B 9 16.234 2.004 -8.692 1.00 0.00 O ATOM 1771 NE2 GLN B 9 16.739 0.796 -10.505 1.00 0.00 N ATOM 0 H GLN B 9 17.497 5.012 -12.215 1.00 0.00 H new ATOM 0 HA GLN B 9 15.580 3.936 -10.348 1.00 0.00 H new ATOM 0 HB2 GLN B 9 18.444 4.903 -10.166 1.00 0.00 H new ATOM 0 HB3 GLN B 9 17.542 4.404 -8.749 1.00 0.00 H new ATOM 0 HG2 GLN B 9 18.224 2.693 -11.161 1.00 0.00 H new ATOM 0 HG3 GLN B 9 18.916 2.567 -9.556 1.00 0.00 H new ATOM 0 HE21 GLN B 9 17.321 0.690 -11.336 1.00 0.00 H new ATOM 0 HE22 GLN B 9 16.023 0.101 -10.291 1.00 0.00 H new ATOM 1780 N PHE B 10 16.111 7.123 -10.527 1.00 0.00 N ATOM 1781 CA PHE B 10 15.626 8.433 -10.103 1.00 0.00 C ATOM 1782 C PHE B 10 14.100 8.471 -10.128 1.00 0.00 C ATOM 1783 O PHE B 10 13.468 9.055 -9.244 1.00 0.00 O ATOM 1784 CB PHE B 10 16.204 9.511 -11.028 1.00 0.00 C ATOM 1785 CG PHE B 10 15.772 10.913 -10.707 1.00 0.00 C ATOM 1786 CD1 PHE B 10 16.193 11.538 -9.545 1.00 0.00 C ATOM 1787 CD2 PHE B 10 14.957 11.615 -11.583 1.00 0.00 C ATOM 1788 CE1 PHE B 10 15.810 12.833 -9.261 1.00 0.00 C ATOM 1789 CE2 PHE B 10 14.569 12.909 -11.302 1.00 0.00 C ATOM 1790 CZ PHE B 10 14.996 13.517 -10.139 1.00 0.00 C ATOM 0 H PHE B 10 16.674 7.145 -11.377 1.00 0.00 H new ATOM 0 HA PHE B 10 15.952 8.623 -9.081 1.00 0.00 H new ATOM 0 HB2 PHE B 10 17.292 9.462 -10.985 1.00 0.00 H new ATOM 0 HB3 PHE B 10 15.915 9.283 -12.054 1.00 0.00 H new ATOM 0 HD1 PHE B 10 16.829 11.006 -8.853 1.00 0.00 H new ATOM 0 HD2 PHE B 10 14.622 11.143 -12.495 1.00 0.00 H new ATOM 0 HE1 PHE B 10 16.147 13.310 -8.353 1.00 0.00 H new ATOM 0 HE2 PHE B 10 13.933 13.445 -11.991 1.00 0.00 H new ATOM 0 HZ PHE B 10 14.692 14.529 -9.916 1.00 0.00 H new ATOM 1800 N GLN B 11 13.520 7.823 -11.137 1.00 0.00 N ATOM 1801 CA GLN B 11 12.076 7.752 -11.284 1.00 0.00 C ATOM 1802 C GLN B 11 11.458 6.965 -10.140 1.00 0.00 C ATOM 1803 O GLN B 11 10.476 7.396 -9.546 1.00 0.00 O ATOM 1804 CB GLN B 11 11.713 7.092 -12.615 1.00 0.00 C ATOM 1805 CG GLN B 11 11.293 8.069 -13.700 1.00 0.00 C ATOM 1806 CD GLN B 11 10.350 9.152 -13.206 1.00 0.00 C ATOM 1807 OE1 GLN B 11 10.609 10.344 -13.386 1.00 0.00 O ATOM 1808 NE2 GLN B 11 9.249 8.751 -12.587 1.00 0.00 N ATOM 0 H GLN B 11 14.038 7.337 -11.869 1.00 0.00 H new ATOM 0 HA GLN B 11 11.681 8.768 -11.265 1.00 0.00 H new ATOM 0 HB2 GLN B 11 12.570 6.519 -12.969 1.00 0.00 H new ATOM 0 HB3 GLN B 11 10.903 6.383 -12.447 1.00 0.00 H new ATOM 0 HG2 GLN B 11 12.183 8.537 -14.121 1.00 0.00 H new ATOM 0 HG3 GLN B 11 10.810 7.518 -14.507 1.00 0.00 H new ATOM 0 HE21 GLN B 11 9.071 7.755 -12.458 1.00 0.00 H new ATOM 0 HE22 GLN B 11 8.580 9.438 -12.240 1.00 0.00 H new ATOM 1817 N GLU B 12 12.059 5.818 -9.829 1.00 0.00 N ATOM 1818 CA GLU B 12 11.592 4.959 -8.752 1.00 0.00 C ATOM 1819 C GLU B 12 11.680 5.656 -7.397 1.00 0.00 C ATOM 1820 O GLU B 12 10.826 5.450 -6.533 1.00 0.00 O ATOM 1821 CB GLU B 12 12.405 3.671 -8.728 1.00 0.00 C ATOM 1822 CG GLU B 12 11.623 2.476 -9.231 1.00 0.00 C ATOM 1823 CD GLU B 12 11.696 2.318 -10.733 1.00 0.00 C ATOM 1824 OE1 GLU B 12 12.677 1.730 -11.227 1.00 0.00 O ATOM 1825 OE2 GLU B 12 10.763 2.772 -11.427 1.00 0.00 O ATOM 0 H GLU B 12 12.881 5.462 -10.317 1.00 0.00 H new ATOM 0 HA GLU B 12 10.544 4.727 -8.939 1.00 0.00 H new ATOM 0 HB2 GLU B 12 13.298 3.799 -9.339 1.00 0.00 H new ATOM 0 HB3 GLU B 12 12.741 3.477 -7.709 1.00 0.00 H new ATOM 0 HG2 GLU B 12 12.004 1.572 -8.756 1.00 0.00 H new ATOM 0 HG3 GLU B 12 10.580 2.578 -8.931 1.00 0.00 H new ATOM 1832 N ALA B 13 12.705 6.483 -7.225 1.00 0.00 N ATOM 1833 CA ALA B 13 12.907 7.212 -5.984 1.00 0.00 C ATOM 1834 C ALA B 13 11.770 8.200 -5.728 1.00 0.00 C ATOM 1835 O ALA B 13 11.195 8.219 -4.642 1.00 0.00 O ATOM 1836 CB ALA B 13 14.247 7.931 -6.005 1.00 0.00 C ATOM 0 H ALA B 13 13.413 6.664 -7.937 1.00 0.00 H new ATOM 0 HA ALA B 13 12.909 6.491 -5.167 1.00 0.00 H new ATOM 0 HB1 ALA B 13 14.384 8.473 -5.069 1.00 0.00 H new ATOM 0 HB2 ALA B 13 15.049 7.202 -6.124 1.00 0.00 H new ATOM 0 HB3 ALA B 13 14.270 8.634 -6.838 1.00 0.00 H new ATOM 1842 N ILE B 14 11.425 8.989 -6.744 1.00 0.00 N ATOM 1843 CA ILE B 14 10.395 10.020 -6.601 1.00 0.00 C ATOM 1844 C ILE B 14 8.978 9.447 -6.738 1.00 0.00 C ATOM 1845 O ILE B 14 7.998 10.123 -6.420 1.00 0.00 O ATOM 1846 CB ILE B 14 10.586 11.168 -7.619 1.00 0.00 C ATOM 1847 CG1 ILE B 14 10.541 10.639 -9.054 1.00 0.00 C ATOM 1848 CG2 ILE B 14 11.901 11.894 -7.361 1.00 0.00 C ATOM 1849 CD1 ILE B 14 10.143 11.680 -10.076 1.00 0.00 C ATOM 0 H ILE B 14 11.842 8.936 -7.674 1.00 0.00 H new ATOM 0 HA ILE B 14 10.510 10.419 -5.593 1.00 0.00 H new ATOM 0 HB ILE B 14 9.766 11.875 -7.492 1.00 0.00 H new ATOM 0 HG12 ILE B 14 11.522 10.242 -9.316 1.00 0.00 H new ATOM 0 HG13 ILE B 14 9.838 9.808 -9.103 1.00 0.00 H new ATOM 0 HG21 ILE B 14 12.020 12.699 -8.086 1.00 0.00 H new ATOM 0 HG22 ILE B 14 11.895 12.311 -6.354 1.00 0.00 H new ATOM 0 HG23 ILE B 14 12.729 11.192 -7.459 1.00 0.00 H new ATOM 0 HD11 ILE B 14 10.134 11.230 -11.069 1.00 0.00 H new ATOM 0 HD12 ILE B 14 9.149 12.060 -9.840 1.00 0.00 H new ATOM 0 HD13 ILE B 14 10.859 12.501 -10.057 1.00 0.00 H new ATOM 1861 N GLN B 15 8.877 8.202 -7.198 1.00 0.00 N ATOM 1862 CA GLN B 15 7.585 7.541 -7.379 1.00 0.00 C ATOM 1863 C GLN B 15 6.920 7.251 -6.036 1.00 0.00 C ATOM 1864 O GLN B 15 7.351 6.368 -5.293 1.00 0.00 O ATOM 1865 CB GLN B 15 7.762 6.239 -8.156 1.00 0.00 C ATOM 1866 CG GLN B 15 7.140 6.259 -9.545 1.00 0.00 C ATOM 1867 CD GLN B 15 8.014 5.592 -10.593 1.00 0.00 C ATOM 1868 OE1 GLN B 15 8.162 6.096 -11.708 1.00 0.00 O ATOM 1869 NE2 GLN B 15 8.598 4.456 -10.247 1.00 0.00 N ATOM 0 H GLN B 15 9.680 7.627 -7.454 1.00 0.00 H new ATOM 0 HA GLN B 15 6.941 8.216 -7.944 1.00 0.00 H new ATOM 0 HB2 GLN B 15 8.827 6.025 -8.249 1.00 0.00 H new ATOM 0 HB3 GLN B 15 7.321 5.423 -7.583 1.00 0.00 H new ATOM 0 HG2 GLN B 15 6.173 5.757 -9.512 1.00 0.00 H new ATOM 0 HG3 GLN B 15 6.953 7.292 -9.839 1.00 0.00 H new ATOM 0 HE21 GLN B 15 8.451 4.070 -9.314 1.00 0.00 H new ATOM 0 HE22 GLN B 15 9.195 3.966 -10.913 1.00 0.00 H new ATOM 1878 N GLY B 16 5.882 8.015 -5.732 1.00 0.00 N ATOM 1879 CA GLY B 16 5.140 7.818 -4.498 1.00 0.00 C ATOM 1880 C GLY B 16 5.598 8.747 -3.392 1.00 0.00 C ATOM 1881 O GLY B 16 5.078 8.700 -2.276 1.00 0.00 O ATOM 0 H GLY B 16 5.536 8.773 -6.320 1.00 0.00 H new ATOM 0 HA2 GLY B 16 4.078 7.978 -4.686 1.00 0.00 H new ATOM 0 HA3 GLY B 16 5.253 6.785 -4.171 1.00 0.00 H new ATOM 1885 N LEU B 17 6.575 9.587 -3.701 1.00 0.00 N ATOM 1886 CA LEU B 17 7.131 10.509 -2.738 1.00 0.00 C ATOM 1887 C LEU B 17 6.381 11.837 -2.750 1.00 0.00 C ATOM 1888 O LEU B 17 5.896 12.287 -3.791 1.00 0.00 O ATOM 1889 CB LEU B 17 8.613 10.728 -3.049 1.00 0.00 C ATOM 1890 CG LEU B 17 9.572 10.215 -1.981 1.00 0.00 C ATOM 1891 CD1 LEU B 17 9.232 10.853 -0.660 1.00 0.00 C ATOM 1892 CD2 LEU B 17 9.496 8.700 -1.871 1.00 0.00 C ATOM 0 H LEU B 17 7.000 9.644 -4.627 1.00 0.00 H new ATOM 0 HA LEU B 17 7.026 10.082 -1.740 1.00 0.00 H new ATOM 0 HB2 LEU B 17 8.848 10.238 -3.994 1.00 0.00 H new ATOM 0 HB3 LEU B 17 8.786 11.795 -3.191 1.00 0.00 H new ATOM 0 HG LEU B 17 10.591 10.481 -2.261 1.00 0.00 H new ATOM 0 HD11 LEU B 17 9.916 10.489 0.107 1.00 0.00 H new ATOM 0 HD12 LEU B 17 9.325 11.936 -0.744 1.00 0.00 H new ATOM 0 HD13 LEU B 17 8.209 10.597 -0.385 1.00 0.00 H new ATOM 0 HD21 LEU B 17 10.189 8.356 -1.103 1.00 0.00 H new ATOM 0 HD22 LEU B 17 8.481 8.405 -1.603 1.00 0.00 H new ATOM 0 HD23 LEU B 17 9.763 8.252 -2.828 1.00 0.00 H new ATOM 1904 N GLU B 18 6.279 12.449 -1.578 1.00 0.00 N ATOM 1905 CA GLU B 18 5.653 13.754 -1.438 1.00 0.00 C ATOM 1906 C GLU B 18 6.698 14.841 -1.656 1.00 0.00 C ATOM 1907 O GLU B 18 7.285 15.364 -0.706 1.00 0.00 O ATOM 1908 CB GLU B 18 5.011 13.898 -0.047 1.00 0.00 C ATOM 1909 CG GLU B 18 4.422 12.604 0.505 1.00 0.00 C ATOM 1910 CD GLU B 18 5.340 11.907 1.494 1.00 0.00 C ATOM 1911 OE1 GLU B 18 6.578 11.972 1.321 1.00 0.00 O ATOM 1912 OE2 GLU B 18 4.830 11.279 2.445 1.00 0.00 O ATOM 0 H GLU B 18 6.626 12.056 -0.703 1.00 0.00 H new ATOM 0 HA GLU B 18 4.866 13.856 -2.186 1.00 0.00 H new ATOM 0 HB2 GLU B 18 5.761 14.269 0.651 1.00 0.00 H new ATOM 0 HB3 GLU B 18 4.224 14.650 -0.098 1.00 0.00 H new ATOM 0 HG2 GLU B 18 3.472 12.823 0.992 1.00 0.00 H new ATOM 0 HG3 GLU B 18 4.208 11.927 -0.322 1.00 0.00 H new ATOM 1919 N VAL B 19 6.933 15.164 -2.919 1.00 0.00 N ATOM 1920 CA VAL B 19 7.942 16.144 -3.289 1.00 0.00 C ATOM 1921 C VAL B 19 7.418 17.093 -4.335 1.00 0.00 C ATOM 1922 O VAL B 19 6.596 16.731 -5.177 1.00 0.00 O ATOM 1923 CB VAL B 19 9.246 15.495 -3.820 1.00 0.00 C ATOM 1924 CG1 VAL B 19 10.231 15.260 -2.686 1.00 0.00 C ATOM 1925 CG2 VAL B 19 8.961 14.196 -4.565 1.00 0.00 C ATOM 0 H VAL B 19 6.434 14.758 -3.710 1.00 0.00 H new ATOM 0 HA VAL B 19 8.177 16.686 -2.373 1.00 0.00 H new ATOM 0 HB VAL B 19 9.695 16.190 -4.529 1.00 0.00 H new ATOM 0 HG11 VAL B 19 11.139 14.804 -3.081 1.00 0.00 H new ATOM 0 HG12 VAL B 19 10.478 16.212 -2.216 1.00 0.00 H new ATOM 0 HG13 VAL B 19 9.783 14.596 -1.947 1.00 0.00 H new ATOM 0 HG21 VAL B 19 9.898 13.769 -4.923 1.00 0.00 H new ATOM 0 HG22 VAL B 19 8.474 13.490 -3.892 1.00 0.00 H new ATOM 0 HG23 VAL B 19 8.307 14.399 -5.413 1.00 0.00 H new ATOM 1935 N GLY B 20 7.880 18.322 -4.248 1.00 0.00 N ATOM 1936 CA GLY B 20 7.591 19.293 -5.264 1.00 0.00 C ATOM 1937 C GLY B 20 8.446 19.068 -6.489 1.00 0.00 C ATOM 1938 O GLY B 20 9.522 18.468 -6.406 1.00 0.00 O ATOM 0 H GLY B 20 8.457 18.666 -3.481 1.00 0.00 H new ATOM 0 HA2 GLY B 20 6.537 19.236 -5.537 1.00 0.00 H new ATOM 0 HA3 GLY B 20 7.766 20.296 -4.874 1.00 0.00 H new ATOM 1942 N GLN B 21 7.967 19.547 -7.618 1.00 0.00 N ATOM 1943 CA GLN B 21 8.687 19.438 -8.888 1.00 0.00 C ATOM 1944 C GLN B 21 10.003 20.201 -8.848 1.00 0.00 C ATOM 1945 O GLN B 21 10.927 19.890 -9.592 1.00 0.00 O ATOM 1946 CB GLN B 21 7.821 19.963 -10.032 1.00 0.00 C ATOM 1947 CG GLN B 21 6.929 18.907 -10.655 1.00 0.00 C ATOM 1948 CD GLN B 21 6.620 19.199 -12.108 1.00 0.00 C ATOM 1949 OE1 GLN B 21 5.558 19.732 -12.436 1.00 0.00 O ATOM 1950 NE2 GLN B 21 7.544 18.853 -12.989 1.00 0.00 N ATOM 0 H GLN B 21 7.068 20.024 -7.691 1.00 0.00 H new ATOM 0 HA GLN B 21 8.909 18.384 -9.054 1.00 0.00 H new ATOM 0 HB2 GLN B 21 7.200 20.778 -9.661 1.00 0.00 H new ATOM 0 HB3 GLN B 21 8.468 20.381 -10.803 1.00 0.00 H new ATOM 0 HG2 GLN B 21 7.414 17.934 -10.578 1.00 0.00 H new ATOM 0 HG3 GLN B 21 5.997 18.845 -10.093 1.00 0.00 H new ATOM 0 HE21 GLN B 21 8.409 18.414 -12.675 1.00 0.00 H new ATOM 0 HE22 GLN B 21 7.391 19.025 -13.983 1.00 0.00 H new ATOM 1959 N GLN B 22 10.081 21.185 -7.963 1.00 0.00 N ATOM 1960 CA GLN B 22 11.292 21.967 -7.774 1.00 0.00 C ATOM 1961 C GLN B 22 12.408 21.078 -7.231 1.00 0.00 C ATOM 1962 O GLN B 22 13.511 21.065 -7.765 1.00 0.00 O ATOM 1963 CB GLN B 22 11.034 23.140 -6.816 1.00 0.00 C ATOM 1964 CG GLN B 22 9.771 23.940 -7.135 1.00 0.00 C ATOM 1965 CD GLN B 22 8.525 23.371 -6.475 1.00 0.00 C ATOM 1966 OE1 GLN B 22 8.607 22.567 -5.546 1.00 0.00 O ATOM 1967 NE2 GLN B 22 7.364 23.768 -6.962 1.00 0.00 N ATOM 0 H GLN B 22 9.308 21.462 -7.358 1.00 0.00 H new ATOM 0 HA GLN B 22 11.598 22.372 -8.738 1.00 0.00 H new ATOM 0 HB2 GLN B 22 10.960 22.755 -5.799 1.00 0.00 H new ATOM 0 HB3 GLN B 22 11.892 23.811 -6.841 1.00 0.00 H new ATOM 0 HG2 GLN B 22 9.909 24.971 -6.810 1.00 0.00 H new ATOM 0 HG3 GLN B 22 9.625 23.963 -8.215 1.00 0.00 H new ATOM 0 HE21 GLN B 22 7.336 24.436 -7.733 1.00 0.00 H new ATOM 0 HE22 GLN B 22 6.495 23.407 -6.568 1.00 0.00 H new ATOM 1976 N THR B 23 12.088 20.303 -6.194 1.00 0.00 N ATOM 1977 CA THR B 23 13.045 19.389 -5.577 1.00 0.00 C ATOM 1978 C THR B 23 13.477 18.291 -6.555 1.00 0.00 C ATOM 1979 O THR B 23 14.634 17.872 -6.561 1.00 0.00 O ATOM 1980 CB THR B 23 12.441 18.742 -4.314 1.00 0.00 C ATOM 1981 OG1 THR B 23 11.052 19.084 -4.204 1.00 0.00 O ATOM 1982 CG2 THR B 23 13.172 19.202 -3.063 1.00 0.00 C ATOM 0 H THR B 23 11.164 20.292 -5.762 1.00 0.00 H new ATOM 0 HA THR B 23 13.922 19.974 -5.300 1.00 0.00 H new ATOM 0 HB THR B 23 12.549 17.661 -4.405 1.00 0.00 H new ATOM 0 HG1 THR B 23 10.561 18.706 -4.963 1.00 0.00 H new ATOM 0 HG21 THR B 23 12.726 18.731 -2.187 1.00 0.00 H new ATOM 0 HG22 THR B 23 14.223 18.920 -3.131 1.00 0.00 H new ATOM 0 HG23 THR B 23 13.092 20.285 -2.973 1.00 0.00 H new ATOM 1990 N ILE B 24 12.542 17.848 -7.392 1.00 0.00 N ATOM 1991 CA ILE B 24 12.820 16.822 -8.395 1.00 0.00 C ATOM 1992 C ILE B 24 13.741 17.372 -9.491 1.00 0.00 C ATOM 1993 O ILE B 24 14.682 16.700 -9.918 1.00 0.00 O ATOM 1994 CB ILE B 24 11.505 16.286 -9.017 1.00 0.00 C ATOM 1995 CG1 ILE B 24 10.616 15.693 -7.920 1.00 0.00 C ATOM 1996 CG2 ILE B 24 11.784 15.245 -10.095 1.00 0.00 C ATOM 1997 CD1 ILE B 24 9.161 15.543 -8.322 1.00 0.00 C ATOM 0 H ILE B 24 11.580 18.186 -7.395 1.00 0.00 H new ATOM 0 HA ILE B 24 13.327 15.995 -7.898 1.00 0.00 H new ATOM 0 HB ILE B 24 10.986 17.120 -9.489 1.00 0.00 H new ATOM 0 HG12 ILE B 24 11.007 14.716 -7.638 1.00 0.00 H new ATOM 0 HG13 ILE B 24 10.675 16.328 -7.036 1.00 0.00 H new ATOM 0 HG21 ILE B 24 10.841 14.890 -10.510 1.00 0.00 H new ATOM 0 HG22 ILE B 24 12.384 15.693 -10.887 1.00 0.00 H new ATOM 0 HG23 ILE B 24 12.327 14.406 -9.659 1.00 0.00 H new ATOM 0 HD11 ILE B 24 8.596 15.117 -7.493 1.00 0.00 H new ATOM 0 HD12 ILE B 24 8.751 16.521 -8.576 1.00 0.00 H new ATOM 0 HD13 ILE B 24 9.089 14.884 -9.187 1.00 0.00 H new ATOM 2009 N GLU B 25 13.486 18.612 -9.909 1.00 0.00 N ATOM 2010 CA GLU B 25 14.288 19.272 -10.929 1.00 0.00 C ATOM 2011 C GLU B 25 15.718 19.504 -10.441 1.00 0.00 C ATOM 2012 O GLU B 25 16.667 19.460 -11.228 1.00 0.00 O ATOM 2013 CB GLU B 25 13.641 20.605 -11.299 1.00 0.00 C ATOM 2014 CG GLU B 25 12.509 20.487 -12.309 1.00 0.00 C ATOM 2015 CD GLU B 25 12.931 19.813 -13.595 1.00 0.00 C ATOM 2016 OE1 GLU B 25 13.583 20.477 -14.430 1.00 0.00 O ATOM 2017 OE2 GLU B 25 12.609 18.624 -13.784 1.00 0.00 O ATOM 0 H GLU B 25 12.720 19.182 -9.549 1.00 0.00 H new ATOM 0 HA GLU B 25 14.332 18.627 -11.807 1.00 0.00 H new ATOM 0 HB2 GLU B 25 13.258 21.074 -10.393 1.00 0.00 H new ATOM 0 HB3 GLU B 25 14.406 21.268 -11.703 1.00 0.00 H new ATOM 0 HG2 GLU B 25 11.689 19.924 -11.863 1.00 0.00 H new ATOM 0 HG3 GLU B 25 12.127 21.482 -12.536 1.00 0.00 H new ATOM 2024 N ILE B 26 15.866 19.737 -9.138 1.00 0.00 N ATOM 2025 CA ILE B 26 17.186 19.947 -8.550 1.00 0.00 C ATOM 2026 C ILE B 26 17.963 18.634 -8.512 1.00 0.00 C ATOM 2027 O ILE B 26 19.098 18.564 -8.979 1.00 0.00 O ATOM 2028 CB ILE B 26 17.107 20.531 -7.116 1.00 0.00 C ATOM 2029 CG1 ILE B 26 16.468 21.921 -7.132 1.00 0.00 C ATOM 2030 CG2 ILE B 26 18.494 20.605 -6.484 1.00 0.00 C ATOM 2031 CD1 ILE B 26 15.933 22.363 -5.783 1.00 0.00 C ATOM 0 H ILE B 26 15.093 19.785 -8.474 1.00 0.00 H new ATOM 0 HA ILE B 26 17.701 20.671 -9.182 1.00 0.00 H new ATOM 0 HB ILE B 26 16.485 19.865 -6.518 1.00 0.00 H new ATOM 0 HG12 ILE B 26 17.206 22.646 -7.475 1.00 0.00 H new ATOM 0 HG13 ILE B 26 15.653 21.928 -7.856 1.00 0.00 H new ATOM 0 HG21 ILE B 26 18.414 21.018 -5.478 1.00 0.00 H new ATOM 0 HG22 ILE B 26 18.924 19.605 -6.433 1.00 0.00 H new ATOM 0 HG23 ILE B 26 19.136 21.245 -7.089 1.00 0.00 H new ATOM 0 HD11 ILE B 26 15.495 23.357 -5.873 1.00 0.00 H new ATOM 0 HD12 ILE B 26 15.171 21.660 -5.446 1.00 0.00 H new ATOM 0 HD13 ILE B 26 16.748 22.390 -5.059 1.00 0.00 H new ATOM 2043 N ALA B 27 17.323 17.592 -7.991 1.00 0.00 N ATOM 2044 CA ALA B 27 17.960 16.289 -7.808 1.00 0.00 C ATOM 2045 C ALA B 27 18.288 15.613 -9.144 1.00 0.00 C ATOM 2046 O ALA B 27 19.129 14.720 -9.197 1.00 0.00 O ATOM 2047 CB ALA B 27 17.071 15.396 -6.959 1.00 0.00 C ATOM 0 H ALA B 27 16.351 17.625 -7.684 1.00 0.00 H new ATOM 0 HA ALA B 27 18.907 16.450 -7.294 1.00 0.00 H new ATOM 0 HB1 ALA B 27 17.550 14.426 -6.826 1.00 0.00 H new ATOM 0 HB2 ALA B 27 16.913 15.860 -5.985 1.00 0.00 H new ATOM 0 HB3 ALA B 27 16.110 15.261 -7.456 1.00 0.00 H new ATOM 2053 N ARG B 28 17.633 16.038 -10.219 1.00 0.00 N ATOM 2054 CA ARG B 28 17.934 15.517 -11.553 1.00 0.00 C ATOM 2055 C ARG B 28 19.345 15.920 -11.991 1.00 0.00 C ATOM 2056 O ARG B 28 20.040 15.166 -12.674 1.00 0.00 O ATOM 2057 CB ARG B 28 16.907 16.022 -12.567 1.00 0.00 C ATOM 2058 CG ARG B 28 16.830 15.174 -13.827 1.00 0.00 C ATOM 2059 CD ARG B 28 17.079 16.006 -15.076 1.00 0.00 C ATOM 2060 NE ARG B 28 15.853 16.218 -15.840 1.00 0.00 N ATOM 2061 CZ ARG B 28 15.096 17.313 -15.758 1.00 0.00 C ATOM 2062 NH1 ARG B 28 15.482 18.346 -15.016 1.00 0.00 N ATOM 2063 NH2 ARG B 28 13.965 17.380 -16.449 1.00 0.00 N ATOM 0 H ARG B 28 16.892 16.739 -10.196 1.00 0.00 H new ATOM 0 HA ARG B 28 17.884 14.429 -11.510 1.00 0.00 H new ATOM 0 HB2 ARG B 28 15.925 16.047 -12.095 1.00 0.00 H new ATOM 0 HB3 ARG B 28 17.155 17.047 -12.843 1.00 0.00 H new ATOM 0 HG2 ARG B 28 17.565 14.371 -13.771 1.00 0.00 H new ATOM 0 HG3 ARG B 28 15.848 14.704 -13.891 1.00 0.00 H new ATOM 0 HD2 ARG B 28 17.502 16.970 -14.792 1.00 0.00 H new ATOM 0 HD3 ARG B 28 17.817 15.507 -15.704 1.00 0.00 H new ATOM 0 HE ARG B 28 15.556 15.480 -16.478 1.00 0.00 H new ATOM 0 HH11 ARG B 28 16.363 18.305 -14.504 1.00 0.00 H new ATOM 0 HH12 ARG B 28 14.897 19.180 -14.959 1.00 0.00 H new ATOM 0 HH21 ARG B 28 13.680 16.597 -17.038 1.00 0.00 H new ATOM 0 HH22 ARG B 28 13.381 18.214 -16.391 1.00 0.00 H new ATOM 2077 N GLY B 29 19.766 17.103 -11.578 1.00 0.00 N ATOM 2078 CA GLY B 29 21.094 17.577 -11.917 1.00 0.00 C ATOM 2079 C GLY B 29 22.080 17.377 -10.785 1.00 0.00 C ATOM 2080 O GLY B 29 23.269 17.196 -11.008 1.00 0.00 O ATOM 0 H GLY B 29 19.213 17.747 -11.013 1.00 0.00 H new ATOM 0 HA2 GLY B 29 21.450 17.052 -12.803 1.00 0.00 H new ATOM 0 HA3 GLY B 29 21.046 18.636 -12.172 1.00 0.00 H new ATOM 2084 N VAL B 30 21.571 17.390 -9.568 1.00 0.00 N ATOM 2085 CA VAL B 30 22.392 17.268 -8.380 1.00 0.00 C ATOM 2086 C VAL B 30 22.781 15.807 -8.131 1.00 0.00 C ATOM 2087 O VAL B 30 23.931 15.504 -7.819 1.00 0.00 O ATOM 2088 CB VAL B 30 21.630 17.883 -7.176 1.00 0.00 C ATOM 2089 CG1 VAL B 30 21.761 17.079 -5.899 1.00 0.00 C ATOM 2090 CG2 VAL B 30 22.087 19.305 -6.952 1.00 0.00 C ATOM 0 H VAL B 30 20.574 17.486 -9.375 1.00 0.00 H new ATOM 0 HA VAL B 30 23.324 17.816 -8.517 1.00 0.00 H new ATOM 0 HB VAL B 30 20.571 17.866 -7.435 1.00 0.00 H new ATOM 0 HG11 VAL B 30 21.203 17.569 -5.101 1.00 0.00 H new ATOM 0 HG12 VAL B 30 21.363 16.077 -6.058 1.00 0.00 H new ATOM 0 HG13 VAL B 30 22.812 17.011 -5.618 1.00 0.00 H new ATOM 0 HG21 VAL B 30 21.548 19.731 -6.106 1.00 0.00 H new ATOM 0 HG22 VAL B 30 23.157 19.315 -6.744 1.00 0.00 H new ATOM 0 HG23 VAL B 30 21.886 19.897 -7.845 1.00 0.00 H new ATOM 2100 N LEU B 31 21.825 14.910 -8.308 1.00 0.00 N ATOM 2101 CA LEU B 31 22.052 13.492 -8.052 1.00 0.00 C ATOM 2102 C LEU B 31 22.382 12.738 -9.334 1.00 0.00 C ATOM 2103 O LEU B 31 23.455 12.157 -9.450 1.00 0.00 O ATOM 2104 CB LEU B 31 20.825 12.870 -7.375 1.00 0.00 C ATOM 2105 CG LEU B 31 21.064 12.208 -6.012 1.00 0.00 C ATOM 2106 CD1 LEU B 31 22.318 12.751 -5.337 1.00 0.00 C ATOM 2107 CD2 LEU B 31 19.850 12.411 -5.119 1.00 0.00 C ATOM 0 H LEU B 31 20.883 15.136 -8.628 1.00 0.00 H new ATOM 0 HA LEU B 31 22.910 13.409 -7.384 1.00 0.00 H new ATOM 0 HB2 LEU B 31 20.072 13.648 -7.250 1.00 0.00 H new ATOM 0 HB3 LEU B 31 20.404 12.124 -8.049 1.00 0.00 H new ATOM 0 HG LEU B 31 21.216 11.141 -6.176 1.00 0.00 H new ATOM 0 HD11 LEU B 31 22.455 12.259 -4.374 1.00 0.00 H new ATOM 0 HD12 LEU B 31 23.184 12.558 -5.970 1.00 0.00 H new ATOM 0 HD13 LEU B 31 22.213 13.825 -5.184 1.00 0.00 H new ATOM 0 HD21 LEU B 31 20.026 11.939 -4.153 1.00 0.00 H new ATOM 0 HD22 LEU B 31 19.678 13.478 -4.975 1.00 0.00 H new ATOM 0 HD23 LEU B 31 18.974 11.962 -5.588 1.00 0.00 H new ATOM 2119 N VAL B 32 21.452 12.744 -10.289 1.00 0.00 N ATOM 2120 CA VAL B 32 21.624 12.006 -11.546 1.00 0.00 C ATOM 2121 C VAL B 32 22.848 12.493 -12.324 1.00 0.00 C ATOM 2122 O VAL B 32 23.698 11.693 -12.722 1.00 0.00 O ATOM 2123 CB VAL B 32 20.373 12.109 -12.446 1.00 0.00 C ATOM 2124 CG1 VAL B 32 20.454 11.138 -13.614 1.00 0.00 C ATOM 2125 CG2 VAL B 32 19.110 11.860 -11.640 1.00 0.00 C ATOM 0 H VAL B 32 20.570 13.251 -10.218 1.00 0.00 H new ATOM 0 HA VAL B 32 21.773 10.962 -11.270 1.00 0.00 H new ATOM 0 HB VAL B 32 20.336 13.121 -12.848 1.00 0.00 H new ATOM 0 HG11 VAL B 32 19.559 11.234 -14.229 1.00 0.00 H new ATOM 0 HG12 VAL B 32 21.334 11.365 -14.215 1.00 0.00 H new ATOM 0 HG13 VAL B 32 20.526 10.118 -13.235 1.00 0.00 H new ATOM 0 HG21 VAL B 32 18.241 11.937 -12.293 1.00 0.00 H new ATOM 0 HG22 VAL B 32 19.148 10.862 -11.203 1.00 0.00 H new ATOM 0 HG23 VAL B 32 19.034 12.602 -10.845 1.00 0.00 H new ATOM 2135 N ASP B 33 22.948 13.801 -12.520 1.00 0.00 N ATOM 2136 CA ASP B 33 24.086 14.369 -13.225 1.00 0.00 C ATOM 2137 C ASP B 33 25.306 14.349 -12.315 1.00 0.00 C ATOM 2138 O ASP B 33 26.368 13.856 -12.693 1.00 0.00 O ATOM 2139 CB ASP B 33 23.783 15.795 -13.693 1.00 0.00 C ATOM 2140 CG ASP B 33 24.820 16.332 -14.661 1.00 0.00 C ATOM 2141 OD1 ASP B 33 25.428 15.524 -15.395 1.00 0.00 O ATOM 2142 OD2 ASP B 33 25.018 17.561 -14.701 1.00 0.00 O ATOM 0 H ASP B 33 22.259 14.483 -12.203 1.00 0.00 H new ATOM 0 HA ASP B 33 24.290 13.767 -14.111 1.00 0.00 H new ATOM 0 HB2 ASP B 33 22.803 15.815 -14.170 1.00 0.00 H new ATOM 0 HB3 ASP B 33 23.728 16.453 -12.826 1.00 0.00 H new ATOM 2147 N GLY B 34 25.133 14.855 -11.102 1.00 0.00 N ATOM 2148 CA GLY B 34 26.194 14.801 -10.124 1.00 0.00 C ATOM 2149 C GLY B 34 26.799 16.155 -9.849 1.00 0.00 C ATOM 2150 O GLY B 34 28.019 16.317 -9.879 1.00 0.00 O ATOM 0 H GLY B 34 24.275 15.302 -10.780 1.00 0.00 H new ATOM 0 HA2 GLY B 34 25.805 14.385 -9.194 1.00 0.00 H new ATOM 0 HA3 GLY B 34 26.973 14.124 -10.475 1.00 0.00 H new ATOM 2154 N LYS B 35 25.943 17.125 -9.586 1.00 0.00 N ATOM 2155 CA LYS B 35 26.386 18.483 -9.332 1.00 0.00 C ATOM 2156 C LYS B 35 26.331 18.798 -7.842 1.00 0.00 C ATOM 2157 O LYS B 35 25.383 18.417 -7.156 1.00 0.00 O ATOM 2158 CB LYS B 35 25.527 19.483 -10.106 1.00 0.00 C ATOM 2159 CG LYS B 35 26.306 20.270 -11.143 1.00 0.00 C ATOM 2160 CD LYS B 35 26.396 19.513 -12.457 1.00 0.00 C ATOM 2161 CE LYS B 35 27.472 20.085 -13.366 1.00 0.00 C ATOM 2162 NZ LYS B 35 27.198 21.499 -13.735 1.00 0.00 N ATOM 0 H LYS B 35 24.932 16.996 -9.543 1.00 0.00 H new ATOM 0 HA LYS B 35 27.418 18.569 -9.671 1.00 0.00 H new ATOM 0 HB2 LYS B 35 24.716 18.948 -10.600 1.00 0.00 H new ATOM 0 HB3 LYS B 35 25.068 20.178 -9.402 1.00 0.00 H new ATOM 0 HG2 LYS B 35 25.825 21.234 -11.308 1.00 0.00 H new ATOM 0 HG3 LYS B 35 27.309 20.475 -10.769 1.00 0.00 H new ATOM 0 HD2 LYS B 35 26.609 18.463 -12.258 1.00 0.00 H new ATOM 0 HD3 LYS B 35 25.433 19.552 -12.965 1.00 0.00 H new ATOM 0 HE2 LYS B 35 28.439 20.022 -12.867 1.00 0.00 H new ATOM 0 HE3 LYS B 35 27.540 19.481 -14.271 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 27.909 21.823 -14.422 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 26.251 21.570 -14.158 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 27.242 22.095 -12.884 1.00 0.00 H new ATOM 2176 N PRO B 36 27.368 19.477 -7.321 1.00 0.00 N ATOM 2177 CA PRO B 36 27.413 19.924 -5.922 1.00 0.00 C ATOM 2178 C PRO B 36 26.306 20.928 -5.589 1.00 0.00 C ATOM 2179 O PRO B 36 25.888 21.719 -6.447 1.00 0.00 O ATOM 2180 CB PRO B 36 28.791 20.584 -5.798 1.00 0.00 C ATOM 2181 CG PRO B 36 29.583 20.037 -6.934 1.00 0.00 C ATOM 2182 CD PRO B 36 28.598 19.833 -8.046 1.00 0.00 C ATOM 0 HA PRO B 36 27.259 19.096 -5.230 1.00 0.00 H new ATOM 0 HB2 PRO B 36 28.715 21.670 -5.856 1.00 0.00 H new ATOM 0 HB3 PRO B 36 29.257 20.348 -4.842 1.00 0.00 H new ATOM 0 HG2 PRO B 36 30.373 20.727 -7.231 1.00 0.00 H new ATOM 0 HG3 PRO B 36 30.066 19.099 -6.660 1.00 0.00 H new ATOM 0 HD2 PRO B 36 28.470 20.735 -8.645 1.00 0.00 H new ATOM 0 HD3 PRO B 36 28.912 19.041 -8.726 1.00 0.00 H new ATOM 2190 N GLN B 37 25.866 20.904 -4.331 1.00 0.00 N ATOM 2191 CA GLN B 37 24.720 21.689 -3.866 1.00 0.00 C ATOM 2192 C GLN B 37 24.951 23.193 -3.998 1.00 0.00 C ATOM 2193 O GLN B 37 24.050 23.929 -4.408 1.00 0.00 O ATOM 2194 CB GLN B 37 24.408 21.347 -2.404 1.00 0.00 C ATOM 2195 CG GLN B 37 23.978 19.906 -2.187 1.00 0.00 C ATOM 2196 CD GLN B 37 25.079 19.055 -1.578 1.00 0.00 C ATOM 2197 OE1 GLN B 37 26.107 18.806 -2.211 1.00 0.00 O ATOM 2198 NE2 GLN B 37 24.877 18.610 -0.348 1.00 0.00 N ATOM 0 H GLN B 37 26.296 20.336 -3.601 1.00 0.00 H new ATOM 0 HA GLN B 37 23.875 21.428 -4.502 1.00 0.00 H new ATOM 0 HB2 GLN B 37 25.291 21.547 -1.798 1.00 0.00 H new ATOM 0 HB3 GLN B 37 23.619 22.009 -2.047 1.00 0.00 H new ATOM 0 HG2 GLN B 37 23.105 19.885 -1.535 1.00 0.00 H new ATOM 0 HG3 GLN B 37 23.674 19.473 -3.140 1.00 0.00 H new ATOM 0 HE21 GLN B 37 24.012 18.839 0.142 1.00 0.00 H new ATOM 0 HE22 GLN B 37 25.586 18.038 0.110 1.00 0.00 H new ATOM 2207 N ALA B 38 26.156 23.639 -3.658 1.00 0.00 N ATOM 2208 CA ALA B 38 26.490 25.060 -3.690 1.00 0.00 C ATOM 2209 C ALA B 38 26.390 25.633 -5.100 1.00 0.00 C ATOM 2210 O ALA B 38 25.834 26.711 -5.296 1.00 0.00 O ATOM 2211 CB ALA B 38 27.882 25.286 -3.125 1.00 0.00 C ATOM 0 H ALA B 38 26.920 23.035 -3.356 1.00 0.00 H new ATOM 0 HA ALA B 38 25.763 25.585 -3.070 1.00 0.00 H new ATOM 0 HB1 ALA B 38 28.118 26.350 -3.155 1.00 0.00 H new ATOM 0 HB2 ALA B 38 27.917 24.935 -2.094 1.00 0.00 H new ATOM 0 HB3 ALA B 38 28.610 24.736 -3.721 1.00 0.00 H new ATOM 2217 N THR B 39 26.900 24.890 -6.076 1.00 0.00 N ATOM 2218 CA THR B 39 26.915 25.337 -7.463 1.00 0.00 C ATOM 2219 C THR B 39 25.508 25.431 -8.047 1.00 0.00 C ATOM 2220 O THR B 39 25.200 26.364 -8.786 1.00 0.00 O ATOM 2221 CB THR B 39 27.746 24.386 -8.334 1.00 0.00 C ATOM 2222 OG1 THR B 39 28.194 23.274 -7.545 1.00 0.00 O ATOM 2223 CG2 THR B 39 28.937 25.113 -8.931 1.00 0.00 C ATOM 0 H THR B 39 27.311 23.968 -5.930 1.00 0.00 H new ATOM 0 HA THR B 39 27.363 26.330 -7.465 1.00 0.00 H new ATOM 0 HB THR B 39 27.121 24.021 -9.149 1.00 0.00 H new ATOM 0 HG1 THR B 39 27.425 22.722 -7.291 1.00 0.00 H new ATOM 0 HG21 THR B 39 29.514 24.422 -9.545 1.00 0.00 H new ATOM 0 HG22 THR B 39 28.586 25.941 -9.547 1.00 0.00 H new ATOM 0 HG23 THR B 39 29.567 25.499 -8.129 1.00 0.00 H new ATOM 2231 N PHE B 40 24.657 24.471 -7.699 1.00 0.00 N ATOM 2232 CA PHE B 40 23.296 24.419 -8.227 1.00 0.00 C ATOM 2233 C PHE B 40 22.462 25.576 -7.689 1.00 0.00 C ATOM 2234 O PHE B 40 21.620 26.126 -8.400 1.00 0.00 O ATOM 2235 CB PHE B 40 22.644 23.088 -7.863 1.00 0.00 C ATOM 2236 CG PHE B 40 21.960 22.408 -9.016 1.00 0.00 C ATOM 2237 CD1 PHE B 40 22.695 21.864 -10.057 1.00 0.00 C ATOM 2238 CD2 PHE B 40 20.578 22.311 -9.056 1.00 0.00 C ATOM 2239 CE1 PHE B 40 22.065 21.236 -11.115 1.00 0.00 C ATOM 2240 CE2 PHE B 40 19.943 21.684 -10.111 1.00 0.00 C ATOM 2241 CZ PHE B 40 20.687 21.146 -11.142 1.00 0.00 C ATOM 0 H PHE B 40 24.886 23.716 -7.052 1.00 0.00 H new ATOM 0 HA PHE B 40 23.345 24.507 -9.312 1.00 0.00 H new ATOM 0 HB2 PHE B 40 23.405 22.420 -7.460 1.00 0.00 H new ATOM 0 HB3 PHE B 40 21.916 23.257 -7.070 1.00 0.00 H new ATOM 0 HD1 PHE B 40 23.773 21.931 -10.042 1.00 0.00 H new ATOM 0 HD2 PHE B 40 19.990 22.731 -8.253 1.00 0.00 H new ATOM 0 HE1 PHE B 40 22.650 20.816 -11.920 1.00 0.00 H new ATOM 0 HE2 PHE B 40 18.865 21.615 -10.129 1.00 0.00 H new ATOM 0 HZ PHE B 40 20.193 20.656 -11.968 1.00 0.00 H new ATOM 2251 N ALA B 41 22.721 25.949 -6.441 1.00 0.00 N ATOM 2252 CA ALA B 41 22.023 27.057 -5.804 1.00 0.00 C ATOM 2253 C ALA B 41 22.321 28.376 -6.512 1.00 0.00 C ATOM 2254 O ALA B 41 21.407 29.110 -6.884 1.00 0.00 O ATOM 2255 CB ALA B 41 22.409 27.143 -4.335 1.00 0.00 C ATOM 0 H ALA B 41 23.415 25.495 -5.847 1.00 0.00 H new ATOM 0 HA ALA B 41 20.951 26.873 -5.878 1.00 0.00 H new ATOM 0 HB1 ALA B 41 21.881 27.975 -3.868 1.00 0.00 H new ATOM 0 HB2 ALA B 41 22.139 26.214 -3.833 1.00 0.00 H new ATOM 0 HB3 ALA B 41 23.484 27.302 -4.250 1.00 0.00 H new ATOM 2261 N THR B 42 23.601 28.658 -6.722 1.00 0.00 N ATOM 2262 CA THR B 42 24.020 29.906 -7.346 1.00 0.00 C ATOM 2263 C THR B 42 23.645 29.971 -8.832 1.00 0.00 C ATOM 2264 O THR B 42 23.148 30.994 -9.303 1.00 0.00 O ATOM 2265 CB THR B 42 25.540 30.111 -7.191 1.00 0.00 C ATOM 2266 OG1 THR B 42 25.992 29.499 -5.975 1.00 0.00 O ATOM 2267 CG2 THR B 42 25.895 31.589 -7.174 1.00 0.00 C ATOM 0 H THR B 42 24.369 28.037 -6.468 1.00 0.00 H new ATOM 0 HA THR B 42 23.488 30.705 -6.830 1.00 0.00 H new ATOM 0 HB THR B 42 26.033 29.646 -8.045 1.00 0.00 H new ATOM 0 HG1 THR B 42 26.959 29.631 -5.882 1.00 0.00 H new ATOM 0 HG21 THR B 42 26.973 31.703 -7.064 1.00 0.00 H new ATOM 0 HG22 THR B 42 25.575 32.051 -8.108 1.00 0.00 H new ATOM 0 HG23 THR B 42 25.391 32.075 -6.338 1.00 0.00 H new ATOM 2275 N SER B 43 23.850 28.873 -9.557 1.00 0.00 N ATOM 2276 CA SER B 43 23.678 28.878 -11.009 1.00 0.00 C ATOM 2277 C SER B 43 22.207 28.847 -11.423 1.00 0.00 C ATOM 2278 O SER B 43 21.800 29.571 -12.334 1.00 0.00 O ATOM 2279 CB SER B 43 24.423 27.699 -11.633 1.00 0.00 C ATOM 2280 OG SER B 43 25.763 27.644 -11.170 1.00 0.00 O ATOM 0 H SER B 43 24.133 27.974 -9.167 1.00 0.00 H new ATOM 0 HA SER B 43 24.098 29.814 -11.378 1.00 0.00 H new ATOM 0 HB2 SER B 43 23.911 26.769 -11.387 1.00 0.00 H new ATOM 0 HB3 SER B 43 24.413 27.791 -12.719 1.00 0.00 H new ATOM 0 HG SER B 43 25.789 27.206 -10.293 1.00 0.00 H new ATOM 2286 N LEU B 44 21.407 28.025 -10.755 1.00 0.00 N ATOM 2287 CA LEU B 44 20.015 27.844 -11.149 1.00 0.00 C ATOM 2288 C LEU B 44 19.091 28.847 -10.462 1.00 0.00 C ATOM 2289 O LEU B 44 17.928 28.988 -10.846 1.00 0.00 O ATOM 2290 CB LEU B 44 19.558 26.416 -10.858 1.00 0.00 C ATOM 2291 CG LEU B 44 19.393 25.532 -12.094 1.00 0.00 C ATOM 2292 CD1 LEU B 44 20.643 24.697 -12.330 1.00 0.00 C ATOM 2293 CD2 LEU B 44 18.169 24.641 -11.953 1.00 0.00 C ATOM 0 H LEU B 44 21.695 27.477 -9.944 1.00 0.00 H new ATOM 0 HA LEU B 44 19.956 28.025 -12.222 1.00 0.00 H new ATOM 0 HB2 LEU B 44 20.279 25.948 -10.188 1.00 0.00 H new ATOM 0 HB3 LEU B 44 18.607 26.455 -10.327 1.00 0.00 H new ATOM 0 HG LEU B 44 19.249 26.178 -12.960 1.00 0.00 H new ATOM 0 HD11 LEU B 44 20.504 24.075 -13.214 1.00 0.00 H new ATOM 0 HD12 LEU B 44 21.498 25.356 -12.481 1.00 0.00 H new ATOM 0 HD13 LEU B 44 20.824 24.060 -11.464 1.00 0.00 H new ATOM 0 HD21 LEU B 44 18.068 24.019 -12.842 1.00 0.00 H new ATOM 0 HD22 LEU B 44 18.282 24.004 -11.075 1.00 0.00 H new ATOM 0 HD23 LEU B 44 17.279 25.260 -11.840 1.00 0.00 H new ATOM 2305 N GLY B 45 19.608 29.544 -9.454 1.00 0.00 N ATOM 2306 CA GLY B 45 18.813 30.537 -8.756 1.00 0.00 C ATOM 2307 C GLY B 45 17.957 29.922 -7.670 1.00 0.00 C ATOM 2308 O GLY B 45 16.798 30.300 -7.486 1.00 0.00 O ATOM 0 H GLY B 45 20.562 29.439 -9.109 1.00 0.00 H new ATOM 0 HA2 GLY B 45 19.473 31.285 -8.317 1.00 0.00 H new ATOM 0 HA3 GLY B 45 18.174 31.056 -9.470 1.00 0.00 H new ATOM 2312 N LEU B 46 18.527 28.965 -6.961 1.00 0.00 N ATOM 2313 CA LEU B 46 17.830 28.290 -5.884 1.00 0.00 C ATOM 2314 C LEU B 46 18.472 28.630 -4.551 1.00 0.00 C ATOM 2315 O LEU B 46 19.579 29.167 -4.507 1.00 0.00 O ATOM 2316 CB LEU B 46 17.842 26.778 -6.094 1.00 0.00 C ATOM 2317 CG LEU B 46 17.674 26.329 -7.539 1.00 0.00 C ATOM 2318 CD1 LEU B 46 18.310 24.972 -7.729 1.00 0.00 C ATOM 2319 CD2 LEU B 46 16.204 26.295 -7.919 1.00 0.00 C ATOM 0 H LEU B 46 19.480 28.636 -7.115 1.00 0.00 H new ATOM 0 HA LEU B 46 16.795 28.632 -5.881 1.00 0.00 H new ATOM 0 HB2 LEU B 46 18.783 26.381 -5.713 1.00 0.00 H new ATOM 0 HB3 LEU B 46 17.044 26.337 -5.497 1.00 0.00 H new ATOM 0 HG LEU B 46 18.173 27.044 -8.194 1.00 0.00 H new ATOM 0 HD11 LEU B 46 18.187 24.654 -8.765 1.00 0.00 H new ATOM 0 HD12 LEU B 46 19.372 25.031 -7.491 1.00 0.00 H new ATOM 0 HD13 LEU B 46 17.830 24.250 -7.069 1.00 0.00 H new ATOM 0 HD21 LEU B 46 16.103 25.972 -8.955 1.00 0.00 H new ATOM 0 HD22 LEU B 46 15.676 25.598 -7.269 1.00 0.00 H new ATOM 0 HD23 LEU B 46 15.776 27.291 -7.806 1.00 0.00 H new ATOM 2331 N THR B 47 17.779 28.322 -3.470 1.00 0.00 N ATOM 2332 CA THR B 47 18.325 28.535 -2.144 1.00 0.00 C ATOM 2333 C THR B 47 19.239 27.372 -1.769 1.00 0.00 C ATOM 2334 O THR B 47 19.074 26.260 -2.277 1.00 0.00 O ATOM 2335 CB THR B 47 17.202 28.680 -1.101 1.00 0.00 C ATOM 2336 OG1 THR B 47 15.926 28.463 -1.724 1.00 0.00 O ATOM 2337 CG2 THR B 47 17.226 30.064 -0.468 1.00 0.00 C ATOM 0 H THR B 47 16.840 27.925 -3.485 1.00 0.00 H new ATOM 0 HA THR B 47 18.901 29.460 -2.154 1.00 0.00 H new ATOM 0 HB THR B 47 17.362 27.935 -0.321 1.00 0.00 H new ATOM 0 HG1 THR B 47 15.216 28.555 -1.055 1.00 0.00 H new ATOM 0 HG21 THR B 47 16.424 30.143 0.265 1.00 0.00 H new ATOM 0 HG22 THR B 47 18.185 30.222 0.025 1.00 0.00 H new ATOM 0 HG23 THR B 47 17.087 30.820 -1.241 1.00 0.00 H new ATOM 2345 N ARG B 48 20.184 27.625 -0.871 1.00 0.00 N ATOM 2346 CA ARG B 48 21.155 26.613 -0.464 1.00 0.00 C ATOM 2347 C ARG B 48 20.470 25.440 0.229 1.00 0.00 C ATOM 2348 O ARG B 48 20.819 24.281 -0.006 1.00 0.00 O ATOM 2349 CB ARG B 48 22.200 27.229 0.465 1.00 0.00 C ATOM 2350 CG ARG B 48 23.451 27.707 -0.255 1.00 0.00 C ATOM 2351 CD ARG B 48 24.523 26.630 -0.296 1.00 0.00 C ATOM 2352 NE ARG B 48 24.963 26.237 1.043 1.00 0.00 N ATOM 2353 CZ ARG B 48 26.187 26.463 1.529 1.00 0.00 C ATOM 2354 NH1 ARG B 48 27.091 27.112 0.804 1.00 0.00 N ATOM 2355 NH2 ARG B 48 26.501 26.048 2.748 1.00 0.00 N ATOM 0 H ARG B 48 20.300 28.527 -0.408 1.00 0.00 H new ATOM 0 HA ARG B 48 21.648 26.239 -1.361 1.00 0.00 H new ATOM 0 HB2 ARG B 48 21.752 28.070 0.994 1.00 0.00 H new ATOM 0 HB3 ARG B 48 22.483 26.493 1.218 1.00 0.00 H new ATOM 0 HG2 ARG B 48 23.194 28.004 -1.272 1.00 0.00 H new ATOM 0 HG3 ARG B 48 23.843 28.592 0.246 1.00 0.00 H new ATOM 0 HD2 ARG B 48 24.138 25.756 -0.821 1.00 0.00 H new ATOM 0 HD3 ARG B 48 25.378 26.993 -0.866 1.00 0.00 H new ATOM 0 HE ARG B 48 24.292 25.759 1.645 1.00 0.00 H new ATOM 0 HH11 ARG B 48 26.853 27.442 -0.131 1.00 0.00 H new ATOM 0 HH12 ARG B 48 28.023 27.280 1.183 1.00 0.00 H new ATOM 0 HH21 ARG B 48 25.809 25.557 3.314 1.00 0.00 H new ATOM 0 HH22 ARG B 48 27.435 26.220 3.120 1.00 0.00 H new ATOM 2369 N GLY B 49 19.486 25.753 1.064 1.00 0.00 N ATOM 2370 CA GLY B 49 18.743 24.730 1.774 1.00 0.00 C ATOM 2371 C GLY B 49 17.839 23.924 0.865 1.00 0.00 C ATOM 2372 O GLY B 49 17.622 22.739 1.106 1.00 0.00 O ATOM 0 H GLY B 49 19.188 26.708 1.263 1.00 0.00 H new ATOM 0 HA2 GLY B 49 19.443 24.058 2.271 1.00 0.00 H new ATOM 0 HA3 GLY B 49 18.142 25.199 2.554 1.00 0.00 H new ATOM 2376 N ALA B 50 17.337 24.559 -0.194 1.00 0.00 N ATOM 2377 CA ALA B 50 16.437 23.900 -1.135 1.00 0.00 C ATOM 2378 C ALA B 50 17.176 22.844 -1.949 1.00 0.00 C ATOM 2379 O ALA B 50 16.695 21.721 -2.109 1.00 0.00 O ATOM 2380 CB ALA B 50 15.792 24.923 -2.056 1.00 0.00 C ATOM 0 H ALA B 50 17.540 25.532 -0.421 1.00 0.00 H new ATOM 0 HA ALA B 50 15.655 23.401 -0.563 1.00 0.00 H new ATOM 0 HB1 ALA B 50 15.124 24.416 -2.752 1.00 0.00 H new ATOM 0 HB2 ALA B 50 15.223 25.639 -1.463 1.00 0.00 H new ATOM 0 HB3 ALA B 50 16.566 25.449 -2.615 1.00 0.00 H new ATOM 2386 N VAL B 51 18.353 23.212 -2.451 1.00 0.00 N ATOM 2387 CA VAL B 51 19.197 22.290 -3.208 1.00 0.00 C ATOM 2388 C VAL B 51 19.628 21.105 -2.339 1.00 0.00 C ATOM 2389 O VAL B 51 19.582 19.949 -2.771 1.00 0.00 O ATOM 2390 CB VAL B 51 20.453 23.001 -3.760 1.00 0.00 C ATOM 2391 CG1 VAL B 51 21.287 22.051 -4.602 1.00 0.00 C ATOM 2392 CG2 VAL B 51 20.058 24.213 -4.581 1.00 0.00 C ATOM 0 H VAL B 51 18.745 24.148 -2.346 1.00 0.00 H new ATOM 0 HA VAL B 51 18.603 21.925 -4.046 1.00 0.00 H new ATOM 0 HB VAL B 51 21.055 23.329 -2.912 1.00 0.00 H new ATOM 0 HG11 VAL B 51 22.165 22.575 -4.979 1.00 0.00 H new ATOM 0 HG12 VAL B 51 21.603 21.205 -3.991 1.00 0.00 H new ATOM 0 HG13 VAL B 51 20.692 21.690 -5.441 1.00 0.00 H new ATOM 0 HG21 VAL B 51 20.954 24.702 -4.962 1.00 0.00 H new ATOM 0 HG22 VAL B 51 19.433 23.898 -5.417 1.00 0.00 H new ATOM 0 HG23 VAL B 51 19.502 24.911 -3.955 1.00 0.00 H new ATOM 2402 N SER B 52 20.014 21.402 -1.103 1.00 0.00 N ATOM 2403 CA SER B 52 20.484 20.387 -0.172 1.00 0.00 C ATOM 2404 C SER B 52 19.341 19.491 0.319 1.00 0.00 C ATOM 2405 O SER B 52 19.567 18.345 0.716 1.00 0.00 O ATOM 2406 CB SER B 52 21.180 21.060 1.005 1.00 0.00 C ATOM 2407 OG SER B 52 22.203 21.933 0.555 1.00 0.00 O ATOM 0 H SER B 52 20.010 22.348 -0.721 1.00 0.00 H new ATOM 0 HA SER B 52 21.192 19.745 -0.696 1.00 0.00 H new ATOM 0 HB2 SER B 52 20.452 21.619 1.592 1.00 0.00 H new ATOM 0 HB3 SER B 52 21.606 20.302 1.663 1.00 0.00 H new ATOM 0 HG SER B 52 21.814 22.803 0.326 1.00 0.00 H new ATOM 2413 N GLN B 53 18.122 20.014 0.310 1.00 0.00 N ATOM 2414 CA GLN B 53 16.953 19.215 0.650 1.00 0.00 C ATOM 2415 C GLN B 53 16.649 18.215 -0.456 1.00 0.00 C ATOM 2416 O GLN B 53 16.267 17.085 -0.184 1.00 0.00 O ATOM 2417 CB GLN B 53 15.733 20.103 0.909 1.00 0.00 C ATOM 2418 CG GLN B 53 14.672 19.441 1.780 1.00 0.00 C ATOM 2419 CD GLN B 53 15.197 19.038 3.148 1.00 0.00 C ATOM 2420 OE1 GLN B 53 15.819 17.988 3.307 1.00 0.00 O ATOM 2421 NE2 GLN B 53 14.934 19.862 4.146 1.00 0.00 N ATOM 0 H GLN B 53 17.918 20.985 0.072 1.00 0.00 H new ATOM 0 HA GLN B 53 17.178 18.669 1.566 1.00 0.00 H new ATOM 0 HB2 GLN B 53 16.061 21.026 1.388 1.00 0.00 H new ATOM 0 HB3 GLN B 53 15.286 20.380 -0.046 1.00 0.00 H new ATOM 0 HG2 GLN B 53 13.833 20.126 1.906 1.00 0.00 H new ATOM 0 HG3 GLN B 53 14.289 18.558 1.269 1.00 0.00 H new ATOM 0 HE21 GLN B 53 14.415 20.723 3.973 1.00 0.00 H new ATOM 0 HE22 GLN B 53 15.250 19.637 5.090 1.00 0.00 H new ATOM 2430 N ALA B 54 16.843 18.642 -1.701 1.00 0.00 N ATOM 2431 CA ALA B 54 16.542 17.815 -2.864 1.00 0.00 C ATOM 2432 C ALA B 54 17.448 16.597 -2.951 1.00 0.00 C ATOM 2433 O ALA B 54 16.979 15.495 -3.239 1.00 0.00 O ATOM 2434 CB ALA B 54 16.659 18.638 -4.131 1.00 0.00 C ATOM 0 H ALA B 54 17.211 19.565 -1.930 1.00 0.00 H new ATOM 0 HA ALA B 54 15.519 17.455 -2.752 1.00 0.00 H new ATOM 0 HB1 ALA B 54 16.432 18.012 -4.994 1.00 0.00 H new ATOM 0 HB2 ALA B 54 15.955 19.469 -4.091 1.00 0.00 H new ATOM 0 HB3 ALA B 54 17.674 19.026 -4.221 1.00 0.00 H new ATOM 2440 N VAL B 55 18.741 16.792 -2.700 1.00 0.00 N ATOM 2441 CA VAL B 55 19.687 15.682 -2.751 1.00 0.00 C ATOM 2442 C VAL B 55 19.379 14.671 -1.643 1.00 0.00 C ATOM 2443 O VAL B 55 19.327 13.471 -1.893 1.00 0.00 O ATOM 2444 CB VAL B 55 21.172 16.157 -2.671 1.00 0.00 C ATOM 2445 CG1 VAL B 55 21.384 17.171 -1.566 1.00 0.00 C ATOM 2446 CG2 VAL B 55 22.127 14.985 -2.490 1.00 0.00 C ATOM 0 H VAL B 55 19.152 17.695 -2.463 1.00 0.00 H new ATOM 0 HA VAL B 55 19.565 15.198 -3.720 1.00 0.00 H new ATOM 0 HB VAL B 55 21.392 16.640 -3.623 1.00 0.00 H new ATOM 0 HG11 VAL B 55 22.431 17.474 -1.546 1.00 0.00 H new ATOM 0 HG12 VAL B 55 20.757 18.044 -1.748 1.00 0.00 H new ATOM 0 HG13 VAL B 55 21.117 16.726 -0.608 1.00 0.00 H new ATOM 0 HG21 VAL B 55 23.151 15.355 -2.439 1.00 0.00 H new ATOM 0 HG22 VAL B 55 21.885 14.457 -1.567 1.00 0.00 H new ATOM 0 HG23 VAL B 55 22.030 14.303 -3.334 1.00 0.00 H new ATOM 2456 N HIS B 56 19.132 15.170 -0.435 1.00 0.00 N ATOM 2457 CA HIS B 56 18.843 14.317 0.711 1.00 0.00 C ATOM 2458 C HIS B 56 17.511 13.580 0.566 1.00 0.00 C ATOM 2459 O HIS B 56 17.428 12.395 0.858 1.00 0.00 O ATOM 2460 CB HIS B 56 18.856 15.135 1.998 1.00 0.00 C ATOM 2461 CG HIS B 56 19.885 14.664 2.972 1.00 0.00 C ATOM 2462 ND1 HIS B 56 19.636 14.498 4.314 1.00 0.00 N ATOM 2463 CD2 HIS B 56 21.174 14.300 2.784 1.00 0.00 C ATOM 2464 CE1 HIS B 56 20.724 14.052 4.909 1.00 0.00 C ATOM 2465 NE2 HIS B 56 21.672 13.923 4.003 1.00 0.00 N ATOM 0 H HIS B 56 19.127 16.168 -0.225 1.00 0.00 H new ATOM 0 HA HIS B 56 19.628 13.562 0.755 1.00 0.00 H new ATOM 0 HB2 HIS B 56 19.043 16.181 1.756 1.00 0.00 H new ATOM 0 HB3 HIS B 56 17.872 15.086 2.464 1.00 0.00 H new ATOM 0 HD2 HIS B 56 21.711 14.306 1.847 1.00 0.00 H new ATOM 0 HE1 HIS B 56 20.822 13.830 5.961 1.00 0.00 H new ATOM 0 HE2 HIS B 56 22.622 13.596 4.180 1.00 0.00 H new ATOM 2474 N ARG B 57 16.481 14.287 0.101 1.00 0.00 N ATOM 2475 CA ARG B 57 15.131 13.728 -0.002 1.00 0.00 C ATOM 2476 C ARG B 57 15.068 12.572 -0.998 1.00 0.00 C ATOM 2477 O ARG B 57 14.553 11.497 -0.680 1.00 0.00 O ATOM 2478 CB ARG B 57 14.142 14.821 -0.416 1.00 0.00 C ATOM 2479 CG ARG B 57 12.692 14.484 -0.118 1.00 0.00 C ATOM 2480 CD ARG B 57 12.360 14.693 1.349 1.00 0.00 C ATOM 2481 NE ARG B 57 11.181 13.925 1.753 1.00 0.00 N ATOM 2482 CZ ARG B 57 11.222 12.666 2.196 1.00 0.00 C ATOM 2483 NH1 ARG B 57 12.386 12.052 2.369 1.00 0.00 N ATOM 2484 NH2 ARG B 57 10.095 12.034 2.493 1.00 0.00 N ATOM 0 H ARG B 57 16.556 15.255 -0.213 1.00 0.00 H new ATOM 0 HA ARG B 57 14.861 13.338 0.979 1.00 0.00 H new ATOM 0 HB2 ARG B 57 14.403 15.746 0.098 1.00 0.00 H new ATOM 0 HB3 ARG B 57 14.249 15.008 -1.484 1.00 0.00 H new ATOM 0 HG2 ARG B 57 12.040 15.106 -0.731 1.00 0.00 H new ATOM 0 HG3 ARG B 57 12.495 13.448 -0.392 1.00 0.00 H new ATOM 0 HD2 ARG B 57 13.213 14.399 1.960 1.00 0.00 H new ATOM 0 HD3 ARG B 57 12.185 15.753 1.535 1.00 0.00 H new ATOM 0 HE ARG B 57 10.270 14.381 1.692 1.00 0.00 H new ATOM 0 HH11 ARG B 57 13.257 12.542 2.163 1.00 0.00 H new ATOM 0 HH12 ARG B 57 12.410 11.090 2.708 1.00 0.00 H new ATOM 0 HH21 ARG B 57 9.199 12.510 2.383 1.00 0.00 H new ATOM 0 HH22 ARG B 57 10.124 11.072 2.832 1.00 0.00 H new ATOM 2498 N VAL B 58 15.599 12.798 -2.195 1.00 0.00 N ATOM 2499 CA VAL B 58 15.558 11.796 -3.256 1.00 0.00 C ATOM 2500 C VAL B 58 16.501 10.629 -2.942 1.00 0.00 C ATOM 2501 O VAL B 58 16.156 9.467 -3.170 1.00 0.00 O ATOM 2502 CB VAL B 58 15.904 12.426 -4.630 1.00 0.00 C ATOM 2503 CG1 VAL B 58 16.062 11.368 -5.715 1.00 0.00 C ATOM 2504 CG2 VAL B 58 14.828 13.429 -5.022 1.00 0.00 C ATOM 0 H VAL B 58 16.064 13.668 -2.456 1.00 0.00 H new ATOM 0 HA VAL B 58 14.541 11.407 -3.309 1.00 0.00 H new ATOM 0 HB VAL B 58 16.861 12.938 -4.533 1.00 0.00 H new ATOM 0 HG11 VAL B 58 16.304 11.851 -6.662 1.00 0.00 H new ATOM 0 HG12 VAL B 58 16.865 10.683 -5.441 1.00 0.00 H new ATOM 0 HG13 VAL B 58 15.130 10.812 -5.819 1.00 0.00 H new ATOM 0 HG21 VAL B 58 15.075 13.869 -5.988 1.00 0.00 H new ATOM 0 HG22 VAL B 58 13.865 12.922 -5.090 1.00 0.00 H new ATOM 0 HG23 VAL B 58 14.772 14.215 -4.269 1.00 0.00 H new ATOM 2514 N TRP B 59 17.676 10.941 -2.393 1.00 0.00 N ATOM 2515 CA TRP B 59 18.647 9.902 -2.019 1.00 0.00 C ATOM 2516 C TRP B 59 18.107 9.001 -0.908 1.00 0.00 C ATOM 2517 O TRP B 59 18.311 7.789 -0.939 1.00 0.00 O ATOM 2518 CB TRP B 59 19.973 10.516 -1.573 1.00 0.00 C ATOM 2519 CG TRP B 59 21.119 9.549 -1.609 1.00 0.00 C ATOM 2520 CD1 TRP B 59 21.692 8.916 -0.546 1.00 0.00 C ATOM 2521 CD2 TRP B 59 21.829 9.104 -2.770 1.00 0.00 C ATOM 2522 NE1 TRP B 59 22.716 8.107 -0.975 1.00 0.00 N ATOM 2523 CE2 TRP B 59 22.821 8.206 -2.337 1.00 0.00 C ATOM 2524 CE3 TRP B 59 21.721 9.381 -4.131 1.00 0.00 C ATOM 2525 CZ2 TRP B 59 23.700 7.584 -3.223 1.00 0.00 C ATOM 2526 CZ3 TRP B 59 22.591 8.765 -5.009 1.00 0.00 C ATOM 2527 CH2 TRP B 59 23.570 7.878 -4.554 1.00 0.00 C ATOM 0 H TRP B 59 17.980 11.895 -2.197 1.00 0.00 H new ATOM 0 HA TRP B 59 18.817 9.297 -2.910 1.00 0.00 H new ATOM 0 HB2 TRP B 59 20.205 11.367 -2.214 1.00 0.00 H new ATOM 0 HB3 TRP B 59 19.864 10.901 -0.559 1.00 0.00 H new ATOM 0 HD1 TRP B 59 21.386 9.033 0.483 1.00 0.00 H new ATOM 0 HE1 TRP B 59 23.303 7.526 -0.376 1.00 0.00 H new ATOM 0 HE3 TRP B 59 20.969 10.066 -4.494 1.00 0.00 H new ATOM 0 HZ2 TRP B 59 24.455 6.896 -2.872 1.00 0.00 H new ATOM 0 HZ3 TRP B 59 22.513 8.973 -6.066 1.00 0.00 H new ATOM 0 HH2 TRP B 59 24.237 7.415 -5.266 1.00 0.00 H new ATOM 2538 N ALA B 60 17.421 9.596 0.064 1.00 0.00 N ATOM 2539 CA ALA B 60 16.843 8.840 1.176 1.00 0.00 C ATOM 2540 C ALA B 60 15.773 7.874 0.681 1.00 0.00 C ATOM 2541 O ALA B 60 15.640 6.768 1.202 1.00 0.00 O ATOM 2542 CB ALA B 60 16.259 9.776 2.224 1.00 0.00 C ATOM 0 H ALA B 60 17.251 10.601 0.106 1.00 0.00 H new ATOM 0 HA ALA B 60 17.645 8.262 1.635 1.00 0.00 H new ATOM 0 HB1 ALA B 60 15.836 9.190 3.040 1.00 0.00 H new ATOM 0 HB2 ALA B 60 17.045 10.423 2.612 1.00 0.00 H new ATOM 0 HB3 ALA B 60 15.477 10.386 1.772 1.00 0.00 H new ATOM 2548 N ALA B 61 15.030 8.295 -0.338 1.00 0.00 N ATOM 2549 CA ALA B 61 14.004 7.459 -0.945 1.00 0.00 C ATOM 2550 C ALA B 61 14.637 6.312 -1.729 1.00 0.00 C ATOM 2551 O ALA B 61 14.149 5.183 -1.699 1.00 0.00 O ATOM 2552 CB ALA B 61 13.120 8.295 -1.854 1.00 0.00 C ATOM 0 H ALA B 61 15.122 9.218 -0.762 1.00 0.00 H new ATOM 0 HA ALA B 61 13.391 7.033 -0.151 1.00 0.00 H new ATOM 0 HB1 ALA B 61 12.356 7.660 -2.303 1.00 0.00 H new ATOM 0 HB2 ALA B 61 12.641 9.083 -1.272 1.00 0.00 H new ATOM 0 HB3 ALA B 61 13.727 8.743 -2.640 1.00 0.00 H new ATOM 2558 N PHE B 62 15.735 6.616 -2.416 1.00 0.00 N ATOM 2559 CA PHE B 62 16.485 5.624 -3.183 1.00 0.00 C ATOM 2560 C PHE B 62 17.102 4.574 -2.253 1.00 0.00 C ATOM 2561 O PHE B 62 17.101 3.382 -2.559 1.00 0.00 O ATOM 2562 CB PHE B 62 17.575 6.330 -4.005 1.00 0.00 C ATOM 2563 CG PHE B 62 18.511 5.408 -4.736 1.00 0.00 C ATOM 2564 CD1 PHE B 62 18.037 4.529 -5.698 1.00 0.00 C ATOM 2565 CD2 PHE B 62 19.868 5.426 -4.458 1.00 0.00 C ATOM 2566 CE1 PHE B 62 18.902 3.685 -6.367 1.00 0.00 C ATOM 2567 CE2 PHE B 62 20.736 4.585 -5.124 1.00 0.00 C ATOM 2568 CZ PHE B 62 20.253 3.713 -6.080 1.00 0.00 C ATOM 0 H PHE B 62 16.130 7.556 -2.457 1.00 0.00 H new ATOM 0 HA PHE B 62 15.805 5.109 -3.861 1.00 0.00 H new ATOM 0 HB2 PHE B 62 17.095 6.987 -4.730 1.00 0.00 H new ATOM 0 HB3 PHE B 62 18.159 6.964 -3.338 1.00 0.00 H new ATOM 0 HD1 PHE B 62 16.982 4.504 -5.926 1.00 0.00 H new ATOM 0 HD2 PHE B 62 20.251 6.106 -3.711 1.00 0.00 H new ATOM 0 HE1 PHE B 62 18.522 3.004 -7.114 1.00 0.00 H new ATOM 0 HE2 PHE B 62 21.792 4.609 -4.898 1.00 0.00 H new ATOM 0 HZ PHE B 62 20.931 3.054 -6.602 1.00 0.00 H new ATOM 2578 N GLU B 63 17.616 5.034 -1.117 1.00 0.00 N ATOM 2579 CA GLU B 63 18.222 4.157 -0.120 1.00 0.00 C ATOM 2580 C GLU B 63 17.166 3.276 0.557 1.00 0.00 C ATOM 2581 O GLU B 63 17.429 2.121 0.890 1.00 0.00 O ATOM 2582 CB GLU B 63 18.961 4.994 0.927 1.00 0.00 C ATOM 2583 CG GLU B 63 20.124 4.272 1.582 1.00 0.00 C ATOM 2584 CD GLU B 63 21.464 4.663 0.996 1.00 0.00 C ATOM 2585 OE1 GLU B 63 22.012 5.713 1.395 1.00 0.00 O ATOM 2586 OE2 GLU B 63 21.985 3.916 0.147 1.00 0.00 O ATOM 0 H GLU B 63 17.625 6.021 -0.862 1.00 0.00 H new ATOM 0 HA GLU B 63 18.932 3.502 -0.626 1.00 0.00 H new ATOM 0 HB2 GLU B 63 19.331 5.904 0.455 1.00 0.00 H new ATOM 0 HB3 GLU B 63 18.254 5.299 1.699 1.00 0.00 H new ATOM 0 HG2 GLU B 63 20.124 4.487 2.651 1.00 0.00 H new ATOM 0 HG3 GLU B 63 19.985 3.196 1.473 1.00 0.00 H new ATOM 2593 N ASP B 64 15.974 3.831 0.750 1.00 0.00 N ATOM 2594 CA ASP B 64 14.862 3.103 1.368 1.00 0.00 C ATOM 2595 C ASP B 64 14.326 2.027 0.420 1.00 0.00 C ATOM 2596 O ASP B 64 14.023 0.908 0.836 1.00 0.00 O ATOM 2597 CB ASP B 64 13.756 4.094 1.754 1.00 0.00 C ATOM 2598 CG ASP B 64 12.448 3.435 2.162 1.00 0.00 C ATOM 2599 OD1 ASP B 64 12.469 2.495 2.983 1.00 0.00 O ATOM 2600 OD2 ASP B 64 11.387 3.881 1.676 1.00 0.00 O ATOM 0 H ASP B 64 15.748 4.790 0.486 1.00 0.00 H new ATOM 0 HA ASP B 64 15.218 2.602 2.268 1.00 0.00 H new ATOM 0 HB2 ASP B 64 14.110 4.715 2.577 1.00 0.00 H new ATOM 0 HB3 ASP B 64 13.568 4.759 0.911 1.00 0.00 H new ATOM 2717 N ALA B 72 10.409 -10.986 -2.146 1.00 0.00 N ATOM 2718 CA ALA B 72 9.167 -10.343 -2.525 1.00 0.00 C ATOM 2719 C ALA B 72 8.082 -10.628 -1.501 1.00 0.00 C ATOM 2720 O ALA B 72 8.229 -11.509 -0.652 1.00 0.00 O ATOM 2721 CB ALA B 72 8.735 -10.811 -3.909 1.00 0.00 C ATOM 0 HA ALA B 72 9.329 -9.266 -2.556 1.00 0.00 H new ATOM 0 HB1 ALA B 72 7.801 -10.321 -4.183 1.00 0.00 H new ATOM 0 HB2 ALA B 72 9.506 -10.556 -4.636 1.00 0.00 H new ATOM 0 HB3 ALA B 72 8.589 -11.891 -3.899 1.00 0.00 H new ATOM 2727 N ARG B 73 7.005 -9.872 -1.576 1.00 0.00 N ATOM 2728 CA ARG B 73 5.862 -10.078 -0.710 1.00 0.00 C ATOM 2729 C ARG B 73 4.624 -10.304 -1.565 1.00 0.00 C ATOM 2730 O ARG B 73 4.200 -9.415 -2.306 1.00 0.00 O ATOM 2731 CB ARG B 73 5.665 -8.875 0.215 1.00 0.00 C ATOM 2732 CG ARG B 73 5.829 -9.199 1.691 1.00 0.00 C ATOM 2733 CD ARG B 73 4.687 -8.623 2.509 1.00 0.00 C ATOM 2734 NE ARG B 73 4.764 -8.998 3.923 1.00 0.00 N ATOM 2735 CZ ARG B 73 4.811 -8.124 4.931 1.00 0.00 C ATOM 2736 NH1 ARG B 73 4.849 -6.818 4.688 1.00 0.00 N ATOM 2737 NH2 ARG B 73 4.825 -8.567 6.183 1.00 0.00 N ATOM 0 H ARG B 73 6.898 -9.101 -2.236 1.00 0.00 H new ATOM 0 HA ARG B 73 6.035 -10.955 -0.086 1.00 0.00 H new ATOM 0 HB2 ARG B 73 6.380 -8.099 -0.058 1.00 0.00 H new ATOM 0 HB3 ARG B 73 4.669 -8.463 0.052 1.00 0.00 H new ATOM 0 HG2 ARG B 73 5.868 -10.280 1.827 1.00 0.00 H new ATOM 0 HG3 ARG B 73 6.776 -8.798 2.051 1.00 0.00 H new ATOM 0 HD2 ARG B 73 4.695 -7.536 2.424 1.00 0.00 H new ATOM 0 HD3 ARG B 73 3.739 -8.968 2.096 1.00 0.00 H new ATOM 0 HE ARG B 73 4.783 -9.992 4.152 1.00 0.00 H new ATOM 0 HH11 ARG B 73 4.842 -6.478 3.726 1.00 0.00 H new ATOM 0 HH12 ARG B 73 4.885 -6.156 5.463 1.00 0.00 H new ATOM 0 HH21 ARG B 73 4.800 -9.569 6.370 1.00 0.00 H new ATOM 0 HH22 ARG B 73 4.861 -7.905 6.958 1.00 0.00 H new ATOM 2751 N VAL B 74 4.056 -11.493 -1.476 1.00 0.00 N ATOM 2752 CA VAL B 74 2.917 -11.850 -2.305 1.00 0.00 C ATOM 2753 C VAL B 74 1.607 -11.391 -1.672 1.00 0.00 C ATOM 2754 O VAL B 74 1.364 -11.597 -0.480 1.00 0.00 O ATOM 2755 CB VAL B 74 2.861 -13.370 -2.597 1.00 0.00 C ATOM 2756 CG1 VAL B 74 3.975 -13.768 -3.551 1.00 0.00 C ATOM 2757 CG2 VAL B 74 2.942 -14.189 -1.314 1.00 0.00 C ATOM 0 H VAL B 74 4.364 -12.228 -0.839 1.00 0.00 H new ATOM 0 HA VAL B 74 3.049 -11.332 -3.255 1.00 0.00 H new ATOM 0 HB VAL B 74 1.901 -13.583 -3.067 1.00 0.00 H new ATOM 0 HG11 VAL B 74 3.922 -14.839 -3.746 1.00 0.00 H new ATOM 0 HG12 VAL B 74 3.864 -13.223 -4.488 1.00 0.00 H new ATOM 0 HG13 VAL B 74 4.940 -13.528 -3.104 1.00 0.00 H new ATOM 0 HG21 VAL B 74 2.900 -15.251 -1.557 1.00 0.00 H new ATOM 0 HG22 VAL B 74 3.879 -13.971 -0.802 1.00 0.00 H new ATOM 0 HG23 VAL B 74 2.105 -13.932 -0.665 1.00 0.00 H new ATOM 2767 N THR B 75 0.790 -10.731 -2.474 1.00 0.00 N ATOM 2768 CA THR B 75 -0.523 -10.286 -2.046 1.00 0.00 C ATOM 2769 C THR B 75 -1.599 -11.050 -2.800 1.00 0.00 C ATOM 2770 O THR B 75 -1.590 -11.090 -4.032 1.00 0.00 O ATOM 2771 CB THR B 75 -0.706 -8.774 -2.288 1.00 0.00 C ATOM 2772 OG1 THR B 75 0.576 -8.136 -2.372 1.00 0.00 O ATOM 2773 CG2 THR B 75 -1.525 -8.138 -1.173 1.00 0.00 C ATOM 0 H THR B 75 1.018 -10.489 -3.438 1.00 0.00 H new ATOM 0 HA THR B 75 -0.611 -10.479 -0.977 1.00 0.00 H new ATOM 0 HB THR B 75 -1.243 -8.641 -3.227 1.00 0.00 H new ATOM 0 HG1 THR B 75 0.454 -7.176 -2.527 1.00 0.00 H new ATOM 0 HG21 THR B 75 -1.639 -7.072 -1.368 1.00 0.00 H new ATOM 0 HG22 THR B 75 -2.508 -8.606 -1.131 1.00 0.00 H new ATOM 0 HG23 THR B 75 -1.015 -8.280 -0.220 1.00 0.00 H new ATOM 2781 N ALA B 76 -2.513 -11.662 -2.066 1.00 0.00 N ATOM 2782 CA ALA B 76 -3.590 -12.429 -2.673 1.00 0.00 C ATOM 2783 C ALA B 76 -4.845 -12.352 -1.824 1.00 0.00 C ATOM 2784 O ALA B 76 -4.772 -12.115 -0.623 1.00 0.00 O ATOM 2785 CB ALA B 76 -3.169 -13.880 -2.857 1.00 0.00 C ATOM 0 H ALA B 76 -2.531 -11.643 -1.046 1.00 0.00 H new ATOM 0 HA ALA B 76 -3.807 -12.000 -3.651 1.00 0.00 H new ATOM 0 HB1 ALA B 76 -3.985 -14.441 -3.312 1.00 0.00 H new ATOM 0 HB2 ALA B 76 -2.293 -13.925 -3.504 1.00 0.00 H new ATOM 0 HB3 ALA B 76 -2.927 -14.314 -1.887 1.00 0.00 H new ATOM 2791 N VAL B 77 -5.992 -12.546 -2.450 1.00 0.00 N ATOM 2792 CA VAL B 77 -7.249 -12.610 -1.725 1.00 0.00 C ATOM 2793 C VAL B 77 -7.373 -13.973 -1.065 1.00 0.00 C ATOM 2794 O VAL B 77 -7.330 -14.990 -1.746 1.00 0.00 O ATOM 2795 CB VAL B 77 -8.467 -12.383 -2.655 1.00 0.00 C ATOM 2796 CG1 VAL B 77 -9.775 -12.487 -1.883 1.00 0.00 C ATOM 2797 CG2 VAL B 77 -8.370 -11.036 -3.348 1.00 0.00 C ATOM 0 H VAL B 77 -6.079 -12.662 -3.460 1.00 0.00 H new ATOM 0 HA VAL B 77 -7.246 -11.816 -0.978 1.00 0.00 H new ATOM 0 HB VAL B 77 -8.456 -13.166 -3.413 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -10.612 -12.323 -2.562 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -9.857 -13.479 -1.438 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -9.794 -11.734 -1.096 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -9.235 -10.897 -3.996 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -8.346 -10.243 -2.600 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -7.459 -10.999 -3.946 1.00 0.00 H new ATOM 2807 N LEU B 78 -7.492 -13.974 0.257 1.00 0.00 N ATOM 2808 CA LEU B 78 -7.628 -15.200 1.037 1.00 0.00 C ATOM 2809 C LEU B 78 -8.255 -14.870 2.390 1.00 0.00 C ATOM 2810 O LEU B 78 -8.042 -13.777 2.915 1.00 0.00 O ATOM 2811 CB LEU B 78 -6.260 -15.872 1.243 1.00 0.00 C ATOM 2812 CG LEU B 78 -5.955 -17.047 0.307 1.00 0.00 C ATOM 2813 CD1 LEU B 78 -4.706 -16.766 -0.517 1.00 0.00 C ATOM 2814 CD2 LEU B 78 -5.787 -18.332 1.098 1.00 0.00 C ATOM 0 H LEU B 78 -7.497 -13.124 0.820 1.00 0.00 H new ATOM 0 HA LEU B 78 -8.269 -15.894 0.493 1.00 0.00 H new ATOM 0 HB2 LEU B 78 -5.482 -15.119 1.118 1.00 0.00 H new ATOM 0 HB3 LEU B 78 -6.199 -16.225 2.273 1.00 0.00 H new ATOM 0 HG LEU B 78 -6.798 -17.168 -0.373 1.00 0.00 H new ATOM 0 HD11 LEU B 78 -4.506 -17.612 -1.175 1.00 0.00 H new ATOM 0 HD12 LEU B 78 -4.860 -15.868 -1.116 1.00 0.00 H new ATOM 0 HD13 LEU B 78 -3.857 -16.616 0.149 1.00 0.00 H new ATOM 0 HD21 LEU B 78 -5.571 -19.154 0.415 1.00 0.00 H new ATOM 0 HD22 LEU B 78 -4.963 -18.220 1.803 1.00 0.00 H new ATOM 0 HD23 LEU B 78 -6.706 -18.546 1.644 1.00 0.00 H new ATOM 2826 N PRO B 79 -9.055 -15.793 2.961 1.00 0.00 N ATOM 2827 CA PRO B 79 -9.694 -15.588 4.270 1.00 0.00 C ATOM 2828 C PRO B 79 -8.690 -15.412 5.417 1.00 0.00 C ATOM 2829 O PRO B 79 -7.548 -15.873 5.343 1.00 0.00 O ATOM 2830 CB PRO B 79 -10.521 -16.862 4.476 1.00 0.00 C ATOM 2831 CG PRO B 79 -10.682 -17.447 3.115 1.00 0.00 C ATOM 2832 CD PRO B 79 -9.429 -17.087 2.368 1.00 0.00 C ATOM 0 HA PRO B 79 -10.283 -14.671 4.279 1.00 0.00 H new ATOM 0 HB2 PRO B 79 -10.014 -17.557 5.146 1.00 0.00 H new ATOM 0 HB3 PRO B 79 -11.488 -16.635 4.924 1.00 0.00 H new ATOM 0 HG2 PRO B 79 -10.811 -18.528 3.166 1.00 0.00 H new ATOM 0 HG3 PRO B 79 -11.564 -17.044 2.617 1.00 0.00 H new ATOM 0 HD2 PRO B 79 -8.648 -17.835 2.504 1.00 0.00 H new ATOM 0 HD3 PRO B 79 -9.607 -17.004 1.296 1.00 0.00 H new ATOM 2840 N GLU B 80 -9.152 -14.769 6.490 1.00 0.00 N ATOM 2841 CA GLU B 80 -8.307 -14.428 7.640 1.00 0.00 C ATOM 2842 C GLU B 80 -7.906 -15.668 8.443 1.00 0.00 C ATOM 2843 O GLU B 80 -6.879 -15.671 9.120 1.00 0.00 O ATOM 2844 CB GLU B 80 -9.017 -13.426 8.568 1.00 0.00 C ATOM 2845 CG GLU B 80 -10.504 -13.241 8.282 1.00 0.00 C ATOM 2846 CD GLU B 80 -11.360 -14.363 8.842 1.00 0.00 C ATOM 2847 OE1 GLU B 80 -11.421 -15.438 8.209 1.00 0.00 O ATOM 2848 OE2 GLU B 80 -11.980 -14.167 9.905 1.00 0.00 O ATOM 0 H GLU B 80 -10.122 -14.469 6.588 1.00 0.00 H new ATOM 0 HA GLU B 80 -7.402 -13.971 7.239 1.00 0.00 H new ATOM 0 HB2 GLU B 80 -8.897 -13.758 9.599 1.00 0.00 H new ATOM 0 HB3 GLU B 80 -8.521 -12.459 8.485 1.00 0.00 H new ATOM 0 HG2 GLU B 80 -10.835 -12.293 8.706 1.00 0.00 H new ATOM 0 HG3 GLU B 80 -10.656 -13.179 7.204 1.00 0.00 H new ATOM 2855 N HIS B 81 -8.725 -16.714 8.369 1.00 0.00 N ATOM 2856 CA HIS B 81 -8.419 -17.989 9.022 1.00 0.00 C ATOM 2857 C HIS B 81 -7.140 -18.591 8.444 1.00 0.00 C ATOM 2858 O HIS B 81 -6.307 -19.137 9.169 1.00 0.00 O ATOM 2859 CB HIS B 81 -9.581 -18.971 8.846 1.00 0.00 C ATOM 2860 CG HIS B 81 -10.735 -18.725 9.769 1.00 0.00 C ATOM 2861 ND1 HIS B 81 -10.641 -18.823 11.138 1.00 0.00 N ATOM 2862 CD2 HIS B 81 -12.018 -18.384 9.507 1.00 0.00 C ATOM 2863 CE1 HIS B 81 -11.814 -18.558 11.678 1.00 0.00 C ATOM 2864 NE2 HIS B 81 -12.670 -18.288 10.710 1.00 0.00 N ATOM 0 H HIS B 81 -9.610 -16.706 7.862 1.00 0.00 H new ATOM 0 HA HIS B 81 -8.272 -17.802 10.086 1.00 0.00 H new ATOM 0 HB2 HIS B 81 -9.935 -18.917 7.817 1.00 0.00 H new ATOM 0 HB3 HIS B 81 -9.213 -19.985 9.004 1.00 0.00 H new ATOM 0 HD2 HIS B 81 -12.449 -18.218 8.531 1.00 0.00 H new ATOM 0 HE1 HIS B 81 -12.037 -18.561 12.735 1.00 0.00 H new ATOM 0 HE2 HIS B 81 -13.653 -18.048 10.836 1.00 0.00 H new ATOM 2873 N GLN B 82 -6.999 -18.470 7.130 1.00 0.00 N ATOM 2874 CA GLN B 82 -5.825 -18.958 6.416 1.00 0.00 C ATOM 2875 C GLN B 82 -4.606 -18.070 6.684 1.00 0.00 C ATOM 2876 O GLN B 82 -3.466 -18.529 6.612 1.00 0.00 O ATOM 2877 CB GLN B 82 -6.114 -19.026 4.913 1.00 0.00 C ATOM 2878 CG GLN B 82 -7.532 -19.471 4.582 1.00 0.00 C ATOM 2879 CD GLN B 82 -7.578 -20.558 3.527 1.00 0.00 C ATOM 2880 OE1 GLN B 82 -8.304 -20.453 2.539 1.00 0.00 O ATOM 2881 NE2 GLN B 82 -6.808 -21.613 3.733 1.00 0.00 N ATOM 0 H GLN B 82 -7.696 -18.030 6.528 1.00 0.00 H new ATOM 0 HA GLN B 82 -5.597 -19.960 6.780 1.00 0.00 H new ATOM 0 HB2 GLN B 82 -5.939 -18.044 4.474 1.00 0.00 H new ATOM 0 HB3 GLN B 82 -5.409 -19.714 4.447 1.00 0.00 H new ATOM 0 HG2 GLN B 82 -8.015 -19.832 5.490 1.00 0.00 H new ATOM 0 HG3 GLN B 82 -8.106 -18.611 4.236 1.00 0.00 H new ATOM 0 HE21 GLN B 82 -6.221 -21.661 4.565 1.00 0.00 H new ATOM 0 HE22 GLN B 82 -6.801 -22.379 3.059 1.00 0.00 H new ATOM 2890 N ALA B 83 -4.863 -16.799 7.006 1.00 0.00 N ATOM 2891 CA ALA B 83 -3.806 -15.807 7.212 1.00 0.00 C ATOM 2892 C ALA B 83 -2.905 -16.144 8.399 1.00 0.00 C ATOM 2893 O ALA B 83 -1.764 -15.683 8.457 1.00 0.00 O ATOM 2894 CB ALA B 83 -4.404 -14.422 7.383 1.00 0.00 C ATOM 0 H ALA B 83 -5.806 -16.431 7.131 1.00 0.00 H new ATOM 0 HA ALA B 83 -3.179 -15.824 6.320 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -3.605 -13.697 7.535 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -4.969 -14.157 6.490 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -5.068 -14.417 8.247 1.00 0.00 H new ATOM 2900 N TYR B 84 -3.422 -16.929 9.346 1.00 0.00 N ATOM 2901 CA TYR B 84 -2.626 -17.399 10.482 1.00 0.00 C ATOM 2902 C TYR B 84 -1.399 -18.157 9.987 1.00 0.00 C ATOM 2903 O TYR B 84 -0.269 -17.880 10.392 1.00 0.00 O ATOM 2904 CB TYR B 84 -3.463 -18.317 11.384 1.00 0.00 C ATOM 2905 CG TYR B 84 -2.699 -18.869 12.577 1.00 0.00 C ATOM 2906 CD1 TYR B 84 -2.647 -18.163 13.775 1.00 0.00 C ATOM 2907 CD2 TYR B 84 -2.027 -20.091 12.507 1.00 0.00 C ATOM 2908 CE1 TYR B 84 -1.953 -18.653 14.862 1.00 0.00 C ATOM 2909 CE2 TYR B 84 -1.331 -20.584 13.595 1.00 0.00 C ATOM 2910 CZ TYR B 84 -1.300 -19.861 14.769 1.00 0.00 C ATOM 2911 OH TYR B 84 -0.605 -20.347 15.855 1.00 0.00 O ATOM 0 H TYR B 84 -4.389 -17.253 9.349 1.00 0.00 H new ATOM 0 HA TYR B 84 -2.307 -16.530 11.058 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -4.330 -17.764 11.744 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -3.840 -19.149 10.789 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -3.159 -17.215 13.855 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -2.051 -20.660 11.589 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -1.922 -18.090 15.783 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -0.814 -21.530 13.526 1.00 0.00 H new ATOM 0 HH TYR B 84 -0.202 -21.210 15.626 1.00 0.00 H new ATOM 2921 N ILE B 85 -1.640 -19.103 9.088 1.00 0.00 N ATOM 2922 CA ILE B 85 -0.585 -19.943 8.547 1.00 0.00 C ATOM 2923 C ILE B 85 0.236 -19.178 7.516 1.00 0.00 C ATOM 2924 O ILE B 85 1.397 -19.493 7.269 1.00 0.00 O ATOM 2925 CB ILE B 85 -1.141 -21.231 7.903 1.00 0.00 C ATOM 2926 CG1 ILE B 85 -2.475 -21.640 8.543 1.00 0.00 C ATOM 2927 CG2 ILE B 85 -0.125 -22.345 8.050 1.00 0.00 C ATOM 2928 CD1 ILE B 85 -3.560 -21.958 7.537 1.00 0.00 C ATOM 0 H ILE B 85 -2.568 -19.307 8.717 1.00 0.00 H new ATOM 0 HA ILE B 85 0.051 -20.228 9.385 1.00 0.00 H new ATOM 0 HB ILE B 85 -1.325 -21.041 6.846 1.00 0.00 H new ATOM 0 HG12 ILE B 85 -2.312 -22.512 9.176 1.00 0.00 H new ATOM 0 HG13 ILE B 85 -2.818 -20.835 9.192 1.00 0.00 H new ATOM 0 HG21 ILE B 85 -0.515 -23.256 7.596 1.00 0.00 H new ATOM 0 HG22 ILE B 85 0.802 -22.060 7.552 1.00 0.00 H new ATOM 0 HG23 ILE B 85 0.071 -22.522 9.108 1.00 0.00 H new ATOM 0 HD11 ILE B 85 -4.473 -22.239 8.063 1.00 0.00 H new ATOM 0 HD12 ILE B 85 -3.752 -21.081 6.920 1.00 0.00 H new ATOM 0 HD13 ILE B 85 -3.238 -22.784 6.903 1.00 0.00 H new ATOM 2940 N VAL B 86 -0.381 -18.164 6.927 1.00 0.00 N ATOM 2941 CA VAL B 86 0.295 -17.276 5.993 1.00 0.00 C ATOM 2942 C VAL B 86 1.391 -16.485 6.720 1.00 0.00 C ATOM 2943 O VAL B 86 2.477 -16.266 6.180 1.00 0.00 O ATOM 2944 CB VAL B 86 -0.736 -16.325 5.316 1.00 0.00 C ATOM 2945 CG1 VAL B 86 -0.117 -15.019 4.842 1.00 0.00 C ATOM 2946 CG2 VAL B 86 -1.423 -17.030 4.156 1.00 0.00 C ATOM 0 H VAL B 86 -1.362 -17.934 7.083 1.00 0.00 H new ATOM 0 HA VAL B 86 0.769 -17.869 5.211 1.00 0.00 H new ATOM 0 HB VAL B 86 -1.472 -16.068 6.078 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -0.885 -14.399 4.379 1.00 0.00 H new ATOM 0 HG12 VAL B 86 0.312 -14.490 5.693 1.00 0.00 H new ATOM 0 HG13 VAL B 86 0.666 -15.231 4.114 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -2.141 -16.353 3.693 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -0.678 -17.329 3.419 1.00 0.00 H new ATOM 0 HG23 VAL B 86 -1.944 -17.914 4.524 1.00 0.00 H new ATOM 2956 N ARG B 87 1.106 -16.106 7.966 1.00 0.00 N ATOM 2957 CA ARG B 87 2.068 -15.402 8.808 1.00 0.00 C ATOM 2958 C ARG B 87 3.230 -16.314 9.201 1.00 0.00 C ATOM 2959 O ARG B 87 4.337 -15.847 9.472 1.00 0.00 O ATOM 2960 CB ARG B 87 1.377 -14.875 10.064 1.00 0.00 C ATOM 2961 CG ARG B 87 0.695 -13.538 9.858 1.00 0.00 C ATOM 2962 CD ARG B 87 0.989 -12.591 11.004 1.00 0.00 C ATOM 2963 NE ARG B 87 1.928 -11.540 10.616 1.00 0.00 N ATOM 2964 CZ ARG B 87 1.607 -10.250 10.526 1.00 0.00 C ATOM 2965 NH1 ARG B 87 0.363 -9.848 10.771 1.00 0.00 N ATOM 2966 NH2 ARG B 87 2.527 -9.359 10.184 1.00 0.00 N ATOM 0 H ARG B 87 0.207 -16.278 8.416 1.00 0.00 H new ATOM 0 HA ARG B 87 2.468 -14.566 8.235 1.00 0.00 H new ATOM 0 HB2 ARG B 87 0.638 -15.604 10.397 1.00 0.00 H new ATOM 0 HB3 ARG B 87 2.113 -14.780 10.862 1.00 0.00 H new ATOM 0 HG2 ARG B 87 1.032 -13.095 8.921 1.00 0.00 H new ATOM 0 HG3 ARG B 87 -0.382 -13.685 9.771 1.00 0.00 H new ATOM 0 HD2 ARG B 87 0.059 -12.138 11.348 1.00 0.00 H new ATOM 0 HD3 ARG B 87 1.400 -13.153 11.843 1.00 0.00 H new ATOM 0 HE ARG B 87 2.888 -11.811 10.401 1.00 0.00 H new ATOM 0 HH11 ARG B 87 -0.351 -10.529 11.029 1.00 0.00 H new ATOM 0 HH12 ARG B 87 0.123 -8.859 10.700 1.00 0.00 H new ATOM 0 HH21 ARG B 87 3.482 -9.661 9.989 1.00 0.00 H new ATOM 0 HH22 ARG B 87 2.280 -8.372 10.115 1.00 0.00 H new ATOM 2980 N LYS B 88 2.969 -17.617 9.241 1.00 0.00 N ATOM 2981 CA LYS B 88 4.008 -18.603 9.515 1.00 0.00 C ATOM 2982 C LYS B 88 4.859 -18.829 8.267 1.00 0.00 C ATOM 2983 O LYS B 88 6.073 -19.020 8.350 1.00 0.00 O ATOM 2984 CB LYS B 88 3.381 -19.923 9.970 1.00 0.00 C ATOM 2985 CG LYS B 88 4.186 -20.651 11.032 1.00 0.00 C ATOM 2986 CD LYS B 88 3.883 -20.119 12.424 1.00 0.00 C ATOM 2987 CE LYS B 88 5.149 -19.946 13.247 1.00 0.00 C ATOM 2988 NZ LYS B 88 4.908 -20.163 14.698 1.00 0.00 N ATOM 0 H LYS B 88 2.043 -18.015 9.086 1.00 0.00 H new ATOM 0 HA LYS B 88 4.646 -18.225 10.314 1.00 0.00 H new ATOM 0 HB2 LYS B 88 2.382 -19.725 10.357 1.00 0.00 H new ATOM 0 HB3 LYS B 88 3.264 -20.576 9.105 1.00 0.00 H new ATOM 0 HG2 LYS B 88 3.962 -21.717 10.992 1.00 0.00 H new ATOM 0 HG3 LYS B 88 5.250 -20.540 10.823 1.00 0.00 H new ATOM 0 HD2 LYS B 88 3.367 -19.162 12.344 1.00 0.00 H new ATOM 0 HD3 LYS B 88 3.207 -20.803 12.936 1.00 0.00 H new ATOM 0 HE2 LYS B 88 5.907 -20.647 12.897 1.00 0.00 H new ATOM 0 HE3 LYS B 88 5.547 -18.943 13.092 1.00 0.00 H new ATOM 0 HZ1 LYS B 88 5.798 -20.035 15.221 1.00 0.00 H new ATOM 0 HZ2 LYS B 88 4.204 -19.478 15.039 1.00 0.00 H new ATOM 0 HZ3 LYS B 88 4.553 -21.129 14.850 1.00 0.00 H new ATOM 3002 N TRP B 89 4.207 -18.778 7.109 1.00 0.00 N ATOM 3003 CA TRP B 89 4.870 -18.985 5.824 1.00 0.00 C ATOM 3004 C TRP B 89 5.740 -17.787 5.453 1.00 0.00 C ATOM 3005 O TRP B 89 6.623 -17.899 4.603 1.00 0.00 O ATOM 3006 CB TRP B 89 3.836 -19.240 4.724 1.00 0.00 C ATOM 3007 CG TRP B 89 3.386 -20.671 4.633 1.00 0.00 C ATOM 3008 CD1 TRP B 89 3.446 -21.622 5.614 1.00 0.00 C ATOM 3009 CD2 TRP B 89 2.804 -21.313 3.490 1.00 0.00 C ATOM 3010 NE1 TRP B 89 2.933 -22.809 5.154 1.00 0.00 N ATOM 3011 CE2 TRP B 89 2.535 -22.647 3.853 1.00 0.00 C ATOM 3012 CE3 TRP B 89 2.485 -20.889 2.195 1.00 0.00 C ATOM 3013 CZ2 TRP B 89 1.960 -23.557 2.969 1.00 0.00 C ATOM 3014 CZ3 TRP B 89 1.916 -21.794 1.320 1.00 0.00 C ATOM 3015 CH2 TRP B 89 1.659 -23.115 1.709 1.00 0.00 C ATOM 0 H TRP B 89 3.207 -18.593 7.034 1.00 0.00 H new ATOM 0 HA TRP B 89 5.514 -19.860 5.918 1.00 0.00 H new ATOM 0 HB2 TRP B 89 2.967 -18.606 4.902 1.00 0.00 H new ATOM 0 HB3 TRP B 89 4.258 -18.940 3.765 1.00 0.00 H new ATOM 0 HD1 TRP B 89 3.840 -21.462 6.607 1.00 0.00 H new ATOM 0 HE1 TRP B 89 2.860 -23.672 5.693 1.00 0.00 H new ATOM 0 HE3 TRP B 89 2.680 -19.873 1.885 1.00 0.00 H new ATOM 0 HZ2 TRP B 89 1.759 -24.575 3.267 1.00 0.00 H new ATOM 0 HZ3 TRP B 89 1.665 -21.478 0.318 1.00 0.00 H new ATOM 0 HH2 TRP B 89 1.214 -23.798 1.001 1.00 0.00 H new ATOM 3026 N GLU B 90 5.479 -16.647 6.095 1.00 0.00 N ATOM 3027 CA GLU B 90 6.276 -15.437 5.911 1.00 0.00 C ATOM 3028 C GLU B 90 7.750 -15.704 6.214 1.00 0.00 C ATOM 3029 O GLU B 90 8.632 -15.409 5.408 1.00 0.00 O ATOM 3030 CB GLU B 90 5.775 -14.331 6.840 1.00 0.00 C ATOM 3031 CG GLU B 90 4.566 -13.580 6.318 1.00 0.00 C ATOM 3032 CD GLU B 90 4.689 -12.084 6.513 1.00 0.00 C ATOM 3033 OE1 GLU B 90 4.693 -11.627 7.674 1.00 0.00 O ATOM 3034 OE2 GLU B 90 4.795 -11.359 5.508 1.00 0.00 O ATOM 0 H GLU B 90 4.710 -16.538 6.756 1.00 0.00 H new ATOM 0 HA GLU B 90 6.174 -15.125 4.872 1.00 0.00 H new ATOM 0 HB2 GLU B 90 5.527 -14.769 7.807 1.00 0.00 H new ATOM 0 HB3 GLU B 90 6.584 -13.621 7.010 1.00 0.00 H new ATOM 0 HG2 GLU B 90 4.437 -13.796 5.257 1.00 0.00 H new ATOM 0 HG3 GLU B 90 3.671 -13.938 6.827 1.00 0.00 H new ATOM 3041 N ALA B 91 7.999 -16.279 7.388 1.00 0.00 N ATOM 3042 CA ALA B 91 9.354 -16.593 7.821 1.00 0.00 C ATOM 3043 C ALA B 91 9.862 -17.870 7.156 1.00 0.00 C ATOM 3044 O ALA B 91 11.070 -18.082 7.036 1.00 0.00 O ATOM 3045 CB ALA B 91 9.397 -16.728 9.337 1.00 0.00 C ATOM 0 H ALA B 91 7.275 -16.537 8.058 1.00 0.00 H new ATOM 0 HA ALA B 91 10.009 -15.776 7.518 1.00 0.00 H new ATOM 0 HB1 ALA B 91 10.414 -16.963 9.653 1.00 0.00 H new ATOM 0 HB2 ALA B 91 9.082 -15.790 9.795 1.00 0.00 H new ATOM 0 HB3 ALA B 91 8.726 -17.528 9.650 1.00 0.00 H new ATOM 3051 N ASP B 92 8.930 -18.710 6.721 1.00 0.00 N ATOM 3052 CA ASP B 92 9.263 -19.993 6.112 1.00 0.00 C ATOM 3053 C ASP B 92 9.881 -19.811 4.728 1.00 0.00 C ATOM 3054 O ASP B 92 10.834 -20.503 4.374 1.00 0.00 O ATOM 3055 CB ASP B 92 8.017 -20.870 6.011 1.00 0.00 C ATOM 3056 CG ASP B 92 8.353 -22.346 5.980 1.00 0.00 C ATOM 3057 OD1 ASP B 92 8.898 -22.860 6.981 1.00 0.00 O ATOM 3058 OD2 ASP B 92 8.071 -23.002 4.958 1.00 0.00 O ATOM 0 H ASP B 92 7.929 -18.523 6.780 1.00 0.00 H new ATOM 0 HA ASP B 92 9.999 -20.481 6.751 1.00 0.00 H new ATOM 0 HB2 ASP B 92 7.363 -20.667 6.859 1.00 0.00 H new ATOM 0 HB3 ASP B 92 7.463 -20.607 5.110 1.00 0.00 H new ATOM 3063 N ALA B 93 9.340 -18.868 3.957 1.00 0.00 N ATOM 3064 CA ALA B 93 9.846 -18.580 2.616 1.00 0.00 C ATOM 3065 C ALA B 93 11.185 -17.853 2.674 1.00 0.00 C ATOM 3066 O ALA B 93 12.009 -17.974 1.765 1.00 0.00 O ATOM 3067 CB ALA B 93 8.836 -17.764 1.829 1.00 0.00 C ATOM 0 H ALA B 93 8.549 -18.289 4.240 1.00 0.00 H new ATOM 0 HA ALA B 93 10.001 -19.531 2.107 1.00 0.00 H new ATOM 0 HB1 ALA B 93 9.230 -17.559 0.834 1.00 0.00 H new ATOM 0 HB2 ALA B 93 7.904 -18.323 1.743 1.00 0.00 H new ATOM 0 HB3 ALA B 93 8.647 -16.823 2.345 1.00 0.00 H new