USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 759 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 112 SER OG : rot 180:sc= 0.39 USER MOD Set 1.2: A 115 THR OG1 : rot -85:sc= 0.422 USER MOD Set 2.1: A 11 SER OG : rot 180:sc=-0.00575 USER MOD Set 2.2: A 12 HIS :FLIP no HD1:sc= -3.25! C(o=-4.8!,f=-3.3!) USER MOD Single : A 6 SER OG : rot 70:sc= 0.422 USER MOD Single : A 7 LYS NZ :NH3+ 154:sc= -0.247 (180deg=-1.06) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 CYS SG : rot 180:sc= 0 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= -0.391 USER MOD Single : A 21 LYS NZ :NH3+ 161:sc= -0.453 (180deg=-1.29) USER MOD Single : A 22 SER OG : rot 114:sc= 1.09 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot -61:sc= 0.895 USER MOD Single : A 37 ASN : amide:sc= -3.69! C(o=-3.7!,f=-4.5!) USER MOD Single : A 40 SER OG : rot 180:sc= -0.0603 USER MOD Single : A 43 SER OG : rot 2:sc= 0.297 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 127:sc= 0.11 USER MOD Single : A 52 SER OG : rot 20:sc= 0.603 USER MOD Single : A 55 LYS NZ :NH3+ -149:sc= -0.0872 (180deg=-0.83) USER MOD Single : A 62 SER OG : rot -117:sc= 0.621 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 HIS :FLIP no HD1:sc= -0.787 F(o=-3.7!,f=-0.79) USER MOD Single : A 85 SER OG : rot 171:sc= 0.217 USER MOD Single : A 90 MET CE :methyl -154:sc= -0.877 (180deg=-2.95!) USER MOD Single : A 91 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 TYR OH : rot 180:sc= -0.107 USER MOD Single : A 107 HIS : no HD1:sc= -0.0466 X(o=-0.047,f=0) USER MOD Single : A 110 SER OG : rot -106:sc= 0.301 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ -160:sc= -0.146 (180deg=-0.9) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 ASN :FLIP amide:sc= -0.0726 F(o=-2.1!,f=-0.073) USER MOD Single : A 126 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 TYR OH : rot 180:sc= -0.0889 USER MOD Single : A 134 LYS NZ :NH3+ -163:sc= -0.443 (180deg=-1.65) USER MOD ----------------------------------------------------------------- ATOM 80 N SER A 6 -6.243 15.827 0.877 1.00 0.00 N ATOM 81 CA SER A 6 -5.473 14.903 1.763 1.00 0.00 C ATOM 82 C SER A 6 -6.318 14.578 2.996 1.00 0.00 C ATOM 83 O SER A 6 -7.031 15.419 3.506 1.00 0.00 O ATOM 84 CB SER A 6 -4.166 15.574 2.194 1.00 0.00 C ATOM 85 OG SER A 6 -3.856 15.192 3.529 1.00 0.00 O ATOM 0 HA SER A 6 -5.240 13.984 1.225 1.00 0.00 H new ATOM 0 HB2 SER A 6 -3.357 15.283 1.524 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.262 16.658 2.127 1.00 0.00 H new ATOM 0 HG SER A 6 -3.595 14.248 3.547 1.00 0.00 H new ATOM 91 N LYS A 7 -6.251 13.362 3.477 1.00 0.00 N ATOM 92 CA LYS A 7 -7.061 12.980 4.676 1.00 0.00 C ATOM 93 C LYS A 7 -6.126 12.586 5.821 1.00 0.00 C ATOM 94 O LYS A 7 -5.225 11.790 5.653 1.00 0.00 O ATOM 95 CB LYS A 7 -7.962 11.787 4.328 1.00 0.00 C ATOM 96 CG LYS A 7 -8.540 11.958 2.921 1.00 0.00 C ATOM 97 CD LYS A 7 -9.462 13.179 2.887 1.00 0.00 C ATOM 98 CE LYS A 7 -10.194 13.228 1.545 1.00 0.00 C ATOM 99 NZ LYS A 7 -10.981 11.976 1.360 1.00 0.00 N ATOM 0 H LYS A 7 -5.671 12.617 3.092 1.00 0.00 H new ATOM 0 HA LYS A 7 -7.676 13.827 4.980 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.390 10.861 4.385 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -8.771 11.708 5.055 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -7.733 12.079 2.198 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -9.094 11.064 2.634 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -10.182 13.128 3.704 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -8.882 14.090 3.030 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -10.855 14.094 1.511 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -9.477 13.343 0.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -11.785 12.161 0.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -10.373 11.242 0.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -11.335 11.649 2.282 1.00 0.00 H new ATOM 113 N ALA A 8 -6.330 13.135 6.988 1.00 0.00 N ATOM 114 CA ALA A 8 -5.448 12.785 8.137 1.00 0.00 C ATOM 115 C ALA A 8 -5.933 11.482 8.776 1.00 0.00 C ATOM 116 O ALA A 8 -7.115 11.214 8.847 1.00 0.00 O ATOM 117 CB ALA A 8 -5.486 13.911 9.177 1.00 0.00 C ATOM 0 H ALA A 8 -7.067 13.809 7.195 1.00 0.00 H new ATOM 0 HA ALA A 8 -4.426 12.656 7.781 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -4.840 13.653 10.016 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -5.137 14.838 8.722 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -6.508 14.044 9.533 1.00 0.00 H new ATOM 123 N TYR A 9 -5.025 10.672 9.246 1.00 0.00 N ATOM 124 CA TYR A 9 -5.428 9.389 9.885 1.00 0.00 C ATOM 125 C TYR A 9 -4.277 8.886 10.761 1.00 0.00 C ATOM 126 O TYR A 9 -3.129 8.909 10.367 1.00 0.00 O ATOM 127 CB TYR A 9 -5.750 8.354 8.800 1.00 0.00 C ATOM 128 CG TYR A 9 -6.852 7.438 9.281 1.00 0.00 C ATOM 129 CD1 TYR A 9 -8.191 7.786 9.070 1.00 0.00 C ATOM 130 CD2 TYR A 9 -6.534 6.245 9.939 1.00 0.00 C ATOM 131 CE1 TYR A 9 -9.212 6.939 9.516 1.00 0.00 C ATOM 132 CE2 TYR A 9 -7.555 5.398 10.386 1.00 0.00 C ATOM 133 CZ TYR A 9 -8.894 5.746 10.175 1.00 0.00 C ATOM 134 OH TYR A 9 -9.901 4.911 10.614 1.00 0.00 O ATOM 0 H TYR A 9 -4.020 10.844 9.215 1.00 0.00 H new ATOM 0 HA TYR A 9 -6.314 9.543 10.501 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -6.057 8.857 7.883 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -4.859 7.773 8.562 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -8.436 8.708 8.563 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -5.500 5.977 10.102 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -10.245 7.206 9.352 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -7.310 4.477 10.893 1.00 0.00 H new ATOM 0 HH TYR A 9 -9.508 4.126 11.050 1.00 0.00 H new ATOM 144 N GLY A 10 -4.575 8.438 11.949 1.00 0.00 N ATOM 145 CA GLY A 10 -3.493 7.942 12.844 1.00 0.00 C ATOM 146 C GLY A 10 -2.628 9.121 13.293 1.00 0.00 C ATOM 147 O GLY A 10 -2.642 9.508 14.444 1.00 0.00 O ATOM 0 H GLY A 10 -5.517 8.394 12.337 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -3.924 7.441 13.711 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -2.882 7.206 12.322 1.00 0.00 H new ATOM 151 N SER A 11 -1.879 9.697 12.392 1.00 0.00 N ATOM 152 CA SER A 11 -1.016 10.854 12.768 1.00 0.00 C ATOM 153 C SER A 11 -0.202 11.309 11.551 1.00 0.00 C ATOM 154 O SER A 11 0.944 11.691 11.670 1.00 0.00 O ATOM 155 CB SER A 11 -0.063 10.436 13.891 1.00 0.00 C ATOM 156 OG SER A 11 0.389 9.110 13.652 1.00 0.00 O ATOM 0 H SER A 11 -1.827 9.417 11.413 1.00 0.00 H new ATOM 0 HA SER A 11 -1.645 11.676 13.110 1.00 0.00 H new ATOM 0 HB2 SER A 11 0.785 11.119 13.937 1.00 0.00 H new ATOM 0 HB3 SER A 11 -0.570 10.492 14.854 1.00 0.00 H new ATOM 0 HG SER A 11 1.001 8.839 14.368 1.00 0.00 H new ATOM 162 N HIS A 12 -0.784 11.274 10.382 1.00 0.00 N ATOM 163 CA HIS A 12 -0.048 11.703 9.168 1.00 0.00 C ATOM 164 C HIS A 12 -1.059 12.149 8.113 1.00 0.00 C ATOM 165 O HIS A 12 -2.176 11.673 8.074 1.00 0.00 O ATOM 166 CB HIS A 12 0.767 10.527 8.625 1.00 0.00 C ATOM 167 CG HIS A 12 1.683 10.004 9.697 1.00 0.00 C ATOM 168 ND1 HIS A 12 1.474 9.135 10.740 1.00 0.00 N flip ATOM 169 CD2 HIS A 12 3.016 10.374 9.776 1.00 0.00 C flip ATOM 170 CE1 HIS A 12 2.657 8.965 11.453 1.00 0.00 C flip ATOM 171 NE2 HIS A 12 3.554 9.734 10.830 1.00 0.00 N flip ATOM 0 H HIS A 12 -1.742 10.964 10.220 1.00 0.00 H new ATOM 0 HA HIS A 12 0.624 12.526 9.412 1.00 0.00 H new ATOM 0 HB2 HIS A 12 0.099 9.735 8.287 1.00 0.00 H new ATOM 0 HB3 HIS A 12 1.349 10.845 7.760 1.00 0.00 H new ATOM 0 HD2 HIS A 12 3.530 11.053 9.112 1.00 0.00 H new ATOM 0 HE1 HIS A 12 2.816 8.345 12.323 1.00 0.00 H new ATOM 0 HE2 HIS A 12 4.528 9.825 11.118 1.00 0.00 H new ATOM 179 N CYS A 13 -0.685 13.055 7.254 1.00 0.00 N ATOM 180 CA CYS A 13 -1.636 13.514 6.206 1.00 0.00 C ATOM 181 C CYS A 13 -1.550 12.561 5.017 1.00 0.00 C ATOM 182 O CYS A 13 -0.484 12.300 4.494 1.00 0.00 O ATOM 183 CB CYS A 13 -1.265 14.927 5.749 1.00 0.00 C ATOM 184 SG CYS A 13 -1.568 16.111 7.087 1.00 0.00 S ATOM 0 H CYS A 13 0.235 13.496 7.232 1.00 0.00 H new ATOM 0 HA CYS A 13 -2.649 13.525 6.609 1.00 0.00 H new ATOM 0 HB2 CYS A 13 -0.216 14.959 5.455 1.00 0.00 H new ATOM 0 HB3 CYS A 13 -1.851 15.200 4.871 1.00 0.00 H new ATOM 0 HG CYS A 13 -1.248 17.307 6.689 1.00 0.00 H new ATOM 189 N TYR A 14 -2.661 12.028 4.590 1.00 0.00 N ATOM 190 CA TYR A 14 -2.635 11.080 3.444 1.00 0.00 C ATOM 191 C TYR A 14 -2.820 11.852 2.137 1.00 0.00 C ATOM 192 O TYR A 14 -3.357 12.942 2.120 1.00 0.00 O ATOM 193 CB TYR A 14 -3.769 10.060 3.592 1.00 0.00 C ATOM 194 CG TYR A 14 -3.457 9.093 4.716 1.00 0.00 C ATOM 195 CD1 TYR A 14 -3.243 9.568 6.018 1.00 0.00 C ATOM 196 CD2 TYR A 14 -3.388 7.718 4.456 1.00 0.00 C ATOM 197 CE1 TYR A 14 -2.959 8.670 7.054 1.00 0.00 C ATOM 198 CE2 TYR A 14 -3.104 6.822 5.493 1.00 0.00 C ATOM 199 CZ TYR A 14 -2.890 7.298 6.791 1.00 0.00 C ATOM 200 OH TYR A 14 -2.609 6.414 7.812 1.00 0.00 O ATOM 0 H TYR A 14 -3.584 12.208 4.985 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.677 10.560 3.431 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -4.708 10.575 3.795 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -3.901 9.514 2.658 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -3.297 10.627 6.222 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -3.554 7.349 3.455 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -2.793 9.037 8.056 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -3.050 5.762 5.291 1.00 0.00 H new ATOM 0 HH TYR A 14 -2.599 5.500 7.460 1.00 0.00 H new ATOM 210 N ALA A 15 -2.385 11.293 1.041 1.00 0.00 N ATOM 211 CA ALA A 15 -2.540 11.994 -0.265 1.00 0.00 C ATOM 212 C ALA A 15 -2.552 10.964 -1.395 1.00 0.00 C ATOM 213 O ALA A 15 -1.671 10.134 -1.504 1.00 0.00 O ATOM 214 CB ALA A 15 -1.376 12.965 -0.468 1.00 0.00 C ATOM 0 H ALA A 15 -1.929 10.382 0.993 1.00 0.00 H new ATOM 0 HA ALA A 15 -3.477 12.551 -0.270 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -1.491 13.477 -1.424 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -1.370 13.699 0.338 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -0.436 12.413 -0.463 1.00 0.00 H new ATOM 220 N LEU A 16 -3.549 11.009 -2.235 1.00 0.00 N ATOM 221 CA LEU A 16 -3.631 10.036 -3.361 1.00 0.00 C ATOM 222 C LEU A 16 -3.034 10.663 -4.624 1.00 0.00 C ATOM 223 O LEU A 16 -3.349 11.781 -4.981 1.00 0.00 O ATOM 224 CB LEU A 16 -5.104 9.679 -3.601 1.00 0.00 C ATOM 225 CG LEU A 16 -5.255 8.897 -4.911 1.00 0.00 C ATOM 226 CD1 LEU A 16 -4.367 7.650 -4.880 1.00 0.00 C ATOM 227 CD2 LEU A 16 -6.717 8.473 -5.078 1.00 0.00 C ATOM 0 H LEU A 16 -4.315 11.682 -2.190 1.00 0.00 H new ATOM 0 HA LEU A 16 -3.071 9.134 -3.116 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.481 9.084 -2.769 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -5.704 10.588 -3.641 1.00 0.00 H new ATOM 0 HG LEU A 16 -4.954 9.530 -5.745 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -4.480 7.100 -5.814 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.326 7.948 -4.758 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -4.663 7.013 -4.046 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -6.830 7.916 -6.008 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -7.011 7.842 -4.239 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -7.352 9.359 -5.105 1.00 0.00 H new ATOM 239 N PHE A 17 -2.187 9.940 -5.311 1.00 0.00 N ATOM 240 CA PHE A 17 -1.575 10.463 -6.557 1.00 0.00 C ATOM 241 C PHE A 17 -1.887 9.479 -7.679 1.00 0.00 C ATOM 242 O PHE A 17 -1.436 8.350 -7.672 1.00 0.00 O ATOM 243 CB PHE A 17 -0.060 10.579 -6.379 1.00 0.00 C ATOM 244 CG PHE A 17 0.262 11.804 -5.555 1.00 0.00 C ATOM 245 CD1 PHE A 17 0.470 13.036 -6.185 1.00 0.00 C ATOM 246 CD2 PHE A 17 0.351 11.705 -4.162 1.00 0.00 C ATOM 247 CE1 PHE A 17 0.769 14.172 -5.422 1.00 0.00 C ATOM 248 CE2 PHE A 17 0.650 12.839 -3.397 1.00 0.00 C ATOM 249 CZ PHE A 17 0.859 14.073 -4.028 1.00 0.00 C ATOM 0 H PHE A 17 -1.893 8.998 -5.053 1.00 0.00 H new ATOM 0 HA PHE A 17 -1.974 11.450 -6.793 1.00 0.00 H new ATOM 0 HB2 PHE A 17 0.328 9.686 -5.888 1.00 0.00 H new ATOM 0 HB3 PHE A 17 0.427 10.645 -7.352 1.00 0.00 H new ATOM 0 HD1 PHE A 17 0.400 13.111 -7.260 1.00 0.00 H new ATOM 0 HD2 PHE A 17 0.189 10.754 -3.677 1.00 0.00 H new ATOM 0 HE1 PHE A 17 0.930 15.123 -5.908 1.00 0.00 H new ATOM 0 HE2 PHE A 17 0.720 12.763 -2.322 1.00 0.00 H new ATOM 0 HZ PHE A 17 1.090 14.948 -3.439 1.00 0.00 H new ATOM 259 N LEU A 18 -2.654 9.895 -8.642 1.00 0.00 N ATOM 260 CA LEU A 18 -2.993 8.984 -9.763 1.00 0.00 C ATOM 261 C LEU A 18 -1.742 8.792 -10.597 1.00 0.00 C ATOM 262 O LEU A 18 -1.779 8.273 -11.695 1.00 0.00 O ATOM 263 CB LEU A 18 -4.104 9.605 -10.614 1.00 0.00 C ATOM 264 CG LEU A 18 -5.140 10.266 -9.704 1.00 0.00 C ATOM 265 CD1 LEU A 18 -6.343 10.710 -10.537 1.00 0.00 C ATOM 266 CD2 LEU A 18 -5.601 9.264 -8.639 1.00 0.00 C ATOM 0 H LEU A 18 -3.061 10.828 -8.701 1.00 0.00 H new ATOM 0 HA LEU A 18 -3.346 8.024 -9.386 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.683 10.342 -11.298 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.579 8.838 -11.225 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.693 11.133 -9.218 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.081 11.181 -9.888 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.018 11.423 -11.294 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -6.789 9.842 -11.024 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -6.339 9.736 -7.991 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -6.047 8.396 -9.125 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.745 8.947 -8.043 1.00 0.00 H new ATOM 278 N SER A 19 -0.627 9.218 -10.076 1.00 0.00 N ATOM 279 CA SER A 19 0.643 9.068 -10.840 1.00 0.00 C ATOM 280 C SER A 19 1.308 7.729 -10.479 1.00 0.00 C ATOM 281 O SER A 19 1.599 7.473 -9.327 1.00 0.00 O ATOM 282 CB SER A 19 1.600 10.213 -10.504 1.00 0.00 C ATOM 283 OG SER A 19 0.972 11.102 -9.590 1.00 0.00 O ATOM 0 H SER A 19 -0.539 9.660 -9.161 1.00 0.00 H new ATOM 0 HA SER A 19 0.417 9.092 -11.906 1.00 0.00 H new ATOM 0 HB2 SER A 19 2.519 9.818 -10.071 1.00 0.00 H new ATOM 0 HB3 SER A 19 1.880 10.746 -11.413 1.00 0.00 H new ATOM 0 HG SER A 19 1.585 11.835 -9.373 1.00 0.00 H new ATOM 289 N PRO A 20 1.554 6.883 -11.450 1.00 0.00 N ATOM 290 CA PRO A 20 2.204 5.569 -11.183 1.00 0.00 C ATOM 291 C PRO A 20 3.624 5.731 -10.620 1.00 0.00 C ATOM 292 O PRO A 20 4.316 6.676 -10.937 1.00 0.00 O ATOM 293 CB PRO A 20 2.247 4.929 -12.573 1.00 0.00 C ATOM 294 CG PRO A 20 1.643 5.906 -13.593 1.00 0.00 C ATOM 295 CD PRO A 20 1.203 7.173 -12.865 1.00 0.00 C ATOM 0 HA PRO A 20 1.670 4.980 -10.437 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.275 4.689 -12.845 1.00 0.00 H new ATOM 0 HB3 PRO A 20 1.690 3.992 -12.573 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.376 6.149 -14.362 1.00 0.00 H new ATOM 0 HG3 PRO A 20 0.793 5.447 -14.097 1.00 0.00 H new ATOM 0 HD2 PRO A 20 1.724 8.055 -13.238 1.00 0.00 H new ATOM 0 HD3 PRO A 20 0.136 7.359 -12.986 1.00 0.00 H new ATOM 303 N LYS A 21 4.068 4.813 -9.798 1.00 0.00 N ATOM 304 CA LYS A 21 5.450 4.932 -9.237 1.00 0.00 C ATOM 305 C LYS A 21 5.915 3.572 -8.703 1.00 0.00 C ATOM 306 O LYS A 21 5.243 2.944 -7.916 1.00 0.00 O ATOM 307 CB LYS A 21 5.451 5.954 -8.092 1.00 0.00 C ATOM 308 CG LYS A 21 5.434 7.382 -8.656 1.00 0.00 C ATOM 309 CD LYS A 21 5.986 8.354 -7.611 1.00 0.00 C ATOM 310 CE LYS A 21 6.042 9.763 -8.202 1.00 0.00 C ATOM 311 NZ LYS A 21 4.793 10.033 -8.967 1.00 0.00 N ATOM 0 H LYS A 21 3.541 3.995 -9.493 1.00 0.00 H new ATOM 0 HA LYS A 21 6.128 5.261 -10.024 1.00 0.00 H new ATOM 0 HB2 LYS A 21 4.581 5.797 -7.454 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.334 5.812 -7.469 1.00 0.00 H new ATOM 0 HG2 LYS A 21 6.033 7.432 -9.565 1.00 0.00 H new ATOM 0 HG3 LYS A 21 4.417 7.664 -8.928 1.00 0.00 H new ATOM 0 HD2 LYS A 21 5.355 8.346 -6.723 1.00 0.00 H new ATOM 0 HD3 LYS A 21 6.982 8.040 -7.297 1.00 0.00 H new ATOM 0 HE2 LYS A 21 6.159 10.498 -7.406 1.00 0.00 H new ATOM 0 HE3 LYS A 21 6.909 9.860 -8.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 4.678 11.059 -9.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 4.851 9.575 -9.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 3.977 9.654 -8.445 1.00 0.00 H new ATOM 325 N SER A 22 7.068 3.120 -9.116 1.00 0.00 N ATOM 326 CA SER A 22 7.577 1.807 -8.622 1.00 0.00 C ATOM 327 C SER A 22 7.421 1.742 -7.102 1.00 0.00 C ATOM 328 O SER A 22 7.571 2.730 -6.414 1.00 0.00 O ATOM 329 CB SER A 22 9.053 1.665 -8.991 1.00 0.00 C ATOM 330 OG SER A 22 9.215 1.916 -10.381 1.00 0.00 O ATOM 0 H SER A 22 7.680 3.603 -9.774 1.00 0.00 H new ATOM 0 HA SER A 22 7.009 0.998 -9.080 1.00 0.00 H new ATOM 0 HB2 SER A 22 9.654 2.365 -8.411 1.00 0.00 H new ATOM 0 HB3 SER A 22 9.406 0.663 -8.747 1.00 0.00 H new ATOM 0 HG SER A 22 9.739 2.735 -10.507 1.00 0.00 H new ATOM 336 N TRP A 23 7.125 0.588 -6.566 1.00 0.00 N ATOM 337 CA TRP A 23 6.968 0.484 -5.087 1.00 0.00 C ATOM 338 C TRP A 23 8.231 1.024 -4.425 1.00 0.00 C ATOM 339 O TRP A 23 8.223 1.444 -3.287 1.00 0.00 O ATOM 340 CB TRP A 23 6.775 -0.981 -4.688 1.00 0.00 C ATOM 341 CG TRP A 23 6.760 -1.095 -3.197 1.00 0.00 C ATOM 342 CD1 TRP A 23 5.645 -1.165 -2.435 1.00 0.00 C ATOM 343 CD2 TRP A 23 7.888 -1.153 -2.278 1.00 0.00 C ATOM 344 NE1 TRP A 23 6.017 -1.261 -1.106 1.00 0.00 N ATOM 345 CE2 TRP A 23 7.390 -1.259 -0.959 1.00 0.00 C ATOM 346 CE3 TRP A 23 9.284 -1.126 -2.459 1.00 0.00 C ATOM 347 CZ2 TRP A 23 8.244 -1.334 0.143 1.00 0.00 C ATOM 348 CZ3 TRP A 23 10.147 -1.201 -1.352 1.00 0.00 C ATOM 349 CH2 TRP A 23 9.627 -1.306 -0.055 1.00 0.00 C ATOM 0 H TRP A 23 6.986 -0.280 -7.083 1.00 0.00 H new ATOM 0 HA TRP A 23 6.098 1.058 -4.767 1.00 0.00 H new ATOM 0 HB2 TRP A 23 5.841 -1.361 -5.102 1.00 0.00 H new ATOM 0 HB3 TRP A 23 7.578 -1.590 -5.102 1.00 0.00 H new ATOM 0 HD1 TRP A 23 4.630 -1.149 -2.804 1.00 0.00 H new ATOM 0 HE1 TRP A 23 5.358 -1.325 -0.330 1.00 0.00 H new ATOM 0 HE3 TRP A 23 9.694 -1.047 -3.455 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 7.839 -1.413 1.141 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 11.216 -1.178 -1.502 1.00 0.00 H new ATOM 0 HH2 TRP A 23 10.295 -1.365 0.792 1.00 0.00 H new ATOM 360 N THR A 24 9.318 1.010 -5.141 1.00 0.00 N ATOM 361 CA THR A 24 10.599 1.513 -4.576 1.00 0.00 C ATOM 362 C THR A 24 10.745 3.000 -4.901 1.00 0.00 C ATOM 363 O THR A 24 11.509 3.716 -4.284 1.00 0.00 O ATOM 364 CB THR A 24 11.758 0.726 -5.192 1.00 0.00 C ATOM 365 OG1 THR A 24 12.951 0.994 -4.470 1.00 0.00 O ATOM 366 CG2 THR A 24 11.941 1.125 -6.655 1.00 0.00 C ATOM 0 H THR A 24 9.375 0.669 -6.101 1.00 0.00 H new ATOM 0 HA THR A 24 10.608 1.382 -3.494 1.00 0.00 H new ATOM 0 HB THR A 24 11.534 -0.339 -5.140 1.00 0.00 H new ATOM 0 HG1 THR A 24 13.692 0.489 -4.864 1.00 0.00 H new ATOM 0 HG21 THR A 24 12.768 0.560 -7.085 1.00 0.00 H new ATOM 0 HG22 THR A 24 11.027 0.909 -7.208 1.00 0.00 H new ATOM 0 HG23 THR A 24 12.159 2.191 -6.717 1.00 0.00 H new ATOM 374 N ASP A 25 10.009 3.461 -5.870 1.00 0.00 N ATOM 375 CA ASP A 25 10.081 4.900 -6.258 1.00 0.00 C ATOM 376 C ASP A 25 9.108 5.695 -5.396 1.00 0.00 C ATOM 377 O ASP A 25 9.420 6.771 -4.925 1.00 0.00 O ATOM 378 CB ASP A 25 9.705 5.062 -7.733 1.00 0.00 C ATOM 379 CG ASP A 25 10.875 4.619 -8.615 1.00 0.00 C ATOM 380 OD1 ASP A 25 12.007 4.800 -8.198 1.00 0.00 O ATOM 381 OD2 ASP A 25 10.619 4.105 -9.692 1.00 0.00 O ATOM 0 H ASP A 25 9.355 2.901 -6.416 1.00 0.00 H new ATOM 0 HA ASP A 25 11.096 5.267 -6.108 1.00 0.00 H new ATOM 0 HB2 ASP A 25 8.820 4.467 -7.960 1.00 0.00 H new ATOM 0 HB3 ASP A 25 9.453 6.102 -7.942 1.00 0.00 H new ATOM 386 N ALA A 26 7.939 5.166 -5.162 1.00 0.00 N ATOM 387 CA ALA A 26 6.972 5.886 -4.311 1.00 0.00 C ATOM 388 C ALA A 26 7.468 5.762 -2.877 1.00 0.00 C ATOM 389 O ALA A 26 7.287 6.639 -2.060 1.00 0.00 O ATOM 390 CB ALA A 26 5.599 5.244 -4.458 1.00 0.00 C ATOM 0 H ALA A 26 7.619 4.268 -5.526 1.00 0.00 H new ATOM 0 HA ALA A 26 6.888 6.935 -4.595 1.00 0.00 H new ATOM 0 HB1 ALA A 26 4.881 5.773 -3.831 1.00 0.00 H new ATOM 0 HB2 ALA A 26 5.281 5.299 -5.499 1.00 0.00 H new ATOM 0 HB3 ALA A 26 5.651 4.200 -4.149 1.00 0.00 H new ATOM 396 N ASP A 27 8.114 4.669 -2.579 1.00 0.00 N ATOM 397 CA ASP A 27 8.656 4.466 -1.217 1.00 0.00 C ATOM 398 C ASP A 27 9.694 5.553 -0.921 1.00 0.00 C ATOM 399 O ASP A 27 9.733 6.110 0.157 1.00 0.00 O ATOM 400 CB ASP A 27 9.321 3.094 -1.165 1.00 0.00 C ATOM 401 CG ASP A 27 10.059 2.926 0.165 1.00 0.00 C ATOM 402 OD1 ASP A 27 9.412 2.576 1.139 1.00 0.00 O ATOM 403 OD2 ASP A 27 11.258 3.152 0.187 1.00 0.00 O ATOM 0 H ASP A 27 8.288 3.904 -3.231 1.00 0.00 H new ATOM 0 HA ASP A 27 7.858 4.522 -0.477 1.00 0.00 H new ATOM 0 HB2 ASP A 27 8.570 2.311 -1.276 1.00 0.00 H new ATOM 0 HB3 ASP A 27 10.019 2.986 -1.995 1.00 0.00 H new ATOM 408 N LEU A 28 10.533 5.856 -1.873 1.00 0.00 N ATOM 409 CA LEU A 28 11.570 6.903 -1.653 1.00 0.00 C ATOM 410 C LEU A 28 10.911 8.288 -1.648 1.00 0.00 C ATOM 411 O LEU A 28 11.161 9.102 -0.781 1.00 0.00 O ATOM 412 CB LEU A 28 12.609 6.830 -2.779 1.00 0.00 C ATOM 413 CG LEU A 28 13.975 7.285 -2.262 1.00 0.00 C ATOM 414 CD1 LEU A 28 14.978 7.301 -3.419 1.00 0.00 C ATOM 415 CD2 LEU A 28 13.859 8.693 -1.668 1.00 0.00 C ATOM 0 H LEU A 28 10.545 5.422 -2.796 1.00 0.00 H new ATOM 0 HA LEU A 28 12.060 6.736 -0.694 1.00 0.00 H new ATOM 0 HB2 LEU A 28 12.676 5.810 -3.158 1.00 0.00 H new ATOM 0 HB3 LEU A 28 12.298 7.460 -3.613 1.00 0.00 H new ATOM 0 HG LEU A 28 14.318 6.595 -1.491 1.00 0.00 H new ATOM 0 HD11 LEU A 28 15.952 7.625 -3.052 1.00 0.00 H new ATOM 0 HD12 LEU A 28 15.064 6.299 -3.840 1.00 0.00 H new ATOM 0 HD13 LEU A 28 14.633 7.990 -4.190 1.00 0.00 H new ATOM 0 HD21 LEU A 28 14.834 9.014 -1.301 1.00 0.00 H new ATOM 0 HD22 LEU A 28 13.515 9.385 -2.437 1.00 0.00 H new ATOM 0 HD23 LEU A 28 13.146 8.683 -0.844 1.00 0.00 H new ATOM 427 N ALA A 29 10.080 8.563 -2.614 1.00 0.00 N ATOM 428 CA ALA A 29 9.415 9.896 -2.671 1.00 0.00 C ATOM 429 C ALA A 29 8.533 10.099 -1.438 1.00 0.00 C ATOM 430 O ALA A 29 8.670 11.072 -0.724 1.00 0.00 O ATOM 431 CB ALA A 29 8.552 9.982 -3.928 1.00 0.00 C ATOM 0 H ALA A 29 9.832 7.922 -3.368 1.00 0.00 H new ATOM 0 HA ALA A 29 10.180 10.672 -2.694 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.066 10.957 -3.970 1.00 0.00 H new ATOM 0 HB2 ALA A 29 9.179 9.852 -4.810 1.00 0.00 H new ATOM 0 HB3 ALA A 29 7.794 9.199 -3.903 1.00 0.00 H new ATOM 437 N CYS A 30 7.628 9.194 -1.173 1.00 0.00 N ATOM 438 CA CYS A 30 6.760 9.361 0.020 1.00 0.00 C ATOM 439 C CYS A 30 7.645 9.375 1.264 1.00 0.00 C ATOM 440 O CYS A 30 7.273 9.890 2.298 1.00 0.00 O ATOM 441 CB CYS A 30 5.755 8.211 0.093 1.00 0.00 C ATOM 442 SG CYS A 30 4.550 8.545 1.402 1.00 0.00 S ATOM 0 H CYS A 30 7.456 8.355 -1.728 1.00 0.00 H new ATOM 0 HA CYS A 30 6.205 10.297 -0.045 1.00 0.00 H new ATOM 0 HB2 CYS A 30 5.246 8.097 -0.864 1.00 0.00 H new ATOM 0 HB3 CYS A 30 6.273 7.273 0.292 1.00 0.00 H new ATOM 447 N GLN A 31 8.829 8.835 1.162 1.00 0.00 N ATOM 448 CA GLN A 31 9.753 8.846 2.328 1.00 0.00 C ATOM 449 C GLN A 31 10.420 10.216 2.390 1.00 0.00 C ATOM 450 O GLN A 31 10.745 10.720 3.447 1.00 0.00 O ATOM 451 CB GLN A 31 10.820 7.760 2.161 1.00 0.00 C ATOM 452 CG GLN A 31 11.898 7.929 3.235 1.00 0.00 C ATOM 453 CD GLN A 31 12.769 6.673 3.287 1.00 0.00 C ATOM 454 OE1 GLN A 31 12.905 6.056 4.325 1.00 0.00 O ATOM 455 NE2 GLN A 31 13.371 6.266 2.203 1.00 0.00 N ATOM 0 H GLN A 31 9.195 8.387 0.322 1.00 0.00 H new ATOM 0 HA GLN A 31 9.200 8.650 3.247 1.00 0.00 H new ATOM 0 HB2 GLN A 31 10.364 6.773 2.241 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.267 7.825 1.169 1.00 0.00 H new ATOM 0 HG2 GLN A 31 12.513 8.802 3.014 1.00 0.00 H new ATOM 0 HG3 GLN A 31 11.435 8.103 4.206 1.00 0.00 H new ATOM 0 HE21 GLN A 31 13.257 6.784 1.331 1.00 0.00 H new ATOM 0 HE22 GLN A 31 13.955 5.430 2.227 1.00 0.00 H new ATOM 464 N LYS A 32 10.614 10.824 1.252 1.00 0.00 N ATOM 465 CA LYS A 32 11.244 12.165 1.217 1.00 0.00 C ATOM 466 C LYS A 32 10.317 13.167 1.909 1.00 0.00 C ATOM 467 O LYS A 32 10.633 14.330 2.052 1.00 0.00 O ATOM 468 CB LYS A 32 11.458 12.578 -0.243 1.00 0.00 C ATOM 469 CG LYS A 32 11.971 14.019 -0.305 1.00 0.00 C ATOM 470 CD LYS A 32 12.700 14.248 -1.633 1.00 0.00 C ATOM 471 CE LYS A 32 11.750 13.962 -2.797 1.00 0.00 C ATOM 472 NZ LYS A 32 12.397 14.362 -4.079 1.00 0.00 N ATOM 0 H LYS A 32 10.360 10.443 0.341 1.00 0.00 H new ATOM 0 HA LYS A 32 12.205 12.144 1.731 1.00 0.00 H new ATOM 0 HB2 LYS A 32 12.173 11.907 -0.719 1.00 0.00 H new ATOM 0 HB3 LYS A 32 10.523 12.491 -0.796 1.00 0.00 H new ATOM 0 HG2 LYS A 32 11.139 14.716 -0.210 1.00 0.00 H new ATOM 0 HG3 LYS A 32 12.645 14.212 0.530 1.00 0.00 H new ATOM 0 HD2 LYS A 32 13.061 15.275 -1.689 1.00 0.00 H new ATOM 0 HD3 LYS A 32 13.574 13.600 -1.696 1.00 0.00 H new ATOM 0 HE2 LYS A 32 11.496 12.902 -2.821 1.00 0.00 H new ATOM 0 HE3 LYS A 32 10.817 14.510 -2.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 11.750 14.167 -4.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 12.618 15.378 -4.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 13.275 13.820 -4.208 1.00 0.00 H new ATOM 486 N ARG A 33 9.169 12.713 2.338 1.00 0.00 N ATOM 487 CA ARG A 33 8.204 13.621 3.023 1.00 0.00 C ATOM 488 C ARG A 33 8.453 13.584 4.531 1.00 0.00 C ATOM 489 O ARG A 33 9.054 12.658 5.037 1.00 0.00 O ATOM 490 CB ARG A 33 6.775 13.148 2.710 1.00 0.00 C ATOM 491 CG ARG A 33 6.217 13.921 1.510 1.00 0.00 C ATOM 492 CD ARG A 33 7.030 13.585 0.258 1.00 0.00 C ATOM 493 NE ARG A 33 6.595 14.461 -0.867 1.00 0.00 N ATOM 494 CZ ARG A 33 6.914 15.726 -0.869 1.00 0.00 C ATOM 495 NH1 ARG A 33 8.156 16.086 -1.053 1.00 0.00 N ATOM 496 NH2 ARG A 33 5.993 16.631 -0.686 1.00 0.00 N ATOM 0 H ARG A 33 8.857 11.747 2.242 1.00 0.00 H new ATOM 0 HA ARG A 33 8.334 14.644 2.671 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.776 12.079 2.496 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.135 13.298 3.579 1.00 0.00 H new ATOM 0 HG2 ARG A 33 5.169 13.664 1.355 1.00 0.00 H new ATOM 0 HG3 ARG A 33 6.257 14.993 1.705 1.00 0.00 H new ATOM 0 HD2 ARG A 33 8.093 13.726 0.453 1.00 0.00 H new ATOM 0 HD3 ARG A 33 6.891 12.537 -0.008 1.00 0.00 H new ATOM 0 HE ARG A 33 6.048 14.072 -1.635 1.00 0.00 H new ATOM 0 HH11 ARG A 33 8.876 15.378 -1.195 1.00 0.00 H new ATOM 0 HH12 ARG A 33 8.405 17.075 -1.055 1.00 0.00 H new ATOM 0 HH21 ARG A 33 5.023 16.350 -0.541 1.00 0.00 H new ATOM 0 HH22 ARG A 33 6.242 17.620 -0.688 1.00 0.00 H new ATOM 510 N PRO A 34 7.993 14.580 5.252 1.00 0.00 N ATOM 511 CA PRO A 34 8.187 14.618 6.724 1.00 0.00 C ATOM 512 C PRO A 34 7.834 13.278 7.368 1.00 0.00 C ATOM 513 O PRO A 34 6.743 13.075 7.865 1.00 0.00 O ATOM 514 CB PRO A 34 7.232 15.741 7.157 1.00 0.00 C ATOM 515 CG PRO A 34 6.549 16.310 5.902 1.00 0.00 C ATOM 516 CD PRO A 34 7.246 15.725 4.669 1.00 0.00 C ATOM 0 HA PRO A 34 9.219 14.798 7.026 1.00 0.00 H new ATOM 0 HB2 PRO A 34 6.486 15.357 7.853 1.00 0.00 H new ATOM 0 HB3 PRO A 34 7.781 16.525 7.678 1.00 0.00 H new ATOM 0 HG2 PRO A 34 5.490 16.054 5.897 1.00 0.00 H new ATOM 0 HG3 PRO A 34 6.614 17.398 5.895 1.00 0.00 H new ATOM 0 HD2 PRO A 34 6.532 15.403 3.911 1.00 0.00 H new ATOM 0 HD3 PRO A 34 7.911 16.447 4.195 1.00 0.00 H new ATOM 524 N SER A 35 8.751 12.354 7.342 1.00 0.00 N ATOM 525 CA SER A 35 8.483 11.017 7.927 1.00 0.00 C ATOM 526 C SER A 35 7.412 10.319 7.096 1.00 0.00 C ATOM 527 O SER A 35 6.803 9.361 7.528 1.00 0.00 O ATOM 528 CB SER A 35 8.002 11.172 9.371 1.00 0.00 C ATOM 529 OG SER A 35 6.583 11.277 9.385 1.00 0.00 O ATOM 0 H SER A 35 9.680 12.470 6.938 1.00 0.00 H new ATOM 0 HA SER A 35 9.396 10.422 7.922 1.00 0.00 H new ATOM 0 HB2 SER A 35 8.321 10.316 9.966 1.00 0.00 H new ATOM 0 HB3 SER A 35 8.448 12.058 9.822 1.00 0.00 H new ATOM 0 HG SER A 35 6.308 12.065 8.871 1.00 0.00 H new ATOM 535 N GLY A 36 7.171 10.796 5.905 1.00 0.00 N ATOM 536 CA GLY A 36 6.133 10.156 5.054 1.00 0.00 C ATOM 537 C GLY A 36 6.625 8.791 4.561 1.00 0.00 C ATOM 538 O GLY A 36 7.695 8.341 4.915 1.00 0.00 O ATOM 0 H GLY A 36 7.646 11.597 5.488 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.210 10.035 5.621 1.00 0.00 H new ATOM 0 HA3 GLY A 36 5.903 10.797 4.203 1.00 0.00 H new ATOM 542 N ASN A 37 5.838 8.132 3.753 1.00 0.00 N ATOM 543 CA ASN A 37 6.224 6.788 3.224 1.00 0.00 C ATOM 544 C ASN A 37 4.964 6.103 2.688 1.00 0.00 C ATOM 545 O ASN A 37 3.894 6.253 3.249 1.00 0.00 O ATOM 546 CB ASN A 37 6.822 5.934 4.355 1.00 0.00 C ATOM 547 CG ASN A 37 8.348 5.884 4.222 1.00 0.00 C ATOM 548 OD1 ASN A 37 8.867 5.340 3.268 1.00 0.00 O ATOM 549 ND2 ASN A 37 9.091 6.429 5.145 1.00 0.00 N ATOM 0 H ASN A 37 4.931 8.471 3.432 1.00 0.00 H new ATOM 0 HA ASN A 37 6.965 6.899 2.433 1.00 0.00 H new ATOM 0 HB2 ASN A 37 6.546 6.353 5.323 1.00 0.00 H new ATOM 0 HB3 ASN A 37 6.412 4.925 4.316 1.00 0.00 H new ATOM 0 HD21 ASN A 37 10.107 6.398 5.066 1.00 0.00 H new ATOM 0 HD22 ASN A 37 8.656 6.886 5.946 1.00 0.00 H new ATOM 556 N LEU A 38 5.070 5.365 1.605 1.00 0.00 N ATOM 557 CA LEU A 38 3.868 4.679 1.044 1.00 0.00 C ATOM 558 C LEU A 38 2.832 4.452 2.154 1.00 0.00 C ATOM 559 O LEU A 38 3.154 4.019 3.242 1.00 0.00 O ATOM 560 CB LEU A 38 4.292 3.337 0.449 1.00 0.00 C ATOM 561 CG LEU A 38 4.991 3.574 -0.888 1.00 0.00 C ATOM 562 CD1 LEU A 38 5.722 2.301 -1.322 1.00 0.00 C ATOM 563 CD2 LEU A 38 3.954 3.961 -1.946 1.00 0.00 C ATOM 0 H LEU A 38 5.937 5.211 1.089 1.00 0.00 H new ATOM 0 HA LEU A 38 3.422 5.300 0.267 1.00 0.00 H new ATOM 0 HB2 LEU A 38 4.961 2.818 1.135 1.00 0.00 H new ATOM 0 HB3 LEU A 38 3.421 2.697 0.308 1.00 0.00 H new ATOM 0 HG LEU A 38 5.715 4.382 -0.779 1.00 0.00 H new ATOM 0 HD11 LEU A 38 6.219 2.474 -2.276 1.00 0.00 H new ATOM 0 HD12 LEU A 38 6.464 2.033 -0.570 1.00 0.00 H new ATOM 0 HD13 LEU A 38 5.004 1.488 -1.429 1.00 0.00 H new ATOM 0 HD21 LEU A 38 4.453 4.130 -2.900 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.227 3.156 -2.054 1.00 0.00 H new ATOM 0 HD23 LEU A 38 3.442 4.873 -1.638 1.00 0.00 H new ATOM 575 N VAL A 39 1.597 4.770 1.884 1.00 0.00 N ATOM 576 CA VAL A 39 0.516 4.616 2.905 1.00 0.00 C ATOM 577 C VAL A 39 0.758 3.396 3.802 1.00 0.00 C ATOM 578 O VAL A 39 1.330 2.405 3.394 1.00 0.00 O ATOM 579 CB VAL A 39 -0.824 4.466 2.181 1.00 0.00 C ATOM 580 CG1 VAL A 39 -0.652 3.537 0.977 1.00 0.00 C ATOM 581 CG2 VAL A 39 -1.871 3.879 3.134 1.00 0.00 C ATOM 0 H VAL A 39 1.283 5.136 0.985 1.00 0.00 H new ATOM 0 HA VAL A 39 0.510 5.500 3.543 1.00 0.00 H new ATOM 0 HB VAL A 39 -1.159 5.446 1.842 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -1.606 3.430 0.461 1.00 0.00 H new ATOM 0 HG12 VAL A 39 0.085 3.960 0.294 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.312 2.559 1.318 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -2.822 3.776 2.611 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -1.539 2.900 3.481 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -1.998 4.543 3.989 1.00 0.00 H new ATOM 591 N SER A 40 0.308 3.478 5.031 1.00 0.00 N ATOM 592 CA SER A 40 0.481 2.348 5.995 1.00 0.00 C ATOM 593 C SER A 40 -0.889 1.721 6.296 1.00 0.00 C ATOM 594 O SER A 40 -1.918 2.296 6.000 1.00 0.00 O ATOM 595 CB SER A 40 1.089 2.887 7.290 1.00 0.00 C ATOM 596 OG SER A 40 0.571 4.187 7.546 1.00 0.00 O ATOM 0 H SER A 40 -0.178 4.291 5.411 1.00 0.00 H new ATOM 0 HA SER A 40 1.139 1.593 5.565 1.00 0.00 H new ATOM 0 HB2 SER A 40 0.856 2.220 8.120 1.00 0.00 H new ATOM 0 HB3 SER A 40 2.175 2.925 7.207 1.00 0.00 H new ATOM 0 HG SER A 40 0.957 4.535 8.377 1.00 0.00 H new ATOM 602 N VAL A 41 -0.916 0.544 6.879 1.00 0.00 N ATOM 603 CA VAL A 41 -2.227 -0.109 7.187 1.00 0.00 C ATOM 604 C VAL A 41 -2.067 -1.072 8.380 1.00 0.00 C ATOM 605 O VAL A 41 -1.718 -2.223 8.211 1.00 0.00 O ATOM 606 CB VAL A 41 -2.714 -0.900 5.952 1.00 0.00 C ATOM 607 CG1 VAL A 41 -4.236 -0.792 5.830 1.00 0.00 C ATOM 608 CG2 VAL A 41 -2.073 -0.343 4.671 1.00 0.00 C ATOM 0 H VAL A 41 -0.091 0.011 7.153 1.00 0.00 H new ATOM 0 HA VAL A 41 -2.957 0.660 7.441 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.425 -1.943 6.078 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.572 -1.352 4.957 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.703 -1.202 6.726 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -4.519 0.255 5.720 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -2.426 -0.911 3.811 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -2.349 0.705 4.552 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -0.988 -0.427 4.741 1.00 0.00 H new ATOM 618 N LEU A 42 -2.317 -0.613 9.585 1.00 0.00 N ATOM 619 CA LEU A 42 -2.173 -1.511 10.781 1.00 0.00 C ATOM 620 C LEU A 42 -3.531 -1.744 11.453 1.00 0.00 C ATOM 621 O LEU A 42 -3.592 -2.235 12.563 1.00 0.00 O ATOM 622 CB LEU A 42 -1.245 -0.863 11.809 1.00 0.00 C ATOM 623 CG LEU A 42 0.205 -0.935 11.331 1.00 0.00 C ATOM 624 CD1 LEU A 42 1.105 -0.200 12.338 1.00 0.00 C ATOM 625 CD2 LEU A 42 0.642 -2.406 11.211 1.00 0.00 C ATOM 0 H LEU A 42 -2.613 0.341 9.793 1.00 0.00 H new ATOM 0 HA LEU A 42 -1.764 -2.461 10.437 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.533 0.177 11.965 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.344 -1.369 12.769 1.00 0.00 H new ATOM 0 HG LEU A 42 0.292 -0.462 10.353 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.141 -0.248 12.003 1.00 0.00 H new ATOM 0 HD12 LEU A 42 0.795 0.842 12.410 1.00 0.00 H new ATOM 0 HD13 LEU A 42 1.018 -0.673 13.316 1.00 0.00 H new ATOM 0 HD21 LEU A 42 1.676 -2.452 10.870 1.00 0.00 H new ATOM 0 HD22 LEU A 42 0.559 -2.891 12.184 1.00 0.00 H new ATOM 0 HD23 LEU A 42 0.001 -2.919 10.494 1.00 0.00 H new ATOM 637 N SER A 43 -4.618 -1.399 10.820 1.00 0.00 N ATOM 638 CA SER A 43 -5.942 -1.615 11.480 1.00 0.00 C ATOM 639 C SER A 43 -7.018 -1.920 10.438 1.00 0.00 C ATOM 640 O SER A 43 -6.972 -1.447 9.320 1.00 0.00 O ATOM 641 CB SER A 43 -6.333 -0.354 12.252 1.00 0.00 C ATOM 642 OG SER A 43 -5.479 -0.211 13.380 1.00 0.00 O ATOM 0 H SER A 43 -4.651 -0.983 9.889 1.00 0.00 H new ATOM 0 HA SER A 43 -5.861 -2.462 12.161 1.00 0.00 H new ATOM 0 HB2 SER A 43 -6.252 0.521 11.607 1.00 0.00 H new ATOM 0 HB3 SER A 43 -7.372 -0.418 12.574 1.00 0.00 H new ATOM 0 HG SER A 43 -4.814 -0.931 13.381 1.00 0.00 H new ATOM 648 N GLY A 44 -7.994 -2.707 10.806 1.00 0.00 N ATOM 649 CA GLY A 44 -9.086 -3.040 9.850 1.00 0.00 C ATOM 650 C GLY A 44 -9.809 -1.754 9.456 1.00 0.00 C ATOM 651 O GLY A 44 -10.511 -1.700 8.467 1.00 0.00 O ATOM 0 H GLY A 44 -8.081 -3.133 11.729 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -8.677 -3.528 8.966 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -9.785 -3.741 10.306 1.00 0.00 H new ATOM 655 N ALA A 45 -9.632 -0.713 10.224 1.00 0.00 N ATOM 656 CA ALA A 45 -10.295 0.577 9.893 1.00 0.00 C ATOM 657 C ALA A 45 -9.451 1.306 8.850 1.00 0.00 C ATOM 658 O ALA A 45 -9.965 1.987 7.986 1.00 0.00 O ATOM 659 CB ALA A 45 -10.406 1.435 11.156 1.00 0.00 C ATOM 0 H ALA A 45 -9.056 -0.702 11.066 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.295 0.393 9.500 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -10.892 2.380 10.912 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -10.996 0.906 11.905 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -9.409 1.631 11.552 1.00 0.00 H new ATOM 665 N GLU A 46 -8.157 1.157 8.919 1.00 0.00 N ATOM 666 CA GLU A 46 -7.277 1.827 7.924 1.00 0.00 C ATOM 667 C GLU A 46 -7.420 1.111 6.581 1.00 0.00 C ATOM 668 O GLU A 46 -7.484 1.730 5.540 1.00 0.00 O ATOM 669 CB GLU A 46 -5.822 1.753 8.391 1.00 0.00 C ATOM 670 CG GLU A 46 -5.605 2.736 9.543 1.00 0.00 C ATOM 671 CD GLU A 46 -4.146 2.672 10.001 1.00 0.00 C ATOM 672 OE1 GLU A 46 -3.292 3.126 9.257 1.00 0.00 O ATOM 673 OE2 GLU A 46 -3.909 2.171 11.087 1.00 0.00 O ATOM 0 H GLU A 46 -7.672 0.600 9.622 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.565 2.873 7.821 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.584 0.740 8.714 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -5.151 1.990 7.565 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.853 3.748 9.223 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.269 2.493 10.373 1.00 0.00 H new ATOM 680 N GLY A 47 -7.482 -0.192 6.599 1.00 0.00 N ATOM 681 CA GLY A 47 -7.632 -0.945 5.323 1.00 0.00 C ATOM 682 C GLY A 47 -8.896 -0.467 4.610 1.00 0.00 C ATOM 683 O GLY A 47 -8.973 -0.458 3.396 1.00 0.00 O ATOM 0 H GLY A 47 -7.435 -0.766 7.441 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.760 -0.788 4.689 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.694 -2.015 5.522 1.00 0.00 H new ATOM 687 N SER A 48 -9.887 -0.061 5.357 1.00 0.00 N ATOM 688 CA SER A 48 -11.147 0.425 4.728 1.00 0.00 C ATOM 689 C SER A 48 -11.018 1.922 4.442 1.00 0.00 C ATOM 690 O SER A 48 -11.509 2.421 3.449 1.00 0.00 O ATOM 691 CB SER A 48 -12.318 0.190 5.684 1.00 0.00 C ATOM 692 OG SER A 48 -13.481 0.827 5.168 1.00 0.00 O ATOM 0 H SER A 48 -9.878 -0.045 6.377 1.00 0.00 H new ATOM 0 HA SER A 48 -11.325 -0.115 3.798 1.00 0.00 H new ATOM 0 HB2 SER A 48 -12.497 -0.879 5.803 1.00 0.00 H new ATOM 0 HB3 SER A 48 -12.081 0.585 6.672 1.00 0.00 H new ATOM 0 HG SER A 48 -14.234 0.677 5.777 1.00 0.00 H new ATOM 698 N PHE A 49 -10.350 2.641 5.304 1.00 0.00 N ATOM 699 CA PHE A 49 -10.181 4.104 5.082 1.00 0.00 C ATOM 700 C PHE A 49 -9.355 4.326 3.816 1.00 0.00 C ATOM 701 O PHE A 49 -9.730 5.085 2.944 1.00 0.00 O ATOM 702 CB PHE A 49 -9.456 4.719 6.283 1.00 0.00 C ATOM 703 CG PHE A 49 -9.607 6.222 6.246 1.00 0.00 C ATOM 704 CD1 PHE A 49 -10.865 6.803 6.450 1.00 0.00 C ATOM 705 CD2 PHE A 49 -8.491 7.035 6.011 1.00 0.00 C ATOM 706 CE1 PHE A 49 -11.007 8.197 6.417 1.00 0.00 C ATOM 707 CE2 PHE A 49 -8.632 8.427 5.979 1.00 0.00 C ATOM 708 CZ PHE A 49 -9.889 9.008 6.182 1.00 0.00 C ATOM 0 H PHE A 49 -9.915 2.277 6.152 1.00 0.00 H new ATOM 0 HA PHE A 49 -11.157 4.576 4.969 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -9.868 4.324 7.212 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -8.400 4.448 6.262 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -11.726 6.177 6.633 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -7.521 6.587 5.854 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -11.977 8.645 6.573 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -7.771 9.053 5.798 1.00 0.00 H new ATOM 0 HZ PHE A 49 -9.997 10.082 6.157 1.00 0.00 H new ATOM 718 N VAL A 50 -8.235 3.663 3.701 1.00 0.00 N ATOM 719 CA VAL A 50 -7.396 3.831 2.486 1.00 0.00 C ATOM 720 C VAL A 50 -8.198 3.375 1.266 1.00 0.00 C ATOM 721 O VAL A 50 -8.216 4.028 0.243 1.00 0.00 O ATOM 722 CB VAL A 50 -6.126 2.987 2.607 1.00 0.00 C ATOM 723 CG1 VAL A 50 -5.217 3.260 1.407 1.00 0.00 C ATOM 724 CG2 VAL A 50 -5.389 3.359 3.896 1.00 0.00 C ATOM 0 H VAL A 50 -7.868 3.014 4.397 1.00 0.00 H new ATOM 0 HA VAL A 50 -7.115 4.879 2.378 1.00 0.00 H new ATOM 0 HB VAL A 50 -6.392 1.930 2.630 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -4.312 2.659 1.492 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -5.740 2.999 0.487 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -4.950 4.317 1.385 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.484 2.758 3.984 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.122 4.416 3.871 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -6.035 3.168 4.753 1.00 0.00 H new ATOM 734 N SER A 51 -8.865 2.257 1.373 1.00 0.00 N ATOM 735 CA SER A 51 -9.670 1.758 0.224 1.00 0.00 C ATOM 736 C SER A 51 -10.674 2.834 -0.196 1.00 0.00 C ATOM 737 O SER A 51 -10.919 3.041 -1.366 1.00 0.00 O ATOM 738 CB SER A 51 -10.425 0.496 0.641 1.00 0.00 C ATOM 739 OG SER A 51 -11.541 0.308 -0.218 1.00 0.00 O ATOM 0 H SER A 51 -8.886 1.669 2.206 1.00 0.00 H new ATOM 0 HA SER A 51 -9.009 1.527 -0.611 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.764 -0.369 0.591 1.00 0.00 H new ATOM 0 HB3 SER A 51 -10.759 0.584 1.675 1.00 0.00 H new ATOM 0 HG SER A 51 -11.514 -0.595 -0.597 1.00 0.00 H new ATOM 745 N SER A 52 -11.255 3.521 0.750 1.00 0.00 N ATOM 746 CA SER A 52 -12.243 4.584 0.403 1.00 0.00 C ATOM 747 C SER A 52 -11.507 5.797 -0.168 1.00 0.00 C ATOM 748 O SER A 52 -12.071 6.591 -0.897 1.00 0.00 O ATOM 749 CB SER A 52 -13.010 4.996 1.660 1.00 0.00 C ATOM 750 OG SER A 52 -12.087 5.243 2.712 1.00 0.00 O ATOM 0 H SER A 52 -11.089 3.393 1.748 1.00 0.00 H new ATOM 0 HA SER A 52 -12.943 4.202 -0.340 1.00 0.00 H new ATOM 0 HB2 SER A 52 -13.602 5.890 1.462 1.00 0.00 H new ATOM 0 HB3 SER A 52 -13.707 4.209 1.949 1.00 0.00 H new ATOM 0 HG SER A 52 -11.199 5.414 2.335 1.00 0.00 H new ATOM 756 N LEU A 53 -10.254 5.948 0.157 1.00 0.00 N ATOM 757 CA LEU A 53 -9.479 7.109 -0.363 1.00 0.00 C ATOM 758 C LEU A 53 -9.055 6.821 -1.805 1.00 0.00 C ATOM 759 O LEU A 53 -8.790 7.721 -2.576 1.00 0.00 O ATOM 760 CB LEU A 53 -8.241 7.314 0.527 1.00 0.00 C ATOM 761 CG LEU A 53 -7.138 8.072 -0.226 1.00 0.00 C ATOM 762 CD1 LEU A 53 -7.593 9.507 -0.509 1.00 0.00 C ATOM 763 CD2 LEU A 53 -5.877 8.115 0.641 1.00 0.00 C ATOM 0 H LEU A 53 -9.731 5.315 0.763 1.00 0.00 H new ATOM 0 HA LEU A 53 -10.088 8.013 -0.347 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.521 7.868 1.423 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -7.862 6.347 0.856 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.931 7.563 -1.167 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.806 10.039 -1.043 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -8.497 9.489 -1.118 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.800 10.015 0.433 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -5.090 8.652 0.112 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -6.097 8.625 1.579 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -5.545 7.098 0.851 1.00 0.00 H new ATOM 775 N VAL A 54 -8.976 5.567 -2.168 1.00 0.00 N ATOM 776 CA VAL A 54 -8.552 5.210 -3.552 1.00 0.00 C ATOM 777 C VAL A 54 -9.656 4.408 -4.247 1.00 0.00 C ATOM 778 O VAL A 54 -9.424 3.753 -5.241 1.00 0.00 O ATOM 779 CB VAL A 54 -7.266 4.383 -3.482 1.00 0.00 C ATOM 780 CG1 VAL A 54 -6.210 5.165 -2.697 1.00 0.00 C ATOM 781 CG2 VAL A 54 -7.539 3.054 -2.773 1.00 0.00 C ATOM 0 H VAL A 54 -9.188 4.774 -1.563 1.00 0.00 H new ATOM 0 HA VAL A 54 -8.370 6.119 -4.125 1.00 0.00 H new ATOM 0 HB VAL A 54 -6.909 4.184 -4.493 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.291 4.582 -2.643 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -6.010 6.112 -3.199 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -6.576 5.359 -1.689 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -6.619 2.471 -2.727 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -7.897 3.248 -1.762 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -8.295 2.496 -3.325 1.00 0.00 H new ATOM 791 N LYS A 55 -10.854 4.454 -3.730 1.00 0.00 N ATOM 792 CA LYS A 55 -11.971 3.696 -4.366 1.00 0.00 C ATOM 793 C LYS A 55 -12.301 4.317 -5.724 1.00 0.00 C ATOM 794 O LYS A 55 -12.776 3.653 -6.625 1.00 0.00 O ATOM 795 CB LYS A 55 -13.205 3.754 -3.465 1.00 0.00 C ATOM 796 CG LYS A 55 -14.331 2.922 -4.085 1.00 0.00 C ATOM 797 CD LYS A 55 -15.485 2.779 -3.082 1.00 0.00 C ATOM 798 CE LYS A 55 -15.242 1.566 -2.177 1.00 0.00 C ATOM 799 NZ LYS A 55 -15.325 0.318 -2.987 1.00 0.00 N ATOM 0 H LYS A 55 -11.108 4.983 -2.896 1.00 0.00 H new ATOM 0 HA LYS A 55 -11.672 2.657 -4.505 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -12.962 3.374 -2.473 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -13.529 4.787 -3.340 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -14.688 3.399 -4.998 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -13.956 1.937 -4.365 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -15.568 3.683 -2.479 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -16.429 2.663 -3.614 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -14.262 1.641 -1.705 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -15.981 1.542 -1.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -15.682 -0.458 -2.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -15.971 0.466 -3.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -14.380 0.073 -3.345 1.00 0.00 H new ATOM 896 N SER A 62 -6.716 -0.271 -11.547 1.00 0.00 N ATOM 897 CA SER A 62 -7.478 -1.122 -10.583 1.00 0.00 C ATOM 898 C SER A 62 -6.638 -1.394 -9.335 1.00 0.00 C ATOM 899 O SER A 62 -7.165 -1.555 -8.254 1.00 0.00 O ATOM 900 CB SER A 62 -7.828 -2.451 -11.260 1.00 0.00 C ATOM 901 OG SER A 62 -7.638 -3.519 -10.339 1.00 0.00 O ATOM 0 HA SER A 62 -8.388 -0.600 -10.287 1.00 0.00 H new ATOM 0 HB2 SER A 62 -8.862 -2.434 -11.605 1.00 0.00 H new ATOM 0 HB3 SER A 62 -7.201 -2.599 -12.139 1.00 0.00 H new ATOM 0 HG SER A 62 -6.939 -4.119 -10.673 1.00 0.00 H new ATOM 907 N TYR A 63 -5.341 -1.461 -9.462 1.00 0.00 N ATOM 908 CA TYR A 63 -4.501 -1.746 -8.264 1.00 0.00 C ATOM 909 C TYR A 63 -3.820 -0.466 -7.774 1.00 0.00 C ATOM 910 O TYR A 63 -3.758 0.527 -8.472 1.00 0.00 O ATOM 911 CB TYR A 63 -3.445 -2.790 -8.623 1.00 0.00 C ATOM 912 CG TYR A 63 -4.094 -4.152 -8.721 1.00 0.00 C ATOM 913 CD1 TYR A 63 -5.046 -4.401 -9.716 1.00 0.00 C ATOM 914 CD2 TYR A 63 -3.746 -5.163 -7.817 1.00 0.00 C ATOM 915 CE1 TYR A 63 -5.648 -5.660 -9.808 1.00 0.00 C ATOM 916 CE2 TYR A 63 -4.349 -6.422 -7.911 1.00 0.00 C ATOM 917 CZ TYR A 63 -5.300 -6.671 -8.907 1.00 0.00 C ATOM 918 OH TYR A 63 -5.894 -7.914 -8.999 1.00 0.00 O ATOM 0 H TYR A 63 -4.830 -1.332 -10.335 1.00 0.00 H new ATOM 0 HA TYR A 63 -5.137 -2.128 -7.466 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -2.971 -2.532 -9.570 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -2.660 -2.803 -7.867 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -5.316 -3.621 -10.413 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -3.013 -4.971 -7.048 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -6.383 -5.852 -10.576 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -4.080 -7.202 -7.214 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.538 -8.499 -8.298 1.00 0.00 H new ATOM 928 N VAL A 64 -3.318 -0.485 -6.567 1.00 0.00 N ATOM 929 CA VAL A 64 -2.648 0.724 -6.004 1.00 0.00 C ATOM 930 C VAL A 64 -1.461 0.280 -5.138 1.00 0.00 C ATOM 931 O VAL A 64 -1.541 -0.686 -4.412 1.00 0.00 O ATOM 932 CB VAL A 64 -3.676 1.493 -5.162 1.00 0.00 C ATOM 933 CG1 VAL A 64 -3.036 2.718 -4.504 1.00 0.00 C ATOM 934 CG2 VAL A 64 -4.826 1.947 -6.063 1.00 0.00 C ATOM 0 H VAL A 64 -3.344 -1.292 -5.943 1.00 0.00 H new ATOM 0 HA VAL A 64 -2.275 1.370 -6.798 1.00 0.00 H new ATOM 0 HB VAL A 64 -4.048 0.833 -4.378 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -3.784 3.246 -3.913 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.221 2.398 -3.855 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -2.647 3.383 -5.275 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -5.559 2.494 -5.470 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -4.438 2.596 -6.849 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.301 1.076 -6.513 1.00 0.00 H new ATOM 944 N TRP A 65 -0.353 0.968 -5.220 1.00 0.00 N ATOM 945 CA TRP A 65 0.841 0.565 -4.413 1.00 0.00 C ATOM 946 C TRP A 65 0.682 1.016 -2.955 1.00 0.00 C ATOM 947 O TRP A 65 0.111 2.051 -2.674 1.00 0.00 O ATOM 948 CB TRP A 65 2.097 1.251 -4.979 1.00 0.00 C ATOM 949 CG TRP A 65 2.911 0.340 -5.851 1.00 0.00 C ATOM 950 CD1 TRP A 65 3.581 0.765 -6.945 1.00 0.00 C ATOM 951 CD2 TRP A 65 3.185 -1.093 -5.739 1.00 0.00 C ATOM 952 NE1 TRP A 65 4.243 -0.302 -7.515 1.00 0.00 N ATOM 953 CE2 TRP A 65 4.028 -1.468 -6.817 1.00 0.00 C ATOM 954 CE3 TRP A 65 2.795 -2.099 -4.833 1.00 0.00 C ATOM 955 CZ2 TRP A 65 4.461 -2.779 -6.985 1.00 0.00 C ATOM 956 CZ3 TRP A 65 3.233 -3.421 -5.004 1.00 0.00 C ATOM 957 CH2 TRP A 65 4.062 -3.760 -6.079 1.00 0.00 C ATOM 0 H TRP A 65 -0.221 1.790 -5.809 1.00 0.00 H new ATOM 0 HA TRP A 65 0.933 -0.520 -4.459 1.00 0.00 H new ATOM 0 HB2 TRP A 65 1.799 2.128 -5.554 1.00 0.00 H new ATOM 0 HB3 TRP A 65 2.715 1.606 -4.154 1.00 0.00 H new ATOM 0 HD1 TRP A 65 3.596 1.780 -7.314 1.00 0.00 H new ATOM 0 HE1 TRP A 65 4.822 -0.235 -8.352 1.00 0.00 H new ATOM 0 HE3 TRP A 65 2.154 -1.851 -4.000 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 5.104 -3.036 -7.814 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 2.928 -4.182 -4.301 1.00 0.00 H new ATOM 0 HH2 TRP A 65 4.392 -4.780 -6.206 1.00 0.00 H new ATOM 968 N ILE A 66 1.237 0.271 -2.029 1.00 0.00 N ATOM 969 CA ILE A 66 1.178 0.681 -0.596 1.00 0.00 C ATOM 970 C ILE A 66 2.549 0.376 0.027 1.00 0.00 C ATOM 971 O ILE A 66 3.412 -0.183 -0.620 1.00 0.00 O ATOM 972 CB ILE A 66 0.063 -0.065 0.142 1.00 0.00 C ATOM 973 CG1 ILE A 66 0.289 -1.576 0.068 1.00 0.00 C ATOM 974 CG2 ILE A 66 -1.281 0.269 -0.505 1.00 0.00 C ATOM 975 CD1 ILE A 66 -0.899 -2.292 0.718 1.00 0.00 C ATOM 0 H ILE A 66 1.729 -0.605 -2.207 1.00 0.00 H new ATOM 0 HA ILE A 66 0.953 1.744 -0.515 1.00 0.00 H new ATOM 0 HB ILE A 66 0.067 0.244 1.187 1.00 0.00 H new ATOM 0 HG12 ILE A 66 0.395 -1.890 -0.970 1.00 0.00 H new ATOM 0 HG13 ILE A 66 1.214 -1.843 0.578 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.078 -0.260 0.018 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.458 1.343 -0.444 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.267 -0.037 -1.551 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -0.745 -3.370 0.669 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -0.983 -1.984 1.760 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -1.815 -2.032 0.188 1.00 0.00 H new ATOM 987 N GLY A 67 2.790 0.775 1.248 1.00 0.00 N ATOM 988 CA GLY A 67 4.133 0.542 1.852 1.00 0.00 C ATOM 989 C GLY A 67 4.236 -0.819 2.538 1.00 0.00 C ATOM 990 O GLY A 67 4.717 -0.906 3.644 1.00 0.00 O ATOM 0 H GLY A 67 2.118 1.250 1.850 1.00 0.00 H new ATOM 0 HA2 GLY A 67 4.895 0.613 1.075 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.343 1.328 2.577 1.00 0.00 H new ATOM 994 N LEU A 68 3.837 -1.887 1.897 1.00 0.00 N ATOM 995 CA LEU A 68 3.982 -3.225 2.549 1.00 0.00 C ATOM 996 C LEU A 68 4.610 -4.203 1.568 1.00 0.00 C ATOM 997 O LEU A 68 4.160 -4.352 0.452 1.00 0.00 O ATOM 998 CB LEU A 68 2.624 -3.766 3.010 1.00 0.00 C ATOM 999 CG LEU A 68 2.797 -5.133 3.711 1.00 0.00 C ATOM 1000 CD1 LEU A 68 3.987 -5.111 4.669 1.00 0.00 C ATOM 1001 CD2 LEU A 68 1.555 -5.451 4.534 1.00 0.00 C ATOM 0 H LEU A 68 3.423 -1.894 0.965 1.00 0.00 H new ATOM 0 HA LEU A 68 4.622 -3.111 3.424 1.00 0.00 H new ATOM 0 HB2 LEU A 68 2.156 -3.057 3.693 1.00 0.00 H new ATOM 0 HB3 LEU A 68 1.958 -3.871 2.154 1.00 0.00 H new ATOM 0 HG LEU A 68 2.958 -5.882 2.936 1.00 0.00 H new ATOM 0 HD11 LEU A 68 4.086 -6.085 5.149 1.00 0.00 H new ATOM 0 HD12 LEU A 68 4.897 -4.886 4.113 1.00 0.00 H new ATOM 0 HD13 LEU A 68 3.828 -4.346 5.429 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.682 -6.415 5.026 1.00 0.00 H new ATOM 0 HD22 LEU A 68 1.409 -4.676 5.286 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.685 -5.489 3.879 1.00 0.00 H new ATOM 1013 N HIS A 69 5.648 -4.875 1.980 1.00 0.00 N ATOM 1014 CA HIS A 69 6.313 -5.854 1.083 1.00 0.00 C ATOM 1015 C HIS A 69 6.411 -7.194 1.791 1.00 0.00 C ATOM 1016 O HIS A 69 5.933 -7.372 2.891 1.00 0.00 O ATOM 1017 CB HIS A 69 7.718 -5.370 0.720 1.00 0.00 C ATOM 1018 CG HIS A 69 8.508 -5.171 1.977 1.00 0.00 C ATOM 1019 ND1 HIS A 69 8.289 -4.375 3.064 1.00 0.00 N flip ATOM 1020 CD2 HIS A 69 9.687 -5.851 2.234 1.00 0.00 C flip ATOM 1021 CE1 HIS A 69 9.311 -4.549 3.991 1.00 0.00 C flip ATOM 1022 NE2 HIS A 69 10.128 -5.452 3.442 1.00 0.00 N flip ATOM 0 H HIS A 69 6.065 -4.786 2.906 1.00 0.00 H new ATOM 0 HA HIS A 69 5.726 -5.956 0.170 1.00 0.00 H new ATOM 0 HB2 HIS A 69 8.212 -6.098 0.077 1.00 0.00 H new ATOM 0 HB3 HIS A 69 7.661 -4.437 0.160 1.00 0.00 H new ATOM 0 HD2 HIS A 69 10.165 -6.569 1.585 1.00 0.00 H new ATOM 0 HE1 HIS A 69 9.420 -4.060 4.948 1.00 0.00 H new ATOM 0 HE2 HIS A 69 10.981 -5.797 3.883 1.00 0.00 H new ATOM 1180 N TRP A 82 5.837 -10.123 5.675 1.00 0.00 N ATOM 1181 CA TRP A 82 4.915 -8.960 5.506 1.00 0.00 C ATOM 1182 C TRP A 82 5.272 -7.853 6.503 1.00 0.00 C ATOM 1183 O TRP A 82 4.911 -7.915 7.661 1.00 0.00 O ATOM 1184 CB TRP A 82 3.471 -9.415 5.748 1.00 0.00 C ATOM 1185 CG TRP A 82 3.266 -10.786 5.183 1.00 0.00 C ATOM 1186 CD1 TRP A 82 3.993 -11.337 4.183 1.00 0.00 C ATOM 1187 CD2 TRP A 82 2.279 -11.786 5.568 1.00 0.00 C ATOM 1188 NE1 TRP A 82 3.516 -12.611 3.932 1.00 0.00 N ATOM 1189 CE2 TRP A 82 2.459 -12.933 4.760 1.00 0.00 C ATOM 1190 CE3 TRP A 82 1.255 -11.808 6.530 1.00 0.00 C ATOM 1191 CZ2 TRP A 82 1.652 -14.061 4.901 1.00 0.00 C ATOM 1192 CZ3 TRP A 82 0.440 -12.943 6.676 1.00 0.00 C ATOM 1193 CH2 TRP A 82 0.638 -14.068 5.863 1.00 0.00 C ATOM 0 HA TRP A 82 5.016 -8.572 4.492 1.00 0.00 H new ATOM 0 HB2 TRP A 82 3.256 -9.417 6.817 1.00 0.00 H new ATOM 0 HB3 TRP A 82 2.777 -8.714 5.284 1.00 0.00 H new ATOM 0 HD1 TRP A 82 4.812 -10.860 3.665 1.00 0.00 H new ATOM 0 HE1 TRP A 82 3.898 -13.236 3.222 1.00 0.00 H new ATOM 0 HE3 TRP A 82 1.093 -10.947 7.161 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 1.809 -14.924 4.271 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 -0.344 -12.949 7.419 1.00 0.00 H new ATOM 0 HH2 TRP A 82 0.009 -14.938 5.980 1.00 0.00 H new ATOM 1204 N GLU A 83 5.969 -6.831 6.069 1.00 0.00 N ATOM 1205 CA GLU A 83 6.327 -5.726 7.018 1.00 0.00 C ATOM 1206 C GLU A 83 6.178 -4.371 6.319 1.00 0.00 C ATOM 1207 O GLU A 83 6.716 -4.153 5.253 1.00 0.00 O ATOM 1208 CB GLU A 83 7.776 -5.905 7.489 1.00 0.00 C ATOM 1209 CG GLU A 83 7.942 -5.326 8.899 1.00 0.00 C ATOM 1210 CD GLU A 83 9.410 -4.965 9.138 1.00 0.00 C ATOM 1211 OE1 GLU A 83 10.257 -5.539 8.472 1.00 0.00 O ATOM 1212 OE2 GLU A 83 9.663 -4.121 9.983 1.00 0.00 O ATOM 0 H GLU A 83 6.303 -6.713 5.112 1.00 0.00 H new ATOM 0 HA GLU A 83 5.658 -5.760 7.878 1.00 0.00 H new ATOM 0 HB2 GLU A 83 8.040 -6.963 7.487 1.00 0.00 H new ATOM 0 HB3 GLU A 83 8.456 -5.406 6.799 1.00 0.00 H new ATOM 0 HG2 GLU A 83 7.316 -4.441 9.015 1.00 0.00 H new ATOM 0 HG3 GLU A 83 7.610 -6.051 9.642 1.00 0.00 H new ATOM 1219 N TRP A 84 5.445 -3.460 6.909 1.00 0.00 N ATOM 1220 CA TRP A 84 5.257 -2.128 6.277 1.00 0.00 C ATOM 1221 C TRP A 84 6.573 -1.360 6.315 1.00 0.00 C ATOM 1222 O TRP A 84 7.441 -1.642 7.119 1.00 0.00 O ATOM 1223 CB TRP A 84 4.175 -1.360 7.031 1.00 0.00 C ATOM 1224 CG TRP A 84 3.176 -2.330 7.574 1.00 0.00 C ATOM 1225 CD1 TRP A 84 3.328 -3.051 8.707 1.00 0.00 C ATOM 1226 CD2 TRP A 84 1.879 -2.699 7.024 1.00 0.00 C ATOM 1227 NE1 TRP A 84 2.209 -3.840 8.887 1.00 0.00 N ATOM 1228 CE2 TRP A 84 1.288 -3.661 7.876 1.00 0.00 C ATOM 1229 CE3 TRP A 84 1.168 -2.299 5.882 1.00 0.00 C ATOM 1230 CZ2 TRP A 84 0.033 -4.207 7.602 1.00 0.00 C ATOM 1231 CZ3 TRP A 84 -0.093 -2.847 5.603 1.00 0.00 C ATOM 1232 CH2 TRP A 84 -0.658 -3.799 6.459 1.00 0.00 C ATOM 0 H TRP A 84 4.970 -3.586 7.803 1.00 0.00 H new ATOM 0 HA TRP A 84 4.948 -2.250 5.239 1.00 0.00 H new ATOM 0 HB2 TRP A 84 4.619 -0.784 7.843 1.00 0.00 H new ATOM 0 HB3 TRP A 84 3.686 -0.649 6.366 1.00 0.00 H new ATOM 0 HD1 TRP A 84 4.184 -3.016 9.364 1.00 0.00 H new ATOM 0 HE1 TRP A 84 2.079 -4.478 9.672 1.00 0.00 H new ATOM 0 HE3 TRP A 84 1.594 -1.565 5.214 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 -0.400 -4.939 8.268 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -0.631 -2.532 4.721 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -1.628 -4.218 6.236 1.00 0.00 H new ATOM 1243 N SER A 85 6.742 -0.398 5.447 1.00 0.00 N ATOM 1244 CA SER A 85 8.021 0.361 5.443 1.00 0.00 C ATOM 1245 C SER A 85 7.911 1.575 6.353 1.00 0.00 C ATOM 1246 O SER A 85 8.851 2.327 6.520 1.00 0.00 O ATOM 1247 CB SER A 85 8.358 0.807 4.021 1.00 0.00 C ATOM 1248 OG SER A 85 8.380 -0.329 3.165 1.00 0.00 O ATOM 0 H SER A 85 6.057 -0.109 4.749 1.00 0.00 H new ATOM 0 HA SER A 85 8.816 -0.287 5.812 1.00 0.00 H new ATOM 0 HB2 SER A 85 7.620 1.528 3.669 1.00 0.00 H new ATOM 0 HB3 SER A 85 9.326 1.308 4.004 1.00 0.00 H new ATOM 0 HG SER A 85 8.455 -0.035 2.233 1.00 0.00 H new ATOM 1288 N VAL A 89 5.878 -3.482 12.506 1.00 0.00 N ATOM 1289 CA VAL A 89 5.763 -4.913 12.125 1.00 0.00 C ATOM 1290 C VAL A 89 4.350 -5.189 11.612 1.00 0.00 C ATOM 1291 O VAL A 89 3.542 -4.294 11.465 1.00 0.00 O ATOM 1292 CB VAL A 89 6.042 -5.784 13.353 1.00 0.00 C ATOM 1293 CG1 VAL A 89 7.553 -5.923 13.552 1.00 0.00 C ATOM 1294 CG2 VAL A 89 5.424 -5.129 14.591 1.00 0.00 C ATOM 0 HA VAL A 89 6.484 -5.145 11.341 1.00 0.00 H new ATOM 0 HB VAL A 89 5.605 -6.771 13.204 1.00 0.00 H new ATOM 0 HG11 VAL A 89 7.749 -6.543 14.427 1.00 0.00 H new ATOM 0 HG12 VAL A 89 7.995 -6.388 12.671 1.00 0.00 H new ATOM 0 HG13 VAL A 89 7.993 -4.937 13.701 1.00 0.00 H new ATOM 0 HG21 VAL A 89 5.621 -5.747 15.467 1.00 0.00 H new ATOM 0 HG22 VAL A 89 5.863 -4.142 14.738 1.00 0.00 H new ATOM 0 HG23 VAL A 89 4.347 -5.031 14.451 1.00 0.00 H new ATOM 1304 N MET A 90 4.050 -6.425 11.338 1.00 0.00 N ATOM 1305 CA MET A 90 2.695 -6.773 10.835 1.00 0.00 C ATOM 1306 C MET A 90 1.699 -6.769 11.998 1.00 0.00 C ATOM 1307 O MET A 90 1.471 -7.784 12.626 1.00 0.00 O ATOM 1308 CB MET A 90 2.739 -8.171 10.208 1.00 0.00 C ATOM 1309 CG MET A 90 1.507 -8.387 9.317 1.00 0.00 C ATOM 1310 SD MET A 90 0.786 -10.016 9.654 1.00 0.00 S ATOM 1311 CE MET A 90 2.307 -10.986 9.499 1.00 0.00 C ATOM 0 H MET A 90 4.689 -7.214 11.441 1.00 0.00 H new ATOM 0 HA MET A 90 2.382 -6.042 10.090 1.00 0.00 H new ATOM 0 HB2 MET A 90 3.649 -8.286 9.619 1.00 0.00 H new ATOM 0 HB3 MET A 90 2.769 -8.929 10.991 1.00 0.00 H new ATOM 0 HG2 MET A 90 0.770 -7.607 9.504 1.00 0.00 H new ATOM 0 HG3 MET A 90 1.789 -8.314 8.267 1.00 0.00 H new ATOM 0 HE1 MET A 90 2.059 -12.008 9.212 1.00 0.00 H new ATOM 0 HE2 MET A 90 2.947 -10.540 8.738 1.00 0.00 H new ATOM 0 HE3 MET A 90 2.832 -10.995 10.454 1.00 0.00 H new ATOM 1321 N ASN A 91 1.096 -5.644 12.287 1.00 0.00 N ATOM 1322 CA ASN A 91 0.111 -5.603 13.404 1.00 0.00 C ATOM 1323 C ASN A 91 -1.288 -5.811 12.822 1.00 0.00 C ATOM 1324 O ASN A 91 -2.275 -5.806 13.529 1.00 0.00 O ATOM 1325 CB ASN A 91 0.191 -4.244 14.119 1.00 0.00 C ATOM 1326 CG ASN A 91 0.275 -4.459 15.634 1.00 0.00 C ATOM 1327 OD1 ASN A 91 1.317 -4.810 16.153 1.00 0.00 O ATOM 1328 ND2 ASN A 91 -0.785 -4.261 16.368 1.00 0.00 N ATOM 0 H ASN A 91 1.243 -4.760 11.801 1.00 0.00 H new ATOM 0 HA ASN A 91 0.330 -6.387 14.128 1.00 0.00 H new ATOM 0 HB2 ASN A 91 1.064 -3.691 13.772 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -0.685 -3.643 13.876 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -0.740 -4.401 17.377 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -1.659 -3.967 15.933 1.00 0.00 H new ATOM 1335 N TYR A 92 -1.372 -5.999 11.532 1.00 0.00 N ATOM 1336 CA TYR A 92 -2.700 -6.216 10.894 1.00 0.00 C ATOM 1337 C TYR A 92 -2.553 -7.202 9.730 1.00 0.00 C ATOM 1338 O TYR A 92 -1.501 -7.321 9.139 1.00 0.00 O ATOM 1339 CB TYR A 92 -3.244 -4.885 10.376 1.00 0.00 C ATOM 1340 CG TYR A 92 -4.594 -5.103 9.731 1.00 0.00 C ATOM 1341 CD1 TYR A 92 -5.650 -5.646 10.476 1.00 0.00 C ATOM 1342 CD2 TYR A 92 -4.790 -4.761 8.387 1.00 0.00 C ATOM 1343 CE1 TYR A 92 -6.899 -5.847 9.876 1.00 0.00 C ATOM 1344 CE2 TYR A 92 -6.039 -4.963 7.788 1.00 0.00 C ATOM 1345 CZ TYR A 92 -7.093 -5.506 8.533 1.00 0.00 C ATOM 1346 OH TYR A 92 -8.325 -5.704 7.942 1.00 0.00 O ATOM 0 H TYR A 92 -0.577 -6.011 10.893 1.00 0.00 H new ATOM 0 HA TYR A 92 -3.393 -6.625 11.629 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -3.333 -4.173 11.197 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -2.551 -4.454 9.654 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -5.500 -5.909 11.513 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -3.977 -4.341 7.813 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -7.713 -6.265 10.450 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -6.190 -4.700 6.751 1.00 0.00 H new ATOM 0 HH TYR A 92 -8.290 -5.413 7.007 1.00 0.00 H new ATOM 1356 N PHE A 93 -3.600 -7.918 9.401 1.00 0.00 N ATOM 1357 CA PHE A 93 -3.513 -8.902 8.281 1.00 0.00 C ATOM 1358 C PHE A 93 -4.743 -8.776 7.375 1.00 0.00 C ATOM 1359 O PHE A 93 -5.845 -8.552 7.835 1.00 0.00 O ATOM 1360 CB PHE A 93 -3.453 -10.318 8.855 1.00 0.00 C ATOM 1361 CG PHE A 93 -4.742 -10.623 9.582 1.00 0.00 C ATOM 1362 CD1 PHE A 93 -5.851 -11.099 8.873 1.00 0.00 C ATOM 1363 CD2 PHE A 93 -4.828 -10.425 10.966 1.00 0.00 C ATOM 1364 CE1 PHE A 93 -7.045 -11.381 9.547 1.00 0.00 C ATOM 1365 CE2 PHE A 93 -6.022 -10.707 11.640 1.00 0.00 C ATOM 1366 CZ PHE A 93 -7.131 -11.184 10.931 1.00 0.00 C ATOM 0 H PHE A 93 -4.509 -7.863 9.860 1.00 0.00 H new ATOM 0 HA PHE A 93 -2.615 -8.700 7.697 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.296 -11.040 8.054 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -2.608 -10.410 9.537 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -5.785 -11.249 7.805 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -3.973 -10.055 11.513 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -7.900 -11.750 9.000 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -6.088 -10.557 12.707 1.00 0.00 H new ATOM 0 HZ PHE A 93 -8.053 -11.400 11.451 1.00 0.00 H new ATOM 1376 N ALA A 94 -4.561 -8.925 6.089 1.00 0.00 N ATOM 1377 CA ALA A 94 -5.715 -8.820 5.148 1.00 0.00 C ATOM 1378 C ALA A 94 -5.256 -9.191 3.733 1.00 0.00 C ATOM 1379 O ALA A 94 -5.822 -8.753 2.751 1.00 0.00 O ATOM 1380 CB ALA A 94 -6.258 -7.387 5.153 1.00 0.00 C ATOM 0 H ALA A 94 -3.661 -9.115 5.649 1.00 0.00 H new ATOM 0 HA ALA A 94 -6.503 -9.503 5.465 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -7.100 -7.315 4.465 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -6.588 -7.126 6.159 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.473 -6.699 4.839 1.00 0.00 H new ATOM 1386 N TRP A 95 -4.231 -9.992 3.623 1.00 0.00 N ATOM 1387 CA TRP A 95 -3.729 -10.390 2.276 1.00 0.00 C ATOM 1388 C TRP A 95 -4.701 -11.386 1.636 1.00 0.00 C ATOM 1389 O TRP A 95 -5.394 -12.117 2.316 1.00 0.00 O ATOM 1390 CB TRP A 95 -2.353 -11.046 2.424 1.00 0.00 C ATOM 1391 CG TRP A 95 -2.317 -11.835 3.695 1.00 0.00 C ATOM 1392 CD1 TRP A 95 -1.972 -11.340 4.905 1.00 0.00 C ATOM 1393 CD2 TRP A 95 -2.634 -13.241 3.903 1.00 0.00 C ATOM 1394 NE1 TRP A 95 -2.056 -12.353 5.843 1.00 0.00 N ATOM 1395 CE2 TRP A 95 -2.460 -13.545 5.274 1.00 0.00 C ATOM 1396 CE3 TRP A 95 -3.051 -14.274 3.043 1.00 0.00 C ATOM 1397 CZ2 TRP A 95 -2.691 -14.826 5.775 1.00 0.00 C ATOM 1398 CZ3 TRP A 95 -3.285 -15.565 3.544 1.00 0.00 C ATOM 1399 CH2 TRP A 95 -3.105 -15.841 4.908 1.00 0.00 C ATOM 0 H TRP A 95 -3.718 -10.389 4.410 1.00 0.00 H new ATOM 0 HA TRP A 95 -3.650 -9.506 1.643 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -2.154 -11.697 1.573 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -1.573 -10.285 2.433 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -1.679 -10.320 5.106 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -1.845 -12.234 6.834 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -3.192 -14.073 1.991 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -2.551 -15.032 6.826 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -3.605 -16.350 2.875 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -3.286 -16.836 5.287 1.00 0.00 H new ATOM 1410 N GLU A 96 -4.754 -11.422 0.331 1.00 0.00 N ATOM 1411 CA GLU A 96 -5.676 -12.371 -0.354 1.00 0.00 C ATOM 1412 C GLU A 96 -5.198 -13.806 -0.119 1.00 0.00 C ATOM 1413 O GLU A 96 -5.946 -14.656 0.324 1.00 0.00 O ATOM 1414 CB GLU A 96 -5.679 -12.081 -1.857 1.00 0.00 C ATOM 1415 CG GLU A 96 -6.856 -12.801 -2.516 1.00 0.00 C ATOM 1416 CD GLU A 96 -6.832 -12.547 -4.024 1.00 0.00 C ATOM 1417 OE1 GLU A 96 -6.100 -11.665 -4.444 1.00 0.00 O ATOM 1418 OE2 GLU A 96 -7.543 -13.238 -4.735 1.00 0.00 O ATOM 0 H GLU A 96 -4.198 -10.834 -0.290 1.00 0.00 H new ATOM 0 HA GLU A 96 -6.683 -12.251 0.045 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -5.753 -11.007 -2.030 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -4.741 -12.412 -2.303 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -6.799 -13.871 -2.316 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -7.796 -12.447 -2.092 1.00 0.00 H new ATOM 1564 N HIS A 107 7.523 -9.459 -4.502 1.00 0.00 N ATOM 1565 CA HIS A 107 8.054 -9.111 -3.154 1.00 0.00 C ATOM 1566 C HIS A 107 7.497 -7.751 -2.729 1.00 0.00 C ATOM 1567 O HIS A 107 8.149 -6.983 -2.051 1.00 0.00 O ATOM 1568 CB HIS A 107 9.585 -9.057 -3.196 1.00 0.00 C ATOM 1569 CG HIS A 107 10.096 -10.102 -4.149 1.00 0.00 C ATOM 1570 ND1 HIS A 107 10.381 -11.394 -3.745 1.00 0.00 N ATOM 1571 CD2 HIS A 107 10.381 -10.060 -5.491 1.00 0.00 C ATOM 1572 CE1 HIS A 107 10.813 -12.067 -4.827 1.00 0.00 C ATOM 1573 NE2 HIS A 107 10.831 -11.301 -5.915 1.00 0.00 N ATOM 0 HA HIS A 107 7.748 -9.870 -2.435 1.00 0.00 H new ATOM 0 HB2 HIS A 107 9.916 -8.068 -3.512 1.00 0.00 H new ATOM 0 HB3 HIS A 107 9.993 -9.227 -2.200 1.00 0.00 H new ATOM 0 HD2 HIS A 107 10.271 -9.191 -6.122 1.00 0.00 H new ATOM 0 HE1 HIS A 107 11.110 -13.105 -4.814 1.00 0.00 H new ATOM 0 HE2 HIS A 107 11.115 -11.569 -6.857 1.00 0.00 H new ATOM 1581 N CYS A 108 6.288 -7.450 -3.122 1.00 0.00 N ATOM 1582 CA CYS A 108 5.673 -6.146 -2.744 1.00 0.00 C ATOM 1583 C CYS A 108 4.159 -6.335 -2.608 1.00 0.00 C ATOM 1584 O CYS A 108 3.615 -7.328 -3.044 1.00 0.00 O ATOM 1585 CB CYS A 108 5.977 -5.107 -3.820 1.00 0.00 C ATOM 1586 SG CYS A 108 7.588 -4.357 -3.480 1.00 0.00 S ATOM 0 H CYS A 108 5.697 -8.056 -3.692 1.00 0.00 H new ATOM 0 HA CYS A 108 6.084 -5.800 -1.796 1.00 0.00 H new ATOM 0 HB2 CYS A 108 5.980 -5.575 -4.804 1.00 0.00 H new ATOM 0 HB3 CYS A 108 5.201 -4.342 -3.834 1.00 0.00 H new ATOM 1591 N ALA A 109 3.472 -5.403 -1.996 1.00 0.00 N ATOM 1592 CA ALA A 109 1.994 -5.554 -1.828 1.00 0.00 C ATOM 1593 C ALA A 109 1.262 -4.330 -2.389 1.00 0.00 C ATOM 1594 O ALA A 109 1.714 -3.202 -2.284 1.00 0.00 O ATOM 1595 CB ALA A 109 1.661 -5.708 -0.343 1.00 0.00 C ATOM 0 H ALA A 109 3.869 -4.548 -1.607 1.00 0.00 H new ATOM 0 HA ALA A 109 1.669 -6.440 -2.374 1.00 0.00 H new ATOM 0 HB1 ALA A 109 0.583 -5.818 -0.221 1.00 0.00 H new ATOM 0 HB2 ALA A 109 2.163 -6.591 0.053 1.00 0.00 H new ATOM 0 HB3 ALA A 109 1.999 -4.825 0.199 1.00 0.00 H new ATOM 1601 N SER A 110 0.124 -4.560 -2.986 1.00 0.00 N ATOM 1602 CA SER A 110 -0.676 -3.451 -3.572 1.00 0.00 C ATOM 1603 C SER A 110 -2.162 -3.764 -3.371 1.00 0.00 C ATOM 1604 O SER A 110 -2.531 -4.884 -3.086 1.00 0.00 O ATOM 1605 CB SER A 110 -0.365 -3.342 -5.070 1.00 0.00 C ATOM 1606 OG SER A 110 0.758 -4.158 -5.375 1.00 0.00 O ATOM 0 H SER A 110 -0.290 -5.486 -3.093 1.00 0.00 H new ATOM 0 HA SER A 110 -0.429 -2.507 -3.087 1.00 0.00 H new ATOM 0 HB2 SER A 110 -1.228 -3.657 -5.657 1.00 0.00 H new ATOM 0 HB3 SER A 110 -0.159 -2.305 -5.336 1.00 0.00 H new ATOM 0 HG SER A 110 1.543 -3.591 -5.527 1.00 0.00 H new ATOM 1612 N LEU A 111 -3.019 -2.794 -3.523 1.00 0.00 N ATOM 1613 CA LEU A 111 -4.473 -3.057 -3.346 1.00 0.00 C ATOM 1614 C LEU A 111 -5.041 -3.555 -4.675 1.00 0.00 C ATOM 1615 O LEU A 111 -4.562 -3.203 -5.731 1.00 0.00 O ATOM 1616 CB LEU A 111 -5.189 -1.761 -2.943 1.00 0.00 C ATOM 1617 CG LEU A 111 -4.659 -1.255 -1.587 1.00 0.00 C ATOM 1618 CD1 LEU A 111 -4.305 0.232 -1.686 1.00 0.00 C ATOM 1619 CD2 LEU A 111 -5.737 -1.433 -0.514 1.00 0.00 C ATOM 0 H LEU A 111 -2.776 -1.833 -3.762 1.00 0.00 H new ATOM 0 HA LEU A 111 -4.622 -3.804 -2.566 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -5.035 -1.000 -3.708 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -6.263 -1.936 -2.879 1.00 0.00 H new ATOM 0 HG LEU A 111 -3.770 -1.828 -1.322 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -3.931 0.582 -0.724 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -3.537 0.373 -2.447 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -5.194 0.800 -1.958 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.360 -1.075 0.444 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.624 -0.863 -0.791 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -5.996 -2.488 -0.430 1.00 0.00 H new ATOM 1631 N SER A 112 -6.051 -4.381 -4.630 1.00 0.00 N ATOM 1632 CA SER A 112 -6.654 -4.917 -5.890 1.00 0.00 C ATOM 1633 C SER A 112 -8.111 -4.456 -6.000 1.00 0.00 C ATOM 1634 O SER A 112 -8.944 -4.821 -5.195 1.00 0.00 O ATOM 1635 CB SER A 112 -6.614 -6.445 -5.856 1.00 0.00 C ATOM 1636 OG SER A 112 -7.586 -6.918 -4.932 1.00 0.00 O ATOM 0 H SER A 112 -6.489 -4.711 -3.770 1.00 0.00 H new ATOM 0 HA SER A 112 -6.090 -4.549 -6.747 1.00 0.00 H new ATOM 0 HB2 SER A 112 -6.813 -6.848 -6.849 1.00 0.00 H new ATOM 0 HB3 SER A 112 -5.621 -6.788 -5.565 1.00 0.00 H new ATOM 0 HG SER A 112 -7.565 -7.897 -4.908 1.00 0.00 H new ATOM 1642 N ARG A 113 -8.428 -3.662 -6.989 1.00 0.00 N ATOM 1643 CA ARG A 113 -9.838 -3.195 -7.135 1.00 0.00 C ATOM 1644 C ARG A 113 -10.774 -4.406 -7.153 1.00 0.00 C ATOM 1645 O ARG A 113 -11.935 -4.312 -6.807 1.00 0.00 O ATOM 1646 CB ARG A 113 -9.991 -2.414 -8.444 1.00 0.00 C ATOM 1647 CG ARG A 113 -11.470 -2.099 -8.691 1.00 0.00 C ATOM 1648 CD ARG A 113 -11.595 -1.140 -9.876 1.00 0.00 C ATOM 1649 NE ARG A 113 -13.011 -1.104 -10.339 1.00 0.00 N ATOM 1650 CZ ARG A 113 -13.435 -0.107 -11.065 1.00 0.00 C ATOM 1651 NH1 ARG A 113 -12.580 0.649 -11.699 1.00 0.00 N ATOM 1652 NH2 ARG A 113 -14.715 0.136 -11.157 1.00 0.00 N ATOM 0 H ARG A 113 -7.778 -3.319 -7.696 1.00 0.00 H new ATOM 0 HA ARG A 113 -10.093 -2.547 -6.297 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -9.416 -1.489 -8.396 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -9.590 -2.996 -9.274 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -12.020 -3.018 -8.893 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -11.912 -1.653 -7.800 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -11.271 -0.141 -9.585 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -10.944 -1.462 -10.688 1.00 0.00 H new ATOM 0 HE ARG A 113 -13.649 -1.859 -10.088 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -11.580 0.460 -11.627 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -12.912 1.429 -12.267 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -15.383 -0.454 -10.661 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -15.047 0.916 -11.725 1.00 0.00 H new ATOM 1666 N SER A 114 -10.278 -5.543 -7.558 1.00 0.00 N ATOM 1667 CA SER A 114 -11.138 -6.761 -7.604 1.00 0.00 C ATOM 1668 C SER A 114 -11.778 -6.993 -6.234 1.00 0.00 C ATOM 1669 O SER A 114 -12.921 -7.393 -6.133 1.00 0.00 O ATOM 1670 CB SER A 114 -10.283 -7.971 -7.978 1.00 0.00 C ATOM 1671 OG SER A 114 -11.107 -9.129 -8.031 1.00 0.00 O ATOM 0 H SER A 114 -9.314 -5.682 -7.859 1.00 0.00 H new ATOM 0 HA SER A 114 -11.922 -6.622 -8.349 1.00 0.00 H new ATOM 0 HB2 SER A 114 -9.803 -7.808 -8.943 1.00 0.00 H new ATOM 0 HB3 SER A 114 -9.488 -8.109 -7.246 1.00 0.00 H new ATOM 0 HG SER A 114 -10.562 -9.907 -8.272 1.00 0.00 H new ATOM 1677 N THR A 115 -11.050 -6.747 -5.177 1.00 0.00 N ATOM 1678 CA THR A 115 -11.614 -6.953 -3.811 1.00 0.00 C ATOM 1679 C THR A 115 -12.040 -5.607 -3.228 1.00 0.00 C ATOM 1680 O THR A 115 -12.045 -5.411 -2.029 1.00 0.00 O ATOM 1681 CB THR A 115 -10.548 -7.581 -2.910 1.00 0.00 C ATOM 1682 OG1 THR A 115 -9.471 -6.669 -2.748 1.00 0.00 O ATOM 1683 CG2 THR A 115 -10.033 -8.873 -3.547 1.00 0.00 C ATOM 0 H THR A 115 -10.087 -6.412 -5.201 1.00 0.00 H new ATOM 0 HA THR A 115 -12.478 -7.615 -3.871 1.00 0.00 H new ATOM 0 HB THR A 115 -10.983 -7.808 -1.937 1.00 0.00 H new ATOM 0 HG1 THR A 115 -8.843 -6.768 -3.494 1.00 0.00 H new ATOM 0 HG21 THR A 115 -9.274 -9.318 -2.904 1.00 0.00 H new ATOM 0 HG22 THR A 115 -10.860 -9.572 -3.671 1.00 0.00 H new ATOM 0 HG23 THR A 115 -9.598 -8.650 -4.521 1.00 0.00 H new ATOM 1691 N ALA A 116 -12.395 -4.674 -4.068 1.00 0.00 N ATOM 1692 CA ALA A 116 -12.817 -3.337 -3.563 1.00 0.00 C ATOM 1693 C ALA A 116 -11.659 -2.699 -2.796 1.00 0.00 C ATOM 1694 O ALA A 116 -11.856 -1.919 -1.886 1.00 0.00 O ATOM 1695 CB ALA A 116 -14.025 -3.497 -2.635 1.00 0.00 C ATOM 0 H ALA A 116 -12.411 -4.780 -5.082 1.00 0.00 H new ATOM 0 HA ALA A 116 -13.092 -2.699 -4.403 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -14.333 -2.518 -2.266 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -14.848 -3.953 -3.185 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -13.755 -4.134 -1.793 1.00 0.00 H new ATOM 1701 N PHE A 117 -10.449 -3.031 -3.159 1.00 0.00 N ATOM 1702 CA PHE A 117 -9.264 -2.455 -2.460 1.00 0.00 C ATOM 1703 C PHE A 117 -9.258 -2.914 -1.002 1.00 0.00 C ATOM 1704 O PHE A 117 -8.652 -2.297 -0.150 1.00 0.00 O ATOM 1705 CB PHE A 117 -9.316 -0.926 -2.517 1.00 0.00 C ATOM 1706 CG PHE A 117 -9.697 -0.482 -3.910 1.00 0.00 C ATOM 1707 CD1 PHE A 117 -8.726 -0.424 -4.915 1.00 0.00 C ATOM 1708 CD2 PHE A 117 -11.021 -0.126 -4.194 1.00 0.00 C ATOM 1709 CE1 PHE A 117 -9.079 -0.011 -6.206 1.00 0.00 C ATOM 1710 CE2 PHE A 117 -11.373 0.286 -5.485 1.00 0.00 C ATOM 1711 CZ PHE A 117 -10.402 0.344 -6.490 1.00 0.00 C ATOM 0 H PHE A 117 -10.229 -3.680 -3.914 1.00 0.00 H new ATOM 0 HA PHE A 117 -8.355 -2.799 -2.954 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -10.040 -0.550 -1.794 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -8.347 -0.509 -2.244 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -7.704 -0.698 -4.696 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -11.770 -0.169 -3.418 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -8.330 0.033 -6.982 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -12.395 0.559 -5.705 1.00 0.00 H new ATOM 0 HZ PHE A 117 -10.674 0.663 -7.485 1.00 0.00 H new ATOM 1721 N LEU A 118 -9.928 -3.997 -0.713 1.00 0.00 N ATOM 1722 CA LEU A 118 -9.965 -4.509 0.689 1.00 0.00 C ATOM 1723 C LEU A 118 -9.082 -5.754 0.797 1.00 0.00 C ATOM 1724 O LEU A 118 -9.220 -6.547 1.707 1.00 0.00 O ATOM 1725 CB LEU A 118 -11.406 -4.871 1.055 1.00 0.00 C ATOM 1726 CG LEU A 118 -12.282 -3.614 1.026 1.00 0.00 C ATOM 1727 CD1 LEU A 118 -13.735 -4.003 1.306 1.00 0.00 C ATOM 1728 CD2 LEU A 118 -11.804 -2.617 2.092 1.00 0.00 C ATOM 0 H LEU A 118 -10.453 -4.551 -1.389 1.00 0.00 H new ATOM 0 HA LEU A 118 -9.597 -3.743 1.371 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -11.793 -5.611 0.355 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -11.436 -5.323 2.046 1.00 0.00 H new ATOM 0 HG LEU A 118 -12.209 -3.148 0.044 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -14.361 -3.111 1.286 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -14.077 -4.703 0.544 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -13.803 -4.472 2.287 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -12.432 -1.726 2.065 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -11.871 -3.078 3.077 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -10.770 -2.338 1.891 1.00 0.00 H new ATOM 1740 N ARG A 119 -8.173 -5.928 -0.124 1.00 0.00 N ATOM 1741 CA ARG A 119 -7.277 -7.119 -0.078 1.00 0.00 C ATOM 1742 C ARG A 119 -5.934 -6.760 -0.722 1.00 0.00 C ATOM 1743 O ARG A 119 -5.876 -6.030 -1.690 1.00 0.00 O ATOM 1744 CB ARG A 119 -7.930 -8.277 -0.842 1.00 0.00 C ATOM 1745 CG ARG A 119 -7.477 -9.617 -0.246 1.00 0.00 C ATOM 1746 CD ARG A 119 -8.203 -9.877 1.082 1.00 0.00 C ATOM 1747 NE ARG A 119 -9.172 -10.996 0.902 1.00 0.00 N ATOM 1748 CZ ARG A 119 -9.258 -11.943 1.796 1.00 0.00 C ATOM 1749 NH1 ARG A 119 -9.217 -11.646 3.066 1.00 0.00 N ATOM 1750 NH2 ARG A 119 -9.380 -13.187 1.421 1.00 0.00 N ATOM 0 H ARG A 119 -8.012 -5.295 -0.908 1.00 0.00 H new ATOM 0 HA ARG A 119 -7.113 -7.422 0.956 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -9.015 -8.193 -0.788 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -7.658 -8.228 -1.896 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -7.686 -10.425 -0.947 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -6.399 -9.606 -0.084 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -7.483 -10.126 1.861 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -8.725 -8.977 1.407 1.00 0.00 H new ATOM 0 HE ARG A 119 -9.770 -11.021 0.076 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -9.118 -10.674 3.360 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -9.284 -12.386 3.765 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -9.408 -13.420 0.428 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -9.447 -13.926 2.121 1.00 0.00 H new ATOM 1764 N TRP A 120 -4.853 -7.260 -0.186 1.00 0.00 N ATOM 1765 CA TRP A 120 -3.514 -6.938 -0.762 1.00 0.00 C ATOM 1766 C TRP A 120 -3.087 -8.035 -1.742 1.00 0.00 C ATOM 1767 O TRP A 120 -3.295 -9.207 -1.505 1.00 0.00 O ATOM 1768 CB TRP A 120 -2.484 -6.844 0.364 1.00 0.00 C ATOM 1769 CG TRP A 120 -3.052 -6.051 1.494 1.00 0.00 C ATOM 1770 CD1 TRP A 120 -3.797 -4.929 1.363 1.00 0.00 C ATOM 1771 CD2 TRP A 120 -2.934 -6.300 2.922 1.00 0.00 C ATOM 1772 NE1 TRP A 120 -4.142 -4.474 2.623 1.00 0.00 N ATOM 1773 CE2 TRP A 120 -3.634 -5.287 3.617 1.00 0.00 C ATOM 1774 CE3 TRP A 120 -2.292 -7.298 3.675 1.00 0.00 C ATOM 1775 CZ2 TRP A 120 -3.696 -5.265 5.009 1.00 0.00 C ATOM 1776 CZ3 TRP A 120 -2.351 -7.280 5.077 1.00 0.00 C ATOM 1777 CH2 TRP A 120 -3.051 -6.266 5.744 1.00 0.00 C ATOM 0 H TRP A 120 -4.839 -7.877 0.626 1.00 0.00 H new ATOM 0 HA TRP A 120 -3.575 -5.986 -1.290 1.00 0.00 H new ATOM 0 HB2 TRP A 120 -2.212 -7.842 0.707 1.00 0.00 H new ATOM 0 HB3 TRP A 120 -1.571 -6.373 -0.002 1.00 0.00 H new ATOM 0 HD1 TRP A 120 -4.076 -4.465 0.429 1.00 0.00 H new ATOM 0 HE1 TRP A 120 -4.703 -3.640 2.797 1.00 0.00 H new ATOM 0 HE3 TRP A 120 -1.749 -8.084 3.171 1.00 0.00 H new ATOM 0 HZ2 TRP A 120 -4.238 -4.481 5.517 1.00 0.00 H new ATOM 0 HZ3 TRP A 120 -1.854 -8.052 5.645 1.00 0.00 H new ATOM 0 HH2 TRP A 120 -3.093 -6.257 6.823 1.00 0.00 H new ATOM 1788 N LYS A 121 -2.482 -7.655 -2.837 1.00 0.00 N ATOM 1789 CA LYS A 121 -2.023 -8.662 -3.839 1.00 0.00 C ATOM 1790 C LYS A 121 -0.532 -8.475 -4.095 1.00 0.00 C ATOM 1791 O LYS A 121 -0.007 -7.383 -4.004 1.00 0.00 O ATOM 1792 CB LYS A 121 -2.796 -8.474 -5.149 1.00 0.00 C ATOM 1793 CG LYS A 121 -2.632 -9.719 -6.031 1.00 0.00 C ATOM 1794 CD LYS A 121 -3.713 -10.747 -5.687 1.00 0.00 C ATOM 1795 CE LYS A 121 -3.496 -12.015 -6.512 1.00 0.00 C ATOM 1796 NZ LYS A 121 -3.345 -11.653 -7.949 1.00 0.00 N ATOM 0 H LYS A 121 -2.285 -6.685 -3.081 1.00 0.00 H new ATOM 0 HA LYS A 121 -2.205 -9.666 -3.455 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -3.852 -8.303 -4.938 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -2.429 -7.593 -5.675 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -2.703 -9.442 -7.083 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -1.644 -10.154 -5.882 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -3.679 -10.983 -4.623 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -4.701 -10.333 -5.891 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -2.607 -12.541 -6.163 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -4.339 -12.694 -6.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -3.536 -12.488 -8.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -4.019 -10.898 -8.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -2.375 -11.320 -8.123 1.00 0.00 H new ATOM 1810 N ASP A 122 0.159 -9.536 -4.403 1.00 0.00 N ATOM 1811 CA ASP A 122 1.618 -9.420 -4.653 1.00 0.00 C ATOM 1812 C ASP A 122 1.860 -8.898 -6.071 1.00 0.00 C ATOM 1813 O ASP A 122 1.159 -9.251 -6.998 1.00 0.00 O ATOM 1814 CB ASP A 122 2.275 -10.792 -4.492 1.00 0.00 C ATOM 1815 CG ASP A 122 1.995 -11.334 -3.091 1.00 0.00 C ATOM 1816 OD1 ASP A 122 0.985 -11.999 -2.925 1.00 0.00 O ATOM 1817 OD2 ASP A 122 2.793 -11.073 -2.206 1.00 0.00 O ATOM 0 H ASP A 122 -0.225 -10.477 -4.492 1.00 0.00 H new ATOM 0 HA ASP A 122 2.052 -8.724 -3.936 1.00 0.00 H new ATOM 0 HB2 ASP A 122 1.889 -11.481 -5.243 1.00 0.00 H new ATOM 0 HB3 ASP A 122 3.350 -10.713 -4.654 1.00 0.00 H new ATOM 1822 N TYR A 123 2.845 -8.058 -6.251 1.00 0.00 N ATOM 1823 CA TYR A 123 3.119 -7.520 -7.618 1.00 0.00 C ATOM 1824 C TYR A 123 4.605 -7.156 -7.748 1.00 0.00 C ATOM 1825 O TYR A 123 5.271 -6.865 -6.775 1.00 0.00 O ATOM 1826 CB TYR A 123 2.250 -6.273 -7.851 1.00 0.00 C ATOM 1827 CG TYR A 123 1.590 -6.353 -9.209 1.00 0.00 C ATOM 1828 CD1 TYR A 123 2.287 -5.940 -10.352 1.00 0.00 C ATOM 1829 CD2 TYR A 123 0.283 -6.841 -9.323 1.00 0.00 C ATOM 1830 CE1 TYR A 123 1.675 -6.013 -11.609 1.00 0.00 C ATOM 1831 CE2 TYR A 123 -0.329 -6.915 -10.581 1.00 0.00 C ATOM 1832 CZ TYR A 123 0.367 -6.501 -11.723 1.00 0.00 C ATOM 1833 OH TYR A 123 -0.235 -6.575 -12.963 1.00 0.00 O ATOM 0 H TYR A 123 3.468 -7.722 -5.517 1.00 0.00 H new ATOM 0 HA TYR A 123 2.878 -8.277 -8.364 1.00 0.00 H new ATOM 0 HB2 TYR A 123 1.491 -6.197 -7.072 1.00 0.00 H new ATOM 0 HB3 TYR A 123 2.863 -5.374 -7.787 1.00 0.00 H new ATOM 0 HD1 TYR A 123 3.296 -5.565 -10.263 1.00 0.00 H new ATOM 0 HD2 TYR A 123 -0.253 -7.160 -8.442 1.00 0.00 H new ATOM 0 HE1 TYR A 123 2.211 -5.693 -12.490 1.00 0.00 H new ATOM 0 HE2 TYR A 123 -1.337 -7.291 -10.670 1.00 0.00 H new ATOM 0 HH TYR A 123 -1.141 -6.937 -12.866 1.00 0.00 H new ATOM 1843 N ASN A 124 5.126 -7.173 -8.949 1.00 0.00 N ATOM 1844 CA ASN A 124 6.566 -6.832 -9.152 1.00 0.00 C ATOM 1845 C ASN A 124 6.871 -5.478 -8.506 1.00 0.00 C ATOM 1846 O ASN A 124 6.332 -4.461 -8.889 1.00 0.00 O ATOM 1847 CB ASN A 124 6.865 -6.760 -10.652 1.00 0.00 C ATOM 1848 CG ASN A 124 6.952 -8.176 -11.225 1.00 0.00 C ATOM 1849 OD1 ASN A 124 6.030 -9.047 -10.921 1.00 0.00 O flip ATOM 1850 ND2 ASN A 124 7.870 -8.492 -11.956 1.00 0.00 N flip ATOM 0 H ASN A 124 4.614 -7.409 -9.799 1.00 0.00 H new ATOM 0 HA ASN A 124 7.188 -7.600 -8.692 1.00 0.00 H new ATOM 0 HB2 ASN A 124 6.083 -6.197 -11.163 1.00 0.00 H new ATOM 0 HB3 ASN A 124 7.802 -6.230 -10.822 1.00 0.00 H new ATOM 0 HD21 ASN A 124 8.591 -7.810 -12.193 1.00 0.00 H new ATOM 0 HD22 ASN A 124 7.920 -9.439 -12.332 1.00 0.00 H new ATOM 1857 N CYS A 125 7.728 -5.466 -7.524 1.00 0.00 N ATOM 1858 CA CYS A 125 8.076 -4.192 -6.825 1.00 0.00 C ATOM 1859 C CYS A 125 8.391 -3.076 -7.826 1.00 0.00 C ATOM 1860 O CYS A 125 8.147 -1.915 -7.561 1.00 0.00 O ATOM 1861 CB CYS A 125 9.310 -4.421 -5.951 1.00 0.00 C ATOM 1862 SG CYS A 125 8.880 -5.478 -4.551 1.00 0.00 S ATOM 0 H CYS A 125 8.209 -6.293 -7.170 1.00 0.00 H new ATOM 0 HA CYS A 125 7.220 -3.891 -6.221 1.00 0.00 H new ATOM 0 HB2 CYS A 125 10.102 -4.885 -6.539 1.00 0.00 H new ATOM 0 HB3 CYS A 125 9.696 -3.466 -5.593 1.00 0.00 H new ATOM 1867 N ASN A 126 8.959 -3.399 -8.953 1.00 0.00 N ATOM 1868 CA ASN A 126 9.317 -2.328 -9.928 1.00 0.00 C ATOM 1869 C ASN A 126 8.078 -1.825 -10.679 1.00 0.00 C ATOM 1870 O ASN A 126 8.013 -0.676 -11.064 1.00 0.00 O ATOM 1871 CB ASN A 126 10.337 -2.871 -10.932 1.00 0.00 C ATOM 1872 CG ASN A 126 11.652 -3.172 -10.212 1.00 0.00 C ATOM 1873 OD1 ASN A 126 11.941 -4.311 -9.899 1.00 0.00 O ATOM 1874 ND2 ASN A 126 12.469 -2.193 -9.934 1.00 0.00 N ATOM 0 H ASN A 126 9.190 -4.350 -9.242 1.00 0.00 H new ATOM 0 HA ASN A 126 9.745 -1.492 -9.375 1.00 0.00 H new ATOM 0 HB2 ASN A 126 9.953 -3.776 -11.403 1.00 0.00 H new ATOM 0 HB3 ASN A 126 10.504 -2.144 -11.727 1.00 0.00 H new ATOM 0 HD21 ASN A 126 13.349 -2.384 -9.455 1.00 0.00 H new ATOM 0 HD22 ASN A 126 12.228 -1.237 -10.196 1.00 0.00 H new ATOM 1881 N VAL A 127 7.092 -2.654 -10.889 1.00 0.00 N ATOM 1882 CA VAL A 127 5.879 -2.169 -11.613 1.00 0.00 C ATOM 1883 C VAL A 127 5.361 -0.943 -10.864 1.00 0.00 C ATOM 1884 O VAL A 127 5.197 -0.976 -9.660 1.00 0.00 O ATOM 1885 CB VAL A 127 4.807 -3.268 -11.630 1.00 0.00 C ATOM 1886 CG1 VAL A 127 3.426 -2.652 -11.886 1.00 0.00 C ATOM 1887 CG2 VAL A 127 5.127 -4.271 -12.741 1.00 0.00 C ATOM 0 H VAL A 127 7.071 -3.631 -10.597 1.00 0.00 H new ATOM 0 HA VAL A 127 6.120 -1.914 -12.645 1.00 0.00 H new ATOM 0 HB VAL A 127 4.800 -3.774 -10.665 1.00 0.00 H new ATOM 0 HG11 VAL A 127 2.673 -3.440 -11.896 1.00 0.00 H new ATOM 0 HG12 VAL A 127 3.194 -1.938 -11.096 1.00 0.00 H new ATOM 0 HG13 VAL A 127 3.429 -2.140 -12.848 1.00 0.00 H new ATOM 0 HG21 VAL A 127 4.367 -5.053 -12.755 1.00 0.00 H new ATOM 0 HG22 VAL A 127 5.138 -3.758 -13.703 1.00 0.00 H new ATOM 0 HG23 VAL A 127 6.104 -4.718 -12.557 1.00 0.00 H new ATOM 1897 N ARG A 128 5.135 0.153 -11.539 1.00 0.00 N ATOM 1898 CA ARG A 128 4.676 1.355 -10.807 1.00 0.00 C ATOM 1899 C ARG A 128 3.170 1.366 -10.710 1.00 0.00 C ATOM 1900 O ARG A 128 2.497 0.833 -11.570 1.00 0.00 O ATOM 1901 CB ARG A 128 5.148 2.597 -11.574 1.00 0.00 C ATOM 1902 CG ARG A 128 5.280 2.260 -13.064 1.00 0.00 C ATOM 1903 CD ARG A 128 5.513 3.542 -13.875 1.00 0.00 C ATOM 1904 NE ARG A 128 6.654 3.335 -14.810 1.00 0.00 N ATOM 1905 CZ ARG A 128 6.897 4.209 -15.747 1.00 0.00 C ATOM 1906 NH1 ARG A 128 5.984 5.081 -16.079 1.00 0.00 N ATOM 1907 NH2 ARG A 128 8.053 4.212 -16.353 1.00 0.00 N ATOM 0 H ARG A 128 5.247 0.262 -12.547 1.00 0.00 H new ATOM 0 HA ARG A 128 5.088 1.350 -9.798 1.00 0.00 H new ATOM 0 HB2 ARG A 128 4.439 3.413 -11.437 1.00 0.00 H new ATOM 0 HB3 ARG A 128 6.106 2.937 -11.181 1.00 0.00 H new ATOM 0 HG2 ARG A 128 6.108 1.568 -13.217 1.00 0.00 H new ATOM 0 HG3 ARG A 128 4.377 1.758 -13.413 1.00 0.00 H new ATOM 0 HD2 ARG A 128 4.613 3.801 -14.433 1.00 0.00 H new ATOM 0 HD3 ARG A 128 5.724 4.376 -13.205 1.00 0.00 H new ATOM 0 HE ARG A 128 7.246 2.509 -14.717 1.00 0.00 H new ATOM 0 HH11 ARG A 128 5.081 5.079 -15.606 1.00 0.00 H new ATOM 0 HH12 ARG A 128 6.174 5.765 -16.812 1.00 0.00 H new ATOM 0 HH21 ARG A 128 8.766 3.531 -16.094 1.00 0.00 H new ATOM 0 HH22 ARG A 128 8.243 4.896 -17.086 1.00 0.00 H new ATOM 1921 N LEU A 129 2.600 1.961 -9.681 1.00 0.00 N ATOM 1922 CA LEU A 129 1.097 1.931 -9.642 1.00 0.00 C ATOM 1923 C LEU A 129 0.579 3.204 -9.030 1.00 0.00 C ATOM 1924 O LEU A 129 1.288 3.831 -8.264 1.00 0.00 O ATOM 1925 CB LEU A 129 0.645 0.761 -8.756 1.00 0.00 C ATOM 1926 CG LEU A 129 0.603 -0.551 -9.556 1.00 0.00 C ATOM 1927 CD1 LEU A 129 1.510 -1.591 -8.892 1.00 0.00 C ATOM 1928 CD2 LEU A 129 -0.829 -1.079 -9.576 1.00 0.00 C ATOM 0 H LEU A 129 3.073 2.437 -8.913 1.00 0.00 H new ATOM 0 HA LEU A 129 0.715 1.821 -10.657 1.00 0.00 H new ATOM 0 HB2 LEU A 129 1.326 0.655 -7.912 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -0.342 0.972 -8.344 1.00 0.00 H new ATOM 0 HG LEU A 129 0.947 -0.365 -10.573 1.00 0.00 H new ATOM 0 HD11 LEU A 129 1.477 -2.519 -9.462 1.00 0.00 H new ATOM 0 HD12 LEU A 129 2.534 -1.217 -8.866 1.00 0.00 H new ATOM 0 HD13 LEU A 129 1.166 -1.778 -7.875 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -0.866 -2.010 -10.142 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -1.164 -1.262 -8.555 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.482 -0.343 -10.045 1.00 0.00 H new ATOM 1940 N PRO A 130 -0.643 3.584 -9.262 1.00 0.00 N ATOM 1941 CA PRO A 130 -1.155 4.780 -8.570 1.00 0.00 C ATOM 1942 C PRO A 130 -0.994 4.518 -7.072 1.00 0.00 C ATOM 1943 O PRO A 130 -1.224 3.410 -6.629 1.00 0.00 O ATOM 1944 CB PRO A 130 -2.625 4.821 -9.006 1.00 0.00 C ATOM 1945 CG PRO A 130 -2.889 3.632 -9.949 1.00 0.00 C ATOM 1946 CD PRO A 130 -1.568 2.886 -10.186 1.00 0.00 C ATOM 0 HA PRO A 130 -0.656 5.723 -8.793 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -3.280 4.767 -8.136 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -2.844 5.761 -9.512 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -3.628 2.961 -9.512 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -3.298 3.985 -10.896 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -1.652 1.825 -9.952 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -1.240 2.959 -11.223 1.00 0.00 H new ATOM 1954 N TYR A 131 -0.540 5.453 -6.284 1.00 0.00 N ATOM 1955 CA TYR A 131 -0.325 5.112 -4.843 1.00 0.00 C ATOM 1956 C TYR A 131 -0.779 6.219 -3.903 1.00 0.00 C ATOM 1957 O TYR A 131 -1.162 7.296 -4.315 1.00 0.00 O ATOM 1958 CB TYR A 131 1.170 4.880 -4.623 1.00 0.00 C ATOM 1959 CG TYR A 131 1.914 6.182 -4.807 1.00 0.00 C ATOM 1960 CD1 TYR A 131 2.057 6.728 -6.087 1.00 0.00 C ATOM 1961 CD2 TYR A 131 2.455 6.843 -3.698 1.00 0.00 C ATOM 1962 CE1 TYR A 131 2.746 7.935 -6.260 1.00 0.00 C ATOM 1963 CE2 TYR A 131 3.142 8.052 -3.871 1.00 0.00 C ATOM 1964 CZ TYR A 131 3.288 8.597 -5.152 1.00 0.00 C ATOM 1965 OH TYR A 131 3.965 9.787 -5.323 1.00 0.00 O ATOM 0 H TYR A 131 -0.314 6.409 -6.559 1.00 0.00 H new ATOM 0 HA TYR A 131 -0.917 4.224 -4.621 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.344 4.488 -3.621 1.00 0.00 H new ATOM 0 HB3 TYR A 131 1.541 4.134 -5.326 1.00 0.00 H new ATOM 0 HD1 TYR A 131 1.636 6.219 -6.942 1.00 0.00 H new ATOM 0 HD2 TYR A 131 2.343 6.422 -2.710 1.00 0.00 H new ATOM 0 HE1 TYR A 131 2.859 8.355 -7.248 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.559 8.563 -3.016 1.00 0.00 H new ATOM 0 HH TYR A 131 4.276 10.114 -4.453 1.00 0.00 H new ATOM 1975 N VAL A 132 -0.703 5.950 -2.619 1.00 0.00 N ATOM 1976 CA VAL A 132 -1.090 6.970 -1.606 1.00 0.00 C ATOM 1977 C VAL A 132 0.149 7.293 -0.778 1.00 0.00 C ATOM 1978 O VAL A 132 1.090 6.524 -0.741 1.00 0.00 O ATOM 1979 CB VAL A 132 -2.190 6.413 -0.702 1.00 0.00 C ATOM 1980 CG1 VAL A 132 -2.499 7.419 0.412 1.00 0.00 C ATOM 1981 CG2 VAL A 132 -3.457 6.168 -1.527 1.00 0.00 C ATOM 0 H VAL A 132 -0.387 5.060 -2.233 1.00 0.00 H new ATOM 0 HA VAL A 132 -1.469 7.869 -2.093 1.00 0.00 H new ATOM 0 HB VAL A 132 -1.853 5.474 -0.263 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -3.283 7.020 1.055 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -1.600 7.595 1.003 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -2.834 8.358 -0.028 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -4.240 5.771 -0.881 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -3.791 7.107 -1.968 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -3.242 5.451 -2.320 1.00 0.00 H new ATOM 1991 N CYS A 133 0.178 8.418 -0.124 1.00 0.00 N ATOM 1992 CA CYS A 133 1.385 8.768 0.679 1.00 0.00 C ATOM 1993 C CYS A 133 0.976 9.406 2.006 1.00 0.00 C ATOM 1994 O CYS A 133 0.186 10.329 2.043 1.00 0.00 O ATOM 1995 CB CYS A 133 2.239 9.753 -0.124 1.00 0.00 C ATOM 1996 SG CYS A 133 3.667 10.275 0.858 1.00 0.00 S ATOM 0 H CYS A 133 -0.574 9.107 -0.109 1.00 0.00 H new ATOM 0 HA CYS A 133 1.954 7.863 0.892 1.00 0.00 H new ATOM 0 HB2 CYS A 133 2.575 9.286 -1.050 1.00 0.00 H new ATOM 0 HB3 CYS A 133 1.642 10.621 -0.403 1.00 0.00 H new ATOM 2001 N LYS A 134 1.520 8.928 3.098 1.00 0.00 N ATOM 2002 CA LYS A 134 1.176 9.518 4.426 1.00 0.00 C ATOM 2003 C LYS A 134 2.319 10.438 4.853 1.00 0.00 C ATOM 2004 O LYS A 134 3.446 10.253 4.444 1.00 0.00 O ATOM 2005 CB LYS A 134 0.993 8.390 5.452 1.00 0.00 C ATOM 2006 CG LYS A 134 2.354 7.973 6.021 1.00 0.00 C ATOM 2007 CD LYS A 134 2.234 6.596 6.679 1.00 0.00 C ATOM 2008 CE LYS A 134 3.461 6.342 7.558 1.00 0.00 C ATOM 2009 NZ LYS A 134 4.654 6.991 6.944 1.00 0.00 N ATOM 0 H LYS A 134 2.186 8.156 3.126 1.00 0.00 H new ATOM 0 HA LYS A 134 0.249 10.087 4.363 1.00 0.00 H new ATOM 0 HB2 LYS A 134 0.339 8.723 6.258 1.00 0.00 H new ATOM 0 HB3 LYS A 134 0.509 7.534 4.982 1.00 0.00 H new ATOM 0 HG2 LYS A 134 3.099 7.944 5.226 1.00 0.00 H new ATOM 0 HG3 LYS A 134 2.695 8.708 6.750 1.00 0.00 H new ATOM 0 HD2 LYS A 134 1.326 6.546 7.280 1.00 0.00 H new ATOM 0 HD3 LYS A 134 2.154 5.822 5.916 1.00 0.00 H new ATOM 0 HE2 LYS A 134 3.293 6.738 8.559 1.00 0.00 H new ATOM 0 HE3 LYS A 134 3.631 5.270 7.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 5.519 6.593 7.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 4.654 6.819 5.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 4.623 8.015 7.123 1.00 0.00 H new ATOM 2023 N PHE A 135 2.048 11.430 5.663 1.00 0.00 N ATOM 2024 CA PHE A 135 3.152 12.352 6.091 1.00 0.00 C ATOM 2025 C PHE A 135 2.615 13.406 7.061 1.00 0.00 C ATOM 2026 O PHE A 135 1.753 14.192 6.725 1.00 0.00 O ATOM 2027 CB PHE A 135 3.743 13.063 4.868 1.00 0.00 C ATOM 2028 CG PHE A 135 2.662 13.839 4.154 1.00 0.00 C ATOM 2029 CD1 PHE A 135 1.850 13.204 3.205 1.00 0.00 C ATOM 2030 CD2 PHE A 135 2.473 15.198 4.437 1.00 0.00 C ATOM 2031 CE1 PHE A 135 0.851 13.925 2.541 1.00 0.00 C ATOM 2032 CE2 PHE A 135 1.474 15.920 3.773 1.00 0.00 C ATOM 2033 CZ PHE A 135 0.662 15.283 2.826 1.00 0.00 C ATOM 0 H PHE A 135 1.126 11.642 6.043 1.00 0.00 H new ATOM 0 HA PHE A 135 3.923 11.760 6.584 1.00 0.00 H new ATOM 0 HB2 PHE A 135 4.542 13.736 5.179 1.00 0.00 H new ATOM 0 HB3 PHE A 135 4.187 12.333 4.191 1.00 0.00 H new ATOM 0 HD1 PHE A 135 1.995 12.157 2.986 1.00 0.00 H new ATOM 0 HD2 PHE A 135 3.098 15.689 5.168 1.00 0.00 H new ATOM 0 HE1 PHE A 135 0.226 13.434 1.809 1.00 0.00 H new ATOM 0 HE2 PHE A 135 1.330 16.968 3.991 1.00 0.00 H new ATOM 0 HZ PHE A 135 -0.110 15.839 2.315 1.00 0.00 H new