USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=32 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 21 LYS NZ :NH3+ 176:sc= 0.0134 (180deg=0) USER MOD Set 1.2: A 131 TYR OH : rot 180:sc=-0.00712 USER MOD Set 2.1: A 22 SER OG : rot -104:sc= 1.16 USER MOD Set 2.2: A 126 ASN :FLIP amide:sc= -0.736 F(o=-1.1!,f=0.42) USER MOD Set 3.1: A 112 SER OG : rot 39:sc= 0.333! USER MOD Set 3.2: A 115 THR OG1 : rot -129:sc= 1.09 USER MOD Set 4.1: A 63 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 114 SER OG : rot 180:sc= 0.0135 USER MOD Set 5.1: A 31 GLN :FLIP amide:sc= 0 F(o=-4.9,f=-4) USER MOD Set 5.2: A 37 ASN : amide:sc= -4.02! C(o=-4!,f=-4.9!) USER MOD Set 6.1: A 9 TYR OH : rot 30:sc= 0 USER MOD Set 6.2: A 43 SER OG : rot 180:sc= 0.587 USER MOD Single : A 6 SER OG : rot 31:sc= 0.432 USER MOD Single : A 7 LYS NZ :NH3+ -173:sc= 0.0242 (180deg=0.00564) USER MOD Single : A 11 SER OG : rot -64:sc= 1.02 USER MOD Single : A 12 HIS :FLIP no HD1:sc= -2.51! C(o=-3.8!,f=-2.5!) USER MOD Single : A 13 CYS SG : rot 180:sc= 0 USER MOD Single : A 14 TYR OH : rot 180:sc= -0.459 USER MOD Single : A 19 SER OG : rot 140:sc= -0.42 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot 180:sc= -0.0826 USER MOD Single : A 40 SER OG : rot 180:sc= -0.0494 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 140:sc= 0.879 USER MOD Single : A 52 SER OG : rot -41:sc= 1.23 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot -25:sc= 0.736 USER MOD Single : A 69 HIS : no HD1:sc= -0.373 X(o=-0.37,f=0.014) USER MOD Single : A 85 SER OG : rot -143:sc= 0.189 USER MOD Single : A 90 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= 0 X(o=0,f=0.064) USER MOD Single : A 92 TYR OH : rot 180:sc=-0.00522 USER MOD Single : A 107 HIS :FLIP no HD1:sc= -0.106 F(o=-0.68,f=-0.11) USER MOD Single : A 110 SER OG : rot -67:sc= 0.0741! USER MOD Single : A 121 LYS NZ :NH3+ 153:sc= 0.437 (180deg=0.201) USER MOD Single : A 123 TYR OH : rot -158:sc= 0.0233 USER MOD Single : A 124 ASN : amide:sc=-0.00111 K(o=-0.0011,f=-0.69) USER MOD Single : A 134 LYS NZ :NH3+ 138:sc= -0.943 (180deg=-4.23!) USER MOD ----------------------------------------------------------------- ATOM 80 N SER A 6 -6.496 15.090 0.514 1.00 0.00 N ATOM 81 CA SER A 6 -5.659 14.337 1.495 1.00 0.00 C ATOM 82 C SER A 6 -6.458 14.137 2.786 1.00 0.00 C ATOM 83 O SER A 6 -7.323 14.924 3.117 1.00 0.00 O ATOM 84 CB SER A 6 -4.383 15.124 1.797 1.00 0.00 C ATOM 85 OG SER A 6 -3.870 15.658 0.585 1.00 0.00 O ATOM 0 HA SER A 6 -5.388 13.368 1.076 1.00 0.00 H new ATOM 0 HB2 SER A 6 -4.595 15.928 2.502 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.643 14.475 2.265 1.00 0.00 H new ATOM 0 HG SER A 6 -4.610 15.841 -0.031 1.00 0.00 H new ATOM 91 N LYS A 7 -6.178 13.089 3.521 1.00 0.00 N ATOM 92 CA LYS A 7 -6.928 12.844 4.790 1.00 0.00 C ATOM 93 C LYS A 7 -5.955 12.385 5.875 1.00 0.00 C ATOM 94 O LYS A 7 -5.038 11.632 5.622 1.00 0.00 O ATOM 95 CB LYS A 7 -7.998 11.770 4.556 1.00 0.00 C ATOM 96 CG LYS A 7 -7.350 10.482 4.019 1.00 0.00 C ATOM 97 CD LYS A 7 -7.190 9.460 5.150 1.00 0.00 C ATOM 98 CE LYS A 7 -6.739 8.119 4.568 1.00 0.00 C ATOM 99 NZ LYS A 7 -6.522 7.145 5.674 1.00 0.00 N ATOM 0 H LYS A 7 -5.465 12.395 3.297 1.00 0.00 H new ATOM 0 HA LYS A 7 -7.414 13.765 5.111 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -8.523 11.560 5.488 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -8.741 12.135 3.847 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -7.964 10.061 3.223 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -6.377 10.710 3.584 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -6.460 9.817 5.876 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -8.134 9.339 5.681 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -7.491 7.739 3.877 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -5.819 8.249 3.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -6.103 6.273 5.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -5.879 7.558 6.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -7.433 6.923 6.125 1.00 0.00 H new ATOM 113 N ALA A 8 -6.139 12.844 7.084 1.00 0.00 N ATOM 114 CA ALA A 8 -5.217 12.446 8.186 1.00 0.00 C ATOM 115 C ALA A 8 -5.689 11.139 8.822 1.00 0.00 C ATOM 116 O ALA A 8 -6.834 10.750 8.698 1.00 0.00 O ATOM 117 CB ALA A 8 -5.189 13.546 9.250 1.00 0.00 C ATOM 0 H ALA A 8 -6.890 13.479 7.356 1.00 0.00 H new ATOM 0 HA ALA A 8 -4.217 12.303 7.777 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -4.515 13.256 10.056 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -4.840 14.476 8.802 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -6.192 13.690 9.650 1.00 0.00 H new ATOM 123 N TYR A 9 -4.808 10.461 9.505 1.00 0.00 N ATOM 124 CA TYR A 9 -5.188 9.178 10.159 1.00 0.00 C ATOM 125 C TYR A 9 -4.038 8.717 11.059 1.00 0.00 C ATOM 126 O TYR A 9 -2.893 8.693 10.656 1.00 0.00 O ATOM 127 CB TYR A 9 -5.457 8.119 9.088 1.00 0.00 C ATOM 128 CG TYR A 9 -6.161 6.939 9.713 1.00 0.00 C ATOM 129 CD1 TYR A 9 -7.550 6.965 9.890 1.00 0.00 C ATOM 130 CD2 TYR A 9 -5.427 5.817 10.117 1.00 0.00 C ATOM 131 CE1 TYR A 9 -8.204 5.872 10.470 1.00 0.00 C ATOM 132 CE2 TYR A 9 -6.081 4.723 10.696 1.00 0.00 C ATOM 133 CZ TYR A 9 -7.470 4.751 10.872 1.00 0.00 C ATOM 134 OH TYR A 9 -8.114 3.673 11.444 1.00 0.00 O ATOM 0 H TYR A 9 -3.837 10.742 9.639 1.00 0.00 H new ATOM 0 HA TYR A 9 -6.088 9.321 10.757 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -6.069 8.540 8.290 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -4.519 7.798 8.635 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -8.117 7.830 9.579 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -4.356 5.796 9.982 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -9.275 5.894 10.607 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -5.514 3.858 11.007 1.00 0.00 H new ATOM 0 HH TYR A 9 -9.025 3.610 11.088 1.00 0.00 H new ATOM 144 N GLY A 10 -4.330 8.355 12.277 1.00 0.00 N ATOM 145 CA GLY A 10 -3.247 7.901 13.193 1.00 0.00 C ATOM 146 C GLY A 10 -2.360 9.092 13.565 1.00 0.00 C ATOM 147 O GLY A 10 -2.415 9.594 14.669 1.00 0.00 O ATOM 0 H GLY A 10 -5.268 8.354 12.677 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -3.678 7.460 14.092 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -2.650 7.126 12.712 1.00 0.00 H new ATOM 151 N SER A 11 -1.542 9.547 12.653 1.00 0.00 N ATOM 152 CA SER A 11 -0.657 10.704 12.964 1.00 0.00 C ATOM 153 C SER A 11 0.131 11.112 11.713 1.00 0.00 C ATOM 154 O SER A 11 1.275 11.511 11.795 1.00 0.00 O ATOM 155 CB SER A 11 0.321 10.313 14.074 1.00 0.00 C ATOM 156 OG SER A 11 1.364 11.277 14.143 1.00 0.00 O ATOM 0 H SER A 11 -1.450 9.168 11.710 1.00 0.00 H new ATOM 0 HA SER A 11 -1.269 11.544 13.292 1.00 0.00 H new ATOM 0 HB2 SER A 11 -0.200 10.255 15.030 1.00 0.00 H new ATOM 0 HB3 SER A 11 0.736 9.325 13.877 1.00 0.00 H new ATOM 0 HG SER A 11 1.873 11.268 13.306 1.00 0.00 H new ATOM 162 N HIS A 12 -0.469 11.015 10.556 1.00 0.00 N ATOM 163 CA HIS A 12 0.243 11.396 9.311 1.00 0.00 C ATOM 164 C HIS A 12 -0.785 11.861 8.279 1.00 0.00 C ATOM 165 O HIS A 12 -1.899 11.376 8.240 1.00 0.00 O ATOM 166 CB HIS A 12 0.995 10.180 8.769 1.00 0.00 C ATOM 167 CG HIS A 12 1.927 9.647 9.821 1.00 0.00 C ATOM 168 ND1 HIS A 12 1.754 8.712 10.811 1.00 0.00 N flip ATOM 169 CD2 HIS A 12 3.238 10.081 9.936 1.00 0.00 C flip ATOM 170 CE1 HIS A 12 2.937 8.566 11.530 1.00 0.00 C flip ATOM 171 NE2 HIS A 12 3.798 9.414 10.962 1.00 0.00 N flip ATOM 0 H HIS A 12 -1.426 10.686 10.424 1.00 0.00 H new ATOM 0 HA HIS A 12 0.952 12.199 9.515 1.00 0.00 H new ATOM 0 HB2 HIS A 12 0.287 9.406 8.471 1.00 0.00 H new ATOM 0 HB3 HIS A 12 1.558 10.457 7.878 1.00 0.00 H new ATOM 0 HD2 HIS A 12 3.722 10.820 9.315 1.00 0.00 H new ATOM 0 HE1 HIS A 12 3.119 7.908 12.367 1.00 0.00 H new ATOM 0 HE2 HIS A 12 4.763 9.541 11.268 1.00 0.00 H new ATOM 179 N CYS A 13 -0.425 12.786 7.434 1.00 0.00 N ATOM 180 CA CYS A 13 -1.390 13.258 6.403 1.00 0.00 C ATOM 181 C CYS A 13 -1.297 12.318 5.202 1.00 0.00 C ATOM 182 O CYS A 13 -0.229 12.078 4.678 1.00 0.00 O ATOM 183 CB CYS A 13 -1.031 14.689 5.980 1.00 0.00 C ATOM 184 SG CYS A 13 -2.224 15.851 6.694 1.00 0.00 S ATOM 0 H CYS A 13 0.491 13.234 7.412 1.00 0.00 H new ATOM 0 HA CYS A 13 -2.405 13.258 6.800 1.00 0.00 H new ATOM 0 HB2 CYS A 13 -0.023 14.936 6.314 1.00 0.00 H new ATOM 0 HB3 CYS A 13 -1.035 14.770 4.893 1.00 0.00 H new ATOM 0 HG CYS A 13 -1.917 17.063 6.337 1.00 0.00 H new ATOM 189 N TYR A 14 -2.403 11.770 4.774 1.00 0.00 N ATOM 190 CA TYR A 14 -2.365 10.827 3.623 1.00 0.00 C ATOM 191 C TYR A 14 -2.833 11.530 2.351 1.00 0.00 C ATOM 192 O TYR A 14 -3.856 12.181 2.334 1.00 0.00 O ATOM 193 CB TYR A 14 -3.278 9.634 3.910 1.00 0.00 C ATOM 194 CG TYR A 14 -2.749 8.868 5.099 1.00 0.00 C ATOM 195 CD1 TYR A 14 -2.848 9.415 6.382 1.00 0.00 C ATOM 196 CD2 TYR A 14 -2.162 7.609 4.920 1.00 0.00 C ATOM 197 CE1 TYR A 14 -2.361 8.705 7.487 1.00 0.00 C ATOM 198 CE2 TYR A 14 -1.674 6.900 6.024 1.00 0.00 C ATOM 199 CZ TYR A 14 -1.774 7.449 7.307 1.00 0.00 C ATOM 200 OH TYR A 14 -1.295 6.750 8.396 1.00 0.00 O ATOM 0 H TYR A 14 -3.328 11.935 5.171 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.341 10.481 3.482 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -4.293 9.979 4.109 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -3.328 8.983 3.037 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -3.300 10.386 6.521 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -2.086 7.185 3.930 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -2.439 9.128 8.478 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -1.221 5.930 5.885 1.00 0.00 H new ATOM 0 HH TYR A 14 -0.920 5.896 8.097 1.00 0.00 H new ATOM 210 N ALA A 15 -2.090 11.401 1.282 1.00 0.00 N ATOM 211 CA ALA A 15 -2.491 12.059 0.004 1.00 0.00 C ATOM 212 C ALA A 15 -2.464 11.031 -1.127 1.00 0.00 C ATOM 213 O ALA A 15 -1.574 10.208 -1.216 1.00 0.00 O ATOM 214 CB ALA A 15 -1.513 13.192 -0.314 1.00 0.00 C ATOM 0 H ALA A 15 -1.222 10.867 1.240 1.00 0.00 H new ATOM 0 HA ALA A 15 -3.498 12.465 0.103 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -1.805 13.673 -1.247 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -1.530 13.925 0.493 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -0.506 12.786 -0.414 1.00 0.00 H new ATOM 220 N LEU A 16 -3.439 11.073 -1.993 1.00 0.00 N ATOM 221 CA LEU A 16 -3.489 10.103 -3.123 1.00 0.00 C ATOM 222 C LEU A 16 -2.894 10.755 -4.376 1.00 0.00 C ATOM 223 O LEU A 16 -3.220 11.875 -4.717 1.00 0.00 O ATOM 224 CB LEU A 16 -4.952 9.715 -3.374 1.00 0.00 C ATOM 225 CG LEU A 16 -5.094 8.987 -4.715 1.00 0.00 C ATOM 226 CD1 LEU A 16 -4.213 7.735 -4.723 1.00 0.00 C ATOM 227 CD2 LEU A 16 -6.556 8.580 -4.916 1.00 0.00 C ATOM 0 H LEU A 16 -4.208 11.742 -1.966 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.912 9.210 -2.881 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.308 9.075 -2.567 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -5.577 10.608 -3.371 1.00 0.00 H new ATOM 0 HG LEU A 16 -4.781 9.651 -5.521 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -4.318 7.222 -5.679 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.171 8.022 -4.578 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -4.521 7.068 -3.918 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -6.662 8.062 -5.869 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.864 7.918 -4.107 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -7.185 9.470 -4.916 1.00 0.00 H new ATOM 239 N PHE A 17 -2.034 10.054 -5.072 1.00 0.00 N ATOM 240 CA PHE A 17 -1.425 10.610 -6.306 1.00 0.00 C ATOM 241 C PHE A 17 -1.754 9.666 -7.457 1.00 0.00 C ATOM 242 O PHE A 17 -1.360 8.514 -7.462 1.00 0.00 O ATOM 243 CB PHE A 17 0.094 10.703 -6.133 1.00 0.00 C ATOM 244 CG PHE A 17 0.435 11.919 -5.304 1.00 0.00 C ATOM 245 CD1 PHE A 17 0.558 13.172 -5.918 1.00 0.00 C ATOM 246 CD2 PHE A 17 0.629 11.794 -3.923 1.00 0.00 C ATOM 247 CE1 PHE A 17 0.874 14.300 -5.150 1.00 0.00 C ATOM 248 CE2 PHE A 17 0.944 12.923 -3.156 1.00 0.00 C ATOM 249 CZ PHE A 17 1.067 14.174 -3.769 1.00 0.00 C ATOM 0 H PHE A 17 -1.729 9.111 -4.830 1.00 0.00 H new ATOM 0 HA PHE A 17 -1.816 11.607 -6.508 1.00 0.00 H new ATOM 0 HB2 PHE A 17 0.471 9.802 -5.648 1.00 0.00 H new ATOM 0 HB3 PHE A 17 0.578 10.767 -7.107 1.00 0.00 H new ATOM 0 HD1 PHE A 17 0.409 13.268 -6.983 1.00 0.00 H new ATOM 0 HD2 PHE A 17 0.536 10.828 -3.449 1.00 0.00 H new ATOM 0 HE1 PHE A 17 0.969 15.266 -5.623 1.00 0.00 H new ATOM 0 HE2 PHE A 17 1.092 12.827 -2.090 1.00 0.00 H new ATOM 0 HZ PHE A 17 1.311 15.043 -3.177 1.00 0.00 H new ATOM 259 N LEU A 18 -2.471 10.142 -8.432 1.00 0.00 N ATOM 260 CA LEU A 18 -2.823 9.274 -9.581 1.00 0.00 C ATOM 261 C LEU A 18 -1.567 9.062 -10.404 1.00 0.00 C ATOM 262 O LEU A 18 -1.606 8.580 -11.519 1.00 0.00 O ATOM 263 CB LEU A 18 -3.897 9.950 -10.436 1.00 0.00 C ATOM 264 CG LEU A 18 -4.981 10.542 -9.530 1.00 0.00 C ATOM 265 CD1 LEU A 18 -6.210 10.896 -10.371 1.00 0.00 C ATOM 266 CD2 LEU A 18 -5.375 9.517 -8.462 1.00 0.00 C ATOM 0 H LEU A 18 -2.828 11.096 -8.482 1.00 0.00 H new ATOM 0 HA LEU A 18 -3.214 8.319 -9.230 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.450 10.735 -11.045 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.338 9.227 -11.122 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.597 11.440 -9.047 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -6.982 11.317 -9.727 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -5.933 11.626 -11.131 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -6.592 9.997 -10.854 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -6.146 9.940 -7.819 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.758 8.618 -8.944 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.501 9.263 -7.862 1.00 0.00 H new ATOM 278 N SER A 19 -0.444 9.428 -9.854 1.00 0.00 N ATOM 279 CA SER A 19 0.829 9.254 -10.609 1.00 0.00 C ATOM 280 C SER A 19 1.433 7.877 -10.291 1.00 0.00 C ATOM 281 O SER A 19 1.711 7.572 -9.149 1.00 0.00 O ATOM 282 CB SER A 19 1.828 10.343 -10.221 1.00 0.00 C ATOM 283 OG SER A 19 1.216 11.244 -9.307 1.00 0.00 O ATOM 0 H SER A 19 -0.351 9.836 -8.924 1.00 0.00 H new ATOM 0 HA SER A 19 0.617 9.327 -11.676 1.00 0.00 H new ATOM 0 HB2 SER A 19 2.713 9.895 -9.769 1.00 0.00 H new ATOM 0 HB3 SER A 19 2.161 10.880 -11.110 1.00 0.00 H new ATOM 0 HG SER A 19 1.860 11.493 -8.612 1.00 0.00 H new ATOM 289 N PRO A 20 1.643 7.054 -11.289 1.00 0.00 N ATOM 290 CA PRO A 20 2.234 5.705 -11.064 1.00 0.00 C ATOM 291 C PRO A 20 3.657 5.789 -10.493 1.00 0.00 C ATOM 292 O PRO A 20 4.393 6.711 -10.787 1.00 0.00 O ATOM 293 CB PRO A 20 2.253 5.110 -12.474 1.00 0.00 C ATOM 294 CG PRO A 20 1.695 6.145 -13.461 1.00 0.00 C ATOM 295 CD PRO A 20 1.306 7.403 -12.694 1.00 0.00 C ATOM 0 HA PRO A 20 1.673 5.114 -10.340 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.270 4.834 -12.753 1.00 0.00 H new ATOM 0 HB3 PRO A 20 1.656 4.199 -12.506 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.441 6.382 -14.220 1.00 0.00 H new ATOM 0 HG3 PRO A 20 0.828 5.739 -13.982 1.00 0.00 H new ATOM 0 HD2 PRO A 20 1.863 8.274 -13.038 1.00 0.00 H new ATOM 0 HD3 PRO A 20 0.247 7.635 -12.810 1.00 0.00 H new ATOM 303 N LYS A 21 4.058 4.835 -9.696 1.00 0.00 N ATOM 304 CA LYS A 21 5.440 4.877 -9.129 1.00 0.00 C ATOM 305 C LYS A 21 5.839 3.486 -8.628 1.00 0.00 C ATOM 306 O LYS A 21 5.139 2.878 -7.848 1.00 0.00 O ATOM 307 CB LYS A 21 5.484 5.868 -7.959 1.00 0.00 C ATOM 308 CG LYS A 21 5.550 7.308 -8.484 1.00 0.00 C ATOM 309 CD LYS A 21 6.145 8.219 -7.407 1.00 0.00 C ATOM 310 CE LYS A 21 6.209 9.655 -7.930 1.00 0.00 C ATOM 311 NZ LYS A 21 6.746 10.548 -6.865 1.00 0.00 N ATOM 0 H LYS A 21 3.494 4.033 -9.414 1.00 0.00 H new ATOM 0 HA LYS A 21 6.135 5.195 -9.906 1.00 0.00 H new ATOM 0 HB2 LYS A 21 4.601 5.742 -7.333 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.351 5.662 -7.331 1.00 0.00 H new ATOM 0 HG2 LYS A 21 6.159 7.349 -9.387 1.00 0.00 H new ATOM 0 HG3 LYS A 21 4.552 7.653 -8.756 1.00 0.00 H new ATOM 0 HD2 LYS A 21 5.537 8.177 -6.504 1.00 0.00 H new ATOM 0 HD3 LYS A 21 7.143 7.875 -7.136 1.00 0.00 H new ATOM 0 HE2 LYS A 21 6.844 9.703 -8.814 1.00 0.00 H new ATOM 0 HE3 LYS A 21 5.216 9.988 -8.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 6.853 11.512 -7.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 6.088 10.562 -6.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 7.672 10.194 -6.550 1.00 0.00 H new ATOM 325 N SER A 22 6.968 2.982 -9.054 1.00 0.00 N ATOM 326 CA SER A 22 7.407 1.636 -8.580 1.00 0.00 C ATOM 327 C SER A 22 7.261 1.572 -7.060 1.00 0.00 C ATOM 328 O SER A 22 7.409 2.565 -6.378 1.00 0.00 O ATOM 329 CB SER A 22 8.868 1.415 -8.965 1.00 0.00 C ATOM 330 OG SER A 22 8.966 1.272 -10.376 1.00 0.00 O ATOM 0 H SER A 22 7.603 3.442 -9.707 1.00 0.00 H new ATOM 0 HA SER A 22 6.793 0.862 -9.040 1.00 0.00 H new ATOM 0 HB2 SER A 22 9.475 2.256 -8.630 1.00 0.00 H new ATOM 0 HB3 SER A 22 9.256 0.525 -8.470 1.00 0.00 H new ATOM 0 HG SER A 22 9.091 0.326 -10.601 1.00 0.00 H new ATOM 336 N TRP A 23 6.978 0.420 -6.517 1.00 0.00 N ATOM 337 CA TRP A 23 6.836 0.333 -5.037 1.00 0.00 C ATOM 338 C TRP A 23 8.126 0.830 -4.403 1.00 0.00 C ATOM 339 O TRP A 23 8.162 1.238 -3.261 1.00 0.00 O ATOM 340 CB TRP A 23 6.595 -1.117 -4.611 1.00 0.00 C ATOM 341 CG TRP A 23 6.494 -1.174 -3.121 1.00 0.00 C ATOM 342 CD1 TRP A 23 5.336 -1.241 -2.424 1.00 0.00 C ATOM 343 CD2 TRP A 23 7.566 -1.163 -2.134 1.00 0.00 C ATOM 344 NE1 TRP A 23 5.629 -1.272 -1.073 1.00 0.00 N ATOM 345 CE2 TRP A 23 6.989 -1.226 -0.842 1.00 0.00 C ATOM 346 CE3 TRP A 23 8.968 -1.106 -2.231 1.00 0.00 C ATOM 347 CZ2 TRP A 23 7.777 -1.231 0.310 1.00 0.00 C ATOM 348 CZ3 TRP A 23 9.763 -1.112 -1.073 1.00 0.00 C ATOM 349 CH2 TRP A 23 9.168 -1.175 0.195 1.00 0.00 C ATOM 0 H TRP A 23 6.841 -0.453 -7.026 1.00 0.00 H new ATOM 0 HA TRP A 23 5.989 0.939 -4.715 1.00 0.00 H new ATOM 0 HB2 TRP A 23 5.680 -1.496 -5.066 1.00 0.00 H new ATOM 0 HB3 TRP A 23 7.410 -1.752 -4.958 1.00 0.00 H new ATOM 0 HD1 TRP A 23 4.345 -1.266 -2.853 1.00 0.00 H new ATOM 0 HE1 TRP A 23 4.925 -1.323 -0.336 1.00 0.00 H new ATOM 0 HE3 TRP A 23 9.437 -1.057 -3.203 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 7.314 -1.278 1.285 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 10.839 -1.068 -1.160 1.00 0.00 H new ATOM 0 HH2 TRP A 23 9.784 -1.180 1.082 1.00 0.00 H new ATOM 360 N THR A 24 9.191 0.797 -5.150 1.00 0.00 N ATOM 361 CA THR A 24 10.501 1.262 -4.620 1.00 0.00 C ATOM 362 C THR A 24 10.660 2.749 -4.931 1.00 0.00 C ATOM 363 O THR A 24 11.458 3.445 -4.336 1.00 0.00 O ATOM 364 CB THR A 24 11.623 0.463 -5.291 1.00 0.00 C ATOM 365 OG1 THR A 24 12.832 0.651 -4.570 1.00 0.00 O ATOM 366 CG2 THR A 24 11.808 0.933 -6.737 1.00 0.00 C ATOM 0 H THR A 24 9.211 0.465 -6.114 1.00 0.00 H new ATOM 0 HA THR A 24 10.549 1.111 -3.542 1.00 0.00 H new ATOM 0 HB THR A 24 11.359 -0.595 -5.293 1.00 0.00 H new ATOM 0 HG1 THR A 24 13.550 0.139 -4.997 1.00 0.00 H new ATOM 0 HG21 THR A 24 12.607 0.360 -7.206 1.00 0.00 H new ATOM 0 HG22 THR A 24 10.881 0.783 -7.290 1.00 0.00 H new ATOM 0 HG23 THR A 24 12.068 1.992 -6.745 1.00 0.00 H new ATOM 374 N ASP A 25 9.899 3.230 -5.870 1.00 0.00 N ATOM 375 CA ASP A 25 9.978 4.666 -6.254 1.00 0.00 C ATOM 376 C ASP A 25 9.047 5.476 -5.360 1.00 0.00 C ATOM 377 O ASP A 25 9.389 6.545 -4.897 1.00 0.00 O ATOM 378 CB ASP A 25 9.551 4.828 -7.713 1.00 0.00 C ATOM 379 CG ASP A 25 9.434 6.316 -8.052 1.00 0.00 C ATOM 380 OD1 ASP A 25 10.059 7.110 -7.370 1.00 0.00 O ATOM 381 OD2 ASP A 25 8.723 6.635 -8.991 1.00 0.00 O ATOM 0 H ASP A 25 9.217 2.683 -6.395 1.00 0.00 H new ATOM 0 HA ASP A 25 11.002 5.021 -6.135 1.00 0.00 H new ATOM 0 HB2 ASP A 25 10.278 4.351 -8.370 1.00 0.00 H new ATOM 0 HB3 ASP A 25 8.596 4.330 -7.880 1.00 0.00 H new ATOM 386 N ALA A 26 7.877 4.966 -5.090 1.00 0.00 N ATOM 387 CA ALA A 26 6.950 5.697 -4.209 1.00 0.00 C ATOM 388 C ALA A 26 7.482 5.551 -2.795 1.00 0.00 C ATOM 389 O ALA A 26 7.330 6.415 -1.959 1.00 0.00 O ATOM 390 CB ALA A 26 5.560 5.084 -4.323 1.00 0.00 C ATOM 0 H ALA A 26 7.531 4.075 -5.445 1.00 0.00 H new ATOM 0 HA ALA A 26 6.879 6.750 -4.483 1.00 0.00 H new ATOM 0 HB1 ALA A 26 4.871 5.622 -3.672 1.00 0.00 H new ATOM 0 HB2 ALA A 26 5.215 5.154 -5.355 1.00 0.00 H new ATOM 0 HB3 ALA A 26 5.599 4.037 -4.024 1.00 0.00 H new ATOM 396 N ASP A 27 8.124 4.448 -2.533 1.00 0.00 N ATOM 397 CA ASP A 27 8.698 4.221 -1.187 1.00 0.00 C ATOM 398 C ASP A 27 9.760 5.287 -0.905 1.00 0.00 C ATOM 399 O ASP A 27 9.826 5.841 0.174 1.00 0.00 O ATOM 400 CB ASP A 27 9.342 2.836 -1.166 1.00 0.00 C ATOM 401 CG ASP A 27 10.138 2.653 0.127 1.00 0.00 C ATOM 402 OD1 ASP A 27 9.559 2.190 1.096 1.00 0.00 O ATOM 403 OD2 ASP A 27 11.313 2.982 0.129 1.00 0.00 O ATOM 0 H ASP A 27 8.275 3.692 -3.200 1.00 0.00 H new ATOM 0 HA ASP A 27 7.920 4.282 -0.426 1.00 0.00 H new ATOM 0 HB2 ASP A 27 8.574 2.067 -1.243 1.00 0.00 H new ATOM 0 HB3 ASP A 27 9.999 2.717 -2.028 1.00 0.00 H new ATOM 408 N LEU A 28 10.590 5.578 -1.870 1.00 0.00 N ATOM 409 CA LEU A 28 11.650 6.606 -1.662 1.00 0.00 C ATOM 410 C LEU A 28 11.023 8.006 -1.655 1.00 0.00 C ATOM 411 O LEU A 28 11.335 8.831 -0.821 1.00 0.00 O ATOM 412 CB LEU A 28 12.683 6.507 -2.796 1.00 0.00 C ATOM 413 CG LEU A 28 13.903 5.704 -2.331 1.00 0.00 C ATOM 414 CD1 LEU A 28 13.506 4.244 -2.101 1.00 0.00 C ATOM 415 CD2 LEU A 28 14.992 5.770 -3.404 1.00 0.00 C ATOM 0 H LEU A 28 10.580 5.148 -2.795 1.00 0.00 H new ATOM 0 HA LEU A 28 12.141 6.432 -0.705 1.00 0.00 H new ATOM 0 HB2 LEU A 28 12.234 6.029 -3.666 1.00 0.00 H new ATOM 0 HB3 LEU A 28 12.992 7.506 -3.105 1.00 0.00 H new ATOM 0 HG LEU A 28 14.278 6.126 -1.399 1.00 0.00 H new ATOM 0 HD11 LEU A 28 14.377 3.678 -1.771 1.00 0.00 H new ATOM 0 HD12 LEU A 28 12.730 4.194 -1.337 1.00 0.00 H new ATOM 0 HD13 LEU A 28 13.128 3.819 -3.031 1.00 0.00 H new ATOM 0 HD21 LEU A 28 15.861 5.200 -3.076 1.00 0.00 H new ATOM 0 HD22 LEU A 28 14.612 5.349 -4.335 1.00 0.00 H new ATOM 0 HD23 LEU A 28 15.280 6.809 -3.567 1.00 0.00 H new ATOM 427 N ALA A 29 10.150 8.283 -2.585 1.00 0.00 N ATOM 428 CA ALA A 29 9.519 9.634 -2.632 1.00 0.00 C ATOM 429 C ALA A 29 8.661 9.854 -1.386 1.00 0.00 C ATOM 430 O ALA A 29 8.819 10.830 -0.683 1.00 0.00 O ATOM 431 CB ALA A 29 8.639 9.741 -3.876 1.00 0.00 C ATOM 0 H ALA A 29 9.847 7.635 -3.312 1.00 0.00 H new ATOM 0 HA ALA A 29 10.302 10.392 -2.667 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.177 10.728 -3.911 1.00 0.00 H new ATOM 0 HB2 ALA A 29 9.249 9.594 -4.767 1.00 0.00 H new ATOM 0 HB3 ALA A 29 7.862 8.978 -3.838 1.00 0.00 H new ATOM 437 N CYS A 30 7.755 8.960 -1.097 1.00 0.00 N ATOM 438 CA CYS A 30 6.911 9.145 0.109 1.00 0.00 C ATOM 439 C CYS A 30 7.822 9.149 1.335 1.00 0.00 C ATOM 440 O CYS A 30 7.469 9.645 2.383 1.00 0.00 O ATOM 441 CB CYS A 30 5.892 8.011 0.207 1.00 0.00 C ATOM 442 SG CYS A 30 4.739 8.356 1.558 1.00 0.00 S ATOM 0 H CYS A 30 7.566 8.118 -1.641 1.00 0.00 H new ATOM 0 HA CYS A 30 6.367 10.088 0.050 1.00 0.00 H new ATOM 0 HB2 CYS A 30 5.349 7.913 -0.733 1.00 0.00 H new ATOM 0 HB3 CYS A 30 6.401 7.063 0.382 1.00 0.00 H new ATOM 447 N GLN A 31 9.009 8.620 1.197 1.00 0.00 N ATOM 448 CA GLN A 31 9.956 8.620 2.343 1.00 0.00 C ATOM 449 C GLN A 31 10.620 9.992 2.405 1.00 0.00 C ATOM 450 O GLN A 31 10.958 10.489 3.462 1.00 0.00 O ATOM 451 CB GLN A 31 11.023 7.540 2.144 1.00 0.00 C ATOM 452 CG GLN A 31 12.117 7.698 3.202 1.00 0.00 C ATOM 453 CD GLN A 31 12.969 6.429 3.251 1.00 0.00 C ATOM 454 OE1 GLN A 31 12.668 5.488 4.104 1.00 0.00 O flip ATOM 455 NE2 GLN A 31 13.918 6.292 2.506 1.00 0.00 N flip ATOM 0 H GLN A 31 9.360 8.190 0.342 1.00 0.00 H new ATOM 0 HA GLN A 31 9.422 8.411 3.270 1.00 0.00 H new ATOM 0 HB2 GLN A 31 10.572 6.551 2.218 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.454 7.620 1.146 1.00 0.00 H new ATOM 0 HG2 GLN A 31 12.742 8.559 2.967 1.00 0.00 H new ATOM 0 HG3 GLN A 31 11.669 7.886 4.178 1.00 0.00 H new ATOM 0 HE21 GLN A 31 14.153 7.027 1.839 1.00 0.00 H new ATOM 0 HE22 GLN A 31 14.480 5.442 2.547 1.00 0.00 H new ATOM 464 N LYS A 32 10.798 10.611 1.271 1.00 0.00 N ATOM 465 CA LYS A 32 11.423 11.953 1.243 1.00 0.00 C ATOM 466 C LYS A 32 10.512 12.937 1.980 1.00 0.00 C ATOM 467 O LYS A 32 10.832 14.097 2.144 1.00 0.00 O ATOM 468 CB LYS A 32 11.607 12.392 -0.216 1.00 0.00 C ATOM 469 CG LYS A 32 11.875 13.898 -0.279 1.00 0.00 C ATOM 470 CD LYS A 32 12.518 14.254 -1.626 1.00 0.00 C ATOM 471 CE LYS A 32 13.949 13.701 -1.694 1.00 0.00 C ATOM 472 NZ LYS A 32 14.798 14.625 -2.496 1.00 0.00 N ATOM 0 H LYS A 32 10.534 10.238 0.359 1.00 0.00 H new ATOM 0 HA LYS A 32 12.397 11.928 1.731 1.00 0.00 H new ATOM 0 HB2 LYS A 32 12.437 11.847 -0.667 1.00 0.00 H new ATOM 0 HB3 LYS A 32 10.715 12.148 -0.793 1.00 0.00 H new ATOM 0 HG2 LYS A 32 10.943 14.448 -0.154 1.00 0.00 H new ATOM 0 HG3 LYS A 32 12.533 14.194 0.538 1.00 0.00 H new ATOM 0 HD2 LYS A 32 11.923 13.843 -2.441 1.00 0.00 H new ATOM 0 HD3 LYS A 32 12.532 15.336 -1.756 1.00 0.00 H new ATOM 0 HE2 LYS A 32 14.358 13.594 -0.689 1.00 0.00 H new ATOM 0 HE3 LYS A 32 13.946 12.708 -2.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 15.768 14.252 -2.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 14.411 14.706 -3.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 14.809 15.563 -2.048 1.00 0.00 H new ATOM 486 N ARG A 33 9.374 12.473 2.426 1.00 0.00 N ATOM 487 CA ARG A 33 8.427 13.363 3.155 1.00 0.00 C ATOM 488 C ARG A 33 8.723 13.293 4.655 1.00 0.00 C ATOM 489 O ARG A 33 9.343 12.360 5.119 1.00 0.00 O ATOM 490 CB ARG A 33 6.991 12.892 2.879 1.00 0.00 C ATOM 491 CG ARG A 33 6.393 13.689 1.713 1.00 0.00 C ATOM 492 CD ARG A 33 7.161 13.372 0.428 1.00 0.00 C ATOM 493 NE ARG A 33 6.672 14.253 -0.672 1.00 0.00 N ATOM 494 CZ ARG A 33 7.154 15.458 -0.807 1.00 0.00 C ATOM 495 NH1 ARG A 33 8.347 15.631 -1.308 1.00 0.00 N ATOM 496 NH2 ARG A 33 6.443 16.489 -0.439 1.00 0.00 N ATOM 0 H ARG A 33 9.059 11.509 2.315 1.00 0.00 H new ATOM 0 HA ARG A 33 8.542 14.393 2.817 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.988 11.828 2.643 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.379 13.022 3.771 1.00 0.00 H new ATOM 0 HG2 ARG A 33 5.339 13.438 1.590 1.00 0.00 H new ATOM 0 HG3 ARG A 33 6.444 14.757 1.925 1.00 0.00 H new ATOM 0 HD2 ARG A 33 8.229 13.524 0.583 1.00 0.00 H new ATOM 0 HD3 ARG A 33 7.024 12.325 0.158 1.00 0.00 H new ATOM 0 HE ARG A 33 5.960 13.913 -1.319 1.00 0.00 H new ATOM 0 HH11 ARG A 33 8.902 14.824 -1.594 1.00 0.00 H new ATOM 0 HH12 ARG A 33 8.724 16.573 -1.414 1.00 0.00 H new ATOM 0 HH21 ARG A 33 5.512 16.352 -0.046 1.00 0.00 H new ATOM 0 HH22 ARG A 33 6.819 17.431 -0.544 1.00 0.00 H new ATOM 510 N PRO A 34 8.277 14.268 5.414 1.00 0.00 N ATOM 511 CA PRO A 34 8.515 14.269 6.880 1.00 0.00 C ATOM 512 C PRO A 34 8.191 12.908 7.497 1.00 0.00 C ATOM 513 O PRO A 34 7.114 12.680 8.012 1.00 0.00 O ATOM 514 CB PRO A 34 7.563 15.372 7.369 1.00 0.00 C ATOM 515 CG PRO A 34 6.839 15.967 6.149 1.00 0.00 C ATOM 516 CD PRO A 34 7.505 15.422 4.882 1.00 0.00 C ATOM 0 HA PRO A 34 9.553 14.450 7.158 1.00 0.00 H new ATOM 0 HB2 PRO A 34 6.841 14.963 8.076 1.00 0.00 H new ATOM 0 HB3 PRO A 34 8.120 16.148 7.895 1.00 0.00 H new ATOM 0 HG2 PRO A 34 5.782 15.700 6.167 1.00 0.00 H new ATOM 0 HG3 PRO A 34 6.894 17.055 6.169 1.00 0.00 H new ATOM 0 HD2 PRO A 34 6.773 15.114 4.136 1.00 0.00 H new ATOM 0 HD3 PRO A 34 8.150 16.162 4.409 1.00 0.00 H new ATOM 524 N SER A 35 9.119 11.997 7.425 1.00 0.00 N ATOM 525 CA SER A 35 8.884 10.640 7.980 1.00 0.00 C ATOM 526 C SER A 35 7.779 9.962 7.176 1.00 0.00 C ATOM 527 O SER A 35 7.205 8.978 7.597 1.00 0.00 O ATOM 528 CB SER A 35 8.472 10.745 9.450 1.00 0.00 C ATOM 529 OG SER A 35 9.177 11.819 10.059 1.00 0.00 O ATOM 0 H SER A 35 10.037 12.137 7.002 1.00 0.00 H new ATOM 0 HA SER A 35 9.799 10.051 7.915 1.00 0.00 H new ATOM 0 HB2 SER A 35 7.397 10.910 9.528 1.00 0.00 H new ATOM 0 HB3 SER A 35 8.690 9.811 9.968 1.00 0.00 H new ATOM 0 HG SER A 35 8.914 11.891 11.000 1.00 0.00 H new ATOM 535 N GLY A 36 7.474 10.483 6.018 1.00 0.00 N ATOM 536 CA GLY A 36 6.402 9.863 5.192 1.00 0.00 C ATOM 537 C GLY A 36 6.867 8.504 4.663 1.00 0.00 C ATOM 538 O GLY A 36 7.944 8.039 4.971 1.00 0.00 O ATOM 0 H GLY A 36 7.918 11.306 5.611 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.498 9.740 5.788 1.00 0.00 H new ATOM 0 HA3 GLY A 36 6.148 10.519 4.359 1.00 0.00 H new ATOM 542 N ASN A 37 6.048 7.867 3.868 1.00 0.00 N ATOM 543 CA ASN A 37 6.401 6.530 3.298 1.00 0.00 C ATOM 544 C ASN A 37 5.108 5.871 2.804 1.00 0.00 C ATOM 545 O ASN A 37 4.063 6.042 3.401 1.00 0.00 O ATOM 546 CB ASN A 37 7.045 5.648 4.383 1.00 0.00 C ATOM 547 CG ASN A 37 8.566 5.625 4.203 1.00 0.00 C ATOM 548 OD1 ASN A 37 9.061 5.138 3.208 1.00 0.00 O ATOM 549 ND2 ASN A 37 9.331 6.126 5.134 1.00 0.00 N ATOM 0 H ASN A 37 5.135 8.221 3.584 1.00 0.00 H new ATOM 0 HA ASN A 37 7.110 6.647 2.479 1.00 0.00 H new ATOM 0 HB2 ASN A 37 6.793 6.031 5.372 1.00 0.00 H new ATOM 0 HB3 ASN A 37 6.648 4.635 4.323 1.00 0.00 H new ATOM 0 HD21 ASN A 37 10.345 6.108 5.025 1.00 0.00 H new ATOM 0 HD22 ASN A 37 8.915 6.535 5.970 1.00 0.00 H new ATOM 556 N LEU A 38 5.159 5.141 1.709 1.00 0.00 N ATOM 557 CA LEU A 38 3.921 4.487 1.178 1.00 0.00 C ATOM 558 C LEU A 38 2.885 4.311 2.300 1.00 0.00 C ATOM 559 O LEU A 38 3.204 3.924 3.406 1.00 0.00 O ATOM 560 CB LEU A 38 4.287 3.127 0.585 1.00 0.00 C ATOM 561 CG LEU A 38 4.979 3.339 -0.762 1.00 0.00 C ATOM 562 CD1 LEU A 38 5.666 2.046 -1.210 1.00 0.00 C ATOM 563 CD2 LEU A 38 3.942 3.762 -1.807 1.00 0.00 C ATOM 0 H LEU A 38 6.004 4.972 1.164 1.00 0.00 H new ATOM 0 HA LEU A 38 3.485 5.118 0.404 1.00 0.00 H new ATOM 0 HB2 LEU A 38 4.945 2.585 1.265 1.00 0.00 H new ATOM 0 HB3 LEU A 38 3.391 2.519 0.456 1.00 0.00 H new ATOM 0 HG LEU A 38 5.732 4.121 -0.658 1.00 0.00 H new ATOM 0 HD11 LEU A 38 6.156 2.208 -2.170 1.00 0.00 H new ATOM 0 HD12 LEU A 38 6.409 1.753 -0.468 1.00 0.00 H new ATOM 0 HD13 LEU A 38 4.923 1.255 -1.311 1.00 0.00 H new ATOM 0 HD21 LEU A 38 4.434 3.913 -2.768 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.186 2.983 -1.905 1.00 0.00 H new ATOM 0 HD23 LEU A 38 3.467 4.691 -1.493 1.00 0.00 H new ATOM 575 N VAL A 39 1.649 4.624 2.015 1.00 0.00 N ATOM 576 CA VAL A 39 0.569 4.523 3.042 1.00 0.00 C ATOM 577 C VAL A 39 0.770 3.310 3.956 1.00 0.00 C ATOM 578 O VAL A 39 1.351 2.312 3.578 1.00 0.00 O ATOM 579 CB VAL A 39 -0.781 4.413 2.331 1.00 0.00 C ATOM 580 CG1 VAL A 39 -0.664 3.439 1.159 1.00 0.00 C ATOM 581 CG2 VAL A 39 -1.849 3.908 3.308 1.00 0.00 C ATOM 0 H VAL A 39 1.337 4.950 1.100 1.00 0.00 H new ATOM 0 HA VAL A 39 0.601 5.416 3.666 1.00 0.00 H new ATOM 0 HB VAL A 39 -1.070 5.397 1.962 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -1.626 3.361 0.653 1.00 0.00 H new ATOM 0 HG12 VAL A 39 0.087 3.803 0.457 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.369 2.457 1.530 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -2.807 3.833 2.793 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -1.562 2.927 3.685 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -1.939 4.605 4.141 1.00 0.00 H new ATOM 591 N SER A 40 0.271 3.407 5.162 1.00 0.00 N ATOM 592 CA SER A 40 0.396 2.286 6.143 1.00 0.00 C ATOM 593 C SER A 40 -0.988 1.652 6.359 1.00 0.00 C ATOM 594 O SER A 40 -2.004 2.263 6.093 1.00 0.00 O ATOM 595 CB SER A 40 0.913 2.842 7.471 1.00 0.00 C ATOM 596 OG SER A 40 0.249 2.193 8.547 1.00 0.00 O ATOM 0 H SER A 40 -0.224 4.226 5.513 1.00 0.00 H new ATOM 0 HA SER A 40 1.089 1.534 5.765 1.00 0.00 H new ATOM 0 HB2 SER A 40 1.989 2.688 7.548 1.00 0.00 H new ATOM 0 HB3 SER A 40 0.741 3.917 7.519 1.00 0.00 H new ATOM 0 HG SER A 40 0.581 2.548 9.398 1.00 0.00 H new ATOM 602 N VAL A 41 -1.037 0.435 6.839 1.00 0.00 N ATOM 603 CA VAL A 41 -2.360 -0.229 7.066 1.00 0.00 C ATOM 604 C VAL A 41 -2.223 -1.261 8.202 1.00 0.00 C ATOM 605 O VAL A 41 -1.951 -2.420 7.965 1.00 0.00 O ATOM 606 CB VAL A 41 -2.813 -0.940 5.774 1.00 0.00 C ATOM 607 CG1 VAL A 41 -4.333 -0.854 5.630 1.00 0.00 C ATOM 608 CG2 VAL A 41 -2.160 -0.286 4.549 1.00 0.00 C ATOM 0 H VAL A 41 -0.222 -0.127 7.083 1.00 0.00 H new ATOM 0 HA VAL A 41 -3.101 0.521 7.341 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.509 -1.985 5.835 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.641 -1.359 4.715 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.807 -1.334 6.486 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -4.636 0.192 5.586 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -2.489 -0.798 3.645 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -2.451 0.763 4.498 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -1.076 -0.358 4.633 1.00 0.00 H new ATOM 618 N LEU A 42 -2.397 -0.842 9.433 1.00 0.00 N ATOM 619 CA LEU A 42 -2.264 -1.796 10.582 1.00 0.00 C ATOM 620 C LEU A 42 -3.608 -1.981 11.294 1.00 0.00 C ATOM 621 O LEU A 42 -3.661 -2.509 12.386 1.00 0.00 O ATOM 622 CB LEU A 42 -1.252 -1.245 11.589 1.00 0.00 C ATOM 623 CG LEU A 42 0.164 -1.400 11.035 1.00 0.00 C ATOM 624 CD1 LEU A 42 1.152 -0.721 11.989 1.00 0.00 C ATOM 625 CD2 LEU A 42 0.520 -2.888 10.902 1.00 0.00 C ATOM 0 H LEU A 42 -2.625 0.118 9.692 1.00 0.00 H new ATOM 0 HA LEU A 42 -1.930 -2.757 10.191 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.461 -0.194 11.791 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.342 -1.776 12.537 1.00 0.00 H new ATOM 0 HG LEU A 42 0.219 -0.935 10.051 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.165 -0.827 11.600 1.00 0.00 H new ATOM 0 HD12 LEU A 42 0.906 0.337 12.075 1.00 0.00 H new ATOM 0 HD13 LEU A 42 1.089 -1.189 12.971 1.00 0.00 H new ATOM 0 HD21 LEU A 42 1.531 -2.986 10.506 1.00 0.00 H new ATOM 0 HD22 LEU A 42 0.466 -3.364 11.881 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -0.183 -3.371 10.224 1.00 0.00 H new ATOM 637 N SER A 43 -4.691 -1.551 10.706 1.00 0.00 N ATOM 638 CA SER A 43 -6.010 -1.713 11.390 1.00 0.00 C ATOM 639 C SER A 43 -7.094 -2.071 10.373 1.00 0.00 C ATOM 640 O SER A 43 -7.055 -1.652 9.234 1.00 0.00 O ATOM 641 CB SER A 43 -6.382 -0.403 12.085 1.00 0.00 C ATOM 642 OG SER A 43 -6.937 0.493 11.133 1.00 0.00 O ATOM 0 H SER A 43 -4.723 -1.099 9.792 1.00 0.00 H new ATOM 0 HA SER A 43 -5.933 -2.516 12.124 1.00 0.00 H new ATOM 0 HB2 SER A 43 -7.099 -0.593 12.884 1.00 0.00 H new ATOM 0 HB3 SER A 43 -5.500 0.040 12.547 1.00 0.00 H new ATOM 0 HG SER A 43 -7.178 1.333 11.576 1.00 0.00 H new ATOM 648 N GLY A 44 -8.067 -2.838 10.786 1.00 0.00 N ATOM 649 CA GLY A 44 -9.165 -3.219 9.855 1.00 0.00 C ATOM 650 C GLY A 44 -9.933 -1.964 9.446 1.00 0.00 C ATOM 651 O GLY A 44 -10.611 -1.936 8.439 1.00 0.00 O ATOM 0 H GLY A 44 -8.148 -3.217 11.729 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -8.756 -3.713 8.974 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -9.836 -3.930 10.337 1.00 0.00 H new ATOM 655 N ALA A 45 -9.824 -0.917 10.219 1.00 0.00 N ATOM 656 CA ALA A 45 -10.537 0.344 9.872 1.00 0.00 C ATOM 657 C ALA A 45 -9.696 1.121 8.861 1.00 0.00 C ATOM 658 O ALA A 45 -10.214 1.767 7.972 1.00 0.00 O ATOM 659 CB ALA A 45 -10.731 1.187 11.135 1.00 0.00 C ATOM 0 H ALA A 45 -9.272 -0.881 11.076 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.513 0.114 9.444 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -11.253 2.109 10.880 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -11.320 0.626 11.860 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -9.759 1.427 11.565 1.00 0.00 H new ATOM 665 N GLU A 46 -8.399 1.055 8.986 1.00 0.00 N ATOM 666 CA GLU A 46 -7.519 1.779 8.029 1.00 0.00 C ATOM 667 C GLU A 46 -7.585 1.084 6.669 1.00 0.00 C ATOM 668 O GLU A 46 -7.600 1.720 5.637 1.00 0.00 O ATOM 669 CB GLU A 46 -6.078 1.763 8.544 1.00 0.00 C ATOM 670 CG GLU A 46 -5.232 2.739 7.727 1.00 0.00 C ATOM 671 CD GLU A 46 -3.834 2.842 8.339 1.00 0.00 C ATOM 672 OE1 GLU A 46 -3.588 2.162 9.323 1.00 0.00 O ATOM 673 OE2 GLU A 46 -3.031 3.597 7.815 1.00 0.00 O ATOM 0 H GLU A 46 -7.911 0.530 9.711 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.852 2.812 7.931 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -6.055 2.039 9.598 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -5.665 0.757 8.469 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.164 2.400 6.693 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.706 3.721 7.710 1.00 0.00 H new ATOM 680 N GLY A 47 -7.631 -0.221 6.661 1.00 0.00 N ATOM 681 CA GLY A 47 -7.705 -0.952 5.367 1.00 0.00 C ATOM 682 C GLY A 47 -8.961 -0.514 4.615 1.00 0.00 C ATOM 683 O GLY A 47 -8.978 -0.440 3.402 1.00 0.00 O ATOM 0 H GLY A 47 -7.620 -0.810 7.494 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.818 -0.747 4.768 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.729 -2.027 5.544 1.00 0.00 H new ATOM 687 N SER A 48 -10.012 -0.214 5.328 1.00 0.00 N ATOM 688 CA SER A 48 -11.268 0.228 4.662 1.00 0.00 C ATOM 689 C SER A 48 -11.190 1.732 4.403 1.00 0.00 C ATOM 690 O SER A 48 -11.731 2.236 3.439 1.00 0.00 O ATOM 691 CB SER A 48 -12.461 -0.074 5.569 1.00 0.00 C ATOM 692 OG SER A 48 -12.732 -1.470 5.538 1.00 0.00 O ATOM 0 H SER A 48 -10.054 -0.256 6.346 1.00 0.00 H new ATOM 0 HA SER A 48 -11.392 -0.303 3.718 1.00 0.00 H new ATOM 0 HB2 SER A 48 -12.247 0.244 6.589 1.00 0.00 H new ATOM 0 HB3 SER A 48 -13.336 0.486 5.238 1.00 0.00 H new ATOM 0 HG SER A 48 -13.495 -1.668 6.120 1.00 0.00 H new ATOM 698 N PHE A 49 -10.514 2.454 5.256 1.00 0.00 N ATOM 699 CA PHE A 49 -10.397 3.924 5.056 1.00 0.00 C ATOM 700 C PHE A 49 -9.543 4.192 3.815 1.00 0.00 C ATOM 701 O PHE A 49 -9.920 4.948 2.942 1.00 0.00 O ATOM 702 CB PHE A 49 -9.738 4.556 6.289 1.00 0.00 C ATOM 703 CG PHE A 49 -10.254 5.966 6.478 1.00 0.00 C ATOM 704 CD1 PHE A 49 -10.023 6.932 5.490 1.00 0.00 C ATOM 705 CD2 PHE A 49 -10.963 6.306 7.636 1.00 0.00 C ATOM 706 CE1 PHE A 49 -10.500 8.236 5.661 1.00 0.00 C ATOM 707 CE2 PHE A 49 -11.441 7.611 7.807 1.00 0.00 C ATOM 708 CZ PHE A 49 -11.209 8.576 6.820 1.00 0.00 C ATOM 0 H PHE A 49 -10.039 2.088 6.081 1.00 0.00 H new ATOM 0 HA PHE A 49 -11.386 4.360 4.918 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -9.953 3.958 7.175 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -8.655 4.568 6.168 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -9.477 6.670 4.596 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -11.141 5.562 8.398 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -10.322 8.981 4.899 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -11.989 7.873 8.700 1.00 0.00 H new ATOM 0 HZ PHE A 49 -11.577 9.583 6.952 1.00 0.00 H new ATOM 718 N VAL A 50 -8.397 3.571 3.726 1.00 0.00 N ATOM 719 CA VAL A 50 -7.529 3.788 2.536 1.00 0.00 C ATOM 720 C VAL A 50 -8.281 3.334 1.286 1.00 0.00 C ATOM 721 O VAL A 50 -8.203 3.953 0.243 1.00 0.00 O ATOM 722 CB VAL A 50 -6.239 2.973 2.678 1.00 0.00 C ATOM 723 CG1 VAL A 50 -5.315 3.275 1.494 1.00 0.00 C ATOM 724 CG2 VAL A 50 -5.532 3.353 3.982 1.00 0.00 C ATOM 0 H VAL A 50 -8.027 2.926 4.424 1.00 0.00 H new ATOM 0 HA VAL A 50 -7.276 4.845 2.456 1.00 0.00 H new ATOM 0 HB VAL A 50 -6.482 1.910 2.693 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -4.396 2.696 1.593 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -5.816 3.006 0.564 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -5.075 4.338 1.482 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.615 2.772 4.081 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.289 4.415 3.968 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -6.188 3.142 4.826 1.00 0.00 H new ATOM 734 N SER A 51 -9.013 2.257 1.384 1.00 0.00 N ATOM 735 CA SER A 51 -9.774 1.762 0.205 1.00 0.00 C ATOM 736 C SER A 51 -10.730 2.853 -0.279 1.00 0.00 C ATOM 737 O SER A 51 -10.862 3.095 -1.459 1.00 0.00 O ATOM 738 CB SER A 51 -10.576 0.522 0.601 1.00 0.00 C ATOM 739 OG SER A 51 -11.664 0.357 -0.299 1.00 0.00 O ATOM 0 H SER A 51 -9.116 1.699 2.232 1.00 0.00 H new ATOM 0 HA SER A 51 -9.079 1.506 -0.595 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.936 -0.360 0.581 1.00 0.00 H new ATOM 0 HB3 SER A 51 -10.946 0.625 1.621 1.00 0.00 H new ATOM 0 HG SER A 51 -11.771 -0.594 -0.512 1.00 0.00 H new ATOM 745 N SER A 52 -11.400 3.514 0.626 1.00 0.00 N ATOM 746 CA SER A 52 -12.349 4.590 0.216 1.00 0.00 C ATOM 747 C SER A 52 -11.566 5.795 -0.311 1.00 0.00 C ATOM 748 O SER A 52 -12.078 6.599 -1.064 1.00 0.00 O ATOM 749 CB SER A 52 -13.189 5.014 1.421 1.00 0.00 C ATOM 750 OG SER A 52 -12.411 5.858 2.261 1.00 0.00 O ATOM 0 H SER A 52 -11.332 3.356 1.631 1.00 0.00 H new ATOM 0 HA SER A 52 -13.004 4.214 -0.570 1.00 0.00 H new ATOM 0 HB2 SER A 52 -14.085 5.538 1.088 1.00 0.00 H new ATOM 0 HB3 SER A 52 -13.521 4.136 1.975 1.00 0.00 H new ATOM 0 HG SER A 52 -11.498 5.506 2.323 1.00 0.00 H new ATOM 756 N LEU A 53 -10.330 5.928 0.085 1.00 0.00 N ATOM 757 CA LEU A 53 -9.511 7.078 -0.386 1.00 0.00 C ATOM 758 C LEU A 53 -9.045 6.813 -1.818 1.00 0.00 C ATOM 759 O LEU A 53 -8.757 7.727 -2.566 1.00 0.00 O ATOM 760 CB LEU A 53 -8.297 7.228 0.546 1.00 0.00 C ATOM 761 CG LEU A 53 -7.176 8.026 -0.134 1.00 0.00 C ATOM 762 CD1 LEU A 53 -7.627 9.473 -0.347 1.00 0.00 C ATOM 763 CD2 LEU A 53 -5.936 8.019 0.763 1.00 0.00 C ATOM 0 H LEU A 53 -9.851 5.286 0.717 1.00 0.00 H new ATOM 0 HA LEU A 53 -10.099 7.996 -0.371 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.600 7.730 1.465 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -7.927 6.242 0.828 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.944 7.571 -1.097 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.828 10.036 -0.830 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -8.515 9.488 -0.979 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.860 9.927 0.616 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -5.137 8.585 0.284 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -6.179 8.475 1.723 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -5.608 6.992 0.922 1.00 0.00 H new ATOM 775 N VAL A 54 -8.948 5.566 -2.198 1.00 0.00 N ATOM 776 CA VAL A 54 -8.475 5.232 -3.573 1.00 0.00 C ATOM 777 C VAL A 54 -9.537 4.423 -4.327 1.00 0.00 C ATOM 778 O VAL A 54 -9.251 3.790 -5.323 1.00 0.00 O ATOM 779 CB VAL A 54 -7.185 4.421 -3.457 1.00 0.00 C ATOM 780 CG1 VAL A 54 -6.178 5.197 -2.605 1.00 0.00 C ATOM 781 CG2 VAL A 54 -7.477 3.074 -2.785 1.00 0.00 C ATOM 0 H VAL A 54 -9.177 4.762 -1.613 1.00 0.00 H new ATOM 0 HA VAL A 54 -8.293 6.151 -4.130 1.00 0.00 H new ATOM 0 HB VAL A 54 -6.777 4.248 -4.453 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.255 4.623 -2.519 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -5.966 6.157 -3.076 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -6.595 5.365 -1.612 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -6.554 2.500 -2.705 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -7.886 3.245 -1.789 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -8.199 2.518 -3.383 1.00 0.00 H new ATOM 791 N LYS A 55 -10.758 4.431 -3.863 1.00 0.00 N ATOM 792 CA LYS A 55 -11.825 3.655 -4.562 1.00 0.00 C ATOM 793 C LYS A 55 -12.490 4.533 -5.627 1.00 0.00 C ATOM 794 O LYS A 55 -13.324 4.076 -6.385 1.00 0.00 O ATOM 795 CB LYS A 55 -12.877 3.200 -3.542 1.00 0.00 C ATOM 796 CG LYS A 55 -14.138 2.723 -4.272 1.00 0.00 C ATOM 797 CD LYS A 55 -14.976 1.850 -3.334 1.00 0.00 C ATOM 798 CE LYS A 55 -15.465 2.689 -2.150 1.00 0.00 C ATOM 799 NZ LYS A 55 -16.592 1.986 -1.476 1.00 0.00 N ATOM 0 H LYS A 55 -11.063 4.939 -3.033 1.00 0.00 H new ATOM 0 HA LYS A 55 -11.381 2.783 -5.042 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -12.476 2.395 -2.927 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -13.124 4.022 -2.870 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -14.723 3.580 -4.607 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -13.863 2.158 -5.162 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -15.827 1.433 -3.873 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -14.382 1.009 -2.976 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -14.650 2.852 -1.445 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -15.789 3.671 -2.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -16.925 2.555 -0.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -17.371 1.852 -2.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -16.268 1.059 -1.134 1.00 0.00 H new ATOM 896 N SER A 62 -6.940 0.051 -11.418 1.00 0.00 N ATOM 897 CA SER A 62 -7.672 -0.892 -10.524 1.00 0.00 C ATOM 898 C SER A 62 -6.819 -1.221 -9.299 1.00 0.00 C ATOM 899 O SER A 62 -7.334 -1.464 -8.229 1.00 0.00 O ATOM 900 CB SER A 62 -7.971 -2.181 -11.298 1.00 0.00 C ATOM 901 OG SER A 62 -6.916 -2.431 -12.216 1.00 0.00 O ATOM 0 HA SER A 62 -8.602 -0.430 -10.194 1.00 0.00 H new ATOM 0 HB2 SER A 62 -8.074 -3.018 -10.608 1.00 0.00 H new ATOM 0 HB3 SER A 62 -8.918 -2.088 -11.830 1.00 0.00 H new ATOM 0 HG SER A 62 -6.468 -1.588 -12.437 1.00 0.00 H new ATOM 907 N TYR A 63 -5.523 -1.244 -9.442 1.00 0.00 N ATOM 908 CA TYR A 63 -4.660 -1.580 -8.271 1.00 0.00 C ATOM 909 C TYR A 63 -3.919 -0.333 -7.779 1.00 0.00 C ATOM 910 O TYR A 63 -3.831 0.666 -8.465 1.00 0.00 O ATOM 911 CB TYR A 63 -3.652 -2.653 -8.680 1.00 0.00 C ATOM 912 CG TYR A 63 -4.347 -3.991 -8.781 1.00 0.00 C ATOM 913 CD1 TYR A 63 -5.337 -4.196 -9.749 1.00 0.00 C ATOM 914 CD2 TYR A 63 -4.000 -5.030 -7.907 1.00 0.00 C ATOM 915 CE1 TYR A 63 -5.979 -5.436 -9.844 1.00 0.00 C ATOM 916 CE2 TYR A 63 -4.642 -6.270 -8.002 1.00 0.00 C ATOM 917 CZ TYR A 63 -5.631 -6.474 -8.971 1.00 0.00 C ATOM 918 OH TYR A 63 -6.263 -7.696 -9.065 1.00 0.00 O ATOM 0 H TYR A 63 -5.026 -1.047 -10.310 1.00 0.00 H new ATOM 0 HA TYR A 63 -5.287 -1.953 -7.461 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -3.199 -2.394 -9.637 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -2.845 -2.705 -7.949 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -5.606 -3.396 -10.423 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -3.236 -4.874 -7.159 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -6.743 -5.592 -10.591 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -4.374 -7.070 -7.327 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.902 -8.304 -8.386 1.00 0.00 H new ATOM 928 N VAL A 64 -3.400 -0.388 -6.579 1.00 0.00 N ATOM 929 CA VAL A 64 -2.674 0.789 -6.011 1.00 0.00 C ATOM 930 C VAL A 64 -1.501 0.288 -5.155 1.00 0.00 C ATOM 931 O VAL A 64 -1.610 -0.693 -4.454 1.00 0.00 O ATOM 932 CB VAL A 64 -3.669 1.588 -5.155 1.00 0.00 C ATOM 933 CG1 VAL A 64 -2.974 2.755 -4.451 1.00 0.00 C ATOM 934 CG2 VAL A 64 -4.780 2.127 -6.060 1.00 0.00 C ATOM 0 H VAL A 64 -3.448 -1.201 -5.965 1.00 0.00 H new ATOM 0 HA VAL A 64 -2.277 1.427 -6.800 1.00 0.00 H new ATOM 0 HB VAL A 64 -4.086 0.929 -4.393 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -3.701 3.304 -3.852 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.186 2.372 -3.803 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -2.540 3.422 -5.195 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -5.492 2.696 -5.462 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -4.346 2.775 -6.822 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.293 1.294 -6.541 1.00 0.00 H new ATOM 944 N TRP A 65 -0.372 0.946 -5.217 1.00 0.00 N ATOM 945 CA TRP A 65 0.807 0.485 -4.415 1.00 0.00 C ATOM 946 C TRP A 65 0.651 0.912 -2.950 1.00 0.00 C ATOM 947 O TRP A 65 0.087 1.947 -2.656 1.00 0.00 O ATOM 948 CB TRP A 65 2.086 1.141 -4.960 1.00 0.00 C ATOM 949 CG TRP A 65 2.856 0.225 -5.867 1.00 0.00 C ATOM 950 CD1 TRP A 65 3.475 0.636 -6.994 1.00 0.00 C ATOM 951 CD2 TRP A 65 3.131 -1.208 -5.752 1.00 0.00 C ATOM 952 NE1 TRP A 65 4.109 -0.438 -7.581 1.00 0.00 N ATOM 953 CE2 TRP A 65 3.919 -1.597 -6.863 1.00 0.00 C ATOM 954 CE3 TRP A 65 2.780 -2.201 -4.818 1.00 0.00 C ATOM 955 CZ2 TRP A 65 4.341 -2.912 -7.038 1.00 0.00 C ATOM 956 CZ3 TRP A 65 3.203 -3.528 -4.996 1.00 0.00 C ATOM 957 CH2 TRP A 65 3.980 -3.882 -6.104 1.00 0.00 C ATOM 0 H TRP A 65 -0.213 1.779 -5.784 1.00 0.00 H new ATOM 0 HA TRP A 65 0.868 -0.601 -4.485 1.00 0.00 H new ATOM 0 HB2 TRP A 65 1.823 2.049 -5.503 1.00 0.00 H new ATOM 0 HB3 TRP A 65 2.721 1.441 -4.126 1.00 0.00 H new ATOM 0 HD1 TRP A 65 3.474 1.646 -7.375 1.00 0.00 H new ATOM 0 HE1 TRP A 65 4.653 -0.381 -8.442 1.00 0.00 H new ATOM 0 HE3 TRP A 65 2.181 -1.940 -3.958 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 4.945 -3.179 -7.893 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 2.927 -4.281 -4.272 1.00 0.00 H new ATOM 0 HH2 TRP A 65 4.300 -4.905 -6.236 1.00 0.00 H new ATOM 968 N ILE A 66 1.196 0.150 -2.032 1.00 0.00 N ATOM 969 CA ILE A 66 1.132 0.547 -0.597 1.00 0.00 C ATOM 970 C ILE A 66 2.490 0.245 0.040 1.00 0.00 C ATOM 971 O ILE A 66 3.386 -0.259 -0.606 1.00 0.00 O ATOM 972 CB ILE A 66 0.031 -0.221 0.141 1.00 0.00 C ATOM 973 CG1 ILE A 66 0.186 -1.724 -0.082 1.00 0.00 C ATOM 974 CG2 ILE A 66 -1.338 0.225 -0.374 1.00 0.00 C ATOM 975 CD1 ILE A 66 -0.990 -2.453 0.579 1.00 0.00 C ATOM 0 H ILE A 66 1.681 -0.728 -2.218 1.00 0.00 H new ATOM 0 HA ILE A 66 0.899 1.609 -0.526 1.00 0.00 H new ATOM 0 HB ILE A 66 0.114 -0.010 1.207 1.00 0.00 H new ATOM 0 HG12 ILE A 66 0.214 -1.945 -1.149 1.00 0.00 H new ATOM 0 HG13 ILE A 66 1.129 -2.072 0.340 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.120 -0.322 0.152 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.462 1.294 -0.199 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.409 0.022 -1.443 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -0.886 -3.527 0.424 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -0.996 -2.240 1.648 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -1.925 -2.111 0.136 1.00 0.00 H new ATOM 987 N GLY A 67 2.668 0.573 1.289 1.00 0.00 N ATOM 988 CA GLY A 67 3.978 0.332 1.943 1.00 0.00 C ATOM 989 C GLY A 67 4.055 -1.074 2.522 1.00 0.00 C ATOM 990 O GLY A 67 4.294 -1.247 3.690 1.00 0.00 O ATOM 0 H GLY A 67 1.958 0.999 1.885 1.00 0.00 H new ATOM 0 HA2 GLY A 67 4.780 0.474 1.219 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.131 1.064 2.736 1.00 0.00 H new ATOM 994 N LEU A 68 3.885 -2.080 1.714 1.00 0.00 N ATOM 995 CA LEU A 68 4.002 -3.483 2.230 1.00 0.00 C ATOM 996 C LEU A 68 5.004 -4.233 1.352 1.00 0.00 C ATOM 997 O LEU A 68 4.885 -4.251 0.143 1.00 0.00 O ATOM 998 CB LEU A 68 2.641 -4.191 2.172 1.00 0.00 C ATOM 999 CG LEU A 68 2.599 -5.406 3.134 1.00 0.00 C ATOM 1000 CD1 LEU A 68 3.948 -6.132 3.195 1.00 0.00 C ATOM 1001 CD2 LEU A 68 2.243 -4.941 4.543 1.00 0.00 C ATOM 0 H LEU A 68 3.670 -1.999 0.720 1.00 0.00 H new ATOM 0 HA LEU A 68 4.337 -3.466 3.267 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.851 -3.488 2.436 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.445 -4.524 1.153 1.00 0.00 H new ATOM 0 HG LEU A 68 1.845 -6.094 2.751 1.00 0.00 H new ATOM 0 HD11 LEU A 68 3.876 -6.977 3.880 1.00 0.00 H new ATOM 0 HD12 LEU A 68 4.213 -6.492 2.201 1.00 0.00 H new ATOM 0 HD13 LEU A 68 4.716 -5.444 3.548 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.215 -5.800 5.213 1.00 0.00 H new ATOM 0 HD22 LEU A 68 2.993 -4.232 4.893 1.00 0.00 H new ATOM 0 HD23 LEU A 68 1.266 -4.459 4.531 1.00 0.00 H new ATOM 1013 N HIS A 69 5.989 -4.857 1.944 1.00 0.00 N ATOM 1014 CA HIS A 69 6.986 -5.605 1.132 1.00 0.00 C ATOM 1015 C HIS A 69 7.325 -6.920 1.818 1.00 0.00 C ATOM 1016 O HIS A 69 6.816 -7.240 2.869 1.00 0.00 O ATOM 1017 CB HIS A 69 8.259 -4.773 0.974 1.00 0.00 C ATOM 1018 CG HIS A 69 8.970 -4.710 2.294 1.00 0.00 C ATOM 1019 ND1 HIS A 69 10.182 -5.344 2.520 1.00 0.00 N ATOM 1020 CD2 HIS A 69 8.635 -4.109 3.475 1.00 0.00 C ATOM 1021 CE1 HIS A 69 10.525 -5.109 3.800 1.00 0.00 C ATOM 1022 NE2 HIS A 69 9.617 -4.359 4.428 1.00 0.00 N ATOM 0 H HIS A 69 6.143 -4.879 2.952 1.00 0.00 H new ATOM 0 HA HIS A 69 6.562 -5.806 0.148 1.00 0.00 H new ATOM 0 HB2 HIS A 69 8.907 -5.217 0.218 1.00 0.00 H new ATOM 0 HB3 HIS A 69 8.012 -3.768 0.632 1.00 0.00 H new ATOM 0 HD2 HIS A 69 7.741 -3.527 3.643 1.00 0.00 H new ATOM 0 HE1 HIS A 69 11.426 -5.482 4.263 1.00 0.00 H new ATOM 0 HE2 HIS A 69 9.638 -4.039 5.396 1.00 0.00 H new ATOM 1180 N TRP A 82 6.216 -10.360 5.330 1.00 0.00 N ATOM 1181 CA TRP A 82 5.344 -9.226 4.878 1.00 0.00 C ATOM 1182 C TRP A 82 5.280 -8.134 5.954 1.00 0.00 C ATOM 1183 O TRP A 82 4.521 -8.233 6.896 1.00 0.00 O ATOM 1184 CB TRP A 82 3.927 -9.753 4.593 1.00 0.00 C ATOM 1185 CG TRP A 82 3.660 -10.975 5.418 1.00 0.00 C ATOM 1186 CD1 TRP A 82 4.312 -12.154 5.297 1.00 0.00 C ATOM 1187 CD2 TRP A 82 2.673 -11.161 6.476 1.00 0.00 C ATOM 1188 NE1 TRP A 82 3.797 -13.047 6.219 1.00 0.00 N ATOM 1189 CE2 TRP A 82 2.785 -12.483 6.968 1.00 0.00 C ATOM 1190 CE3 TRP A 82 1.706 -10.318 7.052 1.00 0.00 C ATOM 1191 CZ2 TRP A 82 1.964 -12.953 7.994 1.00 0.00 C ATOM 1192 CZ3 TRP A 82 0.879 -10.788 8.086 1.00 0.00 C ATOM 1193 CH2 TRP A 82 1.008 -12.103 8.556 1.00 0.00 C ATOM 0 HA TRP A 82 5.768 -8.796 3.970 1.00 0.00 H new ATOM 0 HB2 TRP A 82 3.191 -8.982 4.821 1.00 0.00 H new ATOM 0 HB3 TRP A 82 3.824 -9.989 3.534 1.00 0.00 H new ATOM 0 HD1 TRP A 82 5.105 -12.364 4.595 1.00 0.00 H new ATOM 0 HE1 TRP A 82 4.125 -14.006 6.332 1.00 0.00 H new ATOM 0 HE3 TRP A 82 1.598 -9.304 6.698 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 2.067 -13.967 8.351 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 0.139 -10.133 8.522 1.00 0.00 H new ATOM 0 HH2 TRP A 82 0.369 -12.458 9.351 1.00 0.00 H new ATOM 1204 N GLU A 83 6.062 -7.085 5.826 1.00 0.00 N ATOM 1205 CA GLU A 83 6.020 -6.000 6.859 1.00 0.00 C ATOM 1206 C GLU A 83 5.748 -4.655 6.187 1.00 0.00 C ATOM 1207 O GLU A 83 6.160 -4.415 5.071 1.00 0.00 O ATOM 1208 CB GLU A 83 7.363 -5.933 7.592 1.00 0.00 C ATOM 1209 CG GLU A 83 7.480 -7.119 8.552 1.00 0.00 C ATOM 1210 CD GLU A 83 8.934 -7.273 9.001 1.00 0.00 C ATOM 1211 OE1 GLU A 83 9.640 -6.278 9.008 1.00 0.00 O ATOM 1212 OE2 GLU A 83 9.317 -8.383 9.330 1.00 0.00 O ATOM 0 H GLU A 83 6.719 -6.935 5.061 1.00 0.00 H new ATOM 0 HA GLU A 83 5.224 -6.219 7.571 1.00 0.00 H new ATOM 0 HB2 GLU A 83 8.183 -5.951 6.874 1.00 0.00 H new ATOM 0 HB3 GLU A 83 7.442 -4.996 8.143 1.00 0.00 H new ATOM 0 HG2 GLU A 83 6.836 -6.964 9.418 1.00 0.00 H new ATOM 0 HG3 GLU A 83 7.141 -8.032 8.062 1.00 0.00 H new ATOM 1219 N TRP A 84 5.060 -3.770 6.859 1.00 0.00 N ATOM 1220 CA TRP A 84 4.772 -2.449 6.259 1.00 0.00 C ATOM 1221 C TRP A 84 6.022 -1.581 6.343 1.00 0.00 C ATOM 1222 O TRP A 84 6.622 -1.440 7.390 1.00 0.00 O ATOM 1223 CB TRP A 84 3.629 -1.774 7.016 1.00 0.00 C ATOM 1224 CG TRP A 84 2.529 -2.762 7.240 1.00 0.00 C ATOM 1225 CD1 TRP A 84 2.471 -3.645 8.263 1.00 0.00 C ATOM 1226 CD2 TRP A 84 1.334 -2.986 6.440 1.00 0.00 C ATOM 1227 NE1 TRP A 84 1.320 -4.400 8.138 1.00 0.00 N ATOM 1228 CE2 TRP A 84 0.587 -4.032 7.028 1.00 0.00 C ATOM 1229 CE3 TRP A 84 0.834 -2.390 5.267 1.00 0.00 C ATOM 1230 CZ2 TRP A 84 -0.616 -4.473 6.476 1.00 0.00 C ATOM 1231 CZ3 TRP A 84 -0.375 -2.834 4.707 1.00 0.00 C ATOM 1232 CH2 TRP A 84 -1.097 -3.873 5.310 1.00 0.00 C ATOM 0 H TRP A 84 4.688 -3.912 7.798 1.00 0.00 H new ATOM 0 HA TRP A 84 4.481 -2.578 5.216 1.00 0.00 H new ATOM 0 HB2 TRP A 84 3.988 -1.390 7.971 1.00 0.00 H new ATOM 0 HB3 TRP A 84 3.256 -0.921 6.449 1.00 0.00 H new ATOM 0 HD1 TRP A 84 3.205 -3.744 9.049 1.00 0.00 H new ATOM 0 HE1 TRP A 84 1.046 -5.138 8.786 1.00 0.00 H new ATOM 0 HE3 TRP A 84 1.382 -1.588 4.796 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 -1.171 -5.272 6.946 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -0.751 -2.372 3.806 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -2.025 -4.210 4.873 1.00 0.00 H new ATOM 1243 N SER A 85 6.417 -0.996 5.253 1.00 0.00 N ATOM 1244 CA SER A 85 7.624 -0.136 5.277 1.00 0.00 C ATOM 1245 C SER A 85 7.232 1.244 5.783 1.00 0.00 C ATOM 1246 O SER A 85 8.044 2.142 5.868 1.00 0.00 O ATOM 1247 CB SER A 85 8.212 -0.026 3.869 1.00 0.00 C ATOM 1248 OG SER A 85 7.350 0.765 3.062 1.00 0.00 O ATOM 0 H SER A 85 5.956 -1.076 4.347 1.00 0.00 H new ATOM 0 HA SER A 85 8.375 -0.571 5.936 1.00 0.00 H new ATOM 0 HB2 SER A 85 9.204 0.423 3.911 1.00 0.00 H new ATOM 0 HB3 SER A 85 8.329 -1.018 3.433 1.00 0.00 H new ATOM 0 HG SER A 85 7.337 0.408 2.150 1.00 0.00 H new ATOM 1288 N VAL A 89 5.764 -3.767 12.173 1.00 0.00 N ATOM 1289 CA VAL A 89 5.597 -5.231 11.985 1.00 0.00 C ATOM 1290 C VAL A 89 4.163 -5.515 11.532 1.00 0.00 C ATOM 1291 O VAL A 89 3.260 -4.742 11.784 1.00 0.00 O ATOM 1292 CB VAL A 89 5.867 -5.953 13.307 1.00 0.00 C ATOM 1293 CG1 VAL A 89 4.873 -5.469 14.366 1.00 0.00 C ATOM 1294 CG2 VAL A 89 5.704 -7.461 13.108 1.00 0.00 C ATOM 0 HA VAL A 89 6.300 -5.587 11.232 1.00 0.00 H new ATOM 0 HB VAL A 89 6.883 -5.737 13.636 1.00 0.00 H new ATOM 0 HG11 VAL A 89 5.065 -5.983 15.308 1.00 0.00 H new ATOM 0 HG12 VAL A 89 4.988 -4.395 14.509 1.00 0.00 H new ATOM 0 HG13 VAL A 89 3.857 -5.684 14.036 1.00 0.00 H new ATOM 0 HG21 VAL A 89 5.896 -7.975 14.050 1.00 0.00 H new ATOM 0 HG22 VAL A 89 4.688 -7.677 12.778 1.00 0.00 H new ATOM 0 HG23 VAL A 89 6.412 -7.807 12.355 1.00 0.00 H new ATOM 1304 N MET A 90 3.948 -6.609 10.861 1.00 0.00 N ATOM 1305 CA MET A 90 2.571 -6.932 10.389 1.00 0.00 C ATOM 1306 C MET A 90 1.622 -7.050 11.583 1.00 0.00 C ATOM 1307 O MET A 90 1.469 -8.104 12.165 1.00 0.00 O ATOM 1308 CB MET A 90 2.587 -8.257 9.616 1.00 0.00 C ATOM 1309 CG MET A 90 3.327 -9.332 10.420 1.00 0.00 C ATOM 1310 SD MET A 90 3.909 -10.627 9.297 1.00 0.00 S ATOM 1311 CE MET A 90 4.827 -11.593 10.521 1.00 0.00 C ATOM 0 H MET A 90 4.663 -7.294 10.618 1.00 0.00 H new ATOM 0 HA MET A 90 2.225 -6.132 9.734 1.00 0.00 H new ATOM 0 HB2 MET A 90 1.566 -8.581 9.415 1.00 0.00 H new ATOM 0 HB3 MET A 90 3.072 -8.117 8.650 1.00 0.00 H new ATOM 0 HG2 MET A 90 4.170 -8.889 10.951 1.00 0.00 H new ATOM 0 HG3 MET A 90 2.665 -9.759 11.173 1.00 0.00 H new ATOM 0 HE1 MET A 90 5.279 -12.459 10.037 1.00 0.00 H new ATOM 0 HE2 MET A 90 5.609 -10.974 10.961 1.00 0.00 H new ATOM 0 HE3 MET A 90 4.147 -11.929 11.304 1.00 0.00 H new ATOM 1321 N ASN A 91 0.968 -5.977 11.946 1.00 0.00 N ATOM 1322 CA ASN A 91 0.018 -6.040 13.093 1.00 0.00 C ATOM 1323 C ASN A 91 -1.389 -6.290 12.544 1.00 0.00 C ATOM 1324 O ASN A 91 -2.330 -6.503 13.282 1.00 0.00 O ATOM 1325 CB ASN A 91 0.052 -4.715 13.870 1.00 0.00 C ATOM 1326 CG ASN A 91 0.093 -4.996 15.376 1.00 0.00 C ATOM 1327 OD1 ASN A 91 -0.784 -5.649 15.907 1.00 0.00 O ATOM 1328 ND2 ASN A 91 1.080 -4.528 16.087 1.00 0.00 N ATOM 0 H ASN A 91 1.051 -5.064 11.499 1.00 0.00 H new ATOM 0 HA ASN A 91 0.300 -6.846 13.770 1.00 0.00 H new ATOM 0 HB2 ASN A 91 0.925 -4.133 13.576 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -0.826 -4.117 13.626 1.00 0.00 H new ATOM 0 HD21 ASN A 91 1.117 -4.710 17.090 1.00 0.00 H new ATOM 0 HD22 ASN A 91 1.815 -3.980 15.640 1.00 0.00 H new ATOM 1335 N TYR A 92 -1.530 -6.270 11.244 1.00 0.00 N ATOM 1336 CA TYR A 92 -2.863 -6.511 10.623 1.00 0.00 C ATOM 1337 C TYR A 92 -2.685 -7.408 9.394 1.00 0.00 C ATOM 1338 O TYR A 92 -1.649 -7.399 8.758 1.00 0.00 O ATOM 1339 CB TYR A 92 -3.485 -5.175 10.205 1.00 0.00 C ATOM 1340 CG TYR A 92 -4.864 -5.408 9.629 1.00 0.00 C ATOM 1341 CD1 TYR A 92 -5.857 -6.023 10.406 1.00 0.00 C ATOM 1342 CD2 TYR A 92 -5.153 -5.011 8.316 1.00 0.00 C ATOM 1343 CE1 TYR A 92 -7.130 -6.242 9.869 1.00 0.00 C ATOM 1344 CE2 TYR A 92 -6.430 -5.229 7.782 1.00 0.00 C ATOM 1345 CZ TYR A 92 -7.416 -5.845 8.559 1.00 0.00 C ATOM 1346 OH TYR A 92 -8.675 -6.061 8.032 1.00 0.00 O ATOM 0 H TYR A 92 -0.773 -6.096 10.583 1.00 0.00 H new ATOM 0 HA TYR A 92 -3.522 -7.000 11.341 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -3.548 -4.508 11.065 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -2.851 -4.684 9.467 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -5.639 -6.327 11.419 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -4.391 -4.537 7.716 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -7.893 -6.718 10.467 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -6.653 -4.921 6.771 1.00 0.00 H new ATOM 0 HH TYR A 92 -8.707 -5.725 7.112 1.00 0.00 H new ATOM 1356 N PHE A 93 -3.677 -8.191 9.058 1.00 0.00 N ATOM 1357 CA PHE A 93 -3.552 -9.095 7.874 1.00 0.00 C ATOM 1358 C PHE A 93 -4.822 -9.026 7.022 1.00 0.00 C ATOM 1359 O PHE A 93 -5.915 -8.868 7.528 1.00 0.00 O ATOM 1360 CB PHE A 93 -3.348 -10.533 8.355 1.00 0.00 C ATOM 1361 CG PHE A 93 -4.352 -10.848 9.438 1.00 0.00 C ATOM 1362 CD1 PHE A 93 -4.124 -10.416 10.751 1.00 0.00 C ATOM 1363 CD2 PHE A 93 -5.510 -11.573 9.130 1.00 0.00 C ATOM 1364 CE1 PHE A 93 -5.055 -10.709 11.755 1.00 0.00 C ATOM 1365 CE2 PHE A 93 -6.442 -11.864 10.135 1.00 0.00 C ATOM 1366 CZ PHE A 93 -6.213 -11.432 11.447 1.00 0.00 C ATOM 0 H PHE A 93 -4.568 -8.244 9.551 1.00 0.00 H new ATOM 0 HA PHE A 93 -2.700 -8.778 7.273 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.465 -11.227 7.522 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -2.335 -10.660 8.735 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -3.231 -9.857 10.989 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -5.685 -11.908 8.118 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -4.879 -10.377 12.768 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -7.336 -12.421 9.898 1.00 0.00 H new ATOM 0 HZ PHE A 93 -6.931 -11.657 12.222 1.00 0.00 H new ATOM 1376 N ALA A 94 -4.681 -9.147 5.727 1.00 0.00 N ATOM 1377 CA ALA A 94 -5.873 -9.096 4.833 1.00 0.00 C ATOM 1378 C ALA A 94 -5.439 -9.400 3.393 1.00 0.00 C ATOM 1379 O ALA A 94 -6.055 -8.957 2.442 1.00 0.00 O ATOM 1380 CB ALA A 94 -6.512 -7.703 4.899 1.00 0.00 C ATOM 0 H ALA A 94 -3.789 -9.279 5.251 1.00 0.00 H new ATOM 0 HA ALA A 94 -6.603 -9.837 5.157 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -7.383 -7.671 4.244 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -6.820 -7.492 5.923 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.788 -6.955 4.577 1.00 0.00 H new ATOM 1386 N TRP A 95 -4.383 -10.149 3.228 1.00 0.00 N ATOM 1387 CA TRP A 95 -3.910 -10.480 1.854 1.00 0.00 C ATOM 1388 C TRP A 95 -4.911 -11.415 1.165 1.00 0.00 C ATOM 1389 O TRP A 95 -5.674 -12.111 1.804 1.00 0.00 O ATOM 1390 CB TRP A 95 -2.532 -11.157 1.921 1.00 0.00 C ATOM 1391 CG TRP A 95 -2.440 -12.070 3.108 1.00 0.00 C ATOM 1392 CD1 TRP A 95 -3.487 -12.565 3.814 1.00 0.00 C ATOM 1393 CD2 TRP A 95 -1.239 -12.614 3.731 1.00 0.00 C ATOM 1394 NE1 TRP A 95 -3.002 -13.369 4.829 1.00 0.00 N ATOM 1395 CE2 TRP A 95 -1.623 -13.431 4.820 1.00 0.00 C ATOM 1396 CE3 TRP A 95 0.134 -12.474 3.460 1.00 0.00 C ATOM 1397 CZ2 TRP A 95 -0.680 -14.088 5.610 1.00 0.00 C ATOM 1398 CZ3 TRP A 95 1.088 -13.134 4.254 1.00 0.00 C ATOM 1399 CH2 TRP A 95 0.679 -13.940 5.327 1.00 0.00 C ATOM 0 H TRP A 95 -3.827 -10.546 3.986 1.00 0.00 H new ATOM 0 HA TRP A 95 -3.828 -9.558 1.279 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -2.356 -11.724 1.007 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -1.752 -10.398 1.980 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -4.529 -12.364 3.616 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -3.592 -13.857 5.503 1.00 0.00 H new ATOM 0 HE3 TRP A 95 0.458 -11.855 2.636 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -0.999 -14.707 6.435 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 2.140 -13.020 4.037 1.00 0.00 H new ATOM 0 HH2 TRP A 95 1.415 -14.446 5.934 1.00 0.00 H new ATOM 1410 N GLU A 96 -4.918 -11.429 -0.141 1.00 0.00 N ATOM 1411 CA GLU A 96 -5.871 -12.315 -0.871 1.00 0.00 C ATOM 1412 C GLU A 96 -5.342 -13.751 -0.864 1.00 0.00 C ATOM 1413 O GLU A 96 -6.099 -14.700 -0.837 1.00 0.00 O ATOM 1414 CB GLU A 96 -6.013 -11.828 -2.315 1.00 0.00 C ATOM 1415 CG GLU A 96 -7.226 -12.498 -2.961 1.00 0.00 C ATOM 1416 CD GLU A 96 -7.345 -12.041 -4.417 1.00 0.00 C ATOM 1417 OE1 GLU A 96 -6.753 -12.684 -5.269 1.00 0.00 O ATOM 1418 OE2 GLU A 96 -8.025 -11.057 -4.655 1.00 0.00 O ATOM 0 H GLU A 96 -4.307 -10.867 -0.733 1.00 0.00 H new ATOM 0 HA GLU A 96 -6.844 -12.286 -0.380 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -6.129 -10.744 -2.335 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -5.111 -12.063 -2.880 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -7.123 -13.582 -2.916 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -8.132 -12.241 -2.413 1.00 0.00 H new ATOM 1564 N HIS A 107 7.717 -9.175 -4.270 1.00 0.00 N ATOM 1565 CA HIS A 107 8.186 -8.737 -2.922 1.00 0.00 C ATOM 1566 C HIS A 107 7.506 -7.418 -2.545 1.00 0.00 C ATOM 1567 O HIS A 107 8.032 -6.633 -1.783 1.00 0.00 O ATOM 1568 CB HIS A 107 9.705 -8.549 -2.946 1.00 0.00 C ATOM 1569 CG HIS A 107 10.331 -9.630 -3.781 1.00 0.00 C ATOM 1570 ND1 HIS A 107 10.431 -9.802 -5.138 1.00 0.00 N flip ATOM 1571 CD2 HIS A 107 10.964 -10.726 -3.219 1.00 0.00 C flip ATOM 1572 CE1 HIS A 107 11.111 -10.977 -5.419 1.00 0.00 C flip ATOM 1573 NE2 HIS A 107 11.409 -11.494 -4.229 1.00 0.00 N flip ATOM 0 HA HIS A 107 7.929 -9.496 -2.183 1.00 0.00 H new ATOM 0 HB2 HIS A 107 9.954 -7.569 -3.354 1.00 0.00 H new ATOM 0 HB3 HIS A 107 10.102 -8.582 -1.932 1.00 0.00 H new ATOM 0 HD2 HIS A 107 11.079 -10.927 -2.164 1.00 0.00 H new ATOM 0 HE1 HIS A 107 11.347 -11.384 -6.391 1.00 0.00 H new ATOM 0 HE2 HIS A 107 11.915 -12.370 -4.099 1.00 0.00 H new ATOM 1581 N CYS A 108 6.334 -7.172 -3.070 1.00 0.00 N ATOM 1582 CA CYS A 108 5.614 -5.909 -2.740 1.00 0.00 C ATOM 1583 C CYS A 108 4.105 -6.148 -2.831 1.00 0.00 C ATOM 1584 O CYS A 108 3.641 -6.901 -3.663 1.00 0.00 O ATOM 1585 CB CYS A 108 6.021 -4.812 -3.724 1.00 0.00 C ATOM 1586 SG CYS A 108 7.688 -4.232 -3.320 1.00 0.00 S ATOM 0 H CYS A 108 5.845 -7.793 -3.714 1.00 0.00 H new ATOM 0 HA CYS A 108 5.873 -5.596 -1.728 1.00 0.00 H new ATOM 0 HB2 CYS A 108 5.994 -5.195 -4.744 1.00 0.00 H new ATOM 0 HB3 CYS A 108 5.314 -3.984 -3.676 1.00 0.00 H new ATOM 1591 N ALA A 109 3.335 -5.523 -1.975 1.00 0.00 N ATOM 1592 CA ALA A 109 1.854 -5.732 -2.010 1.00 0.00 C ATOM 1593 C ALA A 109 1.141 -4.466 -2.507 1.00 0.00 C ATOM 1594 O ALA A 109 1.594 -3.348 -2.314 1.00 0.00 O ATOM 1595 CB ALA A 109 1.347 -6.096 -0.609 1.00 0.00 C ATOM 0 H ALA A 109 3.666 -4.880 -1.256 1.00 0.00 H new ATOM 0 HA ALA A 109 1.635 -6.548 -2.699 1.00 0.00 H new ATOM 0 HB1 ALA A 109 0.268 -6.247 -0.640 1.00 0.00 H new ATOM 0 HB2 ALA A 109 1.832 -7.013 -0.273 1.00 0.00 H new ATOM 0 HB3 ALA A 109 1.580 -5.287 0.084 1.00 0.00 H new ATOM 1601 N SER A 110 0.023 -4.655 -3.153 1.00 0.00 N ATOM 1602 CA SER A 110 -0.761 -3.513 -3.693 1.00 0.00 C ATOM 1603 C SER A 110 -2.252 -3.796 -3.472 1.00 0.00 C ATOM 1604 O SER A 110 -2.641 -4.911 -3.190 1.00 0.00 O ATOM 1605 CB SER A 110 -0.475 -3.372 -5.194 1.00 0.00 C ATOM 1606 OG SER A 110 0.698 -4.108 -5.515 1.00 0.00 O ATOM 0 H SER A 110 -0.386 -5.572 -3.332 1.00 0.00 H new ATOM 0 HA SER A 110 -0.483 -2.588 -3.187 1.00 0.00 H new ATOM 0 HB2 SER A 110 -1.321 -3.741 -5.774 1.00 0.00 H new ATOM 0 HB3 SER A 110 -0.343 -2.322 -5.455 1.00 0.00 H new ATOM 0 HG SER A 110 1.475 -3.684 -5.095 1.00 0.00 H new ATOM 1612 N LEU A 111 -3.088 -2.805 -3.599 1.00 0.00 N ATOM 1613 CA LEU A 111 -4.545 -3.032 -3.398 1.00 0.00 C ATOM 1614 C LEU A 111 -5.149 -3.524 -4.715 1.00 0.00 C ATOM 1615 O LEU A 111 -4.631 -3.258 -5.779 1.00 0.00 O ATOM 1616 CB LEU A 111 -5.219 -1.715 -2.993 1.00 0.00 C ATOM 1617 CG LEU A 111 -4.719 -1.262 -1.609 1.00 0.00 C ATOM 1618 CD1 LEU A 111 -4.367 0.227 -1.641 1.00 0.00 C ATOM 1619 CD2 LEU A 111 -5.818 -1.484 -0.566 1.00 0.00 C ATOM 0 H LEU A 111 -2.825 -1.848 -3.833 1.00 0.00 H new ATOM 0 HA LEU A 111 -4.700 -3.772 -2.613 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -5.004 -0.946 -3.735 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -6.301 -1.844 -2.972 1.00 0.00 H new ATOM 0 HG LEU A 111 -3.834 -1.843 -1.349 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -4.014 0.539 -0.658 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -3.584 0.400 -2.379 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -5.252 0.804 -1.909 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.461 -1.163 0.413 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.701 -0.905 -0.839 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -6.076 -2.542 -0.528 1.00 0.00 H new ATOM 1631 N SER A 112 -6.231 -4.254 -4.649 1.00 0.00 N ATOM 1632 CA SER A 112 -6.868 -4.780 -5.896 1.00 0.00 C ATOM 1633 C SER A 112 -8.319 -4.305 -5.972 1.00 0.00 C ATOM 1634 O SER A 112 -9.140 -4.655 -5.148 1.00 0.00 O ATOM 1635 CB SER A 112 -6.840 -6.308 -5.869 1.00 0.00 C ATOM 1636 OG SER A 112 -7.794 -6.778 -4.925 1.00 0.00 O ATOM 0 H SER A 112 -6.704 -4.510 -3.782 1.00 0.00 H new ATOM 0 HA SER A 112 -6.321 -4.414 -6.765 1.00 0.00 H new ATOM 0 HB2 SER A 112 -7.065 -6.705 -6.859 1.00 0.00 H new ATOM 0 HB3 SER A 112 -5.844 -6.660 -5.603 1.00 0.00 H new ATOM 0 HG SER A 112 -8.603 -6.227 -4.975 1.00 0.00 H new ATOM 1642 N ARG A 113 -8.646 -3.509 -6.955 1.00 0.00 N ATOM 1643 CA ARG A 113 -10.050 -3.017 -7.078 1.00 0.00 C ATOM 1644 C ARG A 113 -11.011 -4.209 -7.110 1.00 0.00 C ATOM 1645 O ARG A 113 -12.105 -4.150 -6.587 1.00 0.00 O ATOM 1646 CB ARG A 113 -10.201 -2.209 -8.371 1.00 0.00 C ATOM 1647 CG ARG A 113 -11.671 -1.833 -8.579 1.00 0.00 C ATOM 1648 CD ARG A 113 -11.793 -0.906 -9.790 1.00 0.00 C ATOM 1649 NE ARG A 113 -13.222 -0.540 -9.995 1.00 0.00 N ATOM 1650 CZ ARG A 113 -13.802 0.305 -9.187 1.00 0.00 C ATOM 1651 NH1 ARG A 113 -13.417 1.551 -9.161 1.00 0.00 N ATOM 1652 NH2 ARG A 113 -14.767 -0.097 -8.406 1.00 0.00 N ATOM 0 H ARG A 113 -8.004 -3.179 -7.676 1.00 0.00 H new ATOM 0 HA ARG A 113 -10.284 -2.383 -6.223 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -9.589 -1.308 -8.321 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -9.842 -2.792 -9.219 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -12.269 -2.731 -8.733 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -12.061 -1.339 -7.689 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -11.195 -0.008 -9.635 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -11.402 -1.400 -10.680 1.00 0.00 H new ATOM 0 HE ARG A 113 -13.748 -0.950 -10.767 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -12.663 1.865 -9.772 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -13.870 2.212 -8.530 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -15.068 -1.071 -8.427 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -15.220 0.563 -7.774 1.00 0.00 H new ATOM 1666 N SER A 114 -10.612 -5.287 -7.728 1.00 0.00 N ATOM 1667 CA SER A 114 -11.506 -6.478 -7.801 1.00 0.00 C ATOM 1668 C SER A 114 -11.921 -6.907 -6.391 1.00 0.00 C ATOM 1669 O SER A 114 -12.853 -7.665 -6.214 1.00 0.00 O ATOM 1670 CB SER A 114 -10.764 -7.629 -8.482 1.00 0.00 C ATOM 1671 OG SER A 114 -10.101 -7.138 -9.640 1.00 0.00 O ATOM 0 H SER A 114 -9.707 -5.395 -8.185 1.00 0.00 H new ATOM 0 HA SER A 114 -12.396 -6.222 -8.375 1.00 0.00 H new ATOM 0 HB2 SER A 114 -10.042 -8.069 -7.794 1.00 0.00 H new ATOM 0 HB3 SER A 114 -11.465 -8.417 -8.756 1.00 0.00 H new ATOM 0 HG SER A 114 -9.623 -7.872 -10.079 1.00 0.00 H new ATOM 1677 N THR A 115 -11.233 -6.431 -5.386 1.00 0.00 N ATOM 1678 CA THR A 115 -11.583 -6.813 -3.983 1.00 0.00 C ATOM 1679 C THR A 115 -11.968 -5.563 -3.189 1.00 0.00 C ATOM 1680 O THR A 115 -11.799 -5.501 -1.988 1.00 0.00 O ATOM 1681 CB THR A 115 -10.373 -7.486 -3.329 1.00 0.00 C ATOM 1682 OG1 THR A 115 -9.338 -6.528 -3.153 1.00 0.00 O ATOM 1683 CG2 THR A 115 -9.876 -8.621 -4.226 1.00 0.00 C ATOM 0 H THR A 115 -10.442 -5.793 -5.475 1.00 0.00 H new ATOM 0 HA THR A 115 -12.426 -7.504 -3.992 1.00 0.00 H new ATOM 0 HB THR A 115 -10.660 -7.891 -2.359 1.00 0.00 H new ATOM 0 HG1 THR A 115 -8.501 -6.878 -3.524 1.00 0.00 H new ATOM 0 HG21 THR A 115 -9.015 -9.101 -3.762 1.00 0.00 H new ATOM 0 HG22 THR A 115 -10.672 -9.354 -4.360 1.00 0.00 H new ATOM 0 HG23 THR A 115 -9.587 -8.218 -5.197 1.00 0.00 H new ATOM 1691 N ALA A 116 -12.486 -4.565 -3.854 1.00 0.00 N ATOM 1692 CA ALA A 116 -12.886 -3.316 -3.142 1.00 0.00 C ATOM 1693 C ALA A 116 -11.658 -2.694 -2.471 1.00 0.00 C ATOM 1694 O ALA A 116 -11.768 -1.988 -1.489 1.00 0.00 O ATOM 1695 CB ALA A 116 -13.939 -3.646 -2.082 1.00 0.00 C ATOM 0 H ALA A 116 -12.650 -4.561 -4.861 1.00 0.00 H new ATOM 0 HA ALA A 116 -13.304 -2.608 -3.858 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -14.231 -2.733 -1.562 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -14.813 -4.085 -2.562 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -13.524 -4.355 -1.365 1.00 0.00 H new ATOM 1701 N PHE A 117 -10.493 -2.947 -2.998 1.00 0.00 N ATOM 1702 CA PHE A 117 -9.256 -2.371 -2.397 1.00 0.00 C ATOM 1703 C PHE A 117 -9.155 -2.793 -0.932 1.00 0.00 C ATOM 1704 O PHE A 117 -8.503 -2.147 -0.135 1.00 0.00 O ATOM 1705 CB PHE A 117 -9.303 -0.843 -2.484 1.00 0.00 C ATOM 1706 CG PHE A 117 -9.681 -0.421 -3.882 1.00 0.00 C ATOM 1707 CD1 PHE A 117 -8.691 -0.271 -4.860 1.00 0.00 C ATOM 1708 CD2 PHE A 117 -11.023 -0.175 -4.201 1.00 0.00 C ATOM 1709 CE1 PHE A 117 -9.041 0.124 -6.157 1.00 0.00 C ATOM 1710 CE2 PHE A 117 -11.372 0.220 -5.497 1.00 0.00 C ATOM 1711 CZ PHE A 117 -10.382 0.370 -6.475 1.00 0.00 C ATOM 0 H PHE A 117 -10.343 -3.530 -3.822 1.00 0.00 H new ATOM 0 HA PHE A 117 -8.387 -2.738 -2.943 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -10.026 -0.451 -1.768 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -8.332 -0.425 -2.218 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -7.656 -0.460 -4.614 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -11.788 -0.290 -3.447 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -8.277 0.239 -6.912 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -12.406 0.409 -5.743 1.00 0.00 H new ATOM 0 HZ PHE A 117 -10.653 0.676 -7.475 1.00 0.00 H new ATOM 1721 N LEU A 118 -9.794 -3.869 -0.570 1.00 0.00 N ATOM 1722 CA LEU A 118 -9.738 -4.335 0.845 1.00 0.00 C ATOM 1723 C LEU A 118 -8.703 -5.454 0.973 1.00 0.00 C ATOM 1724 O LEU A 118 -8.154 -5.684 2.033 1.00 0.00 O ATOM 1725 CB LEU A 118 -11.114 -4.864 1.259 1.00 0.00 C ATOM 1726 CG LEU A 118 -12.098 -3.699 1.416 1.00 0.00 C ATOM 1727 CD1 LEU A 118 -13.491 -4.251 1.727 1.00 0.00 C ATOM 1728 CD2 LEU A 118 -11.646 -2.775 2.559 1.00 0.00 C ATOM 0 H LEU A 118 -10.355 -4.449 -1.194 1.00 0.00 H new ATOM 0 HA LEU A 118 -9.456 -3.504 1.492 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -11.484 -5.565 0.510 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -11.035 -5.413 2.197 1.00 0.00 H new ATOM 0 HG LEU A 118 -12.126 -3.128 0.488 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -14.193 -3.425 1.839 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -13.817 -4.896 0.911 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -13.456 -4.826 2.652 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -12.352 -1.951 2.662 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -11.609 -3.340 3.491 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -10.655 -2.378 2.336 1.00 0.00 H new ATOM 1740 N ARG A 119 -8.429 -6.150 -0.098 1.00 0.00 N ATOM 1741 CA ARG A 119 -7.426 -7.253 -0.043 1.00 0.00 C ATOM 1742 C ARG A 119 -6.115 -6.777 -0.670 1.00 0.00 C ATOM 1743 O ARG A 119 -6.089 -5.821 -1.420 1.00 0.00 O ATOM 1744 CB ARG A 119 -7.954 -8.461 -0.818 1.00 0.00 C ATOM 1745 CG ARG A 119 -9.169 -9.041 -0.091 1.00 0.00 C ATOM 1746 CD ARG A 119 -9.553 -10.380 -0.722 1.00 0.00 C ATOM 1747 NE ARG A 119 -10.938 -10.744 -0.312 1.00 0.00 N ATOM 1748 CZ ARG A 119 -11.330 -11.988 -0.363 1.00 0.00 C ATOM 1749 NH1 ARG A 119 -10.885 -12.847 0.513 1.00 0.00 N ATOM 1750 NH2 ARG A 119 -12.164 -12.373 -1.288 1.00 0.00 N ATOM 0 H ARG A 119 -8.858 -6.002 -1.011 1.00 0.00 H new ATOM 0 HA ARG A 119 -7.252 -7.537 0.995 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -8.229 -8.165 -1.830 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -7.175 -9.218 -0.908 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -8.942 -9.178 0.966 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -10.007 -8.346 -0.150 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -9.490 -10.314 -1.808 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -8.854 -11.155 -0.409 1.00 0.00 H new ATOM 0 HE ARG A 119 -11.581 -10.020 0.009 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -10.232 -12.546 1.236 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -11.190 -13.819 0.474 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -12.511 -11.702 -1.973 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -12.469 -13.345 -1.327 1.00 0.00 H new ATOM 1764 N TRP A 120 -5.024 -7.433 -0.367 1.00 0.00 N ATOM 1765 CA TRP A 120 -3.709 -7.013 -0.943 1.00 0.00 C ATOM 1766 C TRP A 120 -3.189 -8.092 -1.895 1.00 0.00 C ATOM 1767 O TRP A 120 -3.230 -9.269 -1.600 1.00 0.00 O ATOM 1768 CB TRP A 120 -2.699 -6.814 0.191 1.00 0.00 C ATOM 1769 CG TRP A 120 -3.386 -6.202 1.368 1.00 0.00 C ATOM 1770 CD1 TRP A 120 -4.361 -5.266 1.303 1.00 0.00 C ATOM 1771 CD2 TRP A 120 -3.164 -6.466 2.782 1.00 0.00 C ATOM 1772 NE1 TRP A 120 -4.754 -4.942 2.588 1.00 0.00 N ATOM 1773 CE2 TRP A 120 -4.046 -5.655 3.534 1.00 0.00 C ATOM 1774 CE3 TRP A 120 -2.295 -7.325 3.478 1.00 0.00 C ATOM 1775 CZ2 TRP A 120 -4.064 -5.695 4.930 1.00 0.00 C ATOM 1776 CZ3 TRP A 120 -2.309 -7.366 4.880 1.00 0.00 C ATOM 1777 CH2 TRP A 120 -3.193 -6.553 5.605 1.00 0.00 C ATOM 0 H TRP A 120 -4.986 -8.241 0.254 1.00 0.00 H new ATOM 0 HA TRP A 120 -3.840 -6.080 -1.491 1.00 0.00 H new ATOM 0 HB2 TRP A 120 -2.257 -7.770 0.471 1.00 0.00 H new ATOM 0 HB3 TRP A 120 -1.884 -6.172 -0.142 1.00 0.00 H new ATOM 0 HD1 TRP A 120 -4.766 -4.842 0.396 1.00 0.00 H new ATOM 0 HE1 TRP A 120 -5.479 -4.259 2.810 1.00 0.00 H new ATOM 0 HE3 TRP A 120 -1.612 -7.957 2.930 1.00 0.00 H new ATOM 0 HZ2 TRP A 120 -4.746 -5.067 5.483 1.00 0.00 H new ATOM 0 HZ3 TRP A 120 -1.635 -8.027 5.404 1.00 0.00 H new ATOM 0 HH2 TRP A 120 -3.200 -6.591 6.684 1.00 0.00 H new ATOM 1788 N LYS A 121 -2.689 -7.692 -3.036 1.00 0.00 N ATOM 1789 CA LYS A 121 -2.150 -8.680 -4.017 1.00 0.00 C ATOM 1790 C LYS A 121 -0.666 -8.410 -4.236 1.00 0.00 C ATOM 1791 O LYS A 121 -0.220 -7.280 -4.216 1.00 0.00 O ATOM 1792 CB LYS A 121 -2.897 -8.547 -5.348 1.00 0.00 C ATOM 1793 CG LYS A 121 -2.569 -9.744 -6.251 1.00 0.00 C ATOM 1794 CD LYS A 121 -3.524 -10.901 -5.949 1.00 0.00 C ATOM 1795 CE LYS A 121 -3.224 -12.069 -6.890 1.00 0.00 C ATOM 1796 NZ LYS A 121 -3.979 -13.273 -6.443 1.00 0.00 N ATOM 0 H LYS A 121 -2.631 -6.717 -3.331 1.00 0.00 H new ATOM 0 HA LYS A 121 -2.286 -9.690 -3.629 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -3.971 -8.498 -5.169 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -2.614 -7.618 -5.843 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -2.654 -9.455 -7.298 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -1.538 -10.060 -6.090 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -3.412 -11.218 -4.912 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -4.557 -10.576 -6.073 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -3.504 -11.809 -7.911 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -2.154 -12.279 -6.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -4.160 -13.892 -7.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -3.421 -13.789 -5.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -4.884 -12.979 -6.024 1.00 0.00 H new ATOM 1810 N ASP A 122 0.106 -9.440 -4.432 1.00 0.00 N ATOM 1811 CA ASP A 122 1.561 -9.240 -4.638 1.00 0.00 C ATOM 1812 C ASP A 122 1.808 -8.646 -6.026 1.00 0.00 C ATOM 1813 O ASP A 122 1.031 -8.838 -6.941 1.00 0.00 O ATOM 1814 CB ASP A 122 2.288 -10.581 -4.517 1.00 0.00 C ATOM 1815 CG ASP A 122 1.805 -11.524 -5.619 1.00 0.00 C ATOM 1816 OD1 ASP A 122 2.332 -11.439 -6.717 1.00 0.00 O ATOM 1817 OD2 ASP A 122 0.919 -12.318 -5.348 1.00 0.00 O ATOM 0 H ASP A 122 -0.209 -10.410 -4.458 1.00 0.00 H new ATOM 0 HA ASP A 122 1.940 -8.555 -3.880 1.00 0.00 H new ATOM 0 HB2 ASP A 122 3.365 -10.432 -4.598 1.00 0.00 H new ATOM 0 HB3 ASP A 122 2.100 -11.022 -3.538 1.00 0.00 H new ATOM 1822 N TYR A 123 2.883 -7.923 -6.192 1.00 0.00 N ATOM 1823 CA TYR A 123 3.173 -7.318 -7.523 1.00 0.00 C ATOM 1824 C TYR A 123 4.679 -7.050 -7.647 1.00 0.00 C ATOM 1825 O TYR A 123 5.382 -6.936 -6.662 1.00 0.00 O ATOM 1826 CB TYR A 123 2.394 -6.000 -7.655 1.00 0.00 C ATOM 1827 CG TYR A 123 1.139 -6.228 -8.468 1.00 0.00 C ATOM 1828 CD1 TYR A 123 1.178 -6.109 -9.862 1.00 0.00 C ATOM 1829 CD2 TYR A 123 -0.060 -6.560 -7.826 1.00 0.00 C ATOM 1830 CE1 TYR A 123 0.017 -6.321 -10.616 1.00 0.00 C ATOM 1831 CE2 TYR A 123 -1.221 -6.772 -8.579 1.00 0.00 C ATOM 1832 CZ TYR A 123 -1.183 -6.652 -9.973 1.00 0.00 C ATOM 1833 OH TYR A 123 -2.326 -6.862 -10.716 1.00 0.00 O ATOM 0 H TYR A 123 3.571 -7.726 -5.465 1.00 0.00 H new ATOM 0 HA TYR A 123 2.868 -8.001 -8.315 1.00 0.00 H new ATOM 0 HB2 TYR A 123 2.135 -5.619 -6.667 1.00 0.00 H new ATOM 0 HB3 TYR A 123 3.017 -5.245 -8.134 1.00 0.00 H new ATOM 0 HD1 TYR A 123 2.104 -5.854 -10.356 1.00 0.00 H new ATOM 0 HD2 TYR A 123 -0.089 -6.653 -6.750 1.00 0.00 H new ATOM 0 HE1 TYR A 123 0.047 -6.229 -11.692 1.00 0.00 H new ATOM 0 HE2 TYR A 123 -2.146 -7.028 -8.084 1.00 0.00 H new ATOM 0 HH TYR A 123 -3.114 -6.731 -10.148 1.00 0.00 H new ATOM 1843 N ASN A 124 5.178 -6.950 -8.852 1.00 0.00 N ATOM 1844 CA ASN A 124 6.636 -6.689 -9.039 1.00 0.00 C ATOM 1845 C ASN A 124 6.995 -5.344 -8.407 1.00 0.00 C ATOM 1846 O ASN A 124 6.521 -4.309 -8.820 1.00 0.00 O ATOM 1847 CB ASN A 124 6.961 -6.655 -10.533 1.00 0.00 C ATOM 1848 CG ASN A 124 6.657 -8.020 -11.154 1.00 0.00 C ATOM 1849 OD1 ASN A 124 6.922 -9.044 -10.557 1.00 0.00 O ATOM 1850 ND2 ASN A 124 6.107 -8.077 -12.336 1.00 0.00 N ATOM 0 H ASN A 124 4.639 -7.038 -9.714 1.00 0.00 H new ATOM 0 HA ASN A 124 7.213 -7.481 -8.562 1.00 0.00 H new ATOM 0 HB2 ASN A 124 6.373 -5.881 -11.026 1.00 0.00 H new ATOM 0 HB3 ASN A 124 8.011 -6.402 -10.682 1.00 0.00 H new ATOM 0 HD21 ASN A 124 5.899 -8.982 -12.759 1.00 0.00 H new ATOM 0 HD22 ASN A 124 5.885 -7.217 -12.837 1.00 0.00 H new ATOM 1857 N CYS A 125 7.824 -5.357 -7.401 1.00 0.00 N ATOM 1858 CA CYS A 125 8.211 -4.086 -6.720 1.00 0.00 C ATOM 1859 C CYS A 125 8.605 -3.014 -7.743 1.00 0.00 C ATOM 1860 O CYS A 125 8.843 -1.878 -7.386 1.00 0.00 O ATOM 1861 CB CYS A 125 9.404 -4.348 -5.802 1.00 0.00 C ATOM 1862 SG CYS A 125 8.892 -5.410 -4.431 1.00 0.00 S ATOM 0 H CYS A 125 8.254 -6.199 -7.017 1.00 0.00 H new ATOM 0 HA CYS A 125 7.355 -3.730 -6.146 1.00 0.00 H new ATOM 0 HB2 CYS A 125 10.209 -4.823 -6.362 1.00 0.00 H new ATOM 0 HB3 CYS A 125 9.795 -3.405 -5.419 1.00 0.00 H new ATOM 1867 N ASN A 126 8.696 -3.353 -9.002 1.00 0.00 N ATOM 1868 CA ASN A 126 9.100 -2.330 -10.013 1.00 0.00 C ATOM 1869 C ASN A 126 7.875 -1.802 -10.768 1.00 0.00 C ATOM 1870 O ASN A 126 7.820 -0.644 -11.129 1.00 0.00 O ATOM 1871 CB ASN A 126 10.082 -2.953 -11.006 1.00 0.00 C ATOM 1872 CG ASN A 126 10.682 -1.855 -11.887 1.00 0.00 C ATOM 1873 OD1 ASN A 126 10.163 -0.659 -11.861 1.00 0.00 O flip ATOM 1874 ND2 ASN A 126 11.633 -2.090 -12.608 1.00 0.00 N flip ATOM 0 H ASN A 126 8.510 -4.285 -9.372 1.00 0.00 H new ATOM 0 HA ASN A 126 9.576 -1.497 -9.495 1.00 0.00 H new ATOM 0 HB2 ASN A 126 10.873 -3.478 -10.471 1.00 0.00 H new ATOM 0 HB3 ASN A 126 9.571 -3.692 -11.624 1.00 0.00 H new ATOM 0 HD21 ASN A 126 12.039 -3.026 -12.628 1.00 0.00 H new ATOM 0 HD22 ASN A 126 12.025 -1.351 -13.192 1.00 0.00 H new ATOM 1881 N VAL A 127 6.886 -2.622 -11.003 1.00 0.00 N ATOM 1882 CA VAL A 127 5.679 -2.118 -11.723 1.00 0.00 C ATOM 1883 C VAL A 127 5.171 -0.905 -10.951 1.00 0.00 C ATOM 1884 O VAL A 127 4.994 -0.967 -9.752 1.00 0.00 O ATOM 1885 CB VAL A 127 4.600 -3.209 -11.756 1.00 0.00 C ATOM 1886 CG1 VAL A 127 3.226 -2.579 -12.010 1.00 0.00 C ATOM 1887 CG2 VAL A 127 4.918 -4.204 -12.874 1.00 0.00 C ATOM 0 H VAL A 127 6.860 -3.605 -10.733 1.00 0.00 H new ATOM 0 HA VAL A 127 5.921 -1.849 -12.751 1.00 0.00 H new ATOM 0 HB VAL A 127 4.584 -3.726 -10.797 1.00 0.00 H new ATOM 0 HG11 VAL A 127 2.466 -3.360 -12.032 1.00 0.00 H new ATOM 0 HG12 VAL A 127 2.997 -1.872 -11.213 1.00 0.00 H new ATOM 0 HG13 VAL A 127 3.237 -2.056 -12.966 1.00 0.00 H new ATOM 0 HG21 VAL A 127 4.153 -4.980 -12.899 1.00 0.00 H new ATOM 0 HG22 VAL A 127 4.937 -3.682 -13.831 1.00 0.00 H new ATOM 0 HG23 VAL A 127 5.891 -4.660 -12.690 1.00 0.00 H new ATOM 1897 N ARG A 128 4.974 0.214 -11.598 1.00 0.00 N ATOM 1898 CA ARG A 128 4.529 1.398 -10.830 1.00 0.00 C ATOM 1899 C ARG A 128 3.024 1.438 -10.738 1.00 0.00 C ATOM 1900 O ARG A 128 2.344 0.940 -11.612 1.00 0.00 O ATOM 1901 CB ARG A 128 5.031 2.657 -11.550 1.00 0.00 C ATOM 1902 CG ARG A 128 5.160 2.376 -13.052 1.00 0.00 C ATOM 1903 CD ARG A 128 5.435 3.685 -13.808 1.00 0.00 C ATOM 1904 NE ARG A 128 4.293 3.975 -14.721 1.00 0.00 N ATOM 1905 CZ ARG A 128 4.070 3.208 -15.754 1.00 0.00 C ATOM 1906 NH1 ARG A 128 5.001 2.398 -16.177 1.00 0.00 N ATOM 1907 NH2 ARG A 128 2.915 3.252 -16.362 1.00 0.00 N ATOM 0 H ARG A 128 5.100 0.352 -12.601 1.00 0.00 H new ATOM 0 HA ARG A 128 4.933 1.347 -9.819 1.00 0.00 H new ATOM 0 HB2 ARG A 128 4.340 3.483 -11.383 1.00 0.00 H new ATOM 0 HB3 ARG A 128 5.995 2.961 -11.143 1.00 0.00 H new ATOM 0 HG2 ARG A 128 5.968 1.667 -13.230 1.00 0.00 H new ATOM 0 HG3 ARG A 128 4.245 1.916 -13.425 1.00 0.00 H new ATOM 0 HD2 ARG A 128 5.569 4.505 -13.102 1.00 0.00 H new ATOM 0 HD3 ARG A 128 6.360 3.602 -14.379 1.00 0.00 H new ATOM 0 HE ARG A 128 3.685 4.773 -14.539 1.00 0.00 H new ATOM 0 HH11 ARG A 128 5.902 2.364 -15.701 1.00 0.00 H new ATOM 0 HH12 ARG A 128 4.827 1.799 -16.984 1.00 0.00 H new ATOM 0 HH21 ARG A 128 2.188 3.885 -16.030 1.00 0.00 H new ATOM 0 HH22 ARG A 128 2.740 2.653 -17.169 1.00 0.00 H new ATOM 1921 N LEU A 129 2.467 2.019 -9.696 1.00 0.00 N ATOM 1922 CA LEU A 129 0.964 2.021 -9.657 1.00 0.00 C ATOM 1923 C LEU A 129 0.480 3.292 -9.012 1.00 0.00 C ATOM 1924 O LEU A 129 1.212 3.887 -8.245 1.00 0.00 O ATOM 1925 CB LEU A 129 0.491 0.838 -8.799 1.00 0.00 C ATOM 1926 CG LEU A 129 0.433 -0.454 -9.630 1.00 0.00 C ATOM 1927 CD1 LEU A 129 1.314 -1.526 -8.987 1.00 0.00 C ATOM 1928 CD2 LEU A 129 -1.008 -0.956 -9.676 1.00 0.00 C ATOM 0 H LEU A 129 2.950 2.466 -8.917 1.00 0.00 H new ATOM 0 HA LEU A 129 0.573 1.944 -10.672 1.00 0.00 H new ATOM 0 HB2 LEU A 129 1.167 0.702 -7.955 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -0.494 1.054 -8.386 1.00 0.00 H new ATOM 0 HG LEU A 129 0.791 -0.249 -10.639 1.00 0.00 H new ATOM 0 HD11 LEU A 129 1.268 -2.439 -9.581 1.00 0.00 H new ATOM 0 HD12 LEU A 129 2.344 -1.172 -8.944 1.00 0.00 H new ATOM 0 HD13 LEU A 129 0.958 -1.732 -7.977 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.055 -1.872 -10.264 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -1.356 -1.157 -8.663 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.643 -0.198 -10.134 1.00 0.00 H new ATOM 1940 N PRO A 130 -0.738 3.704 -9.215 1.00 0.00 N ATOM 1941 CA PRO A 130 -1.204 4.898 -8.486 1.00 0.00 C ATOM 1942 C PRO A 130 -1.009 4.597 -6.999 1.00 0.00 C ATOM 1943 O PRO A 130 -1.240 3.481 -6.579 1.00 0.00 O ATOM 1944 CB PRO A 130 -2.685 4.979 -8.879 1.00 0.00 C ATOM 1945 CG PRO A 130 -3.001 3.813 -9.835 1.00 0.00 C ATOM 1946 CD PRO A 130 -1.699 3.052 -10.136 1.00 0.00 C ATOM 0 HA PRO A 130 -0.691 5.835 -8.704 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -3.316 4.923 -7.992 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -2.897 5.933 -9.362 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -3.734 3.144 -9.384 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -3.440 4.191 -10.759 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -1.795 1.985 -9.936 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -1.398 3.155 -11.179 1.00 0.00 H new ATOM 1954 N TYR A 131 -0.526 5.506 -6.200 1.00 0.00 N ATOM 1955 CA TYR A 131 -0.283 5.123 -4.774 1.00 0.00 C ATOM 1956 C TYR A 131 -0.704 6.210 -3.794 1.00 0.00 C ATOM 1957 O TYR A 131 -1.069 7.304 -4.169 1.00 0.00 O ATOM 1958 CB TYR A 131 1.214 4.872 -4.594 1.00 0.00 C ATOM 1959 CG TYR A 131 1.962 6.170 -4.777 1.00 0.00 C ATOM 1960 CD1 TYR A 131 2.110 6.715 -6.058 1.00 0.00 C ATOM 1961 CD2 TYR A 131 2.504 6.832 -3.669 1.00 0.00 C ATOM 1962 CE1 TYR A 131 2.800 7.921 -6.231 1.00 0.00 C ATOM 1963 CE2 TYR A 131 3.195 8.037 -3.841 1.00 0.00 C ATOM 1964 CZ TYR A 131 3.343 8.581 -5.124 1.00 0.00 C ATOM 1965 OH TYR A 131 4.023 9.770 -5.293 1.00 0.00 O ATOM 0 H TYR A 131 -0.294 6.466 -6.455 1.00 0.00 H new ATOM 0 HA TYR A 131 -0.879 4.235 -4.563 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.409 4.463 -3.603 1.00 0.00 H new ATOM 0 HB3 TYR A 131 1.560 4.134 -5.317 1.00 0.00 H new ATOM 0 HD1 TYR A 131 1.692 6.205 -6.913 1.00 0.00 H new ATOM 0 HD2 TYR A 131 2.389 6.413 -2.680 1.00 0.00 H new ATOM 0 HE1 TYR A 131 2.913 8.342 -7.219 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.614 8.547 -2.986 1.00 0.00 H new ATOM 0 HH TYR A 131 4.334 10.095 -4.423 1.00 0.00 H new ATOM 1975 N VAL A 132 -0.615 5.903 -2.519 1.00 0.00 N ATOM 1976 CA VAL A 132 -0.970 6.903 -1.476 1.00 0.00 C ATOM 1977 C VAL A 132 0.288 7.183 -0.657 1.00 0.00 C ATOM 1978 O VAL A 132 1.217 6.400 -0.661 1.00 0.00 O ATOM 1979 CB VAL A 132 -2.070 6.339 -0.573 1.00 0.00 C ATOM 1980 CG1 VAL A 132 -2.393 7.344 0.536 1.00 0.00 C ATOM 1981 CG2 VAL A 132 -3.331 6.081 -1.402 1.00 0.00 C ATOM 0 H VAL A 132 -0.310 4.998 -2.162 1.00 0.00 H new ATOM 0 HA VAL A 132 -1.339 7.822 -1.932 1.00 0.00 H new ATOM 0 HB VAL A 132 -1.725 5.405 -0.129 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -3.176 6.939 1.177 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -1.498 7.530 1.130 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -2.735 8.279 0.092 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -4.114 5.679 -0.758 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -3.671 7.016 -1.847 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -3.107 5.364 -2.192 1.00 0.00 H new ATOM 1991 N CYS A 133 0.346 8.286 0.033 1.00 0.00 N ATOM 1992 CA CYS A 133 1.571 8.591 0.827 1.00 0.00 C ATOM 1993 C CYS A 133 1.189 9.220 2.166 1.00 0.00 C ATOM 1994 O CYS A 133 0.414 10.151 2.222 1.00 0.00 O ATOM 1995 CB CYS A 133 2.439 9.569 0.033 1.00 0.00 C ATOM 1996 SG CYS A 133 3.851 10.091 1.037 1.00 0.00 S ATOM 0 H CYS A 133 -0.394 8.986 0.083 1.00 0.00 H new ATOM 0 HA CYS A 133 2.120 7.669 1.018 1.00 0.00 H new ATOM 0 HB2 CYS A 133 2.789 9.096 -0.885 1.00 0.00 H new ATOM 0 HB3 CYS A 133 1.849 10.437 -0.260 1.00 0.00 H new ATOM 2001 N LYS A 134 1.741 8.725 3.248 1.00 0.00 N ATOM 2002 CA LYS A 134 1.417 9.304 4.585 1.00 0.00 C ATOM 2003 C LYS A 134 2.562 10.224 5.008 1.00 0.00 C ATOM 2004 O LYS A 134 3.686 10.050 4.583 1.00 0.00 O ATOM 2005 CB LYS A 134 1.248 8.167 5.605 1.00 0.00 C ATOM 2006 CG LYS A 134 2.622 7.689 6.096 1.00 0.00 C ATOM 2007 CD LYS A 134 2.470 6.369 6.864 1.00 0.00 C ATOM 2008 CE LYS A 134 1.990 6.655 8.289 1.00 0.00 C ATOM 2009 NZ LYS A 134 1.918 5.377 9.053 1.00 0.00 N ATOM 0 H LYS A 134 2.400 7.947 3.261 1.00 0.00 H new ATOM 0 HA LYS A 134 0.489 9.874 4.537 1.00 0.00 H new ATOM 0 HB2 LYS A 134 0.651 8.512 6.450 1.00 0.00 H new ATOM 0 HB3 LYS A 134 0.707 7.337 5.150 1.00 0.00 H new ATOM 0 HG2 LYS A 134 3.294 7.552 5.248 1.00 0.00 H new ATOM 0 HG3 LYS A 134 3.071 8.445 6.740 1.00 0.00 H new ATOM 0 HD2 LYS A 134 1.759 5.720 6.354 1.00 0.00 H new ATOM 0 HD3 LYS A 134 3.423 5.840 6.890 1.00 0.00 H new ATOM 0 HE2 LYS A 134 2.672 7.348 8.782 1.00 0.00 H new ATOM 0 HE3 LYS A 134 1.011 7.133 8.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 2.293 5.524 10.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 0.928 5.064 9.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 2.482 4.650 8.568 1.00 0.00 H new ATOM 2023 N PHE A 135 2.295 11.211 5.825 1.00 0.00 N ATOM 2024 CA PHE A 135 3.398 12.136 6.245 1.00 0.00 C ATOM 2025 C PHE A 135 2.876 13.166 7.250 1.00 0.00 C ATOM 2026 O PHE A 135 2.003 13.953 6.948 1.00 0.00 O ATOM 2027 CB PHE A 135 3.939 12.875 5.016 1.00 0.00 C ATOM 2028 CG PHE A 135 2.805 13.567 4.294 1.00 0.00 C ATOM 2029 CD1 PHE A 135 2.087 12.889 3.300 1.00 0.00 C ATOM 2030 CD2 PHE A 135 2.470 14.889 4.617 1.00 0.00 C ATOM 2031 CE1 PHE A 135 1.037 13.531 2.632 1.00 0.00 C ATOM 2032 CE2 PHE A 135 1.422 15.531 3.948 1.00 0.00 C ATOM 2033 CZ PHE A 135 0.705 14.852 2.956 1.00 0.00 C ATOM 0 H PHE A 135 1.376 11.417 6.216 1.00 0.00 H new ATOM 0 HA PHE A 135 4.189 11.548 6.710 1.00 0.00 H new ATOM 0 HB2 PHE A 135 4.688 13.606 5.320 1.00 0.00 H new ATOM 0 HB3 PHE A 135 4.434 12.172 4.346 1.00 0.00 H new ATOM 0 HD1 PHE A 135 2.344 11.870 3.049 1.00 0.00 H new ATOM 0 HD2 PHE A 135 3.022 15.413 5.383 1.00 0.00 H new ATOM 0 HE1 PHE A 135 0.483 13.007 1.867 1.00 0.00 H new ATOM 0 HE2 PHE A 135 1.166 16.550 4.197 1.00 0.00 H new ATOM 0 HZ PHE A 135 -0.105 15.347 2.440 1.00 0.00 H new