USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=36 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 63 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 112 SER OG : rot 12:sc= -0.0554! USER MOD Set 1.3: A 114 SER OG : rot 180:sc=-0.000634 USER MOD Set 1.4: A 115 THR OG1 : rot -133:sc= 1.25! USER MOD Set 2.1: A 31 GLN : amide:sc= -0.0157 X(o=-3,f=-3.4) USER MOD Set 2.2: A 37 ASN :FLIP amide:sc= -2.94! C(o=-5.1!,f=-3!) USER MOD Set 3.1: A 21 LYS NZ :NH3+ 179:sc= 0.504 (180deg=-0.389) USER MOD Set 3.2: A 131 TYR OH : rot 180:sc= 0.702 USER MOD Set 4.1: A 14 TYR OH : rot 150:sc= -0.445 USER MOD Set 4.2: A 134 LYS NZ :NH3+ 155:sc= -1.04 (180deg=-2.32!) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 163:sc= -0.0126 (180deg=-0.391) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 63:sc= 0.911 USER MOD Single : A 12 HIS :FLIP no HD1:sc= -2.41! C(o=-4.2!,f=-2.4!) USER MOD Single : A 13 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= -0.407 USER MOD Single : A 22 SER OG : rot -67:sc= 1.29 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 159:sc= -0.101 (180deg=-0.697) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= -0.647 USER MOD Single : A 43 SER OG : rot 170:sc= 0.951 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 141:sc= 0.819 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.1) USER MOD Single : A 62 SER OG : rot -23:sc= 0.708 USER MOD Single : A 69 HIS :FLIP no HE2:sc= -0.34 F(o=-1.1,f=-0.34) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 90 MET CE :methyl 157:sc= -0.328 (180deg=-1.43) USER MOD Single : A 91 ASN : amide:sc= -0.0793 K(o=-0.079,f=-0.74) USER MOD Single : A 92 TYR OH : rot 180:sc= -0.116 USER MOD Single : A 107 HIS :FLIP no HD1:sc= -0.371 F(o=-1.3!,f=-0.37) USER MOD Single : A 110 SER OG : rot 164:sc= 0.0983 USER MOD Single : A 121 LYS NZ :NH3+ -160:sc=-0.00871 (180deg=-0.573) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 ASN :FLIP amide:sc=-0.00927 F(o=-1.7!,f=-0.0093) USER MOD Single : A 126 ASN : amide:sc= -0.855 K(o=-0.85,f=-3.9!) USER MOD ----------------------------------------------------------------- ATOM 80 N SER A 6 -6.534 15.239 0.594 1.00 0.00 N ATOM 81 CA SER A 6 -5.674 14.529 1.584 1.00 0.00 C ATOM 82 C SER A 6 -6.499 14.227 2.839 1.00 0.00 C ATOM 83 O SER A 6 -7.367 14.990 3.215 1.00 0.00 O ATOM 84 CB SER A 6 -4.482 15.412 1.956 1.00 0.00 C ATOM 85 OG SER A 6 -4.827 16.220 3.075 1.00 0.00 O ATOM 0 HA SER A 6 -5.309 13.598 1.151 1.00 0.00 H new ATOM 0 HB2 SER A 6 -3.616 14.793 2.193 1.00 0.00 H new ATOM 0 HB3 SER A 6 -4.203 16.041 1.111 1.00 0.00 H new ATOM 0 HG SER A 6 -4.065 16.786 3.317 1.00 0.00 H new ATOM 91 N LYS A 7 -6.240 13.120 3.487 1.00 0.00 N ATOM 92 CA LYS A 7 -7.020 12.773 4.715 1.00 0.00 C ATOM 93 C LYS A 7 -6.058 12.356 5.827 1.00 0.00 C ATOM 94 O LYS A 7 -5.144 11.590 5.611 1.00 0.00 O ATOM 95 CB LYS A 7 -7.975 11.608 4.414 1.00 0.00 C ATOM 96 CG LYS A 7 -8.642 11.805 3.046 1.00 0.00 C ATOM 97 CD LYS A 7 -9.731 12.875 3.149 1.00 0.00 C ATOM 98 CE LYS A 7 -10.233 13.224 1.748 1.00 0.00 C ATOM 99 NZ LYS A 7 -10.745 11.992 1.082 1.00 0.00 N ATOM 0 H LYS A 7 -5.525 12.443 3.221 1.00 0.00 H new ATOM 0 HA LYS A 7 -7.596 13.643 5.030 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.426 10.666 4.426 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -8.736 11.543 5.191 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -7.897 12.101 2.307 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -9.074 10.865 2.703 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -10.555 12.513 3.763 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -9.336 13.765 3.638 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -11.023 13.972 1.809 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -9.426 13.660 1.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -11.338 12.257 0.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -9.944 11.417 0.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -11.311 11.441 1.759 1.00 0.00 H new ATOM 113 N ALA A 8 -6.257 12.852 7.019 1.00 0.00 N ATOM 114 CA ALA A 8 -5.349 12.478 8.141 1.00 0.00 C ATOM 115 C ALA A 8 -5.845 11.190 8.798 1.00 0.00 C ATOM 116 O ALA A 8 -7.005 10.836 8.702 1.00 0.00 O ATOM 117 CB ALA A 8 -5.322 13.598 9.181 1.00 0.00 C ATOM 0 H ALA A 8 -7.007 13.498 7.264 1.00 0.00 H new ATOM 0 HA ALA A 8 -4.344 12.323 7.748 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -4.657 13.319 9.999 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -4.962 14.516 8.717 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -6.328 13.758 9.570 1.00 0.00 H new ATOM 123 N TYR A 9 -4.973 10.488 9.463 1.00 0.00 N ATOM 124 CA TYR A 9 -5.382 9.222 10.131 1.00 0.00 C ATOM 125 C TYR A 9 -4.222 8.721 10.995 1.00 0.00 C ATOM 126 O TYR A 9 -3.085 8.689 10.568 1.00 0.00 O ATOM 127 CB TYR A 9 -5.735 8.175 9.065 1.00 0.00 C ATOM 128 CG TYR A 9 -6.841 7.278 9.575 1.00 0.00 C ATOM 129 CD1 TYR A 9 -6.625 6.473 10.699 1.00 0.00 C ATOM 130 CD2 TYR A 9 -8.081 7.251 8.923 1.00 0.00 C ATOM 131 CE1 TYR A 9 -7.647 5.641 11.172 1.00 0.00 C ATOM 132 CE2 TYR A 9 -9.104 6.420 9.397 1.00 0.00 C ATOM 133 CZ TYR A 9 -8.886 5.614 10.522 1.00 0.00 C ATOM 134 OH TYR A 9 -9.893 4.793 10.988 1.00 0.00 O ATOM 0 H TYR A 9 -3.990 10.737 9.573 1.00 0.00 H new ATOM 0 HA TYR A 9 -6.255 9.395 10.760 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -6.050 8.670 8.146 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -4.855 7.580 8.821 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -5.669 6.493 11.202 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -8.248 7.871 8.055 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -7.479 5.020 12.039 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -10.060 6.401 8.896 1.00 0.00 H new ATOM 0 HH TYR A 9 -10.687 4.896 10.423 1.00 0.00 H new ATOM 144 N GLY A 10 -4.492 8.335 12.210 1.00 0.00 N ATOM 145 CA GLY A 10 -3.397 7.846 13.091 1.00 0.00 C ATOM 146 C GLY A 10 -2.524 9.026 13.523 1.00 0.00 C ATOM 147 O GLY A 10 -2.560 9.452 14.660 1.00 0.00 O ATOM 0 H GLY A 10 -5.421 8.337 12.630 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -3.815 7.349 13.967 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -2.794 7.107 12.563 1.00 0.00 H new ATOM 151 N SER A 11 -1.739 9.561 12.625 1.00 0.00 N ATOM 152 CA SER A 11 -0.867 10.715 12.993 1.00 0.00 C ATOM 153 C SER A 11 -0.084 11.192 11.765 1.00 0.00 C ATOM 154 O SER A 11 1.028 11.666 11.875 1.00 0.00 O ATOM 155 CB SER A 11 0.112 10.280 14.087 1.00 0.00 C ATOM 156 OG SER A 11 -0.521 10.391 15.355 1.00 0.00 O ATOM 0 H SER A 11 -1.664 9.250 11.656 1.00 0.00 H new ATOM 0 HA SER A 11 -1.488 11.533 13.359 1.00 0.00 H new ATOM 0 HB2 SER A 11 0.433 9.252 13.916 1.00 0.00 H new ATOM 0 HB3 SER A 11 1.007 10.902 14.059 1.00 0.00 H new ATOM 0 HG SER A 11 -1.283 9.776 15.395 1.00 0.00 H new ATOM 162 N HIS A 12 -0.649 11.073 10.591 1.00 0.00 N ATOM 163 CA HIS A 12 0.069 11.524 9.373 1.00 0.00 C ATOM 164 C HIS A 12 -0.953 11.967 8.326 1.00 0.00 C ATOM 165 O HIS A 12 -2.056 11.458 8.270 1.00 0.00 O ATOM 166 CB HIS A 12 0.897 10.364 8.814 1.00 0.00 C ATOM 167 CG HIS A 12 1.764 9.788 9.898 1.00 0.00 C ATOM 168 ND1 HIS A 12 1.490 8.926 10.929 1.00 0.00 N flip ATOM 169 CD2 HIS A 12 3.113 10.085 9.998 1.00 0.00 C flip ATOM 170 CE1 HIS A 12 2.649 8.689 11.663 1.00 0.00 C flip ATOM 171 NE2 HIS A 12 3.597 9.412 11.059 1.00 0.00 N flip ATOM 0 H HIS A 12 -1.577 10.682 10.428 1.00 0.00 H new ATOM 0 HA HIS A 12 0.728 12.356 9.620 1.00 0.00 H new ATOM 0 HB2 HIS A 12 0.237 9.593 8.415 1.00 0.00 H new ATOM 0 HB3 HIS A 12 1.516 10.712 7.987 1.00 0.00 H new ATOM 0 HD2 HIS A 12 3.674 10.737 9.345 1.00 0.00 H new ATOM 0 HE1 HIS A 12 2.758 8.058 12.532 1.00 0.00 H new ATOM 0 HE2 HIS A 12 4.569 9.449 11.365 1.00 0.00 H new ATOM 179 N CYS A 13 -0.598 12.898 7.489 1.00 0.00 N ATOM 180 CA CYS A 13 -1.552 13.356 6.441 1.00 0.00 C ATOM 181 C CYS A 13 -1.418 12.427 5.235 1.00 0.00 C ATOM 182 O CYS A 13 -0.337 12.213 4.725 1.00 0.00 O ATOM 183 CB CYS A 13 -1.217 14.798 6.036 1.00 0.00 C ATOM 184 SG CYS A 13 -2.422 15.931 6.774 1.00 0.00 S ATOM 0 H CYS A 13 0.310 13.362 7.484 1.00 0.00 H new ATOM 0 HA CYS A 13 -2.574 13.330 6.818 1.00 0.00 H new ATOM 0 HB2 CYS A 13 -0.211 15.055 6.367 1.00 0.00 H new ATOM 0 HB3 CYS A 13 -1.230 14.894 4.950 1.00 0.00 H new ATOM 0 HG CYS A 13 -2.136 17.152 6.432 1.00 0.00 H new ATOM 189 N TYR A 14 -2.506 11.859 4.782 1.00 0.00 N ATOM 190 CA TYR A 14 -2.428 10.929 3.621 1.00 0.00 C ATOM 191 C TYR A 14 -2.861 11.647 2.344 1.00 0.00 C ATOM 192 O TYR A 14 -3.744 12.478 2.358 1.00 0.00 O ATOM 193 CB TYR A 14 -3.342 9.726 3.868 1.00 0.00 C ATOM 194 CG TYR A 14 -2.834 8.946 5.059 1.00 0.00 C ATOM 195 CD1 TYR A 14 -2.926 9.493 6.345 1.00 0.00 C ATOM 196 CD2 TYR A 14 -2.272 7.675 4.881 1.00 0.00 C ATOM 197 CE1 TYR A 14 -2.457 8.771 7.447 1.00 0.00 C ATOM 198 CE2 TYR A 14 -1.804 6.955 5.986 1.00 0.00 C ATOM 199 CZ TYR A 14 -1.896 7.503 7.269 1.00 0.00 C ATOM 200 OH TYR A 14 -1.435 6.793 8.358 1.00 0.00 O ATOM 0 H TYR A 14 -3.441 12.000 5.166 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.399 10.589 3.505 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -4.363 10.062 4.048 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -3.368 9.087 2.985 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -3.359 10.472 6.486 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -2.200 7.251 3.890 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -2.528 9.194 8.438 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -1.371 5.975 5.848 1.00 0.00 H new ATOM 0 HH TYR A 14 -1.527 5.833 8.185 1.00 0.00 H new ATOM 210 N ALA A 15 -2.241 11.328 1.239 1.00 0.00 N ATOM 211 CA ALA A 15 -2.608 11.985 -0.049 1.00 0.00 C ATOM 212 C ALA A 15 -2.586 10.942 -1.170 1.00 0.00 C ATOM 213 O ALA A 15 -1.706 10.108 -1.239 1.00 0.00 O ATOM 214 CB ALA A 15 -1.602 13.095 -0.362 1.00 0.00 C ATOM 0 H ALA A 15 -1.493 10.638 1.173 1.00 0.00 H new ATOM 0 HA ALA A 15 -3.606 12.416 0.031 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -1.871 13.575 -1.303 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -1.615 13.834 0.439 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -0.603 12.668 -0.445 1.00 0.00 H new ATOM 220 N LEU A 16 -3.555 10.982 -2.044 1.00 0.00 N ATOM 221 CA LEU A 16 -3.603 9.993 -3.161 1.00 0.00 C ATOM 222 C LEU A 16 -3.006 10.620 -4.425 1.00 0.00 C ATOM 223 O LEU A 16 -3.324 11.737 -4.784 1.00 0.00 O ATOM 224 CB LEU A 16 -5.067 9.601 -3.410 1.00 0.00 C ATOM 225 CG LEU A 16 -5.204 8.847 -4.738 1.00 0.00 C ATOM 226 CD1 LEU A 16 -4.318 7.597 -4.723 1.00 0.00 C ATOM 227 CD2 LEU A 16 -6.662 8.429 -4.934 1.00 0.00 C ATOM 0 H LEU A 16 -4.318 11.659 -2.033 1.00 0.00 H new ATOM 0 HA LEU A 16 -3.026 9.106 -2.901 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.426 8.977 -2.592 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -5.691 10.495 -3.427 1.00 0.00 H new ATOM 0 HG LEU A 16 -4.892 9.499 -5.554 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -4.421 7.067 -5.670 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.278 7.890 -4.582 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -4.624 6.944 -3.906 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -6.763 7.893 -5.877 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.968 7.780 -4.113 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -7.296 9.316 -4.951 1.00 0.00 H new ATOM 239 N PHE A 17 -2.157 9.899 -5.110 1.00 0.00 N ATOM 240 CA PHE A 17 -1.546 10.423 -6.358 1.00 0.00 C ATOM 241 C PHE A 17 -1.865 9.443 -7.482 1.00 0.00 C ATOM 242 O PHE A 17 -1.427 8.309 -7.473 1.00 0.00 O ATOM 243 CB PHE A 17 -0.029 10.531 -6.182 1.00 0.00 C ATOM 244 CG PHE A 17 0.301 11.773 -5.390 1.00 0.00 C ATOM 245 CD1 PHE A 17 0.280 11.739 -3.990 1.00 0.00 C ATOM 246 CD2 PHE A 17 0.628 12.961 -6.056 1.00 0.00 C ATOM 247 CE1 PHE A 17 0.586 12.892 -3.258 1.00 0.00 C ATOM 248 CE2 PHE A 17 0.934 14.114 -5.322 1.00 0.00 C ATOM 249 CZ PHE A 17 0.913 14.079 -3.923 1.00 0.00 C ATOM 0 H PHE A 17 -1.860 8.958 -4.851 1.00 0.00 H new ATOM 0 HA PHE A 17 -1.942 11.411 -6.591 1.00 0.00 H new ATOM 0 HB2 PHE A 17 0.352 9.648 -5.668 1.00 0.00 H new ATOM 0 HB3 PHE A 17 0.459 10.568 -7.156 1.00 0.00 H new ATOM 0 HD1 PHE A 17 0.028 10.824 -3.476 1.00 0.00 H new ATOM 0 HD2 PHE A 17 0.644 12.988 -7.136 1.00 0.00 H new ATOM 0 HE1 PHE A 17 0.570 12.866 -2.178 1.00 0.00 H new ATOM 0 HE2 PHE A 17 1.186 15.030 -5.836 1.00 0.00 H new ATOM 0 HZ PHE A 17 1.149 14.968 -3.357 1.00 0.00 H new ATOM 259 N LEU A 18 -2.622 9.868 -8.449 1.00 0.00 N ATOM 260 CA LEU A 18 -2.966 8.961 -9.570 1.00 0.00 C ATOM 261 C LEU A 18 -1.719 8.774 -10.413 1.00 0.00 C ATOM 262 O LEU A 18 -1.765 8.275 -11.521 1.00 0.00 O ATOM 263 CB LEU A 18 -4.083 9.585 -10.415 1.00 0.00 C ATOM 264 CG LEU A 18 -5.122 10.228 -9.494 1.00 0.00 C ATOM 265 CD1 LEU A 18 -6.333 10.666 -10.319 1.00 0.00 C ATOM 266 CD2 LEU A 18 -5.566 9.216 -8.435 1.00 0.00 C ATOM 0 H LEU A 18 -3.018 10.806 -8.511 1.00 0.00 H new ATOM 0 HA LEU A 18 -3.316 8.000 -9.194 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.668 10.333 -11.090 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.554 8.822 -11.035 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.682 11.096 -9.003 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.073 11.124 -9.663 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.018 11.389 -11.072 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -6.772 9.798 -10.811 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -6.306 9.676 -7.780 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -6.005 8.346 -8.924 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.704 8.904 -7.846 1.00 0.00 H new ATOM 278 N SER A 19 -0.598 9.179 -9.889 1.00 0.00 N ATOM 279 CA SER A 19 0.668 9.031 -10.661 1.00 0.00 C ATOM 280 C SER A 19 1.322 7.679 -10.334 1.00 0.00 C ATOM 281 O SER A 19 1.611 7.392 -9.188 1.00 0.00 O ATOM 282 CB SER A 19 1.637 10.160 -10.307 1.00 0.00 C ATOM 283 OG SER A 19 1.015 11.045 -9.383 1.00 0.00 O ATOM 0 H SER A 19 -0.502 9.603 -8.966 1.00 0.00 H new ATOM 0 HA SER A 19 0.436 9.078 -11.725 1.00 0.00 H new ATOM 0 HB2 SER A 19 2.550 9.749 -9.875 1.00 0.00 H new ATOM 0 HB3 SER A 19 1.926 10.702 -11.208 1.00 0.00 H new ATOM 0 HG SER A 19 1.636 11.768 -9.154 1.00 0.00 H new ATOM 289 N PRO A 20 1.562 6.856 -11.325 1.00 0.00 N ATOM 290 CA PRO A 20 2.203 5.529 -11.091 1.00 0.00 C ATOM 291 C PRO A 20 3.626 5.663 -10.528 1.00 0.00 C ATOM 292 O PRO A 20 4.332 6.603 -10.834 1.00 0.00 O ATOM 293 CB PRO A 20 2.236 4.920 -12.496 1.00 0.00 C ATOM 294 CG PRO A 20 1.637 5.926 -13.490 1.00 0.00 C ATOM 295 CD PRO A 20 1.211 7.181 -12.733 1.00 0.00 C ATOM 0 HA PRO A 20 1.665 4.929 -10.357 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.261 4.677 -12.777 1.00 0.00 H new ATOM 0 HB3 PRO A 20 1.671 3.988 -12.516 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.370 6.179 -14.256 1.00 0.00 H new ATOM 0 HG3 PRO A 20 0.781 5.486 -14.001 1.00 0.00 H new ATOM 0 HD2 PRO A 20 1.740 8.066 -13.087 1.00 0.00 H new ATOM 0 HD3 PRO A 20 0.145 7.380 -12.848 1.00 0.00 H new ATOM 303 N LYS A 21 4.058 4.729 -9.719 1.00 0.00 N ATOM 304 CA LYS A 21 5.440 4.818 -9.157 1.00 0.00 C ATOM 305 C LYS A 21 5.876 3.443 -8.637 1.00 0.00 C ATOM 306 O LYS A 21 5.190 2.827 -7.852 1.00 0.00 O ATOM 307 CB LYS A 21 5.459 5.825 -8.000 1.00 0.00 C ATOM 308 CG LYS A 21 5.471 7.260 -8.544 1.00 0.00 C ATOM 309 CD LYS A 21 6.043 8.205 -7.484 1.00 0.00 C ATOM 310 CE LYS A 21 6.006 9.641 -8.008 1.00 0.00 C ATOM 311 NZ LYS A 21 4.606 10.154 -7.958 1.00 0.00 N ATOM 0 H LYS A 21 3.519 3.915 -9.425 1.00 0.00 H new ATOM 0 HA LYS A 21 6.125 5.145 -9.939 1.00 0.00 H new ATOM 0 HB2 LYS A 21 4.585 5.677 -7.365 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.338 5.657 -7.377 1.00 0.00 H new ATOM 0 HG2 LYS A 21 6.071 7.310 -9.453 1.00 0.00 H new ATOM 0 HG3 LYS A 21 4.460 7.567 -8.812 1.00 0.00 H new ATOM 0 HD2 LYS A 21 5.465 8.128 -6.563 1.00 0.00 H new ATOM 0 HD3 LYS A 21 7.067 7.921 -7.243 1.00 0.00 H new ATOM 0 HE2 LYS A 21 6.658 10.275 -7.408 1.00 0.00 H new ATOM 0 HE3 LYS A 21 6.381 9.676 -9.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 4.584 11.136 -8.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 3.998 9.564 -8.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 4.258 10.119 -6.978 1.00 0.00 H new ATOM 325 N SER A 22 7.016 2.960 -9.057 1.00 0.00 N ATOM 326 CA SER A 22 7.488 1.630 -8.570 1.00 0.00 C ATOM 327 C SER A 22 7.351 1.573 -7.048 1.00 0.00 C ATOM 328 O SER A 22 7.498 2.568 -6.370 1.00 0.00 O ATOM 329 CB SER A 22 8.950 1.433 -8.963 1.00 0.00 C ATOM 330 OG SER A 22 9.076 1.545 -10.375 1.00 0.00 O ATOM 0 H SER A 22 7.640 3.428 -9.715 1.00 0.00 H new ATOM 0 HA SER A 22 6.886 0.840 -9.019 1.00 0.00 H new ATOM 0 HB2 SER A 22 9.575 2.178 -8.470 1.00 0.00 H new ATOM 0 HB3 SER A 22 9.299 0.455 -8.632 1.00 0.00 H new ATOM 0 HG SER A 22 8.619 0.792 -10.805 1.00 0.00 H new ATOM 336 N TRP A 23 7.076 0.421 -6.501 1.00 0.00 N ATOM 337 CA TRP A 23 6.941 0.327 -5.020 1.00 0.00 C ATOM 338 C TRP A 23 8.219 0.858 -4.384 1.00 0.00 C ATOM 339 O TRP A 23 8.236 1.282 -3.246 1.00 0.00 O ATOM 340 CB TRP A 23 6.738 -1.133 -4.608 1.00 0.00 C ATOM 341 CG TRP A 23 6.823 -1.246 -3.118 1.00 0.00 C ATOM 342 CD1 TRP A 23 5.762 -1.351 -2.285 1.00 0.00 C ATOM 343 CD2 TRP A 23 8.010 -1.268 -2.275 1.00 0.00 C ATOM 344 NE1 TRP A 23 6.223 -1.434 -0.983 1.00 0.00 N ATOM 345 CE2 TRP A 23 7.602 -1.388 -0.925 1.00 0.00 C ATOM 346 CE3 TRP A 23 9.389 -1.194 -2.547 1.00 0.00 C ATOM 347 CZ2 TRP A 23 8.528 -1.433 0.118 1.00 0.00 C ATOM 348 CZ3 TRP A 23 10.323 -1.240 -1.499 1.00 0.00 C ATOM 349 CH2 TRP A 23 9.893 -1.359 -0.169 1.00 0.00 C ATOM 0 H TRP A 23 6.940 -0.452 -7.010 1.00 0.00 H new ATOM 0 HA TRP A 23 6.082 0.911 -4.689 1.00 0.00 H new ATOM 0 HB2 TRP A 23 5.768 -1.489 -4.956 1.00 0.00 H new ATOM 0 HB3 TRP A 23 7.495 -1.763 -5.075 1.00 0.00 H new ATOM 0 HD1 TRP A 23 4.725 -1.367 -2.587 1.00 0.00 H new ATOM 0 HE1 TRP A 23 5.618 -1.519 -0.166 1.00 0.00 H new ATOM 0 HE3 TRP A 23 9.731 -1.101 -3.567 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 8.192 -1.524 1.140 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 11.379 -1.183 -1.718 1.00 0.00 H new ATOM 0 HH2 TRP A 23 10.617 -1.393 0.632 1.00 0.00 H new ATOM 360 N THR A 24 9.291 0.838 -5.119 1.00 0.00 N ATOM 361 CA THR A 24 10.586 1.337 -4.581 1.00 0.00 C ATOM 362 C THR A 24 10.726 2.822 -4.914 1.00 0.00 C ATOM 363 O THR A 24 11.507 3.539 -4.319 1.00 0.00 O ATOM 364 CB THR A 24 11.730 0.546 -5.219 1.00 0.00 C ATOM 365 OG1 THR A 24 12.935 0.797 -4.508 1.00 0.00 O ATOM 366 CG2 THR A 24 11.899 0.961 -6.679 1.00 0.00 C ATOM 0 H THR A 24 9.328 0.494 -6.079 1.00 0.00 H new ATOM 0 HA THR A 24 10.619 1.207 -3.499 1.00 0.00 H new ATOM 0 HB THR A 24 11.498 -0.518 -5.176 1.00 0.00 H new ATOM 0 HG1 THR A 24 13.667 0.289 -4.916 1.00 0.00 H new ATOM 0 HG21 THR A 24 12.715 0.394 -7.126 1.00 0.00 H new ATOM 0 HG22 THR A 24 10.976 0.760 -7.223 1.00 0.00 H new ATOM 0 HG23 THR A 24 12.126 2.026 -6.731 1.00 0.00 H new ATOM 374 N ASP A 25 9.966 3.279 -5.867 1.00 0.00 N ATOM 375 CA ASP A 25 10.029 4.715 -6.265 1.00 0.00 C ATOM 376 C ASP A 25 9.074 5.519 -5.391 1.00 0.00 C ATOM 377 O ASP A 25 9.393 6.604 -4.944 1.00 0.00 O ATOM 378 CB ASP A 25 9.622 4.867 -7.734 1.00 0.00 C ATOM 379 CG ASP A 25 10.781 4.437 -8.637 1.00 0.00 C ATOM 380 OD1 ASP A 25 11.919 4.604 -8.229 1.00 0.00 O ATOM 381 OD2 ASP A 25 10.511 3.951 -9.723 1.00 0.00 O ATOM 0 H ASP A 25 9.297 2.716 -6.393 1.00 0.00 H new ATOM 0 HA ASP A 25 11.047 5.081 -6.136 1.00 0.00 H new ATOM 0 HB2 ASP A 25 8.741 4.260 -7.942 1.00 0.00 H new ATOM 0 HB3 ASP A 25 9.351 5.902 -7.941 1.00 0.00 H new ATOM 386 N ALA A 26 7.912 4.993 -5.119 1.00 0.00 N ATOM 387 CA ALA A 26 6.964 5.722 -4.256 1.00 0.00 C ATOM 388 C ALA A 26 7.477 5.595 -2.831 1.00 0.00 C ATOM 389 O ALA A 26 7.316 6.474 -2.012 1.00 0.00 O ATOM 390 CB ALA A 26 5.583 5.091 -4.381 1.00 0.00 C ATOM 0 H ALA A 26 7.585 4.089 -5.461 1.00 0.00 H new ATOM 0 HA ALA A 26 6.886 6.771 -4.542 1.00 0.00 H new ATOM 0 HB1 ALA A 26 4.879 5.627 -3.744 1.00 0.00 H new ATOM 0 HB2 ALA A 26 5.250 5.147 -5.417 1.00 0.00 H new ATOM 0 HB3 ALA A 26 5.630 4.047 -4.071 1.00 0.00 H new ATOM 396 N ASP A 27 8.115 4.497 -2.546 1.00 0.00 N ATOM 397 CA ASP A 27 8.674 4.288 -1.193 1.00 0.00 C ATOM 398 C ASP A 27 9.765 5.329 -0.939 1.00 0.00 C ATOM 399 O ASP A 27 9.838 5.925 0.117 1.00 0.00 O ATOM 400 CB ASP A 27 9.279 2.888 -1.137 1.00 0.00 C ATOM 401 CG ASP A 27 10.029 2.700 0.182 1.00 0.00 C ATOM 402 OD1 ASP A 27 9.539 3.179 1.193 1.00 0.00 O ATOM 403 OD2 ASP A 27 11.081 2.082 0.162 1.00 0.00 O ATOM 0 H ASP A 27 8.272 3.731 -3.201 1.00 0.00 H new ATOM 0 HA ASP A 27 7.896 4.389 -0.436 1.00 0.00 H new ATOM 0 HB2 ASP A 27 8.493 2.138 -1.229 1.00 0.00 H new ATOM 0 HB3 ASP A 27 9.959 2.742 -1.976 1.00 0.00 H new ATOM 408 N LEU A 28 10.615 5.550 -1.903 1.00 0.00 N ATOM 409 CA LEU A 28 11.709 6.546 -1.727 1.00 0.00 C ATOM 410 C LEU A 28 11.126 7.963 -1.770 1.00 0.00 C ATOM 411 O LEU A 28 11.573 8.849 -1.068 1.00 0.00 O ATOM 412 CB LEU A 28 12.735 6.371 -2.858 1.00 0.00 C ATOM 413 CG LEU A 28 14.146 6.719 -2.361 1.00 0.00 C ATOM 414 CD1 LEU A 28 14.148 8.122 -1.745 1.00 0.00 C ATOM 415 CD2 LEU A 28 14.605 5.691 -1.312 1.00 0.00 C ATOM 0 H LEU A 28 10.599 5.082 -2.809 1.00 0.00 H new ATOM 0 HA LEU A 28 12.197 6.391 -0.765 1.00 0.00 H new ATOM 0 HB2 LEU A 28 12.714 5.343 -3.221 1.00 0.00 H new ATOM 0 HB3 LEU A 28 12.471 7.012 -3.699 1.00 0.00 H new ATOM 0 HG LEU A 28 14.834 6.696 -3.206 1.00 0.00 H new ATOM 0 HD11 LEU A 28 15.151 8.364 -1.394 1.00 0.00 H new ATOM 0 HD12 LEU A 28 13.841 8.850 -2.496 1.00 0.00 H new ATOM 0 HD13 LEU A 28 13.453 8.152 -0.906 1.00 0.00 H new ATOM 0 HD21 LEU A 28 15.607 5.947 -0.966 1.00 0.00 H new ATOM 0 HD22 LEU A 28 13.916 5.700 -0.468 1.00 0.00 H new ATOM 0 HD23 LEU A 28 14.618 4.697 -1.758 1.00 0.00 H new ATOM 427 N ALA A 29 10.141 8.189 -2.594 1.00 0.00 N ATOM 428 CA ALA A 29 9.543 9.552 -2.682 1.00 0.00 C ATOM 429 C ALA A 29 8.709 9.840 -1.435 1.00 0.00 C ATOM 430 O ALA A 29 8.946 10.800 -0.733 1.00 0.00 O ATOM 431 CB ALA A 29 8.648 9.639 -3.911 1.00 0.00 C ATOM 0 H ALA A 29 9.724 7.491 -3.210 1.00 0.00 H new ATOM 0 HA ALA A 29 10.346 10.285 -2.757 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.212 10.636 -3.974 1.00 0.00 H new ATOM 0 HB2 ALA A 29 9.239 9.445 -4.806 1.00 0.00 H new ATOM 0 HB3 ALA A 29 7.852 8.899 -3.834 1.00 0.00 H new ATOM 437 N CYS A 30 7.735 9.021 -1.147 1.00 0.00 N ATOM 438 CA CYS A 30 6.909 9.270 0.059 1.00 0.00 C ATOM 439 C CYS A 30 7.825 9.224 1.278 1.00 0.00 C ATOM 440 O CYS A 30 7.467 9.651 2.357 1.00 0.00 O ATOM 441 CB CYS A 30 5.824 8.199 0.174 1.00 0.00 C ATOM 442 SG CYS A 30 4.796 8.536 1.626 1.00 0.00 S ATOM 0 H CYS A 30 7.480 8.198 -1.692 1.00 0.00 H new ATOM 0 HA CYS A 30 6.424 10.244 -0.007 1.00 0.00 H new ATOM 0 HB2 CYS A 30 5.209 8.191 -0.726 1.00 0.00 H new ATOM 0 HB3 CYS A 30 6.279 7.212 0.258 1.00 0.00 H new ATOM 447 N GLN A 31 9.018 8.722 1.109 1.00 0.00 N ATOM 448 CA GLN A 31 9.966 8.669 2.251 1.00 0.00 C ATOM 449 C GLN A 31 10.609 10.045 2.412 1.00 0.00 C ATOM 450 O GLN A 31 10.951 10.459 3.502 1.00 0.00 O ATOM 451 CB GLN A 31 11.049 7.617 1.984 1.00 0.00 C ATOM 452 CG GLN A 31 12.223 7.825 2.946 1.00 0.00 C ATOM 453 CD GLN A 31 13.091 6.566 2.975 1.00 0.00 C ATOM 454 OE1 GLN A 31 12.592 5.473 3.151 1.00 0.00 O ATOM 455 NE2 GLN A 31 14.380 6.673 2.806 1.00 0.00 N ATOM 0 H GLN A 31 9.374 8.347 0.230 1.00 0.00 H new ATOM 0 HA GLN A 31 9.434 8.396 3.162 1.00 0.00 H new ATOM 0 HB2 GLN A 31 10.636 6.616 2.111 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.394 7.691 0.953 1.00 0.00 H new ATOM 0 HG2 GLN A 31 12.818 8.682 2.630 1.00 0.00 H new ATOM 0 HG3 GLN A 31 11.852 8.046 3.947 1.00 0.00 H new ATOM 0 HE21 GLN A 31 14.801 7.590 2.658 1.00 0.00 H new ATOM 0 HE22 GLN A 31 14.967 5.839 2.822 1.00 0.00 H new ATOM 464 N LYS A 32 10.771 10.762 1.332 1.00 0.00 N ATOM 465 CA LYS A 32 11.382 12.109 1.429 1.00 0.00 C ATOM 466 C LYS A 32 10.430 13.032 2.193 1.00 0.00 C ATOM 467 O LYS A 32 10.756 14.158 2.511 1.00 0.00 O ATOM 468 CB LYS A 32 11.650 12.661 0.017 1.00 0.00 C ATOM 469 CG LYS A 32 10.455 13.490 -0.470 1.00 0.00 C ATOM 470 CD LYS A 32 10.555 13.690 -1.983 1.00 0.00 C ATOM 471 CE LYS A 32 9.349 14.494 -2.473 1.00 0.00 C ATOM 472 NZ LYS A 32 9.301 15.801 -1.760 1.00 0.00 N ATOM 0 H LYS A 32 10.506 10.470 0.391 1.00 0.00 H new ATOM 0 HA LYS A 32 12.331 12.051 1.962 1.00 0.00 H new ATOM 0 HB2 LYS A 32 12.549 13.278 0.025 1.00 0.00 H new ATOM 0 HB3 LYS A 32 11.835 11.838 -0.673 1.00 0.00 H new ATOM 0 HG2 LYS A 32 9.522 12.984 -0.220 1.00 0.00 H new ATOM 0 HG3 LYS A 32 10.439 14.456 0.035 1.00 0.00 H new ATOM 0 HD2 LYS A 32 11.479 14.213 -2.231 1.00 0.00 H new ATOM 0 HD3 LYS A 32 10.590 12.724 -2.487 1.00 0.00 H new ATOM 0 HE2 LYS A 32 9.419 14.657 -3.548 1.00 0.00 H new ATOM 0 HE3 LYS A 32 8.430 13.936 -2.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 8.734 16.476 -2.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 8.869 15.670 -0.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 10.267 16.171 -1.648 1.00 0.00 H new ATOM 486 N ARG A 33 9.251 12.554 2.490 1.00 0.00 N ATOM 487 CA ARG A 33 8.265 13.387 3.234 1.00 0.00 C ATOM 488 C ARG A 33 8.596 13.346 4.728 1.00 0.00 C ATOM 489 O ARG A 33 9.276 12.451 5.187 1.00 0.00 O ATOM 490 CB ARG A 33 6.856 12.821 3.003 1.00 0.00 C ATOM 491 CG ARG A 33 6.178 13.546 1.833 1.00 0.00 C ATOM 492 CD ARG A 33 6.887 13.200 0.515 1.00 0.00 C ATOM 493 NE ARG A 33 5.869 12.914 -0.533 1.00 0.00 N ATOM 494 CZ ARG A 33 5.059 13.856 -0.933 1.00 0.00 C ATOM 495 NH1 ARG A 33 5.285 15.096 -0.598 1.00 0.00 N ATOM 496 NH2 ARG A 33 4.023 13.556 -1.669 1.00 0.00 N ATOM 0 H ARG A 33 8.928 11.617 2.247 1.00 0.00 H new ATOM 0 HA ARG A 33 8.307 14.418 2.882 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.915 11.753 2.793 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.258 12.935 3.907 1.00 0.00 H new ATOM 0 HG2 ARG A 33 5.128 13.259 1.776 1.00 0.00 H new ATOM 0 HG3 ARG A 33 6.205 14.623 1.998 1.00 0.00 H new ATOM 0 HD2 ARG A 33 7.523 14.028 0.203 1.00 0.00 H new ATOM 0 HD3 ARG A 33 7.535 12.335 0.654 1.00 0.00 H new ATOM 0 HE ARG A 33 5.804 11.981 -0.939 1.00 0.00 H new ATOM 0 HH11 ARG A 33 6.095 15.330 -0.023 1.00 0.00 H new ATOM 0 HH12 ARG A 33 4.652 15.832 -0.911 1.00 0.00 H new ATOM 0 HH21 ARG A 33 3.847 12.586 -1.931 1.00 0.00 H new ATOM 0 HH22 ARG A 33 3.390 14.292 -1.982 1.00 0.00 H new ATOM 510 N PRO A 34 8.110 14.300 5.488 1.00 0.00 N ATOM 511 CA PRO A 34 8.371 14.322 6.949 1.00 0.00 C ATOM 512 C PRO A 34 8.092 12.958 7.583 1.00 0.00 C ATOM 513 O PRO A 34 7.050 12.727 8.166 1.00 0.00 O ATOM 514 CB PRO A 34 7.393 15.400 7.444 1.00 0.00 C ATOM 515 CG PRO A 34 6.626 15.959 6.233 1.00 0.00 C ATOM 516 CD PRO A 34 7.271 15.407 4.958 1.00 0.00 C ATOM 0 HA PRO A 34 9.408 14.536 7.208 1.00 0.00 H new ATOM 0 HB2 PRO A 34 6.698 14.976 8.169 1.00 0.00 H new ATOM 0 HB3 PRO A 34 7.935 16.199 7.950 1.00 0.00 H new ATOM 0 HG2 PRO A 34 5.576 15.671 6.283 1.00 0.00 H new ATOM 0 HG3 PRO A 34 6.658 17.049 6.233 1.00 0.00 H new ATOM 0 HD2 PRO A 34 6.527 15.050 4.246 1.00 0.00 H new ATOM 0 HD3 PRO A 34 7.868 16.161 4.444 1.00 0.00 H new ATOM 524 N SER A 35 9.014 12.048 7.450 1.00 0.00 N ATOM 525 CA SER A 35 8.813 10.689 8.014 1.00 0.00 C ATOM 526 C SER A 35 7.693 9.993 7.243 1.00 0.00 C ATOM 527 O SER A 35 7.127 9.017 7.695 1.00 0.00 O ATOM 528 CB SER A 35 8.445 10.791 9.496 1.00 0.00 C ATOM 529 OG SER A 35 8.858 9.606 10.163 1.00 0.00 O ATOM 0 H SER A 35 9.904 12.190 6.971 1.00 0.00 H new ATOM 0 HA SER A 35 9.733 10.112 7.922 1.00 0.00 H new ATOM 0 HB2 SER A 35 8.926 11.661 9.943 1.00 0.00 H new ATOM 0 HB3 SER A 35 7.370 10.929 9.607 1.00 0.00 H new ATOM 0 HG SER A 35 8.626 9.667 11.113 1.00 0.00 H new ATOM 535 N GLY A 36 7.366 10.489 6.080 1.00 0.00 N ATOM 536 CA GLY A 36 6.280 9.856 5.285 1.00 0.00 C ATOM 537 C GLY A 36 6.779 8.549 4.660 1.00 0.00 C ATOM 538 O GLY A 36 7.904 8.138 4.861 1.00 0.00 O ATOM 0 H GLY A 36 7.804 11.303 5.649 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.419 9.658 5.924 1.00 0.00 H new ATOM 0 HA3 GLY A 36 5.946 10.538 4.503 1.00 0.00 H new ATOM 542 N ASN A 37 5.937 7.897 3.904 1.00 0.00 N ATOM 543 CA ASN A 37 6.320 6.611 3.245 1.00 0.00 C ATOM 544 C ASN A 37 5.035 5.925 2.765 1.00 0.00 C ATOM 545 O ASN A 37 3.994 6.065 3.380 1.00 0.00 O ATOM 546 CB ASN A 37 7.053 5.706 4.250 1.00 0.00 C ATOM 547 CG ASN A 37 8.558 5.714 3.960 1.00 0.00 C ATOM 548 OD1 ASN A 37 9.011 5.068 2.921 1.00 0.00 O flip ATOM 549 ND2 ASN A 37 9.326 6.310 4.688 1.00 0.00 N flip ATOM 0 H ASN A 37 4.984 8.205 3.711 1.00 0.00 H new ATOM 0 HA ASN A 37 6.986 6.800 2.403 1.00 0.00 H new ATOM 0 HB2 ASN A 37 6.868 6.053 5.267 1.00 0.00 H new ATOM 0 HB3 ASN A 37 6.667 4.689 4.185 1.00 0.00 H new ATOM 0 HD21 ASN A 37 8.971 6.815 5.500 1.00 0.00 H new ATOM 0 HD22 ASN A 37 10.326 6.306 4.487 1.00 0.00 H new ATOM 556 N LEU A 38 5.089 5.204 1.666 1.00 0.00 N ATOM 557 CA LEU A 38 3.862 4.521 1.143 1.00 0.00 C ATOM 558 C LEU A 38 2.843 4.305 2.273 1.00 0.00 C ATOM 559 O LEU A 38 3.183 3.893 3.364 1.00 0.00 O ATOM 560 CB LEU A 38 4.258 3.173 0.542 1.00 0.00 C ATOM 561 CG LEU A 38 4.964 3.401 -0.795 1.00 0.00 C ATOM 562 CD1 LEU A 38 5.682 2.119 -1.228 1.00 0.00 C ATOM 563 CD2 LEU A 38 3.937 3.800 -1.861 1.00 0.00 C ATOM 0 H LEU A 38 5.932 5.060 1.110 1.00 0.00 H new ATOM 0 HA LEU A 38 3.403 5.148 0.379 1.00 0.00 H new ATOM 0 HB2 LEU A 38 4.915 2.636 1.226 1.00 0.00 H new ATOM 0 HB3 LEU A 38 3.373 2.553 0.398 1.00 0.00 H new ATOM 0 HG LEU A 38 5.695 4.201 -0.681 1.00 0.00 H new ATOM 0 HD11 LEU A 38 6.183 2.287 -2.181 1.00 0.00 H new ATOM 0 HD12 LEU A 38 6.419 1.842 -0.474 1.00 0.00 H new ATOM 0 HD13 LEU A 38 4.955 1.314 -1.337 1.00 0.00 H new ATOM 0 HD21 LEU A 38 4.444 3.962 -2.812 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.201 3.004 -1.973 1.00 0.00 H new ATOM 0 HD23 LEU A 38 3.435 4.718 -1.557 1.00 0.00 H new ATOM 575 N VAL A 39 1.599 4.602 2.011 1.00 0.00 N ATOM 576 CA VAL A 39 0.533 4.451 3.049 1.00 0.00 C ATOM 577 C VAL A 39 0.776 3.223 3.934 1.00 0.00 C ATOM 578 O VAL A 39 1.394 2.257 3.533 1.00 0.00 O ATOM 579 CB VAL A 39 -0.822 4.313 2.354 1.00 0.00 C ATOM 580 CG1 VAL A 39 -0.718 3.289 1.223 1.00 0.00 C ATOM 581 CG2 VAL A 39 -1.881 3.849 3.359 1.00 0.00 C ATOM 0 H VAL A 39 1.269 4.948 1.110 1.00 0.00 H new ATOM 0 HA VAL A 39 0.550 5.334 3.688 1.00 0.00 H new ATOM 0 HB VAL A 39 -1.111 5.282 1.947 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -1.685 3.193 0.729 1.00 0.00 H new ATOM 0 HG12 VAL A 39 0.027 3.620 0.500 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.422 2.323 1.633 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -2.843 3.753 2.856 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -1.591 2.884 3.774 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -1.964 4.579 4.164 1.00 0.00 H new ATOM 591 N SER A 40 0.277 3.272 5.144 1.00 0.00 N ATOM 592 CA SER A 40 0.443 2.132 6.099 1.00 0.00 C ATOM 593 C SER A 40 -0.925 1.475 6.349 1.00 0.00 C ATOM 594 O SER A 40 -1.933 1.931 5.848 1.00 0.00 O ATOM 595 CB SER A 40 1.002 2.672 7.418 1.00 0.00 C ATOM 596 OG SER A 40 0.241 2.153 8.502 1.00 0.00 O ATOM 0 H SER A 40 -0.246 4.065 5.516 1.00 0.00 H new ATOM 0 HA SER A 40 1.127 1.392 5.684 1.00 0.00 H new ATOM 0 HB2 SER A 40 2.049 2.388 7.525 1.00 0.00 H new ATOM 0 HB3 SER A 40 0.965 3.761 7.422 1.00 0.00 H new ATOM 0 HG SER A 40 0.599 2.497 9.347 1.00 0.00 H new ATOM 602 N VAL A 41 -0.974 0.413 7.118 1.00 0.00 N ATOM 603 CA VAL A 41 -2.289 -0.251 7.385 1.00 0.00 C ATOM 604 C VAL A 41 -2.141 -1.250 8.546 1.00 0.00 C ATOM 605 O VAL A 41 -1.857 -2.412 8.341 1.00 0.00 O ATOM 606 CB VAL A 41 -2.786 -0.996 6.120 1.00 0.00 C ATOM 607 CG1 VAL A 41 -4.089 -0.365 5.623 1.00 0.00 C ATOM 608 CG2 VAL A 41 -1.743 -0.920 4.996 1.00 0.00 C ATOM 0 H VAL A 41 -0.168 -0.019 7.569 1.00 0.00 H new ATOM 0 HA VAL A 41 -3.018 0.514 7.653 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.951 -2.040 6.387 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.433 -0.893 4.734 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.848 -0.435 6.403 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -3.916 0.683 5.378 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -2.114 -1.450 4.119 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -1.560 0.123 4.739 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -0.813 -1.380 5.331 1.00 0.00 H new ATOM 618 N LEU A 42 -2.333 -0.805 9.766 1.00 0.00 N ATOM 619 CA LEU A 42 -2.205 -1.732 10.939 1.00 0.00 C ATOM 620 C LEU A 42 -3.556 -1.893 11.638 1.00 0.00 C ATOM 621 O LEU A 42 -3.627 -2.399 12.741 1.00 0.00 O ATOM 622 CB LEU A 42 -1.199 -1.163 11.939 1.00 0.00 C ATOM 623 CG LEU A 42 0.212 -1.274 11.368 1.00 0.00 C ATOM 624 CD1 LEU A 42 1.161 -0.406 12.199 1.00 0.00 C ATOM 625 CD2 LEU A 42 0.677 -2.729 11.427 1.00 0.00 C ATOM 0 H LEU A 42 -2.572 0.158 10.001 1.00 0.00 H new ATOM 0 HA LEU A 42 -1.865 -2.702 10.578 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.434 -0.120 12.153 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.264 -1.705 12.883 1.00 0.00 H new ATOM 0 HG LEU A 42 0.213 -0.935 10.332 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.171 -0.482 11.795 1.00 0.00 H new ATOM 0 HD12 LEU A 42 0.832 0.632 12.161 1.00 0.00 H new ATOM 0 HD13 LEU A 42 1.157 -0.750 13.233 1.00 0.00 H new ATOM 0 HD21 LEU A 42 1.685 -2.806 11.019 1.00 0.00 H new ATOM 0 HD22 LEU A 42 0.678 -3.069 12.463 1.00 0.00 H new ATOM 0 HD23 LEU A 42 0.000 -3.351 10.842 1.00 0.00 H new ATOM 637 N SER A 43 -4.627 -1.467 11.026 1.00 0.00 N ATOM 638 CA SER A 43 -5.959 -1.606 11.687 1.00 0.00 C ATOM 639 C SER A 43 -7.026 -1.958 10.651 1.00 0.00 C ATOM 640 O SER A 43 -6.956 -1.552 9.508 1.00 0.00 O ATOM 641 CB SER A 43 -6.327 -0.286 12.363 1.00 0.00 C ATOM 642 OG SER A 43 -6.864 0.605 11.395 1.00 0.00 O ATOM 0 H SER A 43 -4.640 -1.032 10.104 1.00 0.00 H new ATOM 0 HA SER A 43 -5.907 -2.402 12.430 1.00 0.00 H new ATOM 0 HB2 SER A 43 -7.054 -0.461 13.156 1.00 0.00 H new ATOM 0 HB3 SER A 43 -5.446 0.154 12.830 1.00 0.00 H new ATOM 0 HG SER A 43 -7.248 1.386 11.846 1.00 0.00 H new ATOM 648 N GLY A 44 -8.018 -2.709 11.047 1.00 0.00 N ATOM 649 CA GLY A 44 -9.098 -3.082 10.092 1.00 0.00 C ATOM 650 C GLY A 44 -9.830 -1.819 9.644 1.00 0.00 C ATOM 651 O GLY A 44 -10.540 -1.816 8.658 1.00 0.00 O ATOM 0 H GLY A 44 -8.126 -3.080 11.991 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -8.675 -3.597 9.229 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -9.796 -3.773 10.565 1.00 0.00 H new ATOM 655 N ALA A 45 -9.657 -0.743 10.360 1.00 0.00 N ATOM 656 CA ALA A 45 -10.332 0.528 9.978 1.00 0.00 C ATOM 657 C ALA A 45 -9.473 1.263 8.949 1.00 0.00 C ATOM 658 O ALA A 45 -9.978 1.917 8.059 1.00 0.00 O ATOM 659 CB ALA A 45 -10.507 1.406 11.218 1.00 0.00 C ATOM 0 H ALA A 45 -9.075 -0.689 11.196 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.310 0.309 9.550 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -11.001 2.336 10.938 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -11.115 0.879 11.954 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -9.530 1.629 11.647 1.00 0.00 H new ATOM 665 N GLU A 46 -8.178 1.160 9.066 1.00 0.00 N ATOM 666 CA GLU A 46 -7.284 1.853 8.096 1.00 0.00 C ATOM 667 C GLU A 46 -7.352 1.137 6.745 1.00 0.00 C ATOM 668 O GLU A 46 -7.379 1.759 5.706 1.00 0.00 O ATOM 669 CB GLU A 46 -5.845 1.829 8.618 1.00 0.00 C ATOM 670 CG GLU A 46 -5.673 2.897 9.702 1.00 0.00 C ATOM 671 CD GLU A 46 -5.513 4.270 9.047 1.00 0.00 C ATOM 672 OE1 GLU A 46 -6.518 4.838 8.651 1.00 0.00 O ATOM 673 OE2 GLU A 46 -4.387 4.733 8.952 1.00 0.00 O ATOM 0 H GLU A 46 -7.700 0.626 9.792 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.606 2.887 7.977 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.611 0.845 9.023 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -5.148 2.011 7.800 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -6.537 2.898 10.366 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -4.800 2.671 10.315 1.00 0.00 H new ATOM 680 N GLY A 47 -7.383 -0.167 6.752 1.00 0.00 N ATOM 681 CA GLY A 47 -7.454 -0.912 5.464 1.00 0.00 C ATOM 682 C GLY A 47 -8.765 -0.569 4.756 1.00 0.00 C ATOM 683 O GLY A 47 -8.840 -0.540 3.542 1.00 0.00 O ATOM 0 H GLY A 47 -7.362 -0.747 7.591 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.606 -0.650 4.831 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.396 -1.985 5.647 1.00 0.00 H new ATOM 687 N SER A 48 -9.797 -0.298 5.505 1.00 0.00 N ATOM 688 CA SER A 48 -11.102 0.056 4.882 1.00 0.00 C ATOM 689 C SER A 48 -11.107 1.549 4.555 1.00 0.00 C ATOM 690 O SER A 48 -11.706 1.984 3.592 1.00 0.00 O ATOM 691 CB SER A 48 -12.236 -0.258 5.858 1.00 0.00 C ATOM 692 OG SER A 48 -12.455 -1.663 5.887 1.00 0.00 O ATOM 0 H SER A 48 -9.793 -0.307 6.525 1.00 0.00 H new ATOM 0 HA SER A 48 -11.244 -0.522 3.969 1.00 0.00 H new ATOM 0 HB2 SER A 48 -11.984 0.103 6.855 1.00 0.00 H new ATOM 0 HB3 SER A 48 -13.147 0.258 5.553 1.00 0.00 H new ATOM 0 HG SER A 48 -13.180 -1.868 6.513 1.00 0.00 H new ATOM 698 N PHE A 49 -10.435 2.336 5.350 1.00 0.00 N ATOM 699 CA PHE A 49 -10.390 3.800 5.087 1.00 0.00 C ATOM 700 C PHE A 49 -9.551 4.055 3.836 1.00 0.00 C ATOM 701 O PHE A 49 -9.940 4.796 2.956 1.00 0.00 O ATOM 702 CB PHE A 49 -9.761 4.515 6.286 1.00 0.00 C ATOM 703 CG PHE A 49 -10.095 5.988 6.230 1.00 0.00 C ATOM 704 CD1 PHE A 49 -11.362 6.433 6.626 1.00 0.00 C ATOM 705 CD2 PHE A 49 -9.138 6.907 5.782 1.00 0.00 C ATOM 706 CE1 PHE A 49 -11.673 7.796 6.574 1.00 0.00 C ATOM 707 CE2 PHE A 49 -9.449 8.271 5.731 1.00 0.00 C ATOM 708 CZ PHE A 49 -10.717 8.715 6.127 1.00 0.00 C ATOM 0 H PHE A 49 -9.915 2.027 6.171 1.00 0.00 H new ATOM 0 HA PHE A 49 -11.400 4.180 4.934 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -10.132 4.083 7.215 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -8.680 4.376 6.279 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -12.100 5.724 6.972 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -8.161 6.564 5.476 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -12.651 8.139 6.879 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -8.711 8.981 5.386 1.00 0.00 H new ATOM 0 HZ PHE A 49 -10.957 9.767 6.087 1.00 0.00 H new ATOM 718 N VAL A 50 -8.402 3.439 3.744 1.00 0.00 N ATOM 719 CA VAL A 50 -7.548 3.642 2.542 1.00 0.00 C ATOM 720 C VAL A 50 -8.332 3.211 1.303 1.00 0.00 C ATOM 721 O VAL A 50 -8.314 3.871 0.284 1.00 0.00 O ATOM 722 CB VAL A 50 -6.273 2.805 2.659 1.00 0.00 C ATOM 723 CG1 VAL A 50 -5.468 2.919 1.363 1.00 0.00 C ATOM 724 CG2 VAL A 50 -5.431 3.325 3.827 1.00 0.00 C ATOM 0 H VAL A 50 -8.021 2.807 4.448 1.00 0.00 H new ATOM 0 HA VAL A 50 -7.272 4.694 2.462 1.00 0.00 H new ATOM 0 HB VAL A 50 -6.536 1.762 2.833 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -4.559 2.323 1.446 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -6.067 2.554 0.529 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -5.203 3.962 1.190 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.522 2.730 3.913 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.167 4.368 3.650 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -6.004 3.248 4.751 1.00 0.00 H new ATOM 734 N SER A 51 -9.027 2.107 1.387 1.00 0.00 N ATOM 735 CA SER A 51 -9.817 1.635 0.218 1.00 0.00 C ATOM 736 C SER A 51 -10.785 2.738 -0.215 1.00 0.00 C ATOM 737 O SER A 51 -10.984 2.975 -1.388 1.00 0.00 O ATOM 738 CB SER A 51 -10.609 0.387 0.607 1.00 0.00 C ATOM 739 OG SER A 51 -11.657 0.184 -0.331 1.00 0.00 O ATOM 0 H SER A 51 -9.080 1.514 2.215 1.00 0.00 H new ATOM 0 HA SER A 51 -9.144 1.394 -0.605 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.952 -0.482 0.629 1.00 0.00 H new ATOM 0 HB3 SER A 51 -11.020 0.501 1.610 1.00 0.00 H new ATOM 0 HG SER A 51 -11.747 -0.774 -0.519 1.00 0.00 H new ATOM 745 N SER A 52 -11.387 3.414 0.726 1.00 0.00 N ATOM 746 CA SER A 52 -12.342 4.502 0.372 1.00 0.00 C ATOM 747 C SER A 52 -11.569 5.712 -0.157 1.00 0.00 C ATOM 748 O SER A 52 -12.099 6.531 -0.882 1.00 0.00 O ATOM 749 CB SER A 52 -13.135 4.907 1.614 1.00 0.00 C ATOM 750 OG SER A 52 -13.811 6.131 1.362 1.00 0.00 O ATOM 0 H SER A 52 -11.258 3.259 1.726 1.00 0.00 H new ATOM 0 HA SER A 52 -13.027 4.146 -0.398 1.00 0.00 H new ATOM 0 HB2 SER A 52 -13.853 4.128 1.871 1.00 0.00 H new ATOM 0 HB3 SER A 52 -12.465 5.017 2.467 1.00 0.00 H new ATOM 0 HG SER A 52 -14.322 6.392 2.157 1.00 0.00 H new ATOM 756 N LEU A 53 -10.320 5.831 0.199 1.00 0.00 N ATOM 757 CA LEU A 53 -9.510 6.985 -0.279 1.00 0.00 C ATOM 758 C LEU A 53 -9.060 6.720 -1.717 1.00 0.00 C ATOM 759 O LEU A 53 -8.767 7.631 -2.464 1.00 0.00 O ATOM 760 CB LEU A 53 -8.286 7.145 0.638 1.00 0.00 C ATOM 761 CG LEU A 53 -7.165 7.919 -0.068 1.00 0.00 C ATOM 762 CD1 LEU A 53 -7.612 9.361 -0.325 1.00 0.00 C ATOM 763 CD2 LEU A 53 -5.923 7.934 0.826 1.00 0.00 C ATOM 0 H LEU A 53 -9.824 5.176 0.803 1.00 0.00 H new ATOM 0 HA LEU A 53 -10.102 7.900 -0.255 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.576 7.669 1.549 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -7.921 6.163 0.938 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.937 7.435 -1.017 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.812 9.906 -0.826 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -8.501 9.359 -0.956 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.841 9.845 0.624 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -5.123 8.483 0.329 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -6.162 8.419 1.773 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -5.598 6.911 1.014 1.00 0.00 H new ATOM 775 N VAL A 54 -8.987 5.475 -2.102 1.00 0.00 N ATOM 776 CA VAL A 54 -8.534 5.139 -3.482 1.00 0.00 C ATOM 777 C VAL A 54 -9.628 4.364 -4.222 1.00 0.00 C ATOM 778 O VAL A 54 -9.376 3.729 -5.223 1.00 0.00 O ATOM 779 CB VAL A 54 -7.253 4.305 -3.396 1.00 0.00 C ATOM 780 CG1 VAL A 54 -6.215 5.069 -2.572 1.00 0.00 C ATOM 781 CG2 VAL A 54 -7.544 2.963 -2.720 1.00 0.00 C ATOM 0 H VAL A 54 -9.223 4.673 -1.518 1.00 0.00 H new ATOM 0 HA VAL A 54 -8.332 6.056 -4.036 1.00 0.00 H new ATOM 0 HB VAL A 54 -6.874 4.123 -4.402 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.299 4.482 -2.506 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -6.000 6.024 -3.052 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -6.605 5.247 -1.570 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -6.626 2.377 -2.664 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -7.925 3.138 -1.714 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -8.288 2.417 -3.300 1.00 0.00 H new ATOM 791 N LYS A 55 -10.840 4.412 -3.739 1.00 0.00 N ATOM 792 CA LYS A 55 -11.947 3.679 -4.423 1.00 0.00 C ATOM 793 C LYS A 55 -12.251 4.355 -5.763 1.00 0.00 C ATOM 794 O LYS A 55 -12.700 3.725 -6.702 1.00 0.00 O ATOM 795 CB LYS A 55 -13.201 3.706 -3.546 1.00 0.00 C ATOM 796 CG LYS A 55 -14.298 2.854 -4.190 1.00 0.00 C ATOM 797 CD LYS A 55 -15.575 2.919 -3.342 1.00 0.00 C ATOM 798 CE LYS A 55 -15.534 1.835 -2.260 1.00 0.00 C ATOM 799 NZ LYS A 55 -15.858 0.514 -2.869 1.00 0.00 N ATOM 0 H LYS A 55 -11.113 4.926 -2.901 1.00 0.00 H new ATOM 0 HA LYS A 55 -11.646 2.645 -4.593 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -12.969 3.326 -2.551 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -13.549 4.732 -3.423 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -14.503 3.211 -5.199 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -13.963 1.821 -4.280 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -15.667 3.903 -2.881 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -16.451 2.781 -3.976 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -14.547 1.803 -1.799 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -16.247 2.068 -1.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -16.113 -0.161 -2.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -16.658 0.621 -3.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -15.030 0.158 -3.388 1.00 0.00 H new ATOM 896 N SER A 62 -6.631 -0.303 -11.576 1.00 0.00 N ATOM 897 CA SER A 62 -7.422 -1.170 -10.652 1.00 0.00 C ATOM 898 C SER A 62 -6.623 -1.445 -9.379 1.00 0.00 C ATOM 899 O SER A 62 -7.182 -1.597 -8.315 1.00 0.00 O ATOM 900 CB SER A 62 -7.728 -2.495 -11.357 1.00 0.00 C ATOM 901 OG SER A 62 -6.656 -2.820 -12.232 1.00 0.00 O ATOM 0 HA SER A 62 -8.350 -0.664 -10.385 1.00 0.00 H new ATOM 0 HB2 SER A 62 -7.866 -3.288 -10.622 1.00 0.00 H new ATOM 0 HB3 SER A 62 -8.659 -2.415 -11.918 1.00 0.00 H new ATOM 0 HG SER A 62 -6.171 -2.003 -12.473 1.00 0.00 H new ATOM 907 N TYR A 63 -5.325 -1.524 -9.473 1.00 0.00 N ATOM 908 CA TYR A 63 -4.518 -1.811 -8.250 1.00 0.00 C ATOM 909 C TYR A 63 -3.806 -0.547 -7.766 1.00 0.00 C ATOM 910 O TYR A 63 -3.690 0.432 -8.477 1.00 0.00 O ATOM 911 CB TYR A 63 -3.493 -2.898 -8.566 1.00 0.00 C ATOM 912 CG TYR A 63 -4.187 -4.239 -8.632 1.00 0.00 C ATOM 913 CD1 TYR A 63 -5.135 -4.487 -9.632 1.00 0.00 C ATOM 914 CD2 TYR A 63 -3.884 -5.233 -7.694 1.00 0.00 C ATOM 915 CE1 TYR A 63 -5.778 -5.729 -9.693 1.00 0.00 C ATOM 916 CE2 TYR A 63 -4.528 -6.475 -7.756 1.00 0.00 C ATOM 917 CZ TYR A 63 -5.475 -6.723 -8.756 1.00 0.00 C ATOM 918 OH TYR A 63 -6.110 -7.944 -8.818 1.00 0.00 O ATOM 0 H TYR A 63 -4.791 -1.404 -10.333 1.00 0.00 H new ATOM 0 HA TYR A 63 -5.184 -2.154 -7.458 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -3.000 -2.684 -9.515 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -2.717 -2.915 -7.801 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -5.370 -3.721 -10.356 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -3.153 -5.042 -6.922 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -6.509 -5.920 -10.465 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -4.294 -7.241 -7.032 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.783 -8.520 -8.095 1.00 0.00 H new ATOM 928 N VAL A 64 -3.346 -0.564 -6.542 1.00 0.00 N ATOM 929 CA VAL A 64 -2.655 0.629 -5.970 1.00 0.00 C ATOM 930 C VAL A 64 -1.461 0.158 -5.127 1.00 0.00 C ATOM 931 O VAL A 64 -1.531 -0.840 -4.444 1.00 0.00 O ATOM 932 CB VAL A 64 -3.666 1.386 -5.097 1.00 0.00 C ATOM 933 CG1 VAL A 64 -3.020 2.610 -4.445 1.00 0.00 C ATOM 934 CG2 VAL A 64 -4.842 1.839 -5.967 1.00 0.00 C ATOM 0 H VAL A 64 -3.420 -1.360 -5.909 1.00 0.00 H new ATOM 0 HA VAL A 64 -2.286 1.286 -6.757 1.00 0.00 H new ATOM 0 HB VAL A 64 -4.013 0.718 -4.309 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -3.758 3.128 -3.832 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.187 2.291 -3.818 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -2.654 3.284 -5.219 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -5.563 2.377 -5.352 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -4.478 2.495 -6.758 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.323 0.967 -6.411 1.00 0.00 H new ATOM 944 N TRP A 65 -0.359 0.861 -5.176 1.00 0.00 N ATOM 945 CA TRP A 65 0.833 0.432 -4.381 1.00 0.00 C ATOM 946 C TRP A 65 0.675 0.881 -2.923 1.00 0.00 C ATOM 947 O TRP A 65 0.113 1.921 -2.644 1.00 0.00 O ATOM 948 CB TRP A 65 2.100 1.101 -4.943 1.00 0.00 C ATOM 949 CG TRP A 65 2.903 0.177 -5.816 1.00 0.00 C ATOM 950 CD1 TRP A 65 3.563 0.586 -6.920 1.00 0.00 C ATOM 951 CD2 TRP A 65 3.171 -1.258 -5.692 1.00 0.00 C ATOM 952 NE1 TRP A 65 4.213 -0.489 -7.487 1.00 0.00 N ATOM 953 CE2 TRP A 65 3.999 -1.648 -6.774 1.00 0.00 C ATOM 954 CE3 TRP A 65 2.786 -2.252 -4.770 1.00 0.00 C ATOM 955 CZ2 TRP A 65 4.425 -2.963 -6.936 1.00 0.00 C ATOM 956 CZ3 TRP A 65 3.216 -3.580 -4.935 1.00 0.00 C ATOM 957 CH2 TRP A 65 4.031 -3.933 -6.016 1.00 0.00 C ATOM 0 H TRP A 65 -0.232 1.709 -5.728 1.00 0.00 H new ATOM 0 HA TRP A 65 0.915 -0.653 -4.439 1.00 0.00 H new ATOM 0 HB2 TRP A 65 1.816 1.983 -5.518 1.00 0.00 H new ATOM 0 HB3 TRP A 65 2.722 1.446 -4.117 1.00 0.00 H new ATOM 0 HD1 TRP A 65 3.579 1.597 -7.300 1.00 0.00 H new ATOM 0 HE1 TRP A 65 4.783 -0.433 -8.331 1.00 0.00 H new ATOM 0 HE3 TRP A 65 2.157 -1.992 -3.932 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 5.057 -3.230 -7.770 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 2.915 -4.333 -4.222 1.00 0.00 H new ATOM 0 HH2 TRP A 65 4.355 -4.956 -6.137 1.00 0.00 H new ATOM 968 N ILE A 66 1.207 0.126 -1.994 1.00 0.00 N ATOM 969 CA ILE A 66 1.131 0.538 -0.564 1.00 0.00 C ATOM 970 C ILE A 66 2.482 0.242 0.090 1.00 0.00 C ATOM 971 O ILE A 66 3.360 -0.337 -0.519 1.00 0.00 O ATOM 972 CB ILE A 66 0.023 -0.226 0.168 1.00 0.00 C ATOM 973 CG1 ILE A 66 0.207 -1.730 -0.022 1.00 0.00 C ATOM 974 CG2 ILE A 66 -1.338 0.189 -0.391 1.00 0.00 C ATOM 975 CD1 ILE A 66 -0.963 -2.468 0.637 1.00 0.00 C ATOM 0 H ILE A 66 1.689 -0.756 -2.166 1.00 0.00 H new ATOM 0 HA ILE A 66 0.899 1.601 -0.504 1.00 0.00 H new ATOM 0 HB ILE A 66 0.074 0.010 1.231 1.00 0.00 H new ATOM 0 HG12 ILE A 66 0.253 -1.972 -1.084 1.00 0.00 H new ATOM 0 HG13 ILE A 66 1.150 -2.052 0.419 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.126 -0.355 0.130 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.479 1.260 -0.247 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.380 -0.042 -1.455 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -0.837 -3.542 0.504 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -0.987 -2.234 1.701 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -1.899 -2.153 0.175 1.00 0.00 H new ATOM 987 N GLY A 67 2.670 0.647 1.315 1.00 0.00 N ATOM 988 CA GLY A 67 3.970 0.407 1.987 1.00 0.00 C ATOM 989 C GLY A 67 4.006 -0.993 2.579 1.00 0.00 C ATOM 990 O GLY A 67 4.202 -1.166 3.758 1.00 0.00 O ATOM 0 H GLY A 67 1.974 1.135 1.879 1.00 0.00 H new ATOM 0 HA2 GLY A 67 4.784 0.529 1.273 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.123 1.146 2.773 1.00 0.00 H new ATOM 994 N LEU A 68 3.835 -1.996 1.767 1.00 0.00 N ATOM 995 CA LEU A 68 3.891 -3.394 2.286 1.00 0.00 C ATOM 996 C LEU A 68 4.871 -4.196 1.429 1.00 0.00 C ATOM 997 O LEU A 68 4.763 -4.235 0.219 1.00 0.00 O ATOM 998 CB LEU A 68 2.504 -4.042 2.216 1.00 0.00 C ATOM 999 CG LEU A 68 2.370 -5.183 3.250 1.00 0.00 C ATOM 1000 CD1 LEU A 68 3.688 -5.949 3.420 1.00 0.00 C ATOM 1001 CD2 LEU A 68 1.961 -4.605 4.601 1.00 0.00 C ATOM 0 H LEU A 68 3.659 -1.911 0.766 1.00 0.00 H new ATOM 0 HA LEU A 68 4.220 -3.383 3.325 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.738 -3.289 2.400 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.332 -4.434 1.213 1.00 0.00 H new ATOM 0 HG LEU A 68 1.611 -5.874 2.883 1.00 0.00 H new ATOM 0 HD11 LEU A 68 3.555 -6.743 4.155 1.00 0.00 H new ATOM 0 HD12 LEU A 68 3.982 -6.384 2.465 1.00 0.00 H new ATOM 0 HD13 LEU A 68 4.465 -5.265 3.762 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.867 -5.411 5.328 1.00 0.00 H new ATOM 0 HD22 LEU A 68 2.719 -3.898 4.939 1.00 0.00 H new ATOM 0 HD23 LEU A 68 1.004 -4.092 4.503 1.00 0.00 H new ATOM 1013 N HIS A 69 5.824 -4.843 2.045 1.00 0.00 N ATOM 1014 CA HIS A 69 6.806 -5.647 1.265 1.00 0.00 C ATOM 1015 C HIS A 69 7.106 -6.945 2.001 1.00 0.00 C ATOM 1016 O HIS A 69 6.571 -7.223 3.055 1.00 0.00 O ATOM 1017 CB HIS A 69 8.102 -4.856 1.093 1.00 0.00 C ATOM 1018 CG HIS A 69 8.770 -4.724 2.429 1.00 0.00 C ATOM 1019 ND1 HIS A 69 8.422 -4.022 3.548 1.00 0.00 N flip ATOM 1020 CD2 HIS A 69 9.939 -5.396 2.750 1.00 0.00 C flip ATOM 1021 CE1 HIS A 69 9.352 -4.247 4.556 1.00 0.00 C flip ATOM 1022 NE2 HIS A 69 10.247 -5.083 4.022 1.00 0.00 N flip ATOM 0 H HIS A 69 5.964 -4.849 3.055 1.00 0.00 H new ATOM 0 HA HIS A 69 6.383 -5.871 0.286 1.00 0.00 H new ATOM 0 HB2 HIS A 69 8.763 -5.363 0.389 1.00 0.00 H new ATOM 0 HB3 HIS A 69 7.890 -3.871 0.678 1.00 0.00 H new ATOM 0 HD1 HIS A 69 7.601 -3.422 3.631 1.00 0.00 H new ATOM 0 HD2 HIS A 69 10.500 -6.050 2.099 1.00 0.00 H new ATOM 0 HE1 HIS A 69 9.351 -3.835 5.554 1.00 0.00 H new ATOM 1180 N TRP A 82 5.684 -10.350 5.492 1.00 0.00 N ATOM 1181 CA TRP A 82 4.900 -9.123 5.162 1.00 0.00 C ATOM 1182 C TRP A 82 5.110 -8.054 6.246 1.00 0.00 C ATOM 1183 O TRP A 82 4.561 -8.138 7.326 1.00 0.00 O ATOM 1184 CB TRP A 82 3.401 -9.463 5.059 1.00 0.00 C ATOM 1185 CG TRP A 82 3.189 -10.948 5.040 1.00 0.00 C ATOM 1186 CD1 TRP A 82 3.923 -11.837 4.330 1.00 0.00 C ATOM 1187 CD2 TRP A 82 2.178 -11.724 5.745 1.00 0.00 C ATOM 1188 NE1 TRP A 82 3.430 -13.109 4.562 1.00 0.00 N ATOM 1189 CE2 TRP A 82 2.352 -13.091 5.425 1.00 0.00 C ATOM 1190 CE3 TRP A 82 1.136 -11.375 6.622 1.00 0.00 C ATOM 1191 CZ2 TRP A 82 1.523 -14.078 5.959 1.00 0.00 C ATOM 1192 CZ3 TRP A 82 0.299 -12.366 7.162 1.00 0.00 C ATOM 1193 CH2 TRP A 82 0.492 -13.715 6.830 1.00 0.00 C ATOM 0 HA TRP A 82 5.247 -8.736 4.204 1.00 0.00 H new ATOM 0 HB2 TRP A 82 2.866 -9.026 5.902 1.00 0.00 H new ATOM 0 HB3 TRP A 82 2.985 -9.021 4.154 1.00 0.00 H new ATOM 0 HD1 TRP A 82 4.757 -11.593 3.688 1.00 0.00 H new ATOM 0 HE1 TRP A 82 3.816 -13.957 4.146 1.00 0.00 H new ATOM 0 HE3 TRP A 82 0.978 -10.339 6.882 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 1.677 -15.115 5.701 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 -0.497 -12.087 7.836 1.00 0.00 H new ATOM 0 HH2 TRP A 82 -0.155 -14.472 7.247 1.00 0.00 H new ATOM 1204 N GLU A 83 5.886 -7.038 5.953 1.00 0.00 N ATOM 1205 CA GLU A 83 6.118 -5.949 6.949 1.00 0.00 C ATOM 1206 C GLU A 83 5.817 -4.609 6.275 1.00 0.00 C ATOM 1207 O GLU A 83 6.110 -4.411 5.114 1.00 0.00 O ATOM 1208 CB GLU A 83 7.577 -5.977 7.421 1.00 0.00 C ATOM 1209 CG GLU A 83 7.970 -4.608 7.988 1.00 0.00 C ATOM 1210 CD GLU A 83 9.228 -4.751 8.847 1.00 0.00 C ATOM 1211 OE1 GLU A 83 9.861 -5.791 8.767 1.00 0.00 O ATOM 1212 OE2 GLU A 83 9.537 -3.818 9.569 1.00 0.00 O ATOM 0 H GLU A 83 6.370 -6.917 5.063 1.00 0.00 H new ATOM 0 HA GLU A 83 5.470 -6.088 7.814 1.00 0.00 H new ATOM 0 HB2 GLU A 83 7.707 -6.746 8.182 1.00 0.00 H new ATOM 0 HB3 GLU A 83 8.232 -6.237 6.590 1.00 0.00 H new ATOM 0 HG2 GLU A 83 8.150 -3.904 7.175 1.00 0.00 H new ATOM 0 HG3 GLU A 83 7.153 -4.202 8.585 1.00 0.00 H new ATOM 1219 N TRP A 84 5.231 -3.688 6.986 1.00 0.00 N ATOM 1220 CA TRP A 84 4.910 -2.377 6.377 1.00 0.00 C ATOM 1221 C TRP A 84 6.161 -1.508 6.351 1.00 0.00 C ATOM 1222 O TRP A 84 6.870 -1.391 7.331 1.00 0.00 O ATOM 1223 CB TRP A 84 3.827 -1.681 7.205 1.00 0.00 C ATOM 1224 CG TRP A 84 3.059 -2.704 7.975 1.00 0.00 C ATOM 1225 CD1 TRP A 84 3.493 -3.309 9.105 1.00 0.00 C ATOM 1226 CD2 TRP A 84 1.744 -3.256 7.695 1.00 0.00 C ATOM 1227 NE1 TRP A 84 2.527 -4.198 9.532 1.00 0.00 N ATOM 1228 CE2 TRP A 84 1.428 -4.203 8.697 1.00 0.00 C ATOM 1229 CE3 TRP A 84 0.803 -3.030 6.680 1.00 0.00 C ATOM 1230 CZ2 TRP A 84 0.222 -4.902 8.690 1.00 0.00 C ATOM 1231 CZ3 TRP A 84 -0.416 -3.732 6.667 1.00 0.00 C ATOM 1232 CH2 TRP A 84 -0.705 -4.666 7.672 1.00 0.00 C ATOM 0 H TRP A 84 4.961 -3.791 7.964 1.00 0.00 H new ATOM 0 HA TRP A 84 4.550 -2.529 5.359 1.00 0.00 H new ATOM 0 HB2 TRP A 84 4.281 -0.961 7.887 1.00 0.00 H new ATOM 0 HB3 TRP A 84 3.157 -1.122 6.552 1.00 0.00 H new ATOM 0 HD1 TRP A 84 4.439 -3.126 9.592 1.00 0.00 H new ATOM 0 HE1 TRP A 84 2.615 -4.781 10.364 1.00 0.00 H new ATOM 0 HE3 TRP A 84 1.016 -2.311 5.902 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 0.006 -5.621 9.466 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -1.132 -3.551 5.879 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -1.643 -5.202 7.659 1.00 0.00 H new ATOM 1243 N SER A 85 6.429 -0.883 5.244 1.00 0.00 N ATOM 1244 CA SER A 85 7.622 -0.008 5.168 1.00 0.00 C ATOM 1245 C SER A 85 7.237 1.370 5.689 1.00 0.00 C ATOM 1246 O SER A 85 8.033 2.287 5.713 1.00 0.00 O ATOM 1247 CB SER A 85 8.103 0.097 3.720 1.00 0.00 C ATOM 1248 OG SER A 85 7.040 0.577 2.907 1.00 0.00 O ATOM 0 H SER A 85 5.874 -0.941 4.390 1.00 0.00 H new ATOM 0 HA SER A 85 8.430 -0.424 5.769 1.00 0.00 H new ATOM 0 HB2 SER A 85 8.958 0.770 3.656 1.00 0.00 H new ATOM 0 HB3 SER A 85 8.437 -0.877 3.364 1.00 0.00 H new ATOM 0 HG SER A 85 7.345 0.647 1.978 1.00 0.00 H new ATOM 1288 N VAL A 89 5.440 -3.292 12.163 1.00 0.00 N ATOM 1289 CA VAL A 89 5.479 -4.777 12.017 1.00 0.00 C ATOM 1290 C VAL A 89 4.088 -5.293 11.651 1.00 0.00 C ATOM 1291 O VAL A 89 3.097 -4.612 11.822 1.00 0.00 O ATOM 1292 CB VAL A 89 5.923 -5.405 13.339 1.00 0.00 C ATOM 1293 CG1 VAL A 89 4.873 -5.122 14.416 1.00 0.00 C ATOM 1294 CG2 VAL A 89 6.073 -6.918 13.160 1.00 0.00 C ATOM 0 HA VAL A 89 6.183 -5.046 11.229 1.00 0.00 H new ATOM 0 HB VAL A 89 6.879 -4.977 13.641 1.00 0.00 H new ATOM 0 HG11 VAL A 89 5.189 -5.569 15.358 1.00 0.00 H new ATOM 0 HG12 VAL A 89 4.764 -4.045 14.544 1.00 0.00 H new ATOM 0 HG13 VAL A 89 3.917 -5.550 14.114 1.00 0.00 H new ATOM 0 HG21 VAL A 89 6.389 -7.366 14.102 1.00 0.00 H new ATOM 0 HG22 VAL A 89 5.117 -7.345 12.858 1.00 0.00 H new ATOM 0 HG23 VAL A 89 6.820 -7.121 12.392 1.00 0.00 H new ATOM 1304 N MET A 90 4.011 -6.491 11.147 1.00 0.00 N ATOM 1305 CA MET A 90 2.690 -7.061 10.761 1.00 0.00 C ATOM 1306 C MET A 90 1.778 -7.158 11.986 1.00 0.00 C ATOM 1307 O MET A 90 1.718 -8.181 12.639 1.00 0.00 O ATOM 1308 CB MET A 90 2.899 -8.460 10.177 1.00 0.00 C ATOM 1309 CG MET A 90 1.652 -8.891 9.396 1.00 0.00 C ATOM 1310 SD MET A 90 1.473 -10.691 9.484 1.00 0.00 S ATOM 1311 CE MET A 90 1.003 -10.804 11.229 1.00 0.00 C ATOM 0 H MET A 90 4.810 -7.104 10.985 1.00 0.00 H new ATOM 0 HA MET A 90 2.223 -6.411 10.021 1.00 0.00 H new ATOM 0 HB2 MET A 90 3.769 -8.463 9.520 1.00 0.00 H new ATOM 0 HB3 MET A 90 3.101 -9.171 10.978 1.00 0.00 H new ATOM 0 HG2 MET A 90 0.767 -8.407 9.808 1.00 0.00 H new ATOM 0 HG3 MET A 90 1.734 -8.574 8.356 1.00 0.00 H new ATOM 0 HE1 MET A 90 0.461 -11.734 11.400 1.00 0.00 H new ATOM 0 HE2 MET A 90 1.899 -10.787 11.849 1.00 0.00 H new ATOM 0 HE3 MET A 90 0.366 -9.959 11.490 1.00 0.00 H new ATOM 1321 N ASN A 91 1.048 -6.115 12.296 1.00 0.00 N ATOM 1322 CA ASN A 91 0.124 -6.179 13.464 1.00 0.00 C ATOM 1323 C ASN A 91 -1.297 -6.334 12.929 1.00 0.00 C ATOM 1324 O ASN A 91 -2.241 -6.514 13.673 1.00 0.00 O ATOM 1325 CB ASN A 91 0.237 -4.896 14.301 1.00 0.00 C ATOM 1326 CG ASN A 91 0.114 -5.237 15.789 1.00 0.00 C ATOM 1327 OD1 ASN A 91 -0.524 -6.206 16.151 1.00 0.00 O ATOM 1328 ND2 ASN A 91 0.702 -4.476 16.672 1.00 0.00 N ATOM 0 H ASN A 91 1.053 -5.228 11.792 1.00 0.00 H new ATOM 0 HA ASN A 91 0.382 -7.023 14.104 1.00 0.00 H new ATOM 0 HB2 ASN A 91 1.192 -4.407 14.108 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -0.545 -4.193 14.013 1.00 0.00 H new ATOM 0 HD21 ASN A 91 0.626 -4.695 17.665 1.00 0.00 H new ATOM 0 HD22 ASN A 91 1.238 -3.663 16.368 1.00 0.00 H new ATOM 1335 N TYR A 92 -1.444 -6.278 11.630 1.00 0.00 N ATOM 1336 CA TYR A 92 -2.789 -6.432 11.013 1.00 0.00 C ATOM 1337 C TYR A 92 -2.694 -7.426 9.851 1.00 0.00 C ATOM 1338 O TYR A 92 -1.640 -7.615 9.277 1.00 0.00 O ATOM 1339 CB TYR A 92 -3.280 -5.080 10.497 1.00 0.00 C ATOM 1340 CG TYR A 92 -4.641 -5.240 9.854 1.00 0.00 C ATOM 1341 CD1 TYR A 92 -5.701 -5.805 10.578 1.00 0.00 C ATOM 1342 CD2 TYR A 92 -4.842 -4.827 8.531 1.00 0.00 C ATOM 1343 CE1 TYR A 92 -6.956 -5.957 9.979 1.00 0.00 C ATOM 1344 CE2 TYR A 92 -6.100 -4.978 7.933 1.00 0.00 C ATOM 1345 CZ TYR A 92 -7.155 -5.544 8.656 1.00 0.00 C ATOM 1346 OH TYR A 92 -8.393 -5.694 8.066 1.00 0.00 O ATOM 0 H TYR A 92 -0.682 -6.131 10.968 1.00 0.00 H new ATOM 0 HA TYR A 92 -3.493 -6.803 11.757 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -3.338 -4.366 11.319 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -2.571 -4.677 9.774 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -5.548 -6.123 11.599 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -4.027 -4.392 7.972 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -7.771 -6.393 10.537 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -6.255 -4.657 6.913 1.00 0.00 H new ATOM 0 HH TYR A 92 -8.360 -5.356 7.147 1.00 0.00 H new ATOM 1356 N PHE A 93 -3.779 -8.069 9.503 1.00 0.00 N ATOM 1357 CA PHE A 93 -3.738 -9.057 8.380 1.00 0.00 C ATOM 1358 C PHE A 93 -4.941 -8.850 7.456 1.00 0.00 C ATOM 1359 O PHE A 93 -6.041 -8.589 7.902 1.00 0.00 O ATOM 1360 CB PHE A 93 -3.778 -10.474 8.954 1.00 0.00 C ATOM 1361 CG PHE A 93 -4.928 -10.593 9.924 1.00 0.00 C ATOM 1362 CD1 PHE A 93 -4.789 -10.126 11.236 1.00 0.00 C ATOM 1363 CD2 PHE A 93 -6.136 -11.170 9.511 1.00 0.00 C ATOM 1364 CE1 PHE A 93 -5.856 -10.236 12.136 1.00 0.00 C ATOM 1365 CE2 PHE A 93 -7.203 -11.280 10.411 1.00 0.00 C ATOM 1366 CZ PHE A 93 -7.063 -10.813 11.723 1.00 0.00 C ATOM 0 H PHE A 93 -4.690 -7.954 9.946 1.00 0.00 H new ATOM 0 HA PHE A 93 -2.821 -8.914 7.809 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.891 -11.201 8.149 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -2.838 -10.700 9.458 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -3.858 -9.680 11.554 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -6.244 -11.530 8.499 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -5.748 -9.876 13.148 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -8.134 -11.725 10.093 1.00 0.00 H new ATOM 0 HZ PHE A 93 -7.886 -10.898 12.417 1.00 0.00 H new ATOM 1376 N ALA A 94 -4.742 -8.971 6.169 1.00 0.00 N ATOM 1377 CA ALA A 94 -5.874 -8.791 5.215 1.00 0.00 C ATOM 1378 C ALA A 94 -5.415 -9.144 3.794 1.00 0.00 C ATOM 1379 O ALA A 94 -5.967 -8.675 2.819 1.00 0.00 O ATOM 1380 CB ALA A 94 -6.350 -7.333 5.254 1.00 0.00 C ATOM 0 H ALA A 94 -3.843 -9.187 5.738 1.00 0.00 H new ATOM 0 HA ALA A 94 -6.695 -9.449 5.501 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -7.177 -7.202 4.557 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -6.682 -7.086 6.262 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.529 -6.674 4.971 1.00 0.00 H new ATOM 1386 N TRP A 95 -4.410 -9.970 3.669 1.00 0.00 N ATOM 1387 CA TRP A 95 -3.922 -10.349 2.312 1.00 0.00 C ATOM 1388 C TRP A 95 -4.966 -11.232 1.621 1.00 0.00 C ATOM 1389 O TRP A 95 -5.767 -11.882 2.264 1.00 0.00 O ATOM 1390 CB TRP A 95 -2.603 -11.117 2.441 1.00 0.00 C ATOM 1391 CG TRP A 95 -2.642 -11.973 3.668 1.00 0.00 C ATOM 1392 CD1 TRP A 95 -2.040 -11.674 4.842 1.00 0.00 C ATOM 1393 CD2 TRP A 95 -3.303 -13.257 3.860 1.00 0.00 C ATOM 1394 NE1 TRP A 95 -2.290 -12.693 5.743 1.00 0.00 N ATOM 1395 CE2 TRP A 95 -3.064 -13.691 5.186 1.00 0.00 C ATOM 1396 CE3 TRP A 95 -4.078 -14.079 3.023 1.00 0.00 C ATOM 1397 CZ2 TRP A 95 -3.577 -14.898 5.664 1.00 0.00 C ATOM 1398 CZ3 TRP A 95 -4.595 -15.294 3.501 1.00 0.00 C ATOM 1399 CH2 TRP A 95 -4.346 -15.703 4.818 1.00 0.00 C ATOM 0 H TRP A 95 -3.907 -10.398 4.447 1.00 0.00 H new ATOM 0 HA TRP A 95 -3.761 -9.449 1.718 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -2.442 -11.736 1.558 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -1.768 -10.419 2.498 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -1.460 -10.786 5.043 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -1.944 -12.706 6.703 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -4.277 -13.774 2.006 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -3.381 -15.208 6.680 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -5.189 -15.918 2.849 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -4.747 -16.638 5.179 1.00 0.00 H new ATOM 1410 N GLU A 96 -4.962 -11.260 0.315 1.00 0.00 N ATOM 1411 CA GLU A 96 -5.952 -12.100 -0.416 1.00 0.00 C ATOM 1412 C GLU A 96 -5.598 -13.579 -0.230 1.00 0.00 C ATOM 1413 O GLU A 96 -6.442 -14.396 0.083 1.00 0.00 O ATOM 1414 CB GLU A 96 -5.920 -11.743 -1.908 1.00 0.00 C ATOM 1415 CG GLU A 96 -7.308 -11.953 -2.521 1.00 0.00 C ATOM 1416 CD GLU A 96 -7.725 -13.414 -2.358 1.00 0.00 C ATOM 1417 OE1 GLU A 96 -8.242 -13.748 -1.303 1.00 0.00 O ATOM 1418 OE2 GLU A 96 -7.524 -14.175 -3.290 1.00 0.00 O ATOM 0 H GLU A 96 -4.316 -10.737 -0.276 1.00 0.00 H new ATOM 0 HA GLU A 96 -6.952 -11.916 -0.023 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -5.608 -10.706 -2.037 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -5.187 -12.363 -2.424 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -8.034 -11.301 -2.035 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -7.295 -11.684 -3.577 1.00 0.00 H new ATOM 1564 N HIS A 107 7.731 -9.245 -3.977 1.00 0.00 N ATOM 1565 CA HIS A 107 8.200 -8.756 -2.645 1.00 0.00 C ATOM 1566 C HIS A 107 7.495 -7.439 -2.306 1.00 0.00 C ATOM 1567 O HIS A 107 7.981 -6.648 -1.524 1.00 0.00 O ATOM 1568 CB HIS A 107 9.720 -8.541 -2.683 1.00 0.00 C ATOM 1569 CG HIS A 107 10.343 -9.526 -3.634 1.00 0.00 C ATOM 1570 ND1 HIS A 107 10.340 -9.609 -5.002 1.00 0.00 N flip ATOM 1571 CD2 HIS A 107 11.090 -10.605 -3.196 1.00 0.00 C flip ATOM 1572 CE1 HIS A 107 11.069 -10.716 -5.411 1.00 0.00 C flip ATOM 1573 NE2 HIS A 107 11.498 -11.280 -4.285 1.00 0.00 N flip ATOM 0 HA HIS A 107 7.963 -9.496 -1.881 1.00 0.00 H new ATOM 0 HB2 HIS A 107 9.946 -7.522 -2.998 1.00 0.00 H new ATOM 0 HB3 HIS A 107 10.141 -8.667 -1.685 1.00 0.00 H new ATOM 0 HD2 HIS A 107 11.306 -10.858 -2.169 1.00 0.00 H new ATOM 0 HE1 HIS A 107 11.249 -11.048 -6.423 1.00 0.00 H new ATOM 0 HE2 HIS A 107 12.069 -12.125 -4.252 1.00 0.00 H new ATOM 1581 N CYS A 108 6.347 -7.203 -2.886 1.00 0.00 N ATOM 1582 CA CYS A 108 5.604 -5.943 -2.597 1.00 0.00 C ATOM 1583 C CYS A 108 4.101 -6.212 -2.695 1.00 0.00 C ATOM 1584 O CYS A 108 3.667 -7.075 -3.431 1.00 0.00 O ATOM 1585 CB CYS A 108 6.005 -4.865 -3.603 1.00 0.00 C ATOM 1586 SG CYS A 108 7.647 -4.236 -3.180 1.00 0.00 S ATOM 0 H CYS A 108 5.892 -7.831 -3.549 1.00 0.00 H new ATOM 0 HA CYS A 108 5.847 -5.597 -1.592 1.00 0.00 H new ATOM 0 HB2 CYS A 108 6.009 -5.276 -4.612 1.00 0.00 H new ATOM 0 HB3 CYS A 108 5.278 -4.053 -3.593 1.00 0.00 H new ATOM 1591 N ALA A 109 3.302 -5.488 -1.950 1.00 0.00 N ATOM 1592 CA ALA A 109 1.826 -5.719 -1.995 1.00 0.00 C ATOM 1593 C ALA A 109 1.098 -4.455 -2.473 1.00 0.00 C ATOM 1594 O ALA A 109 1.547 -3.339 -2.276 1.00 0.00 O ATOM 1595 CB ALA A 109 1.324 -6.108 -0.599 1.00 0.00 C ATOM 0 H ALA A 109 3.607 -4.750 -1.315 1.00 0.00 H new ATOM 0 HA ALA A 109 1.619 -6.527 -2.697 1.00 0.00 H new ATOM 0 HB1 ALA A 109 0.248 -6.276 -0.633 1.00 0.00 H new ATOM 0 HB2 ALA A 109 1.824 -7.021 -0.274 1.00 0.00 H new ATOM 0 HB3 ALA A 109 1.543 -5.304 0.104 1.00 0.00 H new ATOM 1601 N SER A 110 -0.029 -4.644 -3.105 1.00 0.00 N ATOM 1602 CA SER A 110 -0.831 -3.498 -3.622 1.00 0.00 C ATOM 1603 C SER A 110 -2.313 -3.796 -3.384 1.00 0.00 C ATOM 1604 O SER A 110 -2.693 -4.919 -3.117 1.00 0.00 O ATOM 1605 CB SER A 110 -0.581 -3.335 -5.125 1.00 0.00 C ATOM 1606 OG SER A 110 -0.313 -4.609 -5.695 1.00 0.00 O ATOM 0 H SER A 110 -0.435 -5.562 -3.288 1.00 0.00 H new ATOM 0 HA SER A 110 -0.544 -2.580 -3.109 1.00 0.00 H new ATOM 0 HB2 SER A 110 -1.451 -2.885 -5.604 1.00 0.00 H new ATOM 0 HB3 SER A 110 0.260 -2.663 -5.295 1.00 0.00 H new ATOM 0 HG SER A 110 -0.398 -4.556 -6.670 1.00 0.00 H new ATOM 1612 N LEU A 111 -3.158 -2.808 -3.486 1.00 0.00 N ATOM 1613 CA LEU A 111 -4.611 -3.053 -3.275 1.00 0.00 C ATOM 1614 C LEU A 111 -5.214 -3.521 -4.600 1.00 0.00 C ATOM 1615 O LEU A 111 -4.766 -3.138 -5.658 1.00 0.00 O ATOM 1616 CB LEU A 111 -5.294 -1.752 -2.836 1.00 0.00 C ATOM 1617 CG LEU A 111 -4.749 -1.293 -1.471 1.00 0.00 C ATOM 1618 CD1 LEU A 111 -4.400 0.197 -1.521 1.00 0.00 C ATOM 1619 CD2 LEU A 111 -5.814 -1.510 -0.391 1.00 0.00 C ATOM 0 H LEU A 111 -2.906 -1.844 -3.706 1.00 0.00 H new ATOM 0 HA LEU A 111 -4.757 -3.809 -2.503 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -5.125 -0.975 -3.582 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -6.372 -1.903 -2.772 1.00 0.00 H new ATOM 0 HG LEU A 111 -3.856 -1.873 -1.238 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -4.015 0.513 -0.551 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -3.642 0.368 -2.285 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -5.294 0.772 -1.762 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.425 -1.184 0.574 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.705 -0.932 -0.637 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -6.070 -2.568 -0.340 1.00 0.00 H new ATOM 1631 N SER A 112 -6.217 -4.356 -4.550 1.00 0.00 N ATOM 1632 CA SER A 112 -6.846 -4.862 -5.812 1.00 0.00 C ATOM 1633 C SER A 112 -8.272 -4.321 -5.928 1.00 0.00 C ATOM 1634 O SER A 112 -9.122 -4.603 -5.108 1.00 0.00 O ATOM 1635 CB SER A 112 -6.889 -6.390 -5.772 1.00 0.00 C ATOM 1636 OG SER A 112 -7.899 -6.808 -4.863 1.00 0.00 O ATOM 0 H SER A 112 -6.631 -4.712 -3.689 1.00 0.00 H new ATOM 0 HA SER A 112 -6.261 -4.529 -6.670 1.00 0.00 H new ATOM 0 HB2 SER A 112 -7.093 -6.786 -6.767 1.00 0.00 H new ATOM 0 HB3 SER A 112 -5.921 -6.785 -5.464 1.00 0.00 H new ATOM 0 HG SER A 112 -8.459 -6.041 -4.621 1.00 0.00 H new ATOM 1642 N ARG A 113 -8.543 -3.544 -6.943 1.00 0.00 N ATOM 1643 CA ARG A 113 -9.920 -2.987 -7.106 1.00 0.00 C ATOM 1644 C ARG A 113 -10.941 -4.130 -7.114 1.00 0.00 C ATOM 1645 O ARG A 113 -12.039 -3.995 -6.612 1.00 0.00 O ATOM 1646 CB ARG A 113 -10.009 -2.213 -8.427 1.00 0.00 C ATOM 1647 CG ARG A 113 -11.470 -1.882 -8.739 1.00 0.00 C ATOM 1648 CD ARG A 113 -11.532 -0.866 -9.881 1.00 0.00 C ATOM 1649 NE ARG A 113 -10.996 -1.487 -11.126 1.00 0.00 N ATOM 1650 CZ ARG A 113 -11.714 -2.359 -11.780 1.00 0.00 C ATOM 1651 NH1 ARG A 113 -13.004 -2.195 -11.889 1.00 0.00 N ATOM 1652 NH2 ARG A 113 -11.140 -3.397 -12.325 1.00 0.00 N ATOM 0 H ARG A 113 -7.875 -3.271 -7.664 1.00 0.00 H new ATOM 0 HA ARG A 113 -10.136 -2.314 -6.276 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -9.425 -1.295 -8.361 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -9.581 -2.806 -9.235 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -12.008 -2.789 -9.016 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -11.960 -1.479 -7.853 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -12.560 -0.541 -10.037 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -10.952 0.021 -9.625 1.00 0.00 H new ATOM 0 HE ARG A 113 -10.069 -1.231 -11.466 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -13.453 -1.384 -11.463 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -13.563 -2.877 -12.400 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -10.132 -3.526 -12.239 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -11.700 -4.079 -12.836 1.00 0.00 H new ATOM 1666 N SER A 114 -10.593 -5.250 -7.685 1.00 0.00 N ATOM 1667 CA SER A 114 -11.547 -6.394 -7.729 1.00 0.00 C ATOM 1668 C SER A 114 -12.011 -6.742 -6.311 1.00 0.00 C ATOM 1669 O SER A 114 -13.111 -7.215 -6.107 1.00 0.00 O ATOM 1670 CB SER A 114 -10.858 -7.609 -8.350 1.00 0.00 C ATOM 1671 OG SER A 114 -9.729 -7.959 -7.560 1.00 0.00 O ATOM 0 H SER A 114 -9.688 -5.423 -8.123 1.00 0.00 H new ATOM 0 HA SER A 114 -12.412 -6.115 -8.331 1.00 0.00 H new ATOM 0 HB2 SER A 114 -11.552 -8.447 -8.405 1.00 0.00 H new ATOM 0 HB3 SER A 114 -10.548 -7.384 -9.370 1.00 0.00 H new ATOM 0 HG SER A 114 -9.284 -8.739 -7.953 1.00 0.00 H new ATOM 1677 N THR A 115 -11.177 -6.515 -5.333 1.00 0.00 N ATOM 1678 CA THR A 115 -11.560 -6.835 -3.925 1.00 0.00 C ATOM 1679 C THR A 115 -11.940 -5.547 -3.194 1.00 0.00 C ATOM 1680 O THR A 115 -11.776 -5.431 -1.996 1.00 0.00 O ATOM 1681 CB THR A 115 -10.376 -7.498 -3.214 1.00 0.00 C ATOM 1682 OG1 THR A 115 -9.337 -6.544 -3.039 1.00 0.00 O ATOM 1683 CG2 THR A 115 -9.863 -8.669 -4.055 1.00 0.00 C ATOM 0 H THR A 115 -10.243 -6.120 -5.447 1.00 0.00 H new ATOM 0 HA THR A 115 -12.412 -7.515 -3.925 1.00 0.00 H new ATOM 0 HB THR A 115 -10.697 -7.868 -2.240 1.00 0.00 H new ATOM 0 HG1 THR A 115 -8.481 -6.939 -3.307 1.00 0.00 H new ATOM 0 HG21 THR A 115 -9.021 -9.140 -3.548 1.00 0.00 H new ATOM 0 HG22 THR A 115 -10.661 -9.399 -4.187 1.00 0.00 H new ATOM 0 HG23 THR A 115 -9.541 -8.303 -5.030 1.00 0.00 H new ATOM 1691 N ALA A 116 -12.437 -4.577 -3.912 1.00 0.00 N ATOM 1692 CA ALA A 116 -12.824 -3.287 -3.269 1.00 0.00 C ATOM 1693 C ALA A 116 -11.613 -2.698 -2.544 1.00 0.00 C ATOM 1694 O ALA A 116 -11.745 -1.956 -1.591 1.00 0.00 O ATOM 1695 CB ALA A 116 -13.962 -3.523 -2.272 1.00 0.00 C ATOM 0 H ALA A 116 -12.592 -4.622 -4.919 1.00 0.00 H new ATOM 0 HA ALA A 116 -13.163 -2.589 -4.034 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -14.240 -2.577 -1.806 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -14.824 -3.937 -2.795 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -13.633 -4.223 -1.504 1.00 0.00 H new ATOM 1701 N PHE A 117 -10.434 -3.025 -2.994 1.00 0.00 N ATOM 1702 CA PHE A 117 -9.203 -2.491 -2.345 1.00 0.00 C ATOM 1703 C PHE A 117 -9.169 -2.917 -0.879 1.00 0.00 C ATOM 1704 O PHE A 117 -8.585 -2.256 -0.044 1.00 0.00 O ATOM 1705 CB PHE A 117 -9.192 -0.962 -2.432 1.00 0.00 C ATOM 1706 CG PHE A 117 -9.553 -0.525 -3.831 1.00 0.00 C ATOM 1707 CD1 PHE A 117 -8.563 -0.456 -4.818 1.00 0.00 C ATOM 1708 CD2 PHE A 117 -10.875 -0.187 -4.140 1.00 0.00 C ATOM 1709 CE1 PHE A 117 -8.896 -0.046 -6.114 1.00 0.00 C ATOM 1710 CE2 PHE A 117 -11.208 0.222 -5.436 1.00 0.00 C ATOM 1711 CZ PHE A 117 -10.219 0.292 -6.425 1.00 0.00 C ATOM 0 H PHE A 117 -10.269 -3.643 -3.788 1.00 0.00 H new ATOM 0 HA PHE A 117 -8.328 -2.888 -2.859 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -9.900 -0.543 -1.717 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -8.206 -0.581 -2.165 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -7.543 -0.719 -4.580 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -11.639 -0.242 -3.378 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -8.132 0.010 -6.875 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -12.228 0.484 -5.674 1.00 0.00 H new ATOM 0 HZ PHE A 117 -10.476 0.606 -7.426 1.00 0.00 H new ATOM 1721 N LEU A 118 -9.792 -4.017 -0.559 1.00 0.00 N ATOM 1722 CA LEU A 118 -9.802 -4.489 0.855 1.00 0.00 C ATOM 1723 C LEU A 118 -8.749 -5.585 1.036 1.00 0.00 C ATOM 1724 O LEU A 118 -8.237 -5.792 2.117 1.00 0.00 O ATOM 1725 CB LEU A 118 -11.186 -5.048 1.187 1.00 0.00 C ATOM 1726 CG LEU A 118 -12.235 -3.935 1.083 1.00 0.00 C ATOM 1727 CD1 LEU A 118 -13.620 -4.517 1.370 1.00 0.00 C ATOM 1728 CD2 LEU A 118 -11.924 -2.827 2.100 1.00 0.00 C ATOM 0 H LEU A 118 -10.296 -4.611 -1.217 1.00 0.00 H new ATOM 0 HA LEU A 118 -9.573 -3.657 1.522 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -11.434 -5.859 0.503 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -11.187 -5.468 2.193 1.00 0.00 H new ATOM 0 HG LEU A 118 -12.214 -3.513 0.078 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -14.368 -3.728 1.297 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -13.844 -5.298 0.644 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -13.636 -4.940 2.374 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -12.673 -2.039 2.021 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -11.940 -3.243 3.107 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -10.938 -2.411 1.895 1.00 0.00 H new ATOM 1740 N ARG A 119 -8.424 -6.290 -0.016 1.00 0.00 N ATOM 1741 CA ARG A 119 -7.403 -7.376 0.090 1.00 0.00 C ATOM 1742 C ARG A 119 -6.095 -6.909 -0.560 1.00 0.00 C ATOM 1743 O ARG A 119 -6.094 -6.064 -1.431 1.00 0.00 O ATOM 1744 CB ARG A 119 -7.916 -8.626 -0.634 1.00 0.00 C ATOM 1745 CG ARG A 119 -8.759 -9.473 0.326 1.00 0.00 C ATOM 1746 CD ARG A 119 -9.909 -8.631 0.881 1.00 0.00 C ATOM 1747 NE ARG A 119 -10.954 -9.529 1.447 1.00 0.00 N ATOM 1748 CZ ARG A 119 -11.728 -10.212 0.649 1.00 0.00 C ATOM 1749 NH1 ARG A 119 -11.543 -10.164 -0.642 1.00 0.00 N ATOM 1750 NH2 ARG A 119 -12.689 -10.946 1.144 1.00 0.00 N ATOM 0 H ARG A 119 -8.822 -6.161 -0.946 1.00 0.00 H new ATOM 0 HA ARG A 119 -7.224 -7.610 1.139 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -8.513 -8.337 -1.499 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -7.076 -9.211 -1.008 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -9.153 -10.346 -0.194 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -8.138 -9.841 1.143 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -9.540 -7.954 1.652 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -10.335 -8.012 0.091 1.00 0.00 H new ATOM 0 HE ARG A 119 -11.064 -9.610 2.458 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -10.792 -9.592 -1.029 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -12.149 -10.699 -1.264 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -12.833 -10.984 2.153 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -13.295 -11.480 0.521 1.00 0.00 H new ATOM 1764 N TRP A 120 -4.984 -7.455 -0.139 1.00 0.00 N ATOM 1765 CA TRP A 120 -3.674 -7.044 -0.729 1.00 0.00 C ATOM 1766 C TRP A 120 -3.196 -8.108 -1.718 1.00 0.00 C ATOM 1767 O TRP A 120 -3.343 -9.292 -1.491 1.00 0.00 O ATOM 1768 CB TRP A 120 -2.635 -6.900 0.386 1.00 0.00 C ATOM 1769 CG TRP A 120 -3.198 -6.078 1.498 1.00 0.00 C ATOM 1770 CD1 TRP A 120 -3.855 -4.905 1.347 1.00 0.00 C ATOM 1771 CD2 TRP A 120 -3.160 -6.344 2.928 1.00 0.00 C ATOM 1772 NE1 TRP A 120 -4.223 -4.436 2.595 1.00 0.00 N ATOM 1773 CE2 TRP A 120 -3.818 -5.288 3.601 1.00 0.00 C ATOM 1774 CE3 TRP A 120 -2.623 -7.391 3.699 1.00 0.00 C ATOM 1775 CZ2 TRP A 120 -3.938 -5.272 4.992 1.00 0.00 C ATOM 1776 CZ3 TRP A 120 -2.743 -7.378 5.097 1.00 0.00 C ATOM 1777 CH2 TRP A 120 -3.400 -6.322 5.742 1.00 0.00 C ATOM 0 H TRP A 120 -4.927 -8.168 0.588 1.00 0.00 H new ATOM 0 HA TRP A 120 -3.798 -6.093 -1.246 1.00 0.00 H new ATOM 0 HB2 TRP A 120 -2.348 -7.884 0.758 1.00 0.00 H new ATOM 0 HB3 TRP A 120 -1.732 -6.431 -0.004 1.00 0.00 H new ATOM 0 HD1 TRP A 120 -4.059 -4.415 0.406 1.00 0.00 H new ATOM 0 HE1 TRP A 120 -4.732 -3.566 2.752 1.00 0.00 H new ATOM 0 HE3 TRP A 120 -2.115 -8.210 3.212 1.00 0.00 H new ATOM 0 HZ2 TRP A 120 -4.443 -4.454 5.485 1.00 0.00 H new ATOM 0 HZ3 TRP A 120 -2.326 -8.187 5.679 1.00 0.00 H new ATOM 0 HH2 TRP A 120 -3.491 -6.319 6.818 1.00 0.00 H new ATOM 1788 N LYS A 121 -2.615 -7.692 -2.813 1.00 0.00 N ATOM 1789 CA LYS A 121 -2.112 -8.671 -3.824 1.00 0.00 C ATOM 1790 C LYS A 121 -0.621 -8.443 -4.045 1.00 0.00 C ATOM 1791 O LYS A 121 -0.138 -7.329 -4.003 1.00 0.00 O ATOM 1792 CB LYS A 121 -2.864 -8.478 -5.146 1.00 0.00 C ATOM 1793 CG LYS A 121 -2.735 -9.740 -6.009 1.00 0.00 C ATOM 1794 CD LYS A 121 -3.855 -10.725 -5.656 1.00 0.00 C ATOM 1795 CE LYS A 121 -3.511 -12.110 -6.208 1.00 0.00 C ATOM 1796 NZ LYS A 121 -3.031 -11.981 -7.613 1.00 0.00 N ATOM 0 H LYS A 121 -2.466 -6.712 -3.052 1.00 0.00 H new ATOM 0 HA LYS A 121 -2.277 -9.686 -3.463 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -3.915 -8.267 -4.949 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -2.461 -7.618 -5.681 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -2.789 -9.477 -7.065 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -1.763 -10.206 -5.846 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -3.983 -10.774 -4.575 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -4.801 -10.381 -6.073 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -2.743 -12.578 -5.592 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -4.388 -12.756 -6.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -3.119 -12.898 -8.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -3.604 -11.271 -8.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -2.034 -11.684 -7.613 1.00 0.00 H new ATOM 1810 N ASP A 122 0.117 -9.494 -4.270 1.00 0.00 N ATOM 1811 CA ASP A 122 1.578 -9.337 -4.480 1.00 0.00 C ATOM 1812 C ASP A 122 1.843 -8.757 -5.871 1.00 0.00 C ATOM 1813 O ASP A 122 1.066 -8.940 -6.787 1.00 0.00 O ATOM 1814 CB ASP A 122 2.265 -10.699 -4.352 1.00 0.00 C ATOM 1815 CG ASP A 122 2.286 -11.125 -2.883 1.00 0.00 C ATOM 1816 OD1 ASP A 122 3.074 -10.568 -2.137 1.00 0.00 O ATOM 1817 OD2 ASP A 122 1.514 -12.001 -2.530 1.00 0.00 O ATOM 0 H ASP A 122 -0.230 -10.452 -4.317 1.00 0.00 H new ATOM 0 HA ASP A 122 1.977 -8.658 -3.727 1.00 0.00 H new ATOM 0 HB2 ASP A 122 1.737 -11.442 -4.949 1.00 0.00 H new ATOM 0 HB3 ASP A 122 3.282 -10.643 -4.740 1.00 0.00 H new ATOM 1822 N TYR A 123 2.935 -8.057 -6.038 1.00 0.00 N ATOM 1823 CA TYR A 123 3.245 -7.466 -7.372 1.00 0.00 C ATOM 1824 C TYR A 123 4.751 -7.185 -7.470 1.00 0.00 C ATOM 1825 O TYR A 123 5.426 -7.019 -6.474 1.00 0.00 O ATOM 1826 CB TYR A 123 2.455 -6.161 -7.541 1.00 0.00 C ATOM 1827 CG TYR A 123 1.234 -6.408 -8.396 1.00 0.00 C ATOM 1828 CD1 TYR A 123 1.321 -6.297 -9.790 1.00 0.00 C ATOM 1829 CD2 TYR A 123 0.016 -6.751 -7.797 1.00 0.00 C ATOM 1830 CE1 TYR A 123 0.191 -6.527 -10.582 1.00 0.00 C ATOM 1831 CE2 TYR A 123 -1.114 -6.982 -8.591 1.00 0.00 C ATOM 1832 CZ TYR A 123 -1.027 -6.870 -9.983 1.00 0.00 C ATOM 1833 OH TYR A 123 -2.140 -7.098 -10.766 1.00 0.00 O ATOM 0 H TYR A 123 3.624 -7.870 -5.309 1.00 0.00 H new ATOM 0 HA TYR A 123 2.962 -8.163 -8.161 1.00 0.00 H new ATOM 0 HB2 TYR A 123 2.156 -5.778 -6.566 1.00 0.00 H new ATOM 0 HB3 TYR A 123 3.085 -5.401 -8.002 1.00 0.00 H new ATOM 0 HD1 TYR A 123 2.261 -6.034 -10.253 1.00 0.00 H new ATOM 0 HD2 TYR A 123 -0.052 -6.837 -6.723 1.00 0.00 H new ATOM 0 HE1 TYR A 123 0.258 -6.440 -11.656 1.00 0.00 H new ATOM 0 HE2 TYR A 123 -2.053 -7.247 -8.129 1.00 0.00 H new ATOM 0 HH TYR A 123 -2.902 -7.326 -10.193 1.00 0.00 H new ATOM 1843 N ASN A 124 5.279 -7.131 -8.666 1.00 0.00 N ATOM 1844 CA ASN A 124 6.738 -6.860 -8.828 1.00 0.00 C ATOM 1845 C ASN A 124 7.070 -5.492 -8.233 1.00 0.00 C ATOM 1846 O ASN A 124 6.591 -4.474 -8.687 1.00 0.00 O ATOM 1847 CB ASN A 124 7.097 -6.872 -10.316 1.00 0.00 C ATOM 1848 CG ASN A 124 7.098 -8.312 -10.831 1.00 0.00 C ATOM 1849 OD1 ASN A 124 6.726 -9.277 -10.033 1.00 0.00 O flip ATOM 1850 ND2 ASN A 124 7.438 -8.563 -11.969 1.00 0.00 N flip ATOM 0 H ASN A 124 4.763 -7.263 -9.536 1.00 0.00 H new ATOM 0 HA ASN A 124 7.311 -7.630 -8.311 1.00 0.00 H new ATOM 0 HB2 ASN A 124 6.380 -6.274 -10.878 1.00 0.00 H new ATOM 0 HB3 ASN A 124 8.077 -6.420 -10.468 1.00 0.00 H new ATOM 0 HD21 ASN A 124 7.729 -7.810 -12.592 1.00 0.00 H new ATOM 0 HD22 ASN A 124 7.433 -9.527 -12.302 1.00 0.00 H new ATOM 1857 N CYS A 125 7.878 -5.464 -7.211 1.00 0.00 N ATOM 1858 CA CYS A 125 8.238 -4.169 -6.562 1.00 0.00 C ATOM 1859 C CYS A 125 8.638 -3.120 -7.604 1.00 0.00 C ATOM 1860 O CYS A 125 8.837 -1.968 -7.275 1.00 0.00 O ATOM 1861 CB CYS A 125 9.420 -4.389 -5.616 1.00 0.00 C ATOM 1862 SG CYS A 125 8.901 -5.421 -4.225 1.00 0.00 S ATOM 0 H CYS A 125 8.309 -6.288 -6.793 1.00 0.00 H new ATOM 0 HA CYS A 125 7.366 -3.810 -6.016 1.00 0.00 H new ATOM 0 HB2 CYS A 125 10.242 -4.867 -6.150 1.00 0.00 H new ATOM 0 HB3 CYS A 125 9.791 -3.431 -5.252 1.00 0.00 H new ATOM 1867 N ASN A 126 8.782 -3.497 -8.847 1.00 0.00 N ATOM 1868 CA ASN A 126 9.199 -2.493 -9.874 1.00 0.00 C ATOM 1869 C ASN A 126 7.981 -1.960 -10.637 1.00 0.00 C ATOM 1870 O ASN A 126 7.947 -0.806 -11.021 1.00 0.00 O ATOM 1871 CB ASN A 126 10.173 -3.145 -10.857 1.00 0.00 C ATOM 1872 CG ASN A 126 11.175 -4.007 -10.087 1.00 0.00 C ATOM 1873 OD1 ASN A 126 10.799 -4.965 -9.440 1.00 0.00 O ATOM 1874 ND2 ASN A 126 12.443 -3.707 -10.127 1.00 0.00 N ATOM 0 H ASN A 126 8.632 -4.444 -9.194 1.00 0.00 H new ATOM 0 HA ASN A 126 9.685 -1.658 -9.369 1.00 0.00 H new ATOM 0 HB2 ASN A 126 9.627 -3.757 -11.575 1.00 0.00 H new ATOM 0 HB3 ASN A 126 10.699 -2.379 -11.427 1.00 0.00 H new ATOM 0 HD21 ASN A 126 13.118 -4.276 -9.616 1.00 0.00 H new ATOM 0 HD22 ASN A 126 12.760 -2.904 -10.669 1.00 0.00 H new ATOM 1881 N VAL A 127 6.979 -2.767 -10.856 1.00 0.00 N ATOM 1882 CA VAL A 127 5.782 -2.259 -11.589 1.00 0.00 C ATOM 1883 C VAL A 127 5.287 -1.023 -10.843 1.00 0.00 C ATOM 1884 O VAL A 127 5.131 -1.048 -9.639 1.00 0.00 O ATOM 1885 CB VAL A 127 4.688 -3.333 -11.603 1.00 0.00 C ATOM 1886 CG1 VAL A 127 3.338 -2.702 -11.960 1.00 0.00 C ATOM 1887 CG2 VAL A 127 5.039 -4.401 -12.643 1.00 0.00 C ATOM 0 H VAL A 127 6.935 -3.743 -10.564 1.00 0.00 H new ATOM 0 HA VAL A 127 6.033 -2.013 -12.621 1.00 0.00 H new ATOM 0 HB VAL A 127 4.620 -3.787 -10.614 1.00 0.00 H new ATOM 0 HG11 VAL A 127 2.567 -3.472 -11.968 1.00 0.00 H new ATOM 0 HG12 VAL A 127 3.085 -1.942 -11.221 1.00 0.00 H new ATOM 0 HG13 VAL A 127 3.401 -2.242 -12.946 1.00 0.00 H new ATOM 0 HG21 VAL A 127 4.263 -5.166 -12.655 1.00 0.00 H new ATOM 0 HG22 VAL A 127 5.110 -3.940 -13.628 1.00 0.00 H new ATOM 0 HG23 VAL A 127 5.995 -4.858 -12.387 1.00 0.00 H new ATOM 1897 N ARG A 128 5.071 0.076 -11.520 1.00 0.00 N ATOM 1898 CA ARG A 128 4.635 1.282 -10.783 1.00 0.00 C ATOM 1899 C ARG A 128 3.132 1.313 -10.675 1.00 0.00 C ATOM 1900 O ARG A 128 2.447 0.801 -11.535 1.00 0.00 O ATOM 1901 CB ARG A 128 5.122 2.521 -11.549 1.00 0.00 C ATOM 1902 CG ARG A 128 5.309 2.172 -13.031 1.00 0.00 C ATOM 1903 CD ARG A 128 5.598 3.445 -13.837 1.00 0.00 C ATOM 1904 NE ARG A 128 6.633 3.152 -14.868 1.00 0.00 N ATOM 1905 CZ ARG A 128 7.855 2.870 -14.506 1.00 0.00 C ATOM 1906 NH1 ARG A 128 8.202 2.970 -13.252 1.00 0.00 N ATOM 1907 NH2 ARG A 128 8.727 2.488 -15.398 1.00 0.00 N ATOM 0 H ARG A 128 5.177 0.183 -12.529 1.00 0.00 H new ATOM 0 HA ARG A 128 5.054 1.269 -9.777 1.00 0.00 H new ATOM 0 HB2 ARG A 128 4.401 3.332 -11.445 1.00 0.00 H new ATOM 0 HB3 ARG A 128 6.063 2.875 -11.127 1.00 0.00 H new ATOM 0 HG2 ARG A 128 6.130 1.465 -13.146 1.00 0.00 H new ATOM 0 HG3 ARG A 128 4.413 1.685 -13.414 1.00 0.00 H new ATOM 0 HD2 ARG A 128 4.685 3.803 -14.313 1.00 0.00 H new ATOM 0 HD3 ARG A 128 5.943 4.238 -13.174 1.00 0.00 H new ATOM 0 HE ARG A 128 6.386 3.172 -15.858 1.00 0.00 H new ATOM 0 HH11 ARG A 128 7.519 3.268 -12.556 1.00 0.00 H new ATOM 0 HH12 ARG A 128 9.157 2.750 -12.968 1.00 0.00 H new ATOM 0 HH21 ARG A 128 8.454 2.410 -16.378 1.00 0.00 H new ATOM 0 HH22 ARG A 128 9.682 2.268 -15.116 1.00 0.00 H new ATOM 1921 N LEU A 129 2.580 1.897 -9.632 1.00 0.00 N ATOM 1922 CA LEU A 129 1.076 1.881 -9.582 1.00 0.00 C ATOM 1923 C LEU A 129 0.573 3.148 -8.949 1.00 0.00 C ATOM 1924 O LEU A 129 1.287 3.755 -8.175 1.00 0.00 O ATOM 1925 CB LEU A 129 0.620 0.699 -8.714 1.00 0.00 C ATOM 1926 CG LEU A 129 0.584 -0.601 -9.533 1.00 0.00 C ATOM 1927 CD1 LEU A 129 1.528 -1.634 -8.909 1.00 0.00 C ATOM 1928 CD2 LEU A 129 -0.838 -1.155 -9.521 1.00 0.00 C ATOM 0 H LEU A 129 3.065 2.356 -8.861 1.00 0.00 H new ATOM 0 HA LEU A 129 0.685 1.792 -10.595 1.00 0.00 H new ATOM 0 HB2 LEU A 129 1.297 0.582 -7.868 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -0.369 0.903 -8.305 1.00 0.00 H new ATOM 0 HG LEU A 129 0.899 -0.395 -10.556 1.00 0.00 H new ATOM 0 HD11 LEU A 129 1.499 -2.554 -9.493 1.00 0.00 H new ATOM 0 HD12 LEU A 129 2.545 -1.241 -8.902 1.00 0.00 H new ATOM 0 HD13 LEU A 129 1.213 -1.844 -7.887 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -0.874 -2.078 -10.100 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -1.140 -1.359 -8.494 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.517 -0.424 -9.961 1.00 0.00 H new ATOM 1940 N PRO A 130 -0.646 3.545 -9.174 1.00 0.00 N ATOM 1941 CA PRO A 130 -1.144 4.739 -8.465 1.00 0.00 C ATOM 1942 C PRO A 130 -0.991 4.454 -6.969 1.00 0.00 C ATOM 1943 O PRO A 130 -1.219 3.339 -6.545 1.00 0.00 O ATOM 1944 CB PRO A 130 -2.610 4.807 -8.906 1.00 0.00 C ATOM 1945 CG PRO A 130 -2.887 3.638 -9.870 1.00 0.00 C ATOM 1946 CD PRO A 130 -1.580 2.869 -10.107 1.00 0.00 C ATOM 0 HA PRO A 130 -0.631 5.678 -8.671 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -3.269 4.747 -8.040 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -2.814 5.759 -9.397 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -3.644 2.975 -9.451 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -3.280 4.013 -10.815 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -1.685 1.808 -9.881 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -1.246 2.943 -11.142 1.00 0.00 H new ATOM 1954 N TYR A 131 -0.547 5.380 -6.165 1.00 0.00 N ATOM 1955 CA TYR A 131 -0.341 5.019 -4.726 1.00 0.00 C ATOM 1956 C TYR A 131 -0.770 6.127 -3.771 1.00 0.00 C ATOM 1957 O TYR A 131 -1.154 7.209 -4.170 1.00 0.00 O ATOM 1958 CB TYR A 131 1.147 4.751 -4.509 1.00 0.00 C ATOM 1959 CG TYR A 131 1.919 6.037 -4.688 1.00 0.00 C ATOM 1960 CD1 TYR A 131 2.086 6.580 -5.968 1.00 0.00 C ATOM 1961 CD2 TYR A 131 2.466 6.689 -3.576 1.00 0.00 C ATOM 1962 CE1 TYR A 131 2.799 7.772 -6.137 1.00 0.00 C ATOM 1963 CE2 TYR A 131 3.180 7.881 -3.744 1.00 0.00 C ATOM 1964 CZ TYR A 131 3.346 8.423 -5.024 1.00 0.00 C ATOM 1965 OH TYR A 131 4.049 9.599 -5.190 1.00 0.00 O ATOM 0 H TYR A 131 -0.323 6.341 -6.425 1.00 0.00 H new ATOM 0 HA TYR A 131 -0.954 4.143 -4.514 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.314 4.350 -3.509 1.00 0.00 H new ATOM 0 HB3 TYR A 131 1.500 4.001 -5.216 1.00 0.00 H new ATOM 0 HD1 TYR A 131 1.664 6.078 -6.826 1.00 0.00 H new ATOM 0 HD2 TYR A 131 2.337 6.272 -2.588 1.00 0.00 H new ATOM 0 HE1 TYR A 131 2.927 8.190 -7.125 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.603 8.383 -2.886 1.00 0.00 H new ATOM 0 HH TYR A 131 4.360 9.920 -4.318 1.00 0.00 H new ATOM 1975 N VAL A 132 -0.672 5.850 -2.491 1.00 0.00 N ATOM 1976 CA VAL A 132 -1.032 6.863 -1.460 1.00 0.00 C ATOM 1977 C VAL A 132 0.217 7.133 -0.620 1.00 0.00 C ATOM 1978 O VAL A 132 1.131 6.333 -0.592 1.00 0.00 O ATOM 1979 CB VAL A 132 -2.150 6.317 -0.569 1.00 0.00 C ATOM 1980 CG1 VAL A 132 -2.442 7.310 0.561 1.00 0.00 C ATOM 1981 CG2 VAL A 132 -3.417 6.117 -1.404 1.00 0.00 C ATOM 0 H VAL A 132 -0.354 4.955 -2.118 1.00 0.00 H new ATOM 0 HA VAL A 132 -1.382 7.782 -1.929 1.00 0.00 H new ATOM 0 HB VAL A 132 -1.836 5.364 -0.143 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -3.239 6.918 1.193 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -1.542 7.455 1.159 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -2.753 8.264 0.136 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -4.213 5.728 -0.769 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -3.726 7.071 -1.830 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -3.215 5.409 -2.208 1.00 0.00 H new ATOM 1991 N CYS A 133 0.284 8.250 0.049 1.00 0.00 N ATOM 1992 CA CYS A 133 1.503 8.548 0.860 1.00 0.00 C ATOM 1993 C CYS A 133 1.114 9.208 2.187 1.00 0.00 C ATOM 1994 O CYS A 133 0.356 10.155 2.214 1.00 0.00 O ATOM 1995 CB CYS A 133 2.402 9.494 0.060 1.00 0.00 C ATOM 1996 SG CYS A 133 3.705 10.157 1.124 1.00 0.00 S ATOM 0 H CYS A 133 -0.443 8.965 0.071 1.00 0.00 H new ATOM 0 HA CYS A 133 2.030 7.619 1.078 1.00 0.00 H new ATOM 0 HB2 CYS A 133 2.844 8.963 -0.783 1.00 0.00 H new ATOM 0 HB3 CYS A 133 1.809 10.310 -0.354 1.00 0.00 H new ATOM 2001 N LYS A 134 1.638 8.718 3.287 1.00 0.00 N ATOM 2002 CA LYS A 134 1.304 9.326 4.612 1.00 0.00 C ATOM 2003 C LYS A 134 2.463 10.228 5.047 1.00 0.00 C ATOM 2004 O LYS A 134 3.585 10.046 4.623 1.00 0.00 O ATOM 2005 CB LYS A 134 1.087 8.206 5.644 1.00 0.00 C ATOM 2006 CG LYS A 134 2.430 7.776 6.253 1.00 0.00 C ATOM 2007 CD LYS A 134 2.264 6.452 7.008 1.00 0.00 C ATOM 2008 CE LYS A 134 1.725 6.725 8.416 1.00 0.00 C ATOM 2009 NZ LYS A 134 1.379 5.435 9.075 1.00 0.00 N ATOM 0 H LYS A 134 2.280 7.926 3.323 1.00 0.00 H new ATOM 0 HA LYS A 134 0.392 9.919 4.537 1.00 0.00 H new ATOM 0 HB2 LYS A 134 0.417 8.552 6.431 1.00 0.00 H new ATOM 0 HB3 LYS A 134 0.605 7.352 5.168 1.00 0.00 H new ATOM 0 HG2 LYS A 134 3.176 7.664 5.466 1.00 0.00 H new ATOM 0 HG3 LYS A 134 2.795 8.547 6.931 1.00 0.00 H new ATOM 0 HD2 LYS A 134 1.581 5.797 6.467 1.00 0.00 H new ATOM 0 HD3 LYS A 134 3.221 5.934 7.069 1.00 0.00 H new ATOM 0 HE2 LYS A 134 2.471 7.258 9.005 1.00 0.00 H new ATOM 0 HE3 LYS A 134 0.845 7.365 8.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 1.424 5.550 10.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 0.417 5.152 8.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 2.054 4.702 8.778 1.00 0.00 H new ATOM 2023 N PHE A 135 2.203 11.209 5.876 1.00 0.00 N ATOM 2024 CA PHE A 135 3.312 12.120 6.308 1.00 0.00 C ATOM 2025 C PHE A 135 2.792 13.154 7.312 1.00 0.00 C ATOM 2026 O PHE A 135 1.896 13.917 7.018 1.00 0.00 O ATOM 2027 CB PHE A 135 3.867 12.860 5.090 1.00 0.00 C ATOM 2028 CG PHE A 135 2.757 13.624 4.405 1.00 0.00 C ATOM 2029 CD1 PHE A 135 1.968 12.996 3.433 1.00 0.00 C ATOM 2030 CD2 PHE A 135 2.517 14.962 4.742 1.00 0.00 C ATOM 2031 CE1 PHE A 135 0.941 13.705 2.799 1.00 0.00 C ATOM 2032 CE2 PHE A 135 1.488 15.671 4.109 1.00 0.00 C ATOM 2033 CZ PHE A 135 0.701 15.041 3.138 1.00 0.00 C ATOM 0 H PHE A 135 1.285 11.418 6.268 1.00 0.00 H new ATOM 0 HA PHE A 135 4.092 11.520 6.776 1.00 0.00 H new ATOM 0 HB2 PHE A 135 4.656 13.546 5.398 1.00 0.00 H new ATOM 0 HB3 PHE A 135 4.315 12.150 4.395 1.00 0.00 H new ATOM 0 HD1 PHE A 135 2.152 11.964 3.173 1.00 0.00 H new ATOM 0 HD2 PHE A 135 3.126 15.448 5.490 1.00 0.00 H new ATOM 0 HE1 PHE A 135 0.334 13.221 2.048 1.00 0.00 H new ATOM 0 HE2 PHE A 135 1.302 16.702 4.370 1.00 0.00 H new ATOM 0 HZ PHE A 135 -0.093 15.587 2.650 1.00 0.00 H new