USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 784 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 16 TYR OH : rot 140:sc= 0.00649 USER MOD Set 1.2: A 82 SER OG : rot 180:sc= 0.00614 USER MOD Single : A 11 LYS NZ :NH3+ -133:sc= -0.523 (180deg=-1.87!) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 ASN : amide:sc= -0.469 K(o=-0.47,f=-4.7!) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 30:sc= -0.137 USER MOD Single : A 31 SER OG : rot 180:sc= -1.24 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 74:sc= -0.778! USER MOD Single : A 48 THR OG1 : rot -150:sc= 0.0182 USER MOD Single : A 50 SER OG : rot -2:sc= -0.926 USER MOD Single : A 52 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 ASN : amide:sc= -0.0135 X(o=-0.014,f=-0.17) USER MOD Single : A 57 GLN : amide:sc= -1.33 K(o=-1.3,f=-0.27) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0.2 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 19:sc= 1.22 USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 83 TYR OH : rot 80:sc= 0 USER MOD Single : A 85 CYS SG : rot 46:sc= -1.43 USER MOD Single : A 87 SER OG : rot -140:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 TYR OH : rot -27:sc= 0.92 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.0593 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ASN : amide:sc= -0.378 X(o=-0.38,f=0.062) USER MOD Single : A 101 ASN : amide:sc= 0.507 K(o=0.51,f=-4.1!) USER MOD Single : A 103 ASN : amide:sc= -0.111 X(o=-0.11,f=0) USER MOD Single : A 105 SER OG : rot 92:sc= -0.23 USER MOD ----------------------------------------------------------------- ATOM 112 N ALA A 10 -8.530 3.599 11.931 1.00 0.00 N ATOM 113 CA ALA A 10 -7.440 3.939 11.025 1.00 0.00 C ATOM 114 C ALA A 10 -7.746 3.485 9.602 1.00 0.00 C ATOM 115 O ALA A 10 -8.530 2.560 9.390 1.00 0.00 O ATOM 116 CB ALA A 10 -6.139 3.317 11.510 1.00 0.00 C ATOM 0 HA ALA A 10 -7.332 5.024 11.017 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -5.333 3.579 10.825 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -5.905 3.693 12.506 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -6.246 2.233 11.548 1.00 0.00 H new ATOM 122 N LYS A 11 -7.123 4.143 8.629 1.00 0.00 N ATOM 123 CA LYS A 11 -7.330 3.808 7.225 1.00 0.00 C ATOM 124 C LYS A 11 -6.363 2.715 6.779 1.00 0.00 C ATOM 125 O LYS A 11 -5.174 2.966 6.585 1.00 0.00 O ATOM 126 CB LYS A 11 -7.153 5.052 6.352 1.00 0.00 C ATOM 127 CG LYS A 11 -8.192 5.172 5.248 1.00 0.00 C ATOM 128 CD LYS A 11 -8.841 6.547 5.237 1.00 0.00 C ATOM 129 CE LYS A 11 -7.819 7.642 4.973 1.00 0.00 C ATOM 130 NZ LYS A 11 -7.366 8.294 6.234 1.00 0.00 N ATOM 0 H LYS A 11 -6.471 4.911 8.787 1.00 0.00 H new ATOM 0 HA LYS A 11 -8.348 3.435 7.111 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -7.202 5.939 6.984 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -6.159 5.033 5.904 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -7.722 4.983 4.283 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -8.958 4.409 5.384 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -9.616 6.579 4.471 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -9.331 6.727 6.194 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -6.959 7.219 4.454 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -8.253 8.392 4.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -7.387 9.327 6.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -7.998 8.020 7.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -6.396 7.990 6.453 1.00 0.00 H new ATOM 144 N LYS A 12 -6.883 1.502 6.617 1.00 0.00 N ATOM 145 CA LYS A 12 -6.065 0.372 6.192 1.00 0.00 C ATOM 146 C LYS A 12 -5.715 0.480 4.712 1.00 0.00 C ATOM 147 O LYS A 12 -6.597 0.459 3.853 1.00 0.00 O ATOM 148 CB LYS A 12 -6.798 -0.944 6.460 1.00 0.00 C ATOM 149 CG LYS A 12 -6.591 -1.482 7.866 1.00 0.00 C ATOM 150 CD LYS A 12 -5.406 -2.433 7.929 1.00 0.00 C ATOM 151 CE LYS A 12 -4.987 -2.710 9.365 1.00 0.00 C ATOM 152 NZ LYS A 12 -5.278 -4.113 9.769 1.00 0.00 N ATOM 0 H LYS A 12 -7.866 1.277 6.773 1.00 0.00 H new ATOM 0 HA LYS A 12 -5.140 0.388 6.768 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -7.865 -0.797 6.290 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -6.461 -1.691 5.741 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -6.430 -0.652 8.554 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -7.492 -1.999 8.195 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -5.665 -3.371 7.437 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -4.567 -2.006 7.380 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -3.920 -2.514 9.476 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -5.508 -2.025 10.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -4.977 -4.260 10.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -6.299 -4.293 9.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -4.761 -4.767 9.148 1.00 0.00 H new ATOM 166 N VAL A 13 -4.424 0.598 4.421 1.00 0.00 N ATOM 167 CA VAL A 13 -3.958 0.710 3.045 1.00 0.00 C ATOM 168 C VAL A 13 -2.826 -0.272 2.765 1.00 0.00 C ATOM 169 O VAL A 13 -1.827 -0.304 3.484 1.00 0.00 O ATOM 170 CB VAL A 13 -3.473 2.138 2.731 1.00 0.00 C ATOM 171 CG1 VAL A 13 -4.649 3.098 2.657 1.00 0.00 C ATOM 172 CG2 VAL A 13 -2.462 2.598 3.770 1.00 0.00 C ATOM 0 H VAL A 13 -3.682 0.618 5.120 1.00 0.00 H new ATOM 0 HA VAL A 13 -4.807 0.473 2.404 1.00 0.00 H new ATOM 0 HB VAL A 13 -2.981 2.130 1.758 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -4.286 4.101 2.434 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -5.332 2.776 1.871 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -5.173 3.106 3.613 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -2.130 3.609 3.532 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -2.925 2.591 4.757 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.605 1.925 3.767 1.00 0.00 H new ATOM 182 N ARG A 14 -2.989 -1.073 1.717 1.00 0.00 N ATOM 183 CA ARG A 14 -1.981 -2.058 1.343 1.00 0.00 C ATOM 184 C ARG A 14 -0.990 -1.469 0.344 1.00 0.00 C ATOM 185 O ARG A 14 -1.338 -0.594 -0.448 1.00 0.00 O ATOM 186 CB ARG A 14 -2.647 -3.299 0.746 1.00 0.00 C ATOM 187 CG ARG A 14 -1.966 -4.602 1.132 1.00 0.00 C ATOM 188 CD ARG A 14 -2.978 -5.713 1.366 1.00 0.00 C ATOM 189 NE ARG A 14 -2.346 -6.936 1.856 1.00 0.00 N ATOM 190 CZ ARG A 14 -3.006 -7.919 2.464 1.00 0.00 C ATOM 191 NH1 ARG A 14 -4.315 -7.827 2.659 1.00 0.00 N ATOM 192 NH2 ARG A 14 -2.354 -8.997 2.878 1.00 0.00 N ATOM 0 H ARG A 14 -3.810 -1.059 1.112 1.00 0.00 H new ATOM 0 HA ARG A 14 -1.437 -2.344 2.243 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -3.687 -3.333 1.069 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -2.653 -3.210 -0.340 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -1.274 -4.899 0.344 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -1.375 -4.451 2.035 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -3.725 -5.377 2.086 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -3.505 -5.925 0.436 1.00 0.00 H new ATOM 0 HE ARG A 14 -1.340 -7.043 1.724 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -4.821 -7.000 2.342 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -4.816 -8.583 3.126 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -1.348 -9.072 2.730 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -2.859 -9.751 3.344 1.00 0.00 H new ATOM 206 N PHE A 15 0.246 -1.955 0.389 1.00 0.00 N ATOM 207 CA PHE A 15 1.289 -1.477 -0.511 1.00 0.00 C ATOM 208 C PHE A 15 2.063 -2.644 -1.116 1.00 0.00 C ATOM 209 O PHE A 15 2.554 -3.514 -0.397 1.00 0.00 O ATOM 210 CB PHE A 15 2.248 -0.545 0.233 1.00 0.00 C ATOM 211 CG PHE A 15 1.628 0.763 0.631 1.00 0.00 C ATOM 212 CD1 PHE A 15 1.061 1.595 -0.321 1.00 0.00 C ATOM 213 CD2 PHE A 15 1.610 1.160 1.958 1.00 0.00 C ATOM 214 CE1 PHE A 15 0.489 2.800 0.043 1.00 0.00 C ATOM 215 CE2 PHE A 15 1.040 2.364 2.329 1.00 0.00 C ATOM 216 CZ PHE A 15 0.480 3.184 1.370 1.00 0.00 C ATOM 0 H PHE A 15 0.550 -2.680 1.039 1.00 0.00 H new ATOM 0 HA PHE A 15 0.810 -0.924 -1.319 1.00 0.00 H new ATOM 0 HB2 PHE A 15 2.613 -1.051 1.127 1.00 0.00 H new ATOM 0 HB3 PHE A 15 3.114 -0.349 -0.399 1.00 0.00 H new ATOM 0 HD1 PHE A 15 1.066 1.299 -1.360 1.00 0.00 H new ATOM 0 HD2 PHE A 15 2.046 0.522 2.712 1.00 0.00 H new ATOM 0 HE1 PHE A 15 0.050 3.440 -0.708 1.00 0.00 H new ATOM 0 HE2 PHE A 15 1.033 2.662 3.367 1.00 0.00 H new ATOM 0 HZ PHE A 15 0.035 4.125 1.657 1.00 0.00 H new ATOM 226 N TYR A 16 2.165 -2.656 -2.441 1.00 0.00 N ATOM 227 CA TYR A 16 2.879 -3.717 -3.142 1.00 0.00 C ATOM 228 C TYR A 16 4.136 -3.174 -3.814 1.00 0.00 C ATOM 229 O TYR A 16 4.365 -1.965 -3.839 1.00 0.00 O ATOM 230 CB TYR A 16 1.969 -4.369 -4.185 1.00 0.00 C ATOM 231 CG TYR A 16 0.640 -4.826 -3.627 1.00 0.00 C ATOM 232 CD1 TYR A 16 0.577 -5.586 -2.466 1.00 0.00 C ATOM 233 CD2 TYR A 16 -0.551 -4.498 -4.262 1.00 0.00 C ATOM 234 CE1 TYR A 16 -0.636 -6.006 -1.953 1.00 0.00 C ATOM 235 CE2 TYR A 16 -1.768 -4.913 -3.755 1.00 0.00 C ATOM 236 CZ TYR A 16 -1.804 -5.667 -2.600 1.00 0.00 C ATOM 237 OH TYR A 16 -3.014 -6.083 -2.093 1.00 0.00 O ATOM 0 H TYR A 16 1.763 -1.944 -3.050 1.00 0.00 H new ATOM 0 HA TYR A 16 3.176 -4.468 -2.410 1.00 0.00 H new ATOM 0 HB2 TYR A 16 1.790 -3.660 -4.993 1.00 0.00 H new ATOM 0 HB3 TYR A 16 2.484 -5.225 -4.621 1.00 0.00 H new ATOM 0 HD1 TYR A 16 1.491 -5.853 -1.956 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -0.526 -3.909 -5.167 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -0.668 -6.597 -1.050 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -2.685 -4.649 -4.260 1.00 0.00 H new ATOM 0 HH TYR A 16 -3.672 -5.363 -2.186 1.00 0.00 H new ATOM 247 N ARG A 17 4.949 -4.076 -4.354 1.00 0.00 N ATOM 248 CA ARG A 17 6.184 -3.686 -5.024 1.00 0.00 C ATOM 249 C ARG A 17 5.979 -3.590 -6.533 1.00 0.00 C ATOM 250 O ARG A 17 5.341 -4.450 -7.139 1.00 0.00 O ATOM 251 CB ARG A 17 7.297 -4.689 -4.709 1.00 0.00 C ATOM 252 CG ARG A 17 8.610 -4.034 -4.309 1.00 0.00 C ATOM 253 CD ARG A 17 9.029 -4.430 -2.902 1.00 0.00 C ATOM 254 NE ARG A 17 9.378 -5.846 -2.813 1.00 0.00 N ATOM 255 CZ ARG A 17 10.060 -6.379 -1.802 1.00 0.00 C ATOM 256 NH1 ARG A 17 10.466 -5.618 -0.793 1.00 0.00 N ATOM 257 NH2 ARG A 17 10.335 -7.675 -1.799 1.00 0.00 N ATOM 0 H ARG A 17 4.775 -5.081 -4.341 1.00 0.00 H new ATOM 0 HA ARG A 17 6.475 -2.703 -4.654 1.00 0.00 H new ATOM 0 HB2 ARG A 17 6.967 -5.344 -3.903 1.00 0.00 H new ATOM 0 HB3 ARG A 17 7.466 -5.318 -5.583 1.00 0.00 H new ATOM 0 HG2 ARG A 17 9.390 -4.320 -5.015 1.00 0.00 H new ATOM 0 HG3 ARG A 17 8.509 -2.950 -4.367 1.00 0.00 H new ATOM 0 HD2 ARG A 17 9.883 -3.826 -2.595 1.00 0.00 H new ATOM 0 HD3 ARG A 17 8.218 -4.212 -2.207 1.00 0.00 H new ATOM 0 HE ARG A 17 9.082 -6.462 -3.570 1.00 0.00 H new ATOM 0 HH11 ARG A 17 10.256 -4.620 -0.790 1.00 0.00 H new ATOM 0 HH12 ARG A 17 10.988 -6.031 -0.021 1.00 0.00 H new ATOM 0 HH21 ARG A 17 10.024 -8.264 -2.571 1.00 0.00 H new ATOM 0 HH22 ARG A 17 10.858 -8.084 -1.024 1.00 0.00 H new ATOM 271 N ASN A 18 6.525 -2.537 -7.133 1.00 0.00 N ATOM 272 CA ASN A 18 6.403 -2.327 -8.571 1.00 0.00 C ATOM 273 C ASN A 18 7.047 -3.472 -9.345 1.00 0.00 C ATOM 274 O ASN A 18 8.270 -3.541 -9.468 1.00 0.00 O ATOM 275 CB ASN A 18 7.049 -0.999 -8.969 1.00 0.00 C ATOM 276 CG ASN A 18 6.534 -0.480 -10.297 1.00 0.00 C ATOM 277 OD1 ASN A 18 6.144 -1.256 -11.171 1.00 0.00 O ATOM 278 ND2 ASN A 18 6.528 0.838 -10.455 1.00 0.00 N ATOM 0 H ASN A 18 7.056 -1.816 -6.645 1.00 0.00 H new ATOM 0 HA ASN A 18 5.342 -2.297 -8.820 1.00 0.00 H new ATOM 0 HB2 ASN A 18 6.857 -0.258 -8.193 1.00 0.00 H new ATOM 0 HB3 ASN A 18 8.130 -1.127 -9.027 1.00 0.00 H new ATOM 0 HD21 ASN A 18 6.191 1.246 -11.327 1.00 0.00 H new ATOM 0 HD22 ASN A 18 6.860 1.443 -9.704 1.00 0.00 H new ATOM 285 N GLY A 19 6.216 -4.369 -9.867 1.00 0.00 N ATOM 286 CA GLY A 19 6.724 -5.498 -10.623 1.00 0.00 C ATOM 287 C GLY A 19 7.117 -6.663 -9.735 1.00 0.00 C ATOM 288 O GLY A 19 8.181 -7.256 -9.914 1.00 0.00 O ATOM 0 H GLY A 19 5.200 -4.334 -9.780 1.00 0.00 H new ATOM 0 HA2 GLY A 19 5.965 -5.827 -11.333 1.00 0.00 H new ATOM 0 HA3 GLY A 19 7.589 -5.181 -11.205 1.00 0.00 H new ATOM 292 N ASP A 20 6.257 -6.991 -8.776 1.00 0.00 N ATOM 293 CA ASP A 20 6.521 -8.091 -7.857 1.00 0.00 C ATOM 294 C ASP A 20 5.236 -8.845 -7.529 1.00 0.00 C ATOM 295 O ASP A 20 4.420 -8.384 -6.730 1.00 0.00 O ATOM 296 CB ASP A 20 7.161 -7.566 -6.571 1.00 0.00 C ATOM 297 CG ASP A 20 7.860 -8.658 -5.786 1.00 0.00 C ATOM 298 OD1 ASP A 20 7.182 -9.622 -5.374 1.00 0.00 O ATOM 299 OD2 ASP A 20 9.089 -8.549 -5.583 1.00 0.00 O ATOM 0 H ASP A 20 5.372 -6.510 -8.616 1.00 0.00 H new ATOM 0 HA ASP A 20 7.212 -8.780 -8.343 1.00 0.00 H new ATOM 0 HB2 ASP A 20 7.879 -6.784 -6.819 1.00 0.00 H new ATOM 0 HB3 ASP A 20 6.393 -7.108 -5.947 1.00 0.00 H new ATOM 304 N ARG A 21 5.064 -10.007 -8.150 1.00 0.00 N ATOM 305 CA ARG A 21 3.878 -10.826 -7.924 1.00 0.00 C ATOM 306 C ARG A 21 4.128 -11.856 -6.826 1.00 0.00 C ATOM 307 O ARG A 21 3.203 -12.264 -6.123 1.00 0.00 O ATOM 308 CB ARG A 21 3.467 -11.532 -9.217 1.00 0.00 C ATOM 309 CG ARG A 21 4.527 -12.476 -9.758 1.00 0.00 C ATOM 310 CD ARG A 21 3.907 -13.610 -10.558 1.00 0.00 C ATOM 311 NE ARG A 21 3.606 -13.212 -11.931 1.00 0.00 N ATOM 312 CZ ARG A 21 2.875 -13.941 -12.771 1.00 0.00 C ATOM 313 NH1 ARG A 21 2.370 -15.105 -12.383 1.00 0.00 N ATOM 314 NH2 ARG A 21 2.649 -13.504 -14.003 1.00 0.00 N ATOM 0 H ARG A 21 5.730 -10.403 -8.813 1.00 0.00 H new ATOM 0 HA ARG A 21 3.069 -10.169 -7.603 1.00 0.00 H new ATOM 0 HB2 ARG A 21 2.550 -12.093 -9.039 1.00 0.00 H new ATOM 0 HB3 ARG A 21 3.240 -10.782 -9.974 1.00 0.00 H new ATOM 0 HG2 ARG A 21 5.222 -11.922 -10.389 1.00 0.00 H new ATOM 0 HG3 ARG A 21 5.106 -12.887 -8.931 1.00 0.00 H new ATOM 0 HD2 ARG A 21 4.588 -14.461 -10.569 1.00 0.00 H new ATOM 0 HD3 ARG A 21 2.991 -13.941 -10.068 1.00 0.00 H new ATOM 0 HE ARG A 21 3.978 -12.323 -12.266 1.00 0.00 H new ATOM 0 HH11 ARG A 21 2.541 -15.445 -11.437 1.00 0.00 H new ATOM 0 HH12 ARG A 21 1.810 -15.660 -13.031 1.00 0.00 H new ATOM 0 HH21 ARG A 21 3.035 -12.610 -14.306 1.00 0.00 H new ATOM 0 HH22 ARG A 21 2.089 -14.062 -14.647 1.00 0.00 H new ATOM 328 N TYR A 22 5.382 -12.272 -6.683 1.00 0.00 N ATOM 329 CA TYR A 22 5.752 -13.254 -5.670 1.00 0.00 C ATOM 330 C TYR A 22 5.388 -12.760 -4.273 1.00 0.00 C ATOM 331 O TYR A 22 4.910 -13.528 -3.438 1.00 0.00 O ATOM 332 CB TYR A 22 7.250 -13.554 -5.743 1.00 0.00 C ATOM 333 CG TYR A 22 7.611 -14.591 -6.783 1.00 0.00 C ATOM 334 CD1 TYR A 22 7.465 -14.323 -8.138 1.00 0.00 C ATOM 335 CD2 TYR A 22 8.096 -15.838 -6.410 1.00 0.00 C ATOM 336 CE1 TYR A 22 7.792 -15.268 -9.092 1.00 0.00 C ATOM 337 CE2 TYR A 22 8.427 -16.788 -7.357 1.00 0.00 C ATOM 338 CZ TYR A 22 8.273 -16.498 -8.696 1.00 0.00 C ATOM 339 OH TYR A 22 8.601 -17.442 -9.643 1.00 0.00 O ATOM 0 H TYR A 22 6.160 -11.944 -7.256 1.00 0.00 H new ATOM 0 HA TYR A 22 5.195 -14.170 -5.868 1.00 0.00 H new ATOM 0 HB2 TYR A 22 7.786 -12.631 -5.962 1.00 0.00 H new ATOM 0 HB3 TYR A 22 7.591 -13.897 -4.766 1.00 0.00 H new ATOM 0 HD1 TYR A 22 7.090 -13.360 -8.451 1.00 0.00 H new ATOM 0 HD2 TYR A 22 8.216 -16.069 -5.362 1.00 0.00 H new ATOM 0 HE1 TYR A 22 7.671 -15.044 -10.142 1.00 0.00 H new ATOM 0 HE2 TYR A 22 8.804 -17.752 -7.050 1.00 0.00 H new ATOM 0 HH TYR A 22 8.925 -18.253 -9.198 1.00 0.00 H new ATOM 349 N PHE A 23 5.619 -11.475 -4.027 1.00 0.00 N ATOM 350 CA PHE A 23 5.314 -10.879 -2.730 1.00 0.00 C ATOM 351 C PHE A 23 3.807 -10.780 -2.518 1.00 0.00 C ATOM 352 O PHE A 23 3.042 -10.664 -3.477 1.00 0.00 O ATOM 353 CB PHE A 23 5.948 -9.492 -2.621 1.00 0.00 C ATOM 354 CG PHE A 23 5.885 -8.910 -1.238 1.00 0.00 C ATOM 355 CD1 PHE A 23 6.256 -9.666 -0.137 1.00 0.00 C ATOM 356 CD2 PHE A 23 5.455 -7.609 -1.039 1.00 0.00 C ATOM 357 CE1 PHE A 23 6.199 -9.132 1.137 1.00 0.00 C ATOM 358 CE2 PHE A 23 5.396 -7.070 0.233 1.00 0.00 C ATOM 359 CZ PHE A 23 5.768 -7.833 1.322 1.00 0.00 C ATOM 0 H PHE A 23 6.016 -10.826 -4.707 1.00 0.00 H new ATOM 0 HA PHE A 23 5.730 -11.523 -1.955 1.00 0.00 H new ATOM 0 HB2 PHE A 23 6.990 -9.552 -2.934 1.00 0.00 H new ATOM 0 HB3 PHE A 23 5.446 -8.817 -3.314 1.00 0.00 H new ATOM 0 HD1 PHE A 23 6.593 -10.683 -0.276 1.00 0.00 H new ATOM 0 HD2 PHE A 23 5.162 -7.008 -1.887 1.00 0.00 H new ATOM 0 HE1 PHE A 23 6.491 -9.730 1.987 1.00 0.00 H new ATOM 0 HE2 PHE A 23 5.059 -6.054 0.375 1.00 0.00 H new ATOM 0 HZ PHE A 23 5.722 -7.415 2.317 1.00 0.00 H new ATOM 369 N LYS A 24 3.386 -10.826 -1.258 1.00 0.00 N ATOM 370 CA LYS A 24 1.970 -10.741 -0.923 1.00 0.00 C ATOM 371 C LYS A 24 1.545 -9.291 -0.717 1.00 0.00 C ATOM 372 O LYS A 24 0.486 -8.872 -1.184 1.00 0.00 O ATOM 373 CB LYS A 24 1.674 -11.555 0.339 1.00 0.00 C ATOM 374 CG LYS A 24 0.191 -11.789 0.575 1.00 0.00 C ATOM 375 CD LYS A 24 -0.056 -12.514 1.889 1.00 0.00 C ATOM 376 CE LYS A 24 -0.283 -14.002 1.670 1.00 0.00 C ATOM 377 NZ LYS A 24 -1.204 -14.578 2.688 1.00 0.00 N ATOM 0 H LYS A 24 4.005 -10.922 -0.453 1.00 0.00 H new ATOM 0 HA LYS A 24 1.400 -11.153 -1.756 1.00 0.00 H new ATOM 0 HB2 LYS A 24 2.179 -12.518 0.267 1.00 0.00 H new ATOM 0 HB3 LYS A 24 2.094 -11.038 1.202 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -0.333 -10.833 0.581 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -0.222 -12.373 -0.247 1.00 0.00 H new ATOM 0 HD2 LYS A 24 0.797 -12.369 2.552 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -0.924 -12.082 2.387 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -0.696 -14.164 0.674 1.00 0.00 H new ATOM 0 HE3 LYS A 24 0.673 -14.525 1.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -1.333 -15.593 2.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -0.799 -14.447 3.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -2.125 -14.097 2.635 1.00 0.00 H new ATOM 391 N GLY A 25 2.379 -8.528 -0.017 1.00 0.00 N ATOM 392 CA GLY A 25 2.072 -7.133 0.237 1.00 0.00 C ATOM 393 C GLY A 25 2.186 -6.771 1.705 1.00 0.00 C ATOM 394 O GLY A 25 2.366 -7.643 2.554 1.00 0.00 O ATOM 0 H GLY A 25 3.262 -8.851 0.379 1.00 0.00 H new ATOM 0 HA2 GLY A 25 2.748 -6.504 -0.342 1.00 0.00 H new ATOM 0 HA3 GLY A 25 1.061 -6.918 -0.109 1.00 0.00 H new ATOM 398 N ILE A 26 2.082 -5.480 2.003 1.00 0.00 N ATOM 399 CA ILE A 26 2.175 -5.003 3.379 1.00 0.00 C ATOM 400 C ILE A 26 0.945 -4.183 3.759 1.00 0.00 C ATOM 401 O ILE A 26 0.503 -3.321 2.999 1.00 0.00 O ATOM 402 CB ILE A 26 3.442 -4.151 3.593 1.00 0.00 C ATOM 403 CG1 ILE A 26 3.575 -3.748 5.063 1.00 0.00 C ATOM 404 CG2 ILE A 26 3.411 -2.918 2.700 1.00 0.00 C ATOM 405 CD1 ILE A 26 5.009 -3.574 5.514 1.00 0.00 C ATOM 0 H ILE A 26 1.933 -4.746 1.311 1.00 0.00 H new ATOM 0 HA ILE A 26 2.230 -5.883 4.019 1.00 0.00 H new ATOM 0 HB ILE A 26 4.311 -4.750 3.322 1.00 0.00 H new ATOM 0 HG12 ILE A 26 3.036 -2.815 5.226 1.00 0.00 H new ATOM 0 HG13 ILE A 26 3.097 -4.505 5.684 1.00 0.00 H new ATOM 0 HG21 ILE A 26 4.313 -2.328 2.864 1.00 0.00 H new ATOM 0 HG22 ILE A 26 3.364 -3.226 1.656 1.00 0.00 H new ATOM 0 HG23 ILE A 26 2.535 -2.316 2.941 1.00 0.00 H new ATOM 0 HD11 ILE A 26 5.028 -3.288 6.566 1.00 0.00 H new ATOM 0 HD12 ILE A 26 5.548 -4.512 5.383 1.00 0.00 H new ATOM 0 HD13 ILE A 26 5.486 -2.796 4.918 1.00 0.00 H new ATOM 417 N VAL A 27 0.399 -4.456 4.938 1.00 0.00 N ATOM 418 CA VAL A 27 -0.779 -3.744 5.420 1.00 0.00 C ATOM 419 C VAL A 27 -0.387 -2.600 6.349 1.00 0.00 C ATOM 420 O VAL A 27 0.430 -2.775 7.254 1.00 0.00 O ATOM 421 CB VAL A 27 -1.743 -4.687 6.163 1.00 0.00 C ATOM 422 CG1 VAL A 27 -3.049 -3.975 6.481 1.00 0.00 C ATOM 423 CG2 VAL A 27 -1.996 -5.944 5.346 1.00 0.00 C ATOM 0 H VAL A 27 0.753 -5.166 5.579 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.284 -3.340 4.543 1.00 0.00 H new ATOM 0 HB VAL A 27 -1.280 -4.982 7.105 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -3.717 -4.658 7.006 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -2.847 -3.109 7.111 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -3.520 -3.648 5.554 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.679 -6.598 5.887 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.437 -5.672 4.387 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -1.053 -6.464 5.177 1.00 0.00 H new ATOM 433 N TYR A 28 -0.974 -1.429 6.119 1.00 0.00 N ATOM 434 CA TYR A 28 -0.686 -0.256 6.937 1.00 0.00 C ATOM 435 C TYR A 28 -1.951 0.256 7.618 1.00 0.00 C ATOM 436 O TYR A 28 -3.056 -0.197 7.318 1.00 0.00 O ATOM 437 CB TYR A 28 -0.071 0.850 6.077 1.00 0.00 C ATOM 438 CG TYR A 28 1.440 0.889 6.129 1.00 0.00 C ATOM 439 CD1 TYR A 28 2.199 -0.106 5.525 1.00 0.00 C ATOM 440 CD2 TYR A 28 2.106 1.918 6.781 1.00 0.00 C ATOM 441 CE1 TYR A 28 3.580 -0.075 5.570 1.00 0.00 C ATOM 442 CE2 TYR A 28 3.487 1.957 6.829 1.00 0.00 C ATOM 443 CZ TYR A 28 4.218 0.958 6.223 1.00 0.00 C ATOM 444 OH TYR A 28 5.593 0.992 6.270 1.00 0.00 O ATOM 0 H TYR A 28 -1.651 -1.268 5.374 1.00 0.00 H new ATOM 0 HA TYR A 28 0.027 -0.546 7.709 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -0.387 0.713 5.043 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -0.462 1.813 6.405 1.00 0.00 H new ATOM 0 HD1 TYR A 28 1.702 -0.916 5.012 1.00 0.00 H new ATOM 0 HD2 TYR A 28 1.536 2.701 7.259 1.00 0.00 H new ATOM 0 HE1 TYR A 28 4.156 -0.856 5.096 1.00 0.00 H new ATOM 0 HE2 TYR A 28 3.990 2.766 7.338 1.00 0.00 H new ATOM 0 HH TYR A 28 5.958 0.563 5.468 1.00 0.00 H new ATOM 454 N ALA A 29 -1.782 1.201 8.537 1.00 0.00 N ATOM 455 CA ALA A 29 -2.909 1.775 9.260 1.00 0.00 C ATOM 456 C ALA A 29 -2.761 3.287 9.397 1.00 0.00 C ATOM 457 O ALA A 29 -2.120 3.775 10.327 1.00 0.00 O ATOM 458 CB ALA A 29 -3.039 1.129 10.632 1.00 0.00 C ATOM 0 H ALA A 29 -0.874 1.585 8.798 1.00 0.00 H new ATOM 0 HA ALA A 29 -3.816 1.576 8.689 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -3.885 1.567 11.162 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -3.199 0.057 10.516 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -2.126 1.300 11.202 1.00 0.00 H new ATOM 464 N ILE A 30 -3.358 4.021 8.464 1.00 0.00 N ATOM 465 CA ILE A 30 -3.293 5.477 8.480 1.00 0.00 C ATOM 466 C ILE A 30 -4.105 6.050 9.636 1.00 0.00 C ATOM 467 O ILE A 30 -5.296 6.328 9.494 1.00 0.00 O ATOM 468 CB ILE A 30 -3.807 6.079 7.158 1.00 0.00 C ATOM 469 CG1 ILE A 30 -3.145 5.388 5.965 1.00 0.00 C ATOM 470 CG2 ILE A 30 -3.546 7.577 7.121 1.00 0.00 C ATOM 471 CD1 ILE A 30 -1.634 5.466 5.983 1.00 0.00 C ATOM 0 H ILE A 30 -3.892 3.631 7.687 1.00 0.00 H new ATOM 0 HA ILE A 30 -2.244 5.745 8.607 1.00 0.00 H new ATOM 0 HB ILE A 30 -4.883 5.916 7.097 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -3.446 4.341 5.949 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -3.513 5.840 5.044 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.915 7.987 6.181 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -4.061 8.057 7.953 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -2.475 7.762 7.202 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -1.233 4.955 5.108 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -1.323 6.511 5.968 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -1.256 4.988 6.887 1.00 0.00 H new ATOM 483 N SER A 31 -3.452 6.225 10.782 1.00 0.00 N ATOM 484 CA SER A 31 -4.114 6.767 11.963 1.00 0.00 C ATOM 485 C SER A 31 -3.690 8.213 12.209 1.00 0.00 C ATOM 486 O SER A 31 -2.644 8.651 11.733 1.00 0.00 O ATOM 487 CB SER A 31 -3.794 5.908 13.189 1.00 0.00 C ATOM 488 OG SER A 31 -4.979 5.476 13.834 1.00 0.00 O ATOM 0 H SER A 31 -2.466 5.999 10.917 1.00 0.00 H new ATOM 0 HA SER A 31 -5.190 6.751 11.789 1.00 0.00 H new ATOM 0 HB2 SER A 31 -3.205 5.042 12.886 1.00 0.00 H new ATOM 0 HB3 SER A 31 -3.184 6.480 13.888 1.00 0.00 H new ATOM 0 HG SER A 31 -4.747 4.928 14.612 1.00 0.00 H new ATOM 494 N PRO A 32 -4.502 8.975 12.962 1.00 0.00 N ATOM 495 CA PRO A 32 -4.206 10.378 13.270 1.00 0.00 C ATOM 496 C PRO A 32 -3.002 10.526 14.194 1.00 0.00 C ATOM 497 O PRO A 32 -2.307 11.542 14.169 1.00 0.00 O ATOM 498 CB PRO A 32 -5.477 10.870 13.965 1.00 0.00 C ATOM 499 CG PRO A 32 -6.100 9.640 14.529 1.00 0.00 C ATOM 500 CD PRO A 32 -5.770 8.531 13.570 1.00 0.00 C ATOM 0 HA PRO A 32 -3.950 10.945 12.375 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -5.246 11.592 14.748 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -6.146 11.366 13.262 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -5.709 9.425 15.523 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -7.179 9.760 14.630 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -5.658 7.576 14.083 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -6.551 8.401 12.821 1.00 0.00 H new ATOM 508 N ASP A 33 -2.759 9.505 15.010 1.00 0.00 N ATOM 509 CA ASP A 33 -1.638 9.521 15.943 1.00 0.00 C ATOM 510 C ASP A 33 -0.418 8.830 15.341 1.00 0.00 C ATOM 511 O ASP A 33 0.721 9.191 15.636 1.00 0.00 O ATOM 512 CB ASP A 33 -2.029 8.839 17.256 1.00 0.00 C ATOM 513 CG ASP A 33 -1.448 9.542 18.467 1.00 0.00 C ATOM 514 OD1 ASP A 33 -0.385 10.182 18.330 1.00 0.00 O ATOM 515 OD2 ASP A 33 -2.059 9.453 19.554 1.00 0.00 O ATOM 0 H ASP A 33 -3.324 8.656 15.044 1.00 0.00 H new ATOM 0 HA ASP A 33 -1.381 10.561 16.145 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -3.115 8.814 17.340 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -1.687 7.804 17.241 1.00 0.00 H new ATOM 520 N ARG A 34 -0.666 7.834 14.497 1.00 0.00 N ATOM 521 CA ARG A 34 0.412 7.092 13.853 1.00 0.00 C ATOM 522 C ARG A 34 1.211 7.995 12.918 1.00 0.00 C ATOM 523 O ARG A 34 2.330 8.398 13.234 1.00 0.00 O ATOM 524 CB ARG A 34 -0.155 5.901 13.077 1.00 0.00 C ATOM 525 CG ARG A 34 0.182 4.555 13.698 1.00 0.00 C ATOM 526 CD ARG A 34 -0.994 3.594 13.623 1.00 0.00 C ATOM 527 NE ARG A 34 -0.613 2.232 13.989 1.00 0.00 N ATOM 528 CZ ARG A 34 -0.332 1.851 15.233 1.00 0.00 C ATOM 529 NH1 ARG A 34 -0.388 2.723 16.232 1.00 0.00 N ATOM 530 NH2 ARG A 34 0.006 0.592 15.479 1.00 0.00 N ATOM 0 H ARG A 34 -1.603 7.522 14.243 1.00 0.00 H new ATOM 0 HA ARG A 34 1.082 6.723 14.629 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -1.238 6.002 13.014 1.00 0.00 H new ATOM 0 HB3 ARG A 34 0.228 5.927 12.057 1.00 0.00 H new ATOM 0 HG2 ARG A 34 1.040 4.121 13.185 1.00 0.00 H new ATOM 0 HG3 ARG A 34 0.471 4.696 14.739 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -1.787 3.939 14.287 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -1.401 3.597 12.612 1.00 0.00 H new ATOM 0 HE ARG A 34 -0.559 1.533 13.248 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -0.648 3.692 16.049 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -0.171 2.424 17.183 1.00 0.00 H new ATOM 0 HH21 ARG A 34 0.050 -0.083 14.715 1.00 0.00 H new ATOM 0 HH22 ARG A 34 0.222 0.299 16.432 1.00 0.00 H new ATOM 544 N PHE A 35 0.630 8.308 11.764 1.00 0.00 N ATOM 545 CA PHE A 35 1.288 9.162 10.784 1.00 0.00 C ATOM 546 C PHE A 35 0.714 10.575 10.820 1.00 0.00 C ATOM 547 O PHE A 35 -0.405 10.790 11.285 1.00 0.00 O ATOM 548 CB PHE A 35 1.135 8.574 9.379 1.00 0.00 C ATOM 549 CG PHE A 35 1.561 7.137 9.280 1.00 0.00 C ATOM 550 CD1 PHE A 35 2.887 6.809 9.047 1.00 0.00 C ATOM 551 CD2 PHE A 35 0.635 6.115 9.419 1.00 0.00 C ATOM 552 CE1 PHE A 35 3.282 5.487 8.955 1.00 0.00 C ATOM 553 CE2 PHE A 35 1.025 4.792 9.328 1.00 0.00 C ATOM 554 CZ PHE A 35 2.350 4.478 9.096 1.00 0.00 C ATOM 0 H PHE A 35 -0.296 7.982 11.485 1.00 0.00 H new ATOM 0 HA PHE A 35 2.347 9.212 11.037 1.00 0.00 H new ATOM 0 HB2 PHE A 35 0.093 8.658 9.070 1.00 0.00 H new ATOM 0 HB3 PHE A 35 1.723 9.168 8.679 1.00 0.00 H new ATOM 0 HD1 PHE A 35 3.620 7.594 8.936 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -0.402 6.355 9.600 1.00 0.00 H new ATOM 0 HE1 PHE A 35 4.318 5.244 8.773 1.00 0.00 H new ATOM 0 HE2 PHE A 35 0.294 4.004 9.438 1.00 0.00 H new ATOM 0 HZ PHE A 35 2.657 3.445 9.025 1.00 0.00 H new ATOM 564 N ARG A 36 1.489 11.535 10.325 1.00 0.00 N ATOM 565 CA ARG A 36 1.059 12.929 10.300 1.00 0.00 C ATOM 566 C ARG A 36 1.218 13.521 8.903 1.00 0.00 C ATOM 567 O ARG A 36 0.317 14.189 8.395 1.00 0.00 O ATOM 568 CB ARG A 36 1.862 13.751 11.310 1.00 0.00 C ATOM 569 CG ARG A 36 1.161 15.027 11.749 1.00 0.00 C ATOM 570 CD ARG A 36 2.085 16.232 11.658 1.00 0.00 C ATOM 571 NE ARG A 36 1.481 17.430 12.239 1.00 0.00 N ATOM 572 CZ ARG A 36 1.898 18.667 11.984 1.00 0.00 C ATOM 573 NH1 ARG A 36 2.918 18.876 11.161 1.00 0.00 N ATOM 574 NH2 ARG A 36 1.294 19.701 12.555 1.00 0.00 N ATOM 0 H ARG A 36 2.418 11.373 9.936 1.00 0.00 H new ATOM 0 HA ARG A 36 0.004 12.963 10.572 1.00 0.00 H new ATOM 0 HB2 ARG A 36 2.064 13.137 12.187 1.00 0.00 H new ATOM 0 HB3 ARG A 36 2.826 14.008 10.872 1.00 0.00 H new ATOM 0 HG2 ARG A 36 0.282 15.193 11.126 1.00 0.00 H new ATOM 0 HG3 ARG A 36 0.808 14.915 12.774 1.00 0.00 H new ATOM 0 HD2 ARG A 36 3.020 16.011 12.173 1.00 0.00 H new ATOM 0 HD3 ARG A 36 2.333 16.421 10.613 1.00 0.00 H new ATOM 0 HE ARG A 36 0.694 17.310 12.877 1.00 0.00 H new ATOM 0 HH11 ARG A 36 3.387 18.085 10.720 1.00 0.00 H new ATOM 0 HH12 ARG A 36 3.233 19.827 10.970 1.00 0.00 H new ATOM 0 HH21 ARG A 36 0.510 19.547 13.189 1.00 0.00 H new ATOM 0 HH22 ARG A 36 1.613 20.650 12.360 1.00 0.00 H new ATOM 588 N SER A 37 2.368 13.272 8.287 1.00 0.00 N ATOM 589 CA SER A 37 2.647 13.781 6.949 1.00 0.00 C ATOM 590 C SER A 37 3.031 12.646 6.005 1.00 0.00 C ATOM 591 O SER A 37 3.405 11.559 6.445 1.00 0.00 O ATOM 592 CB SER A 37 3.766 14.821 6.998 1.00 0.00 C ATOM 593 OG SER A 37 3.522 15.787 8.006 1.00 0.00 O ATOM 0 H SER A 37 3.123 12.720 8.693 1.00 0.00 H new ATOM 0 HA SER A 37 1.740 14.253 6.571 1.00 0.00 H new ATOM 0 HB2 SER A 37 4.718 14.326 7.187 1.00 0.00 H new ATOM 0 HB3 SER A 37 3.850 15.315 6.030 1.00 0.00 H new ATOM 0 HG SER A 37 4.253 16.439 8.018 1.00 0.00 H new ATOM 599 N PHE A 38 2.937 12.907 4.705 1.00 0.00 N ATOM 600 CA PHE A 38 3.276 11.909 3.698 1.00 0.00 C ATOM 601 C PHE A 38 4.733 11.480 3.826 1.00 0.00 C ATOM 602 O PHE A 38 5.083 10.338 3.528 1.00 0.00 O ATOM 603 CB PHE A 38 3.016 12.461 2.296 1.00 0.00 C ATOM 604 CG PHE A 38 2.549 11.421 1.317 1.00 0.00 C ATOM 605 CD1 PHE A 38 1.511 10.562 1.643 1.00 0.00 C ATOM 606 CD2 PHE A 38 3.147 11.302 0.074 1.00 0.00 C ATOM 607 CE1 PHE A 38 1.078 9.604 0.745 1.00 0.00 C ATOM 608 CE2 PHE A 38 2.720 10.346 -0.828 1.00 0.00 C ATOM 609 CZ PHE A 38 1.684 9.497 -0.492 1.00 0.00 C ATOM 0 H PHE A 38 2.629 13.802 4.325 1.00 0.00 H new ATOM 0 HA PHE A 38 2.644 11.036 3.860 1.00 0.00 H new ATOM 0 HB2 PHE A 38 2.268 13.251 2.359 1.00 0.00 H new ATOM 0 HB3 PHE A 38 3.931 12.918 1.919 1.00 0.00 H new ATOM 0 HD1 PHE A 38 1.035 10.642 2.609 1.00 0.00 H new ATOM 0 HD2 PHE A 38 3.957 11.964 -0.194 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.268 8.941 1.010 1.00 0.00 H new ATOM 0 HE2 PHE A 38 3.196 10.263 -1.794 1.00 0.00 H new ATOM 0 HZ PHE A 38 1.348 8.750 -1.196 1.00 0.00 H new ATOM 619 N GLU A 39 5.580 12.403 4.269 1.00 0.00 N ATOM 620 CA GLU A 39 7.001 12.120 4.435 1.00 0.00 C ATOM 621 C GLU A 39 7.221 11.030 5.479 1.00 0.00 C ATOM 622 O GLU A 39 8.058 10.145 5.300 1.00 0.00 O ATOM 623 CB GLU A 39 7.751 13.390 4.842 1.00 0.00 C ATOM 624 CG GLU A 39 7.474 14.577 3.934 1.00 0.00 C ATOM 625 CD GLU A 39 8.541 14.761 2.872 1.00 0.00 C ATOM 626 OE1 GLU A 39 9.560 15.423 3.163 1.00 0.00 O ATOM 627 OE2 GLU A 39 8.358 14.242 1.751 1.00 0.00 O ATOM 0 H GLU A 39 5.307 13.353 4.520 1.00 0.00 H new ATOM 0 HA GLU A 39 7.389 11.767 3.480 1.00 0.00 H new ATOM 0 HB2 GLU A 39 7.476 13.653 5.864 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.822 13.185 4.842 1.00 0.00 H new ATOM 0 HG2 GLU A 39 6.506 14.442 3.452 1.00 0.00 H new ATOM 0 HG3 GLU A 39 7.407 15.483 4.537 1.00 0.00 H new ATOM 634 N ALA A 40 6.464 11.100 6.570 1.00 0.00 N ATOM 635 CA ALA A 40 6.577 10.118 7.641 1.00 0.00 C ATOM 636 C ALA A 40 6.222 8.721 7.145 1.00 0.00 C ATOM 637 O ALA A 40 6.831 7.732 7.553 1.00 0.00 O ATOM 638 CB ALA A 40 5.683 10.509 8.809 1.00 0.00 C ATOM 0 H ALA A 40 5.767 11.826 6.735 1.00 0.00 H new ATOM 0 HA ALA A 40 7.613 10.102 7.979 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.776 9.768 9.603 1.00 0.00 H new ATOM 0 HB2 ALA A 40 5.985 11.486 9.187 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.647 10.554 8.475 1.00 0.00 H new ATOM 644 N LEU A 41 5.231 8.646 6.262 1.00 0.00 N ATOM 645 CA LEU A 41 4.794 7.370 5.709 1.00 0.00 C ATOM 646 C LEU A 41 5.826 6.818 4.730 1.00 0.00 C ATOM 647 O LEU A 41 6.070 5.613 4.685 1.00 0.00 O ATOM 648 CB LEU A 41 3.443 7.531 5.007 1.00 0.00 C ATOM 649 CG LEU A 41 2.802 6.227 4.530 1.00 0.00 C ATOM 650 CD1 LEU A 41 2.042 5.560 5.665 1.00 0.00 C ATOM 651 CD2 LEU A 41 1.879 6.491 3.349 1.00 0.00 C ATOM 0 H LEU A 41 4.716 9.455 5.914 1.00 0.00 H new ATOM 0 HA LEU A 41 4.687 6.663 6.532 1.00 0.00 H new ATOM 0 HB2 LEU A 41 2.754 8.029 5.689 1.00 0.00 H new ATOM 0 HB3 LEU A 41 3.573 8.190 4.148 1.00 0.00 H new ATOM 0 HG LEU A 41 3.593 5.551 4.205 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.593 4.634 5.307 1.00 0.00 H new ATOM 0 HD12 LEU A 41 2.729 5.338 6.482 1.00 0.00 H new ATOM 0 HD13 LEU A 41 1.259 6.229 6.021 1.00 0.00 H new ATOM 0 HD21 LEU A 41 1.430 5.553 3.021 1.00 0.00 H new ATOM 0 HD22 LEU A 41 1.093 7.184 3.649 1.00 0.00 H new ATOM 0 HD23 LEU A 41 2.452 6.925 2.530 1.00 0.00 H new ATOM 663 N LEU A 42 6.428 7.709 3.949 1.00 0.00 N ATOM 664 CA LEU A 42 7.433 7.311 2.971 1.00 0.00 C ATOM 665 C LEU A 42 8.651 6.701 3.657 1.00 0.00 C ATOM 666 O LEU A 42 9.222 5.722 3.176 1.00 0.00 O ATOM 667 CB LEU A 42 7.859 8.515 2.128 1.00 0.00 C ATOM 668 CG LEU A 42 6.825 8.988 1.106 1.00 0.00 C ATOM 669 CD1 LEU A 42 7.190 10.366 0.575 1.00 0.00 C ATOM 670 CD2 LEU A 42 6.709 7.987 -0.034 1.00 0.00 C ATOM 0 H LEU A 42 6.237 8.711 3.975 1.00 0.00 H new ATOM 0 HA LEU A 42 6.990 6.557 2.320 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.091 9.344 2.797 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.779 8.263 1.601 1.00 0.00 H new ATOM 0 HG LEU A 42 5.857 9.059 1.601 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.443 10.686 -0.151 1.00 0.00 H new ATOM 0 HD12 LEU A 42 7.222 11.077 1.400 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.168 10.324 0.095 1.00 0.00 H new ATOM 0 HD21 LEU A 42 5.969 8.338 -0.753 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.675 7.885 -0.528 1.00 0.00 H new ATOM 0 HD23 LEU A 42 6.400 7.019 0.361 1.00 0.00 H new ATOM 682 N ALA A 43 9.043 7.284 4.786 1.00 0.00 N ATOM 683 CA ALA A 43 10.192 6.797 5.538 1.00 0.00 C ATOM 684 C ALA A 43 9.952 5.381 6.053 1.00 0.00 C ATOM 685 O ALA A 43 10.883 4.584 6.164 1.00 0.00 O ATOM 686 CB ALA A 43 10.502 7.735 6.694 1.00 0.00 C ATOM 0 H ALA A 43 8.581 8.094 5.199 1.00 0.00 H new ATOM 0 HA ALA A 43 11.050 6.770 4.866 1.00 0.00 H new ATOM 0 HB1 ALA A 43 11.363 7.359 7.247 1.00 0.00 H new ATOM 0 HB2 ALA A 43 10.726 8.729 6.306 1.00 0.00 H new ATOM 0 HB3 ALA A 43 9.640 7.791 7.359 1.00 0.00 H new ATOM 692 N ASP A 44 8.697 5.077 6.365 1.00 0.00 N ATOM 693 CA ASP A 44 8.334 3.756 6.868 1.00 0.00 C ATOM 694 C ASP A 44 8.209 2.754 5.726 1.00 0.00 C ATOM 695 O ASP A 44 8.543 1.579 5.879 1.00 0.00 O ATOM 696 CB ASP A 44 7.018 3.828 7.645 1.00 0.00 C ATOM 697 CG ASP A 44 7.231 4.121 9.118 1.00 0.00 C ATOM 698 OD1 ASP A 44 8.173 3.550 9.706 1.00 0.00 O ATOM 699 OD2 ASP A 44 6.456 4.922 9.682 1.00 0.00 O ATOM 0 H ASP A 44 7.915 5.726 6.279 1.00 0.00 H new ATOM 0 HA ASP A 44 9.126 3.419 7.537 1.00 0.00 H new ATOM 0 HB2 ASP A 44 6.385 4.602 7.211 1.00 0.00 H new ATOM 0 HB3 ASP A 44 6.484 2.883 7.539 1.00 0.00 H new ATOM 704 N LEU A 45 7.724 3.226 4.581 1.00 0.00 N ATOM 705 CA LEU A 45 7.554 2.370 3.413 1.00 0.00 C ATOM 706 C LEU A 45 8.905 1.904 2.878 1.00 0.00 C ATOM 707 O LEU A 45 9.022 0.807 2.330 1.00 0.00 O ATOM 708 CB LEU A 45 6.787 3.113 2.318 1.00 0.00 C ATOM 709 CG LEU A 45 5.264 3.008 2.409 1.00 0.00 C ATOM 710 CD1 LEU A 45 4.603 4.004 1.470 1.00 0.00 C ATOM 711 CD2 LEU A 45 4.808 1.591 2.093 1.00 0.00 C ATOM 0 H LEU A 45 7.442 4.196 4.438 1.00 0.00 H new ATOM 0 HA LEU A 45 6.982 1.493 3.716 1.00 0.00 H new ATOM 0 HB2 LEU A 45 7.066 4.166 2.351 1.00 0.00 H new ATOM 0 HB3 LEU A 45 7.105 2.729 1.349 1.00 0.00 H new ATOM 0 HG LEU A 45 4.963 3.247 3.429 1.00 0.00 H new ATOM 0 HD11 LEU A 45 3.520 3.914 1.549 1.00 0.00 H new ATOM 0 HD12 LEU A 45 4.904 5.016 1.742 1.00 0.00 H new ATOM 0 HD13 LEU A 45 4.911 3.797 0.445 1.00 0.00 H new ATOM 0 HD21 LEU A 45 3.722 1.534 2.162 1.00 0.00 H new ATOM 0 HD22 LEU A 45 5.121 1.324 1.084 1.00 0.00 H new ATOM 0 HD23 LEU A 45 5.254 0.898 2.806 1.00 0.00 H new ATOM 723 N THR A 46 9.921 2.745 3.039 1.00 0.00 N ATOM 724 CA THR A 46 11.264 2.418 2.572 1.00 0.00 C ATOM 725 C THR A 46 11.897 1.340 3.446 1.00 0.00 C ATOM 726 O THR A 46 12.694 0.532 2.971 1.00 0.00 O ATOM 727 CB THR A 46 12.143 3.670 2.569 1.00 0.00 C ATOM 728 OG1 THR A 46 11.464 4.759 1.970 1.00 0.00 O ATOM 729 CG2 THR A 46 13.449 3.481 1.827 1.00 0.00 C ATOM 0 H THR A 46 9.841 3.657 3.489 1.00 0.00 H new ATOM 0 HA THR A 46 11.185 2.035 1.555 1.00 0.00 H new ATOM 0 HB THR A 46 12.363 3.871 3.617 1.00 0.00 H new ATOM 0 HG1 THR A 46 10.780 5.096 2.585 1.00 0.00 H new ATOM 0 HG21 THR A 46 14.025 4.406 1.863 1.00 0.00 H new ATOM 0 HG22 THR A 46 14.021 2.679 2.295 1.00 0.00 H new ATOM 0 HG23 THR A 46 13.243 3.222 0.789 1.00 0.00 H new ATOM 737 N ARG A 47 11.537 1.335 4.725 1.00 0.00 N ATOM 738 CA ARG A 47 12.069 0.356 5.665 1.00 0.00 C ATOM 739 C ARG A 47 11.695 -1.061 5.244 1.00 0.00 C ATOM 740 O ARG A 47 12.469 -2.000 5.431 1.00 0.00 O ATOM 741 CB ARG A 47 11.547 0.636 7.075 1.00 0.00 C ATOM 742 CG ARG A 47 12.466 0.129 8.175 1.00 0.00 C ATOM 743 CD ARG A 47 11.684 -0.250 9.423 1.00 0.00 C ATOM 744 NE ARG A 47 12.238 -1.432 10.079 1.00 0.00 N ATOM 745 CZ ARG A 47 11.983 -1.767 11.341 1.00 0.00 C ATOM 746 NH1 ARG A 47 11.183 -1.014 12.088 1.00 0.00 N ATOM 747 NH2 ARG A 47 12.528 -2.860 11.860 1.00 0.00 N ATOM 0 H ARG A 47 10.879 1.998 5.134 1.00 0.00 H new ATOM 0 HA ARG A 47 13.156 0.441 5.664 1.00 0.00 H new ATOM 0 HB2 ARG A 47 11.408 1.710 7.195 1.00 0.00 H new ATOM 0 HB3 ARG A 47 10.567 0.173 7.189 1.00 0.00 H new ATOM 0 HG2 ARG A 47 13.022 -0.737 7.816 1.00 0.00 H new ATOM 0 HG3 ARG A 47 13.198 0.898 8.422 1.00 0.00 H new ATOM 0 HD2 ARG A 47 11.688 0.587 10.121 1.00 0.00 H new ATOM 0 HD3 ARG A 47 10.644 -0.438 9.156 1.00 0.00 H new ATOM 0 HE ARG A 47 12.857 -2.036 9.538 1.00 0.00 H new ATOM 0 HH11 ARG A 47 10.760 -0.173 11.695 1.00 0.00 H new ATOM 0 HH12 ARG A 47 10.992 -1.277 13.055 1.00 0.00 H new ATOM 0 HH21 ARG A 47 13.142 -3.443 11.291 1.00 0.00 H new ATOM 0 HH22 ARG A 47 12.333 -3.117 12.828 1.00 0.00 H new ATOM 761 N THR A 48 10.503 -1.210 4.676 1.00 0.00 N ATOM 762 CA THR A 48 10.025 -2.512 4.228 1.00 0.00 C ATOM 763 C THR A 48 10.097 -2.625 2.709 1.00 0.00 C ATOM 764 O THR A 48 10.947 -3.334 2.168 1.00 0.00 O ATOM 765 CB THR A 48 8.589 -2.743 4.703 1.00 0.00 C ATOM 766 OG1 THR A 48 7.942 -1.510 4.958 1.00 0.00 O ATOM 767 CG2 THR A 48 8.502 -3.576 5.963 1.00 0.00 C ATOM 0 H THR A 48 9.850 -0.444 4.515 1.00 0.00 H new ATOM 0 HA THR A 48 10.670 -3.277 4.661 1.00 0.00 H new ATOM 0 HB THR A 48 8.101 -3.286 3.894 1.00 0.00 H new ATOM 0 HG1 THR A 48 7.274 -1.631 5.665 1.00 0.00 H new ATOM 0 HG21 THR A 48 7.457 -3.702 6.245 1.00 0.00 H new ATOM 0 HG22 THR A 48 8.950 -4.554 5.784 1.00 0.00 H new ATOM 0 HG23 THR A 48 9.037 -3.074 6.769 1.00 0.00 H new ATOM 775 N LEU A 49 9.201 -1.921 2.025 1.00 0.00 N ATOM 776 CA LEU A 49 9.162 -1.943 0.568 1.00 0.00 C ATOM 777 C LEU A 49 10.327 -1.151 -0.020 1.00 0.00 C ATOM 778 O LEU A 49 10.159 -0.011 -0.453 1.00 0.00 O ATOM 779 CB LEU A 49 7.835 -1.371 0.063 1.00 0.00 C ATOM 780 CG LEU A 49 6.584 -2.027 0.649 1.00 0.00 C ATOM 781 CD1 LEU A 49 5.328 -1.362 0.106 1.00 0.00 C ATOM 782 CD2 LEU A 49 6.574 -3.518 0.348 1.00 0.00 C ATOM 0 H LEU A 49 8.492 -1.328 2.457 1.00 0.00 H new ATOM 0 HA LEU A 49 9.250 -2.980 0.243 1.00 0.00 H new ATOM 0 HB2 LEU A 49 7.807 -0.305 0.288 1.00 0.00 H new ATOM 0 HB3 LEU A 49 7.804 -1.469 -1.022 1.00 0.00 H new ATOM 0 HG LEU A 49 6.600 -1.895 1.731 1.00 0.00 H new ATOM 0 HD11 LEU A 49 4.448 -1.842 0.534 1.00 0.00 H new ATOM 0 HD12 LEU A 49 5.331 -0.305 0.373 1.00 0.00 H new ATOM 0 HD13 LEU A 49 5.304 -1.462 -0.979 1.00 0.00 H new ATOM 0 HD21 LEU A 49 5.677 -3.969 0.772 1.00 0.00 H new ATOM 0 HD22 LEU A 49 6.582 -3.671 -0.731 1.00 0.00 H new ATOM 0 HD23 LEU A 49 7.456 -3.984 0.787 1.00 0.00 H new ATOM 794 N SER A 50 11.506 -1.765 -0.033 1.00 0.00 N ATOM 795 CA SER A 50 12.698 -1.117 -0.568 1.00 0.00 C ATOM 796 C SER A 50 13.870 -2.092 -0.617 1.00 0.00 C ATOM 797 O SER A 50 14.351 -2.554 0.418 1.00 0.00 O ATOM 798 CB SER A 50 13.068 0.100 0.282 1.00 0.00 C ATOM 799 OG SER A 50 13.783 1.056 -0.481 1.00 0.00 O ATOM 0 H SER A 50 11.661 -2.709 0.320 1.00 0.00 H new ATOM 0 HA SER A 50 12.478 -0.788 -1.584 1.00 0.00 H new ATOM 0 HB2 SER A 50 12.163 0.555 0.685 1.00 0.00 H new ATOM 0 HB3 SER A 50 13.672 -0.216 1.133 1.00 0.00 H new ATOM 0 HG SER A 50 13.920 0.714 -1.389 1.00 0.00 H new ATOM 805 N ASP A 51 14.327 -2.399 -1.826 1.00 0.00 N ATOM 806 CA ASP A 51 15.444 -3.318 -2.012 1.00 0.00 C ATOM 807 C ASP A 51 16.466 -2.741 -2.985 1.00 0.00 C ATOM 808 O ASP A 51 16.303 -1.627 -3.484 1.00 0.00 O ATOM 809 CB ASP A 51 14.939 -4.672 -2.519 1.00 0.00 C ATOM 810 CG ASP A 51 15.264 -5.805 -1.565 1.00 0.00 C ATOM 811 OD1 ASP A 51 14.516 -5.985 -0.580 1.00 0.00 O ATOM 812 OD2 ASP A 51 16.265 -6.512 -1.802 1.00 0.00 O ATOM 0 H ASP A 51 13.941 -2.025 -2.693 1.00 0.00 H new ATOM 0 HA ASP A 51 15.931 -3.461 -1.047 1.00 0.00 H new ATOM 0 HB2 ASP A 51 13.860 -4.622 -2.666 1.00 0.00 H new ATOM 0 HB3 ASP A 51 15.384 -4.881 -3.492 1.00 0.00 H new ATOM 817 N ASN A 52 17.520 -3.504 -3.252 1.00 0.00 N ATOM 818 CA ASN A 52 18.569 -3.068 -4.167 1.00 0.00 C ATOM 819 C ASN A 52 18.360 -3.657 -5.559 1.00 0.00 C ATOM 820 O ASN A 52 19.318 -3.884 -6.298 1.00 0.00 O ATOM 821 CB ASN A 52 19.945 -3.470 -3.627 1.00 0.00 C ATOM 822 CG ASN A 52 20.796 -2.269 -3.262 1.00 0.00 C ATOM 823 OD1 ASN A 52 20.559 -1.612 -2.248 1.00 0.00 O ATOM 824 ND2 ASN A 52 21.793 -1.978 -4.087 1.00 0.00 N ATOM 0 H ASN A 52 17.671 -4.428 -2.848 1.00 0.00 H new ATOM 0 HA ASN A 52 18.521 -1.982 -4.244 1.00 0.00 H new ATOM 0 HB2 ASN A 52 19.817 -4.102 -2.748 1.00 0.00 H new ATOM 0 HB3 ASN A 52 20.466 -4.067 -4.376 1.00 0.00 H new ATOM 0 HD21 ASN A 52 22.400 -1.182 -3.892 1.00 0.00 H new ATOM 0 HD22 ASN A 52 21.953 -2.550 -4.916 1.00 0.00 H new ATOM 831 N VAL A 53 17.101 -3.900 -5.912 1.00 0.00 N ATOM 832 CA VAL A 53 16.768 -4.463 -7.215 1.00 0.00 C ATOM 833 C VAL A 53 15.480 -3.855 -7.761 1.00 0.00 C ATOM 834 O VAL A 53 15.414 -3.460 -8.924 1.00 0.00 O ATOM 835 CB VAL A 53 16.612 -5.993 -7.145 1.00 0.00 C ATOM 836 CG1 VAL A 53 16.462 -6.580 -8.540 1.00 0.00 C ATOM 837 CG2 VAL A 53 17.793 -6.618 -6.419 1.00 0.00 C ATOM 0 H VAL A 53 16.296 -3.716 -5.314 1.00 0.00 H new ATOM 0 HA VAL A 53 17.594 -4.222 -7.884 1.00 0.00 H new ATOM 0 HB VAL A 53 15.707 -6.222 -6.582 1.00 0.00 H new ATOM 0 HG11 VAL A 53 16.353 -7.662 -8.470 1.00 0.00 H new ATOM 0 HG12 VAL A 53 15.579 -6.157 -9.020 1.00 0.00 H new ATOM 0 HG13 VAL A 53 17.346 -6.342 -9.132 1.00 0.00 H new ATOM 0 HG21 VAL A 53 17.665 -7.700 -6.380 1.00 0.00 H new ATOM 0 HG22 VAL A 53 18.714 -6.381 -6.951 1.00 0.00 H new ATOM 0 HG23 VAL A 53 17.848 -6.222 -5.405 1.00 0.00 H new ATOM 847 N ASN A 54 14.459 -3.786 -6.913 1.00 0.00 N ATOM 848 CA ASN A 54 13.171 -3.227 -7.311 1.00 0.00 C ATOM 849 C ASN A 54 13.146 -1.717 -7.102 1.00 0.00 C ATOM 850 O ASN A 54 12.836 -0.958 -8.020 1.00 0.00 O ATOM 851 CB ASN A 54 12.041 -3.883 -6.517 1.00 0.00 C ATOM 852 CG ASN A 54 11.605 -5.206 -7.116 1.00 0.00 C ATOM 853 OD1 ASN A 54 11.312 -5.295 -8.308 1.00 0.00 O ATOM 854 ND2 ASN A 54 11.559 -6.242 -6.288 1.00 0.00 N ATOM 0 H ASN A 54 14.498 -4.110 -5.947 1.00 0.00 H new ATOM 0 HA ASN A 54 13.026 -3.431 -8.372 1.00 0.00 H new ATOM 0 HB2 ASN A 54 12.368 -4.043 -5.490 1.00 0.00 H new ATOM 0 HB3 ASN A 54 11.188 -3.206 -6.478 1.00 0.00 H new ATOM 0 HD21 ASN A 54 11.272 -7.158 -6.633 1.00 0.00 H new ATOM 0 HD22 ASN A 54 11.811 -6.122 -5.307 1.00 0.00 H new ATOM 861 N LEU A 55 13.476 -1.286 -5.888 1.00 0.00 N ATOM 862 CA LEU A 55 13.490 0.134 -5.558 1.00 0.00 C ATOM 863 C LEU A 55 14.750 0.500 -4.776 1.00 0.00 C ATOM 864 O LEU A 55 14.698 0.724 -3.567 1.00 0.00 O ATOM 865 CB LEU A 55 12.244 0.503 -4.748 1.00 0.00 C ATOM 866 CG LEU A 55 10.919 0.032 -5.347 1.00 0.00 C ATOM 867 CD1 LEU A 55 9.951 -0.381 -4.248 1.00 0.00 C ATOM 868 CD2 LEU A 55 10.308 1.125 -6.213 1.00 0.00 C ATOM 0 H LEU A 55 13.737 -1.901 -5.117 1.00 0.00 H new ATOM 0 HA LEU A 55 13.488 0.699 -6.490 1.00 0.00 H new ATOM 0 HB2 LEU A 55 12.342 0.083 -3.747 1.00 0.00 H new ATOM 0 HB3 LEU A 55 12.210 1.587 -4.636 1.00 0.00 H new ATOM 0 HG LEU A 55 11.115 -0.837 -5.975 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.014 -0.713 -4.695 1.00 0.00 H new ATOM 0 HD12 LEU A 55 10.385 -1.195 -3.668 1.00 0.00 H new ATOM 0 HD13 LEU A 55 9.760 0.469 -3.593 1.00 0.00 H new ATOM 0 HD21 LEU A 55 9.365 0.773 -6.632 1.00 0.00 H new ATOM 0 HD22 LEU A 55 10.127 2.012 -5.606 1.00 0.00 H new ATOM 0 HD23 LEU A 55 10.994 1.374 -7.023 1.00 0.00 H new ATOM 880 N PRO A 56 15.905 0.566 -5.462 1.00 0.00 N ATOM 881 CA PRO A 56 17.182 0.906 -4.826 1.00 0.00 C ATOM 882 C PRO A 56 17.117 2.226 -4.065 1.00 0.00 C ATOM 883 O PRO A 56 17.462 2.291 -2.886 1.00 0.00 O ATOM 884 CB PRO A 56 18.153 1.018 -6.006 1.00 0.00 C ATOM 885 CG PRO A 56 17.543 0.186 -7.081 1.00 0.00 C ATOM 886 CD PRO A 56 16.056 0.312 -6.906 1.00 0.00 C ATOM 0 HA PRO A 56 17.476 0.163 -4.085 1.00 0.00 H new ATOM 0 HB2 PRO A 56 18.270 2.054 -6.325 1.00 0.00 H new ATOM 0 HB3 PRO A 56 19.145 0.653 -5.738 1.00 0.00 H new ATOM 0 HG2 PRO A 56 17.851 0.534 -8.067 1.00 0.00 H new ATOM 0 HG3 PRO A 56 17.859 -0.854 -6.997 1.00 0.00 H new ATOM 0 HD2 PRO A 56 15.648 1.128 -7.503 1.00 0.00 H new ATOM 0 HD3 PRO A 56 15.537 -0.596 -7.211 1.00 0.00 H new ATOM 894 N GLN A 57 16.673 3.276 -4.748 1.00 0.00 N ATOM 895 CA GLN A 57 16.563 4.595 -4.136 1.00 0.00 C ATOM 896 C GLN A 57 15.612 4.565 -2.944 1.00 0.00 C ATOM 897 O GLN A 57 15.955 5.022 -1.852 1.00 0.00 O ATOM 898 CB GLN A 57 16.077 5.618 -5.164 1.00 0.00 C ATOM 899 CG GLN A 57 17.204 6.299 -5.923 1.00 0.00 C ATOM 900 CD GLN A 57 17.748 5.443 -7.050 1.00 0.00 C ATOM 901 OE1 GLN A 57 17.482 5.700 -8.224 1.00 0.00 O ATOM 902 NE2 GLN A 57 18.512 4.416 -6.697 1.00 0.00 N ATOM 0 H GLN A 57 16.384 3.239 -5.725 1.00 0.00 H new ATOM 0 HA GLN A 57 17.552 4.887 -3.782 1.00 0.00 H new ATOM 0 HB2 GLN A 57 15.419 5.121 -5.876 1.00 0.00 H new ATOM 0 HB3 GLN A 57 15.482 6.377 -4.656 1.00 0.00 H new ATOM 0 HG2 GLN A 57 16.844 7.244 -6.330 1.00 0.00 H new ATOM 0 HG3 GLN A 57 18.011 6.538 -5.231 1.00 0.00 H new ATOM 0 HE21 GLN A 57 18.707 4.240 -5.711 1.00 0.00 H new ATOM 0 HE22 GLN A 57 18.904 3.803 -7.412 1.00 0.00 H new ATOM 911 N GLY A 58 14.418 4.025 -3.159 1.00 0.00 N ATOM 912 CA GLY A 58 13.436 3.946 -2.094 1.00 0.00 C ATOM 913 C GLY A 58 12.014 4.065 -2.606 1.00 0.00 C ATOM 914 O GLY A 58 11.676 3.512 -3.652 1.00 0.00 O ATOM 0 H GLY A 58 14.112 3.640 -4.053 1.00 0.00 H new ATOM 0 HA2 GLY A 58 13.551 2.999 -1.567 1.00 0.00 H new ATOM 0 HA3 GLY A 58 13.626 4.738 -1.370 1.00 0.00 H new ATOM 918 N VAL A 59 11.179 4.789 -1.868 1.00 0.00 N ATOM 919 CA VAL A 59 9.787 4.979 -2.253 1.00 0.00 C ATOM 920 C VAL A 59 9.463 6.460 -2.431 1.00 0.00 C ATOM 921 O VAL A 59 9.575 7.247 -1.492 1.00 0.00 O ATOM 922 CB VAL A 59 8.827 4.371 -1.211 1.00 0.00 C ATOM 923 CG1 VAL A 59 8.991 5.058 0.137 1.00 0.00 C ATOM 924 CG2 VAL A 59 7.385 4.459 -1.692 1.00 0.00 C ATOM 0 H VAL A 59 11.443 5.254 -0.999 1.00 0.00 H new ATOM 0 HA VAL A 59 9.648 4.465 -3.204 1.00 0.00 H new ATOM 0 HB VAL A 59 9.079 3.318 -1.087 1.00 0.00 H new ATOM 0 HG11 VAL A 59 8.304 4.614 0.858 1.00 0.00 H new ATOM 0 HG12 VAL A 59 10.016 4.933 0.487 1.00 0.00 H new ATOM 0 HG13 VAL A 59 8.771 6.120 0.033 1.00 0.00 H new ATOM 0 HG21 VAL A 59 6.724 4.024 -0.942 1.00 0.00 H new ATOM 0 HG22 VAL A 59 7.117 5.504 -1.850 1.00 0.00 H new ATOM 0 HG23 VAL A 59 7.280 3.912 -2.629 1.00 0.00 H new ATOM 934 N ARG A 60 9.063 6.832 -3.642 1.00 0.00 N ATOM 935 CA ARG A 60 8.723 8.218 -3.944 1.00 0.00 C ATOM 936 C ARG A 60 7.240 8.357 -4.274 1.00 0.00 C ATOM 937 O ARG A 60 6.502 9.057 -3.581 1.00 0.00 O ATOM 938 CB ARG A 60 9.568 8.729 -5.113 1.00 0.00 C ATOM 939 CG ARG A 60 10.847 9.427 -4.680 1.00 0.00 C ATOM 940 CD ARG A 60 11.619 9.964 -5.874 1.00 0.00 C ATOM 941 NE ARG A 60 13.037 10.148 -5.571 1.00 0.00 N ATOM 942 CZ ARG A 60 13.521 11.189 -4.898 1.00 0.00 C ATOM 943 NH1 ARG A 60 12.708 12.139 -4.454 1.00 0.00 N ATOM 944 NH2 ARG A 60 14.824 11.279 -4.666 1.00 0.00 N ATOM 0 H ARG A 60 8.966 6.193 -4.431 1.00 0.00 H new ATOM 0 HA ARG A 60 8.937 8.819 -3.060 1.00 0.00 H new ATOM 0 HB2 ARG A 60 9.823 7.890 -5.760 1.00 0.00 H new ATOM 0 HB3 ARG A 60 8.970 9.420 -5.708 1.00 0.00 H new ATOM 0 HG2 ARG A 60 10.605 10.247 -4.003 1.00 0.00 H new ATOM 0 HG3 ARG A 60 11.473 8.729 -4.124 1.00 0.00 H new ATOM 0 HD2 ARG A 60 11.514 9.276 -6.713 1.00 0.00 H new ATOM 0 HD3 ARG A 60 11.188 10.916 -6.186 1.00 0.00 H new ATOM 0 HE ARG A 60 13.694 9.437 -5.894 1.00 0.00 H new ATOM 0 HH11 ARG A 60 11.705 12.074 -4.628 1.00 0.00 H new ATOM 0 HH12 ARG A 60 13.086 12.934 -3.939 1.00 0.00 H new ATOM 0 HH21 ARG A 60 15.454 10.551 -5.003 1.00 0.00 H new ATOM 0 HH22 ARG A 60 15.196 12.076 -4.150 1.00 0.00 H new ATOM 958 N THR A 61 6.810 7.684 -5.337 1.00 0.00 N ATOM 959 CA THR A 61 5.415 7.731 -5.761 1.00 0.00 C ATOM 960 C THR A 61 4.732 6.387 -5.535 1.00 0.00 C ATOM 961 O THR A 61 5.348 5.332 -5.692 1.00 0.00 O ATOM 962 CB THR A 61 5.322 8.122 -7.237 1.00 0.00 C ATOM 963 OG1 THR A 61 6.087 9.285 -7.497 1.00 0.00 O ATOM 964 CG2 THR A 61 3.906 8.392 -7.695 1.00 0.00 C ATOM 0 H THR A 61 7.408 7.099 -5.921 1.00 0.00 H new ATOM 0 HA THR A 61 4.904 8.483 -5.160 1.00 0.00 H new ATOM 0 HB THR A 61 5.708 7.265 -7.788 1.00 0.00 H new ATOM 0 HG1 THR A 61 6.016 9.518 -8.446 1.00 0.00 H new ATOM 0 HG21 THR A 61 3.911 8.664 -8.751 1.00 0.00 H new ATOM 0 HG22 THR A 61 3.301 7.496 -7.554 1.00 0.00 H new ATOM 0 HG23 THR A 61 3.485 9.210 -7.111 1.00 0.00 H new ATOM 972 N ILE A 62 3.457 6.432 -5.163 1.00 0.00 N ATOM 973 CA ILE A 62 2.690 5.216 -4.916 1.00 0.00 C ATOM 974 C ILE A 62 1.398 5.207 -5.727 1.00 0.00 C ATOM 975 O ILE A 62 0.421 5.862 -5.364 1.00 0.00 O ATOM 976 CB ILE A 62 2.346 5.062 -3.421 1.00 0.00 C ATOM 977 CG1 ILE A 62 3.602 5.222 -2.564 1.00 0.00 C ATOM 978 CG2 ILE A 62 1.692 3.712 -3.164 1.00 0.00 C ATOM 979 CD1 ILE A 62 3.357 5.953 -1.262 1.00 0.00 C ATOM 0 H ILE A 62 2.933 7.296 -5.026 1.00 0.00 H new ATOM 0 HA ILE A 62 3.316 4.379 -5.225 1.00 0.00 H new ATOM 0 HB ILE A 62 1.640 5.845 -3.145 1.00 0.00 H new ATOM 0 HG12 ILE A 62 4.011 4.236 -2.346 1.00 0.00 H new ATOM 0 HG13 ILE A 62 4.357 5.761 -3.137 1.00 0.00 H new ATOM 0 HG21 ILE A 62 1.455 3.618 -2.104 1.00 0.00 H new ATOM 0 HG22 ILE A 62 0.775 3.634 -3.749 1.00 0.00 H new ATOM 0 HG23 ILE A 62 2.376 2.915 -3.455 1.00 0.00 H new ATOM 0 HD11 ILE A 62 4.292 6.030 -0.706 1.00 0.00 H new ATOM 0 HD12 ILE A 62 2.977 6.953 -1.472 1.00 0.00 H new ATOM 0 HD13 ILE A 62 2.626 5.404 -0.669 1.00 0.00 H new ATOM 991 N TYR A 63 1.401 4.461 -6.826 1.00 0.00 N ATOM 992 CA TYR A 63 0.230 4.367 -7.690 1.00 0.00 C ATOM 993 C TYR A 63 -0.803 3.410 -7.101 1.00 0.00 C ATOM 994 O TYR A 63 -0.545 2.740 -6.102 1.00 0.00 O ATOM 995 CB TYR A 63 0.636 3.900 -9.088 1.00 0.00 C ATOM 996 CG TYR A 63 1.801 4.669 -9.670 1.00 0.00 C ATOM 997 CD1 TYR A 63 3.111 4.300 -9.390 1.00 0.00 C ATOM 998 CD2 TYR A 63 1.590 5.764 -10.498 1.00 0.00 C ATOM 999 CE1 TYR A 63 4.178 5.001 -9.920 1.00 0.00 C ATOM 1000 CE2 TYR A 63 2.653 6.469 -11.032 1.00 0.00 C ATOM 1001 CZ TYR A 63 3.944 6.084 -10.740 1.00 0.00 C ATOM 1002 OH TYR A 63 5.003 6.784 -11.268 1.00 0.00 O ATOM 0 H TYR A 63 2.202 3.912 -7.140 1.00 0.00 H new ATOM 0 HA TYR A 63 -0.217 5.358 -7.763 1.00 0.00 H new ATOM 0 HB2 TYR A 63 0.894 2.842 -9.047 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -0.220 3.994 -9.756 1.00 0.00 H new ATOM 0 HD1 TYR A 63 3.299 3.452 -8.748 1.00 0.00 H new ATOM 0 HD2 TYR A 63 0.580 6.070 -10.728 1.00 0.00 H new ATOM 0 HE1 TYR A 63 5.190 4.702 -9.693 1.00 0.00 H new ATOM 0 HE2 TYR A 63 2.473 7.318 -11.675 1.00 0.00 H new ATOM 0 HH TYR A 63 4.666 7.517 -11.825 1.00 0.00 H new ATOM 1012 N THR A 64 -1.974 3.353 -7.728 1.00 0.00 N ATOM 1013 CA THR A 64 -3.046 2.479 -7.267 1.00 0.00 C ATOM 1014 C THR A 64 -2.861 1.062 -7.800 1.00 0.00 C ATOM 1015 O THR A 64 -1.882 0.771 -8.490 1.00 0.00 O ATOM 1016 CB THR A 64 -4.404 3.028 -7.705 1.00 0.00 C ATOM 1017 OG1 THR A 64 -4.533 2.980 -9.115 1.00 0.00 O ATOM 1018 CG2 THR A 64 -4.641 4.457 -7.270 1.00 0.00 C ATOM 0 H THR A 64 -2.204 3.902 -8.556 1.00 0.00 H new ATOM 0 HA THR A 64 -3.010 2.445 -6.178 1.00 0.00 H new ATOM 0 HB THR A 64 -5.143 2.391 -7.219 1.00 0.00 H new ATOM 0 HG1 THR A 64 -5.409 3.334 -9.376 1.00 0.00 H new ATOM 0 HG21 THR A 64 -5.622 4.784 -7.613 1.00 0.00 H new ATOM 0 HG22 THR A 64 -4.598 4.518 -6.183 1.00 0.00 H new ATOM 0 HG23 THR A 64 -3.873 5.100 -7.700 1.00 0.00 H new ATOM 1026 N ILE A 65 -3.805 0.184 -7.476 1.00 0.00 N ATOM 1027 CA ILE A 65 -3.745 -1.203 -7.922 1.00 0.00 C ATOM 1028 C ILE A 65 -3.903 -1.299 -9.437 1.00 0.00 C ATOM 1029 O ILE A 65 -3.240 -2.104 -10.091 1.00 0.00 O ATOM 1030 CB ILE A 65 -4.832 -2.059 -7.242 1.00 0.00 C ATOM 1031 CG1 ILE A 65 -4.673 -3.533 -7.627 1.00 0.00 C ATOM 1032 CG2 ILE A 65 -6.220 -1.554 -7.612 1.00 0.00 C ATOM 1033 CD1 ILE A 65 -4.010 -4.370 -6.555 1.00 0.00 C ATOM 0 H ILE A 65 -4.621 0.409 -6.906 1.00 0.00 H new ATOM 0 HA ILE A 65 -2.765 -1.587 -7.639 1.00 0.00 H new ATOM 0 HB ILE A 65 -4.713 -1.972 -6.162 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.656 -3.951 -7.847 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -4.086 -3.600 -8.543 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -6.974 -2.171 -7.123 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -6.330 -0.520 -7.286 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -6.351 -1.610 -8.693 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -3.931 -5.402 -6.896 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -3.014 -3.978 -6.351 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -4.607 -4.334 -5.644 1.00 0.00 H new ATOM 1045 N ASP A 66 -4.785 -0.472 -9.988 1.00 0.00 N ATOM 1046 CA ASP A 66 -5.031 -0.464 -11.426 1.00 0.00 C ATOM 1047 C ASP A 66 -3.905 0.250 -12.167 1.00 0.00 C ATOM 1048 O ASP A 66 -3.362 -0.271 -13.141 1.00 0.00 O ATOM 1049 CB ASP A 66 -6.368 0.214 -11.732 1.00 0.00 C ATOM 1050 CG ASP A 66 -7.553 -0.673 -11.407 1.00 0.00 C ATOM 1051 OD1 ASP A 66 -7.633 -1.786 -11.968 1.00 0.00 O ATOM 1052 OD2 ASP A 66 -8.402 -0.255 -10.591 1.00 0.00 O ATOM 0 H ASP A 66 -5.341 0.201 -9.461 1.00 0.00 H new ATOM 0 HA ASP A 66 -5.069 -1.498 -11.768 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -6.442 1.139 -11.160 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -6.401 0.487 -12.787 1.00 0.00 H new ATOM 1057 N GLY A 67 -3.558 1.445 -11.698 1.00 0.00 N ATOM 1058 CA GLY A 67 -2.498 2.210 -12.328 1.00 0.00 C ATOM 1059 C GLY A 67 -3.023 3.417 -13.079 1.00 0.00 C ATOM 1060 O GLY A 67 -2.549 3.733 -14.170 1.00 0.00 O ATOM 0 H GLY A 67 -3.992 1.897 -10.893 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.790 2.539 -11.567 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.950 1.567 -13.017 1.00 0.00 H new ATOM 1064 N LEU A 68 -4.005 4.094 -12.492 1.00 0.00 N ATOM 1065 CA LEU A 68 -4.597 5.274 -13.113 1.00 0.00 C ATOM 1066 C LEU A 68 -4.280 6.529 -12.307 1.00 0.00 C ATOM 1067 O LEU A 68 -3.930 7.568 -12.868 1.00 0.00 O ATOM 1068 CB LEU A 68 -6.112 5.104 -13.238 1.00 0.00 C ATOM 1069 CG LEU A 68 -6.562 3.862 -14.013 1.00 0.00 C ATOM 1070 CD1 LEU A 68 -7.606 3.086 -13.224 1.00 0.00 C ATOM 1071 CD2 LEU A 68 -7.107 4.254 -15.379 1.00 0.00 C ATOM 0 H LEU A 68 -4.407 3.846 -11.588 1.00 0.00 H new ATOM 0 HA LEU A 68 -4.167 5.385 -14.109 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -6.542 5.065 -12.237 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -6.523 5.987 -13.727 1.00 0.00 H new ATOM 0 HG LEU A 68 -5.695 3.217 -14.160 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -7.912 2.208 -13.792 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -7.182 2.772 -12.270 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -8.473 3.722 -13.044 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -7.422 3.359 -15.916 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -7.960 4.920 -15.253 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -6.330 4.764 -15.948 1.00 0.00 H new ATOM 1083 N LYS A 69 -4.402 6.426 -10.988 1.00 0.00 N ATOM 1084 CA LYS A 69 -4.128 7.553 -10.103 1.00 0.00 C ATOM 1085 C LYS A 69 -2.856 7.315 -9.296 1.00 0.00 C ATOM 1086 O LYS A 69 -2.453 6.172 -9.077 1.00 0.00 O ATOM 1087 CB LYS A 69 -5.308 7.787 -9.159 1.00 0.00 C ATOM 1088 CG LYS A 69 -5.446 9.232 -8.702 1.00 0.00 C ATOM 1089 CD LYS A 69 -6.700 9.880 -9.265 1.00 0.00 C ATOM 1090 CE LYS A 69 -6.448 11.322 -9.674 1.00 0.00 C ATOM 1091 NZ LYS A 69 -6.280 11.460 -11.147 1.00 0.00 N ATOM 0 H LYS A 69 -4.689 5.573 -10.508 1.00 0.00 H new ATOM 0 HA LYS A 69 -3.985 8.440 -10.720 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -6.228 7.483 -9.659 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -5.195 7.147 -8.284 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -5.475 9.269 -7.613 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -4.570 9.799 -9.017 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -7.048 9.312 -10.128 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -7.494 9.846 -8.519 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -7.280 11.944 -9.344 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -5.555 11.691 -9.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -6.110 12.458 -11.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -5.470 10.887 -11.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -7.142 11.132 -11.627 1.00 0.00 H new ATOM 1105 N LYS A 70 -2.229 8.400 -8.857 1.00 0.00 N ATOM 1106 CA LYS A 70 -1.001 8.310 -8.074 1.00 0.00 C ATOM 1107 C LYS A 70 -1.192 8.927 -6.692 1.00 0.00 C ATOM 1108 O LYS A 70 -1.575 10.090 -6.567 1.00 0.00 O ATOM 1109 CB LYS A 70 0.147 9.010 -8.803 1.00 0.00 C ATOM 1110 CG LYS A 70 -0.237 10.359 -9.390 1.00 0.00 C ATOM 1111 CD LYS A 70 0.911 11.353 -9.307 1.00 0.00 C ATOM 1112 CE LYS A 70 1.137 12.060 -10.634 1.00 0.00 C ATOM 1113 NZ LYS A 70 1.351 13.523 -10.455 1.00 0.00 N ATOM 0 H LYS A 70 -2.550 9.353 -9.030 1.00 0.00 H new ATOM 0 HA LYS A 70 -0.754 7.255 -7.952 1.00 0.00 H new ATOM 0 HB2 LYS A 70 0.976 9.148 -8.109 1.00 0.00 H new ATOM 0 HB3 LYS A 70 0.506 8.363 -9.604 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -0.535 10.232 -10.431 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -1.101 10.755 -8.857 1.00 0.00 H new ATOM 0 HD2 LYS A 70 0.699 12.090 -8.533 1.00 0.00 H new ATOM 0 HD3 LYS A 70 1.822 10.833 -9.011 1.00 0.00 H new ATOM 0 HE2 LYS A 70 2.002 11.625 -11.134 1.00 0.00 H new ATOM 0 HE3 LYS A 70 0.277 11.896 -11.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 1.501 13.968 -11.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 0.515 13.943 -10.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 2.186 13.681 -9.856 1.00 0.00 H new ATOM 1127 N ILE A 71 -0.923 8.139 -5.656 1.00 0.00 N ATOM 1128 CA ILE A 71 -1.065 8.608 -4.283 1.00 0.00 C ATOM 1129 C ILE A 71 0.041 9.594 -3.921 1.00 0.00 C ATOM 1130 O ILE A 71 1.226 9.287 -4.047 1.00 0.00 O ATOM 1131 CB ILE A 71 -1.041 7.436 -3.282 1.00 0.00 C ATOM 1132 CG1 ILE A 71 -2.021 6.345 -3.715 1.00 0.00 C ATOM 1133 CG2 ILE A 71 -1.373 7.928 -1.881 1.00 0.00 C ATOM 1134 CD1 ILE A 71 -3.465 6.793 -3.708 1.00 0.00 C ATOM 0 H ILE A 71 -0.606 7.173 -5.741 1.00 0.00 H new ATOM 0 HA ILE A 71 -2.031 9.110 -4.220 1.00 0.00 H new ATOM 0 HB ILE A 71 -0.037 7.011 -3.268 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -1.758 6.009 -4.718 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -1.912 5.486 -3.052 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -1.352 7.089 -1.186 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -0.639 8.672 -1.573 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -2.367 8.376 -1.879 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -4.103 5.969 -4.026 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -3.745 7.102 -2.701 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -3.589 7.632 -4.392 1.00 0.00 H new ATOM 1146 N SER A 72 -0.356 10.779 -3.470 1.00 0.00 N ATOM 1147 CA SER A 72 0.601 11.811 -3.088 1.00 0.00 C ATOM 1148 C SER A 72 0.152 12.524 -1.817 1.00 0.00 C ATOM 1149 O SER A 72 0.424 13.710 -1.628 1.00 0.00 O ATOM 1150 CB SER A 72 0.771 12.823 -4.222 1.00 0.00 C ATOM 1151 OG SER A 72 2.048 13.436 -4.172 1.00 0.00 O ATOM 0 H SER A 72 -1.334 11.049 -3.360 1.00 0.00 H new ATOM 0 HA SER A 72 1.560 11.330 -2.894 1.00 0.00 H new ATOM 0 HB2 SER A 72 0.642 12.323 -5.182 1.00 0.00 H new ATOM 0 HB3 SER A 72 -0.005 13.586 -4.152 1.00 0.00 H new ATOM 0 HG SER A 72 2.132 14.077 -4.908 1.00 0.00 H new ATOM 1157 N SER A 73 -0.539 11.793 -0.948 1.00 0.00 N ATOM 1158 CA SER A 73 -1.027 12.354 0.306 1.00 0.00 C ATOM 1159 C SER A 73 -1.647 11.270 1.181 1.00 0.00 C ATOM 1160 O SER A 73 -1.656 10.093 0.817 1.00 0.00 O ATOM 1161 CB SER A 73 -2.054 13.452 0.032 1.00 0.00 C ATOM 1162 OG SER A 73 -1.418 14.685 -0.259 1.00 0.00 O ATOM 0 H SER A 73 -0.773 10.810 -1.090 1.00 0.00 H new ATOM 0 HA SER A 73 -0.178 12.784 0.837 1.00 0.00 H new ATOM 0 HB2 SER A 73 -2.688 13.160 -0.805 1.00 0.00 H new ATOM 0 HB3 SER A 73 -2.704 13.570 0.899 1.00 0.00 H new ATOM 0 HG SER A 73 -0.490 14.519 -0.525 1.00 0.00 H new ATOM 1168 N LEU A 74 -2.165 11.672 2.336 1.00 0.00 N ATOM 1169 CA LEU A 74 -2.789 10.734 3.264 1.00 0.00 C ATOM 1170 C LEU A 74 -4.303 10.720 3.086 1.00 0.00 C ATOM 1171 O LEU A 74 -4.953 9.695 3.291 1.00 0.00 O ATOM 1172 CB LEU A 74 -2.436 11.101 4.707 1.00 0.00 C ATOM 1173 CG LEU A 74 -0.941 11.259 4.988 1.00 0.00 C ATOM 1174 CD1 LEU A 74 -0.718 11.852 6.370 1.00 0.00 C ATOM 1175 CD2 LEU A 74 -0.233 9.918 4.861 1.00 0.00 C ATOM 0 H LEU A 74 -2.166 12.641 2.653 1.00 0.00 H new ATOM 0 HA LEU A 74 -2.407 9.737 3.047 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -2.939 12.034 4.962 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -2.835 10.333 5.369 1.00 0.00 H new ATOM 0 HG LEU A 74 -0.521 11.942 4.250 1.00 0.00 H new ATOM 0 HD11 LEU A 74 0.351 11.957 6.553 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -1.194 12.831 6.427 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -1.152 11.194 7.123 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.830 10.047 5.064 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -0.656 9.214 5.577 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.365 9.531 3.851 1.00 0.00 H new ATOM 1187 N ASP A 75 -4.859 11.864 2.701 1.00 0.00 N ATOM 1188 CA ASP A 75 -6.298 11.984 2.495 1.00 0.00 C ATOM 1189 C ASP A 75 -6.734 11.222 1.249 1.00 0.00 C ATOM 1190 O ASP A 75 -7.838 10.678 1.196 1.00 0.00 O ATOM 1191 CB ASP A 75 -6.695 13.456 2.371 1.00 0.00 C ATOM 1192 CG ASP A 75 -8.119 13.712 2.824 1.00 0.00 C ATOM 1193 OD1 ASP A 75 -8.605 12.970 3.702 1.00 0.00 O ATOM 1194 OD2 ASP A 75 -8.748 14.655 2.300 1.00 0.00 O ATOM 0 H ASP A 75 -4.335 12.721 2.525 1.00 0.00 H new ATOM 0 HA ASP A 75 -6.801 11.550 3.359 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -6.013 14.064 2.965 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -6.584 13.773 1.334 1.00 0.00 H new ATOM 1199 N GLN A 76 -5.862 11.185 0.247 1.00 0.00 N ATOM 1200 CA GLN A 76 -6.157 10.490 -1.000 1.00 0.00 C ATOM 1201 C GLN A 76 -6.416 9.007 -0.750 1.00 0.00 C ATOM 1202 O GLN A 76 -7.233 8.387 -1.430 1.00 0.00 O ATOM 1203 CB GLN A 76 -5.002 10.658 -1.989 1.00 0.00 C ATOM 1204 CG GLN A 76 -4.915 12.051 -2.591 1.00 0.00 C ATOM 1205 CD GLN A 76 -4.532 12.029 -4.058 1.00 0.00 C ATOM 1206 OE1 GLN A 76 -5.215 11.418 -4.880 1.00 0.00 O ATOM 1207 NE2 GLN A 76 -3.434 12.696 -4.393 1.00 0.00 N ATOM 0 H GLN A 76 -4.944 11.629 0.275 1.00 0.00 H new ATOM 0 HA GLN A 76 -7.058 10.931 -1.426 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -4.064 10.431 -1.482 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -5.114 9.930 -2.793 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -5.876 12.553 -2.478 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -4.182 12.637 -2.037 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -2.898 13.189 -3.678 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -3.126 12.716 -5.365 1.00 0.00 H new ATOM 1216 N LEU A 77 -5.715 8.446 0.230 1.00 0.00 N ATOM 1217 CA LEU A 77 -5.870 7.036 0.569 1.00 0.00 C ATOM 1218 C LEU A 77 -7.204 6.786 1.263 1.00 0.00 C ATOM 1219 O LEU A 77 -7.634 7.574 2.106 1.00 0.00 O ATOM 1220 CB LEU A 77 -4.721 6.577 1.468 1.00 0.00 C ATOM 1221 CG LEU A 77 -3.330 6.663 0.836 1.00 0.00 C ATOM 1222 CD1 LEU A 77 -2.284 6.992 1.889 1.00 0.00 C ATOM 1223 CD2 LEU A 77 -2.985 5.360 0.130 1.00 0.00 C ATOM 0 H LEU A 77 -5.035 8.946 0.803 1.00 0.00 H new ATOM 0 HA LEU A 77 -5.850 6.462 -0.357 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -4.728 7.179 2.377 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -4.904 5.545 1.768 1.00 0.00 H new ATOM 0 HG LEU A 77 -3.337 7.464 0.097 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.301 7.049 1.421 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.522 7.950 2.351 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.278 6.213 2.651 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -1.993 5.438 -0.314 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.997 4.542 0.850 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -3.718 5.165 -0.653 1.00 0.00 H new ATOM 1235 N VAL A 78 -7.856 5.686 0.902 1.00 0.00 N ATOM 1236 CA VAL A 78 -9.143 5.331 1.490 1.00 0.00 C ATOM 1237 C VAL A 78 -9.047 4.030 2.279 1.00 0.00 C ATOM 1238 O VAL A 78 -8.144 3.223 2.058 1.00 0.00 O ATOM 1239 CB VAL A 78 -10.232 5.184 0.412 1.00 0.00 C ATOM 1240 CG1 VAL A 78 -11.601 5.016 1.054 1.00 0.00 C ATOM 1241 CG2 VAL A 78 -10.220 6.382 -0.527 1.00 0.00 C ATOM 0 H VAL A 78 -7.514 5.024 0.205 1.00 0.00 H new ATOM 0 HA VAL A 78 -9.417 6.143 2.164 1.00 0.00 H new ATOM 0 HB VAL A 78 -10.018 4.290 -0.173 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -12.358 4.914 0.276 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -11.602 4.124 1.681 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -11.826 5.890 1.666 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -10.997 6.260 -1.282 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -10.407 7.292 0.042 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -9.248 6.452 -1.015 1.00 0.00 H new ATOM 1251 N GLU A 79 -9.985 3.832 3.200 1.00 0.00 N ATOM 1252 CA GLU A 79 -10.006 2.629 4.024 1.00 0.00 C ATOM 1253 C GLU A 79 -10.243 1.388 3.167 1.00 0.00 C ATOM 1254 O GLU A 79 -11.218 1.314 2.420 1.00 0.00 O ATOM 1255 CB GLU A 79 -11.093 2.738 5.094 1.00 0.00 C ATOM 1256 CG GLU A 79 -10.818 1.895 6.329 1.00 0.00 C ATOM 1257 CD GLU A 79 -11.919 2.002 7.364 1.00 0.00 C ATOM 1258 OE1 GLU A 79 -13.105 1.921 6.981 1.00 0.00 O ATOM 1259 OE2 GLU A 79 -11.596 2.166 8.560 1.00 0.00 O ATOM 0 H GLU A 79 -10.740 4.489 3.394 1.00 0.00 H new ATOM 0 HA GLU A 79 -9.035 2.534 4.510 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -11.195 3.782 5.392 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -12.047 2.435 4.663 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -10.702 0.852 6.034 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -9.874 2.207 6.775 1.00 0.00 H new ATOM 1266 N GLY A 80 -9.342 0.417 3.281 1.00 0.00 N ATOM 1267 CA GLY A 80 -9.471 -0.807 2.512 1.00 0.00 C ATOM 1268 C GLY A 80 -9.173 -0.600 1.039 1.00 0.00 C ATOM 1269 O GLY A 80 -10.067 -0.696 0.200 1.00 0.00 O ATOM 0 H GLY A 80 -8.526 0.456 3.892 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -8.792 -1.559 2.915 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -10.482 -1.198 2.624 1.00 0.00 H new ATOM 1273 N GLU A 81 -7.912 -0.317 0.726 1.00 0.00 N ATOM 1274 CA GLU A 81 -7.499 -0.097 -0.654 1.00 0.00 C ATOM 1275 C GLU A 81 -6.069 -0.577 -0.878 1.00 0.00 C ATOM 1276 O GLU A 81 -5.291 -0.703 0.069 1.00 0.00 O ATOM 1277 CB GLU A 81 -7.612 1.386 -1.012 1.00 0.00 C ATOM 1278 CG GLU A 81 -9.023 1.819 -1.376 1.00 0.00 C ATOM 1279 CD GLU A 81 -9.389 1.473 -2.806 1.00 0.00 C ATOM 1280 OE1 GLU A 81 -8.925 2.180 -3.725 1.00 0.00 O ATOM 1281 OE2 GLU A 81 -10.138 0.495 -3.007 1.00 0.00 O ATOM 0 H GLU A 81 -7.160 -0.235 1.410 1.00 0.00 H new ATOM 0 HA GLU A 81 -8.162 -0.672 -1.300 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -7.264 1.982 -0.168 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -6.948 1.601 -1.849 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -9.731 1.343 -0.698 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -9.118 2.895 -1.231 1.00 0.00 H new ATOM 1288 N SER A 82 -5.728 -0.843 -2.134 1.00 0.00 N ATOM 1289 CA SER A 82 -4.391 -1.309 -2.484 1.00 0.00 C ATOM 1290 C SER A 82 -3.658 -0.274 -3.329 1.00 0.00 C ATOM 1291 O SER A 82 -4.280 0.519 -4.036 1.00 0.00 O ATOM 1292 CB SER A 82 -4.473 -2.637 -3.238 1.00 0.00 C ATOM 1293 OG SER A 82 -5.206 -3.600 -2.500 1.00 0.00 O ATOM 0 H SER A 82 -6.360 -0.744 -2.928 1.00 0.00 H new ATOM 0 HA SER A 82 -3.831 -1.458 -1.561 1.00 0.00 H new ATOM 0 HB2 SER A 82 -4.947 -2.480 -4.207 1.00 0.00 H new ATOM 0 HB3 SER A 82 -3.468 -3.011 -3.432 1.00 0.00 H new ATOM 0 HG SER A 82 -5.245 -4.439 -3.005 1.00 0.00 H new ATOM 1299 N TYR A 83 -2.331 -0.289 -3.255 1.00 0.00 N ATOM 1300 CA TYR A 83 -1.511 0.647 -4.014 1.00 0.00 C ATOM 1301 C TYR A 83 -0.134 0.059 -4.298 1.00 0.00 C ATOM 1302 O TYR A 83 0.394 -0.721 -3.506 1.00 0.00 O ATOM 1303 CB TYR A 83 -1.369 1.968 -3.254 1.00 0.00 C ATOM 1304 CG TYR A 83 -2.691 2.579 -2.847 1.00 0.00 C ATOM 1305 CD1 TYR A 83 -3.355 3.464 -3.687 1.00 0.00 C ATOM 1306 CD2 TYR A 83 -3.272 2.273 -1.623 1.00 0.00 C ATOM 1307 CE1 TYR A 83 -4.563 4.026 -3.318 1.00 0.00 C ATOM 1308 CE2 TYR A 83 -4.480 2.830 -1.249 1.00 0.00 C ATOM 1309 CZ TYR A 83 -5.121 3.706 -2.099 1.00 0.00 C ATOM 1310 OH TYR A 83 -6.324 4.263 -1.729 1.00 0.00 O ATOM 0 H TYR A 83 -1.801 -0.940 -2.676 1.00 0.00 H new ATOM 0 HA TYR A 83 -2.008 0.836 -4.966 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -0.766 1.801 -2.362 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -0.826 2.679 -3.877 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -2.921 3.717 -4.643 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -2.772 1.589 -0.953 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -5.067 4.713 -3.982 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -4.920 2.580 -0.295 1.00 0.00 H new ATOM 0 HH TYR A 83 -7.056 3.780 -2.165 1.00 0.00 H new ATOM 1320 N VAL A 84 0.444 0.439 -5.433 1.00 0.00 N ATOM 1321 CA VAL A 84 1.761 -0.050 -5.822 1.00 0.00 C ATOM 1322 C VAL A 84 2.833 1.006 -5.578 1.00 0.00 C ATOM 1323 O VAL A 84 2.782 2.098 -6.143 1.00 0.00 O ATOM 1324 CB VAL A 84 1.791 -0.463 -7.306 1.00 0.00 C ATOM 1325 CG1 VAL A 84 3.104 -1.154 -7.641 1.00 0.00 C ATOM 1326 CG2 VAL A 84 0.608 -1.360 -7.634 1.00 0.00 C ATOM 0 H VAL A 84 0.020 1.084 -6.100 1.00 0.00 H new ATOM 0 HA VAL A 84 1.969 -0.924 -5.205 1.00 0.00 H new ATOM 0 HB VAL A 84 1.715 0.436 -7.917 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.107 -1.439 -8.693 1.00 0.00 H new ATOM 0 HG12 VAL A 84 3.933 -0.474 -7.447 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.214 -2.046 -7.024 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.646 -1.642 -8.686 1.00 0.00 H new ATOM 0 HG22 VAL A 84 0.649 -2.257 -7.016 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -0.321 -0.825 -7.435 1.00 0.00 H new ATOM 1336 N CYS A 85 3.803 0.672 -4.733 1.00 0.00 N ATOM 1337 CA CYS A 85 4.888 1.593 -4.415 1.00 0.00 C ATOM 1338 C CYS A 85 5.946 1.587 -5.513 1.00 0.00 C ATOM 1339 O CYS A 85 6.334 0.528 -6.009 1.00 0.00 O ATOM 1340 CB CYS A 85 5.523 1.221 -3.073 1.00 0.00 C ATOM 1341 SG CYS A 85 4.557 1.728 -1.633 1.00 0.00 S ATOM 0 H CYS A 85 3.860 -0.228 -4.257 1.00 0.00 H new ATOM 0 HA CYS A 85 4.471 2.598 -4.345 1.00 0.00 H new ATOM 0 HB2 CYS A 85 5.667 0.141 -3.038 1.00 0.00 H new ATOM 0 HB3 CYS A 85 6.511 1.676 -3.012 1.00 0.00 H new ATOM 0 HG CYS A 85 3.310 1.406 -1.812 1.00 0.00 H new ATOM 1347 N GLY A 86 6.411 2.774 -5.888 1.00 0.00 N ATOM 1348 CA GLY A 86 7.420 2.882 -6.925 1.00 0.00 C ATOM 1349 C GLY A 86 8.566 3.791 -6.526 1.00 0.00 C ATOM 1350 O GLY A 86 8.788 4.039 -5.341 1.00 0.00 O ATOM 0 H GLY A 86 6.107 3.663 -5.492 1.00 0.00 H new ATOM 0 HA2 GLY A 86 7.810 1.890 -7.153 1.00 0.00 H new ATOM 0 HA3 GLY A 86 6.960 3.261 -7.837 1.00 0.00 H new ATOM 1354 N SER A 87 9.297 4.287 -7.519 1.00 0.00 N ATOM 1355 CA SER A 87 10.428 5.174 -7.267 1.00 0.00 C ATOM 1356 C SER A 87 10.769 5.988 -8.511 1.00 0.00 C ATOM 1357 O SER A 87 10.475 7.181 -8.583 1.00 0.00 O ATOM 1358 CB SER A 87 11.647 4.365 -6.822 1.00 0.00 C ATOM 1359 OG SER A 87 12.792 5.191 -6.702 1.00 0.00 O ATOM 0 H SER A 87 9.127 4.090 -8.505 1.00 0.00 H new ATOM 0 HA SER A 87 10.147 5.863 -6.470 1.00 0.00 H new ATOM 0 HB2 SER A 87 11.439 3.885 -5.866 1.00 0.00 H new ATOM 0 HB3 SER A 87 11.842 3.570 -7.542 1.00 0.00 H new ATOM 0 HG SER A 87 13.577 4.714 -7.043 1.00 0.00 H new ATOM 1365 N ILE A 88 11.390 5.335 -9.487 1.00 0.00 N ATOM 1366 CA ILE A 88 11.771 5.998 -10.728 1.00 0.00 C ATOM 1367 C ILE A 88 11.523 5.096 -11.932 1.00 0.00 C ATOM 1368 O ILE A 88 12.238 5.168 -12.932 1.00 0.00 O ATOM 1369 CB ILE A 88 13.253 6.416 -10.710 1.00 0.00 C ATOM 1370 CG1 ILE A 88 14.135 5.234 -10.300 1.00 0.00 C ATOM 1371 CG2 ILE A 88 13.462 7.591 -9.767 1.00 0.00 C ATOM 1372 CD1 ILE A 88 15.466 5.196 -11.018 1.00 0.00 C ATOM 0 H ILE A 88 11.640 4.347 -9.443 1.00 0.00 H new ATOM 0 HA ILE A 88 11.151 6.891 -10.813 1.00 0.00 H new ATOM 0 HB ILE A 88 13.538 6.727 -11.715 1.00 0.00 H new ATOM 0 HG12 ILE A 88 14.312 5.279 -9.225 1.00 0.00 H new ATOM 0 HG13 ILE A 88 13.599 4.306 -10.496 1.00 0.00 H new ATOM 0 HG21 ILE A 88 14.515 7.874 -9.766 1.00 0.00 H new ATOM 0 HG22 ILE A 88 12.859 8.436 -10.100 1.00 0.00 H new ATOM 0 HG23 ILE A 88 13.162 7.306 -8.759 1.00 0.00 H new ATOM 0 HD11 ILE A 88 16.038 4.333 -10.678 1.00 0.00 H new ATOM 0 HD12 ILE A 88 15.298 5.120 -12.092 1.00 0.00 H new ATOM 0 HD13 ILE A 88 16.022 6.108 -10.802 1.00 0.00 H new ATOM 1384 N GLU A 89 10.505 4.248 -11.830 1.00 0.00 N ATOM 1385 CA GLU A 89 10.162 3.332 -12.911 1.00 0.00 C ATOM 1386 C GLU A 89 8.673 3.412 -13.240 1.00 0.00 C ATOM 1387 O GLU A 89 7.863 3.791 -12.394 1.00 0.00 O ATOM 1388 CB GLU A 89 10.536 1.898 -12.531 1.00 0.00 C ATOM 1389 CG GLU A 89 9.932 1.440 -11.215 1.00 0.00 C ATOM 1390 CD GLU A 89 10.943 1.415 -10.086 1.00 0.00 C ATOM 1391 OE1 GLU A 89 11.926 2.185 -10.151 1.00 0.00 O ATOM 1392 OE2 GLU A 89 10.754 0.626 -9.136 1.00 0.00 O ATOM 0 H GLU A 89 9.903 4.176 -11.010 1.00 0.00 H new ATOM 0 HA GLU A 89 10.728 3.625 -13.795 1.00 0.00 H new ATOM 0 HB2 GLU A 89 10.211 1.224 -13.324 1.00 0.00 H new ATOM 0 HB3 GLU A 89 11.621 1.819 -12.470 1.00 0.00 H new ATOM 0 HG2 GLU A 89 9.110 2.103 -10.947 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.509 0.443 -11.341 1.00 0.00 H new ATOM 1399 N PRO A 90 8.291 3.051 -14.477 1.00 0.00 N ATOM 1400 CA PRO A 90 6.890 3.084 -14.912 1.00 0.00 C ATOM 1401 C PRO A 90 6.030 2.071 -14.163 1.00 0.00 C ATOM 1402 O PRO A 90 6.544 1.125 -13.567 1.00 0.00 O ATOM 1403 CB PRO A 90 6.964 2.728 -16.399 1.00 0.00 C ATOM 1404 CG PRO A 90 8.248 1.987 -16.553 1.00 0.00 C ATOM 1405 CD PRO A 90 9.190 2.585 -15.547 1.00 0.00 C ATOM 0 HA PRO A 90 6.427 4.052 -14.718 1.00 0.00 H new ATOM 0 HB2 PRO A 90 6.115 2.114 -16.701 1.00 0.00 H new ATOM 0 HB3 PRO A 90 6.947 3.623 -17.021 1.00 0.00 H new ATOM 0 HG2 PRO A 90 8.108 0.921 -16.372 1.00 0.00 H new ATOM 0 HG3 PRO A 90 8.640 2.090 -17.565 1.00 0.00 H new ATOM 0 HD2 PRO A 90 9.906 1.850 -15.179 1.00 0.00 H new ATOM 0 HD3 PRO A 90 9.767 3.406 -15.974 1.00 0.00 H new ATOM 1413 N PHE A 91 4.718 2.278 -14.198 1.00 0.00 N ATOM 1414 CA PHE A 91 3.786 1.382 -13.522 1.00 0.00 C ATOM 1415 C PHE A 91 3.710 0.036 -14.233 1.00 0.00 C ATOM 1416 O PHE A 91 3.852 -0.041 -15.454 1.00 0.00 O ATOM 1417 CB PHE A 91 2.395 2.017 -13.455 1.00 0.00 C ATOM 1418 CG PHE A 91 1.425 1.247 -12.606 1.00 0.00 C ATOM 1419 CD1 PHE A 91 1.354 1.467 -11.239 1.00 0.00 C ATOM 1420 CD2 PHE A 91 0.584 0.303 -13.173 1.00 0.00 C ATOM 1421 CE1 PHE A 91 0.462 0.760 -10.454 1.00 0.00 C ATOM 1422 CE2 PHE A 91 -0.310 -0.407 -12.394 1.00 0.00 C ATOM 1423 CZ PHE A 91 -0.371 -0.178 -11.033 1.00 0.00 C ATOM 0 H PHE A 91 4.276 3.057 -14.686 1.00 0.00 H new ATOM 0 HA PHE A 91 4.152 1.215 -12.509 1.00 0.00 H new ATOM 0 HB2 PHE A 91 2.485 3.030 -13.062 1.00 0.00 H new ATOM 0 HB3 PHE A 91 1.994 2.102 -14.465 1.00 0.00 H new ATOM 0 HD1 PHE A 91 2.003 2.199 -10.782 1.00 0.00 H new ATOM 0 HD2 PHE A 91 0.628 0.120 -14.236 1.00 0.00 H new ATOM 0 HE1 PHE A 91 0.416 0.941 -9.390 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -0.960 -1.140 -12.849 1.00 0.00 H new ATOM 0 HZ PHE A 91 -1.069 -0.731 -10.422 1.00 0.00 H new ATOM 1433 N LYS A 92 3.483 -1.023 -13.462 1.00 0.00 N ATOM 1434 CA LYS A 92 3.387 -2.368 -14.018 1.00 0.00 C ATOM 1435 C LYS A 92 2.075 -3.031 -13.611 1.00 0.00 C ATOM 1436 O LYS A 92 1.861 -3.338 -12.438 1.00 0.00 O ATOM 1437 CB LYS A 92 4.568 -3.220 -13.554 1.00 0.00 C ATOM 1438 CG LYS A 92 5.920 -2.673 -13.985 1.00 0.00 C ATOM 1439 CD LYS A 92 7.059 -3.367 -13.255 1.00 0.00 C ATOM 1440 CE LYS A 92 8.412 -2.848 -13.715 1.00 0.00 C ATOM 1441 NZ LYS A 92 9.437 -2.936 -12.639 1.00 0.00 N ATOM 0 H LYS A 92 3.362 -0.976 -12.450 1.00 0.00 H new ATOM 0 HA LYS A 92 3.412 -2.288 -15.105 1.00 0.00 H new ATOM 0 HB2 LYS A 92 4.546 -3.295 -12.467 1.00 0.00 H new ATOM 0 HB3 LYS A 92 4.452 -4.230 -13.946 1.00 0.00 H new ATOM 0 HG2 LYS A 92 6.041 -2.805 -15.060 1.00 0.00 H new ATOM 0 HG3 LYS A 92 5.960 -1.602 -13.789 1.00 0.00 H new ATOM 0 HD2 LYS A 92 6.954 -3.211 -12.181 1.00 0.00 H new ATOM 0 HD3 LYS A 92 7.002 -4.442 -13.428 1.00 0.00 H new ATOM 0 HE2 LYS A 92 8.745 -3.420 -14.581 1.00 0.00 H new ATOM 0 HE3 LYS A 92 8.312 -1.812 -14.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 10.345 -2.572 -12.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 9.132 -2.369 -11.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 9.551 -3.928 -12.349 1.00 0.00 H new ATOM 1455 N LYS A 93 1.201 -3.250 -14.587 1.00 0.00 N ATOM 1456 CA LYS A 93 -0.092 -3.877 -14.330 1.00 0.00 C ATOM 1457 C LYS A 93 0.049 -5.392 -14.220 1.00 0.00 C ATOM 1458 O LYS A 93 0.289 -6.076 -15.214 1.00 0.00 O ATOM 1459 CB LYS A 93 -1.083 -3.524 -15.440 1.00 0.00 C ATOM 1460 CG LYS A 93 -2.523 -3.434 -14.963 1.00 0.00 C ATOM 1461 CD LYS A 93 -3.491 -3.321 -16.130 1.00 0.00 C ATOM 1462 CE LYS A 93 -4.192 -4.642 -16.405 1.00 0.00 C ATOM 1463 NZ LYS A 93 -3.572 -5.374 -17.543 1.00 0.00 N ATOM 0 H LYS A 93 1.363 -3.003 -15.563 1.00 0.00 H new ATOM 0 HA LYS A 93 -0.470 -3.496 -13.381 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -0.795 -2.570 -15.883 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -1.016 -4.274 -16.228 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -2.767 -4.316 -14.371 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -2.637 -2.569 -14.309 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -4.233 -2.552 -15.915 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -2.951 -3.002 -17.022 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -4.157 -5.264 -15.511 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -5.244 -4.456 -16.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -4.079 -6.269 -17.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -3.628 -4.791 -18.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -2.575 -5.574 -17.325 1.00 0.00 H new ATOM 1477 N LEU A 94 -0.105 -5.908 -13.005 1.00 0.00 N ATOM 1478 CA LEU A 94 0.003 -7.342 -12.765 1.00 0.00 C ATOM 1479 C LEU A 94 -1.119 -7.827 -11.854 1.00 0.00 C ATOM 1480 O LEU A 94 -1.726 -7.040 -11.127 1.00 0.00 O ATOM 1481 CB LEU A 94 1.361 -7.676 -12.144 1.00 0.00 C ATOM 1482 CG LEU A 94 2.573 -7.333 -13.011 1.00 0.00 C ATOM 1483 CD1 LEU A 94 3.863 -7.700 -12.295 1.00 0.00 C ATOM 1484 CD2 LEU A 94 2.485 -8.045 -14.354 1.00 0.00 C ATOM 0 H LEU A 94 -0.305 -5.355 -12.172 1.00 0.00 H new ATOM 0 HA LEU A 94 -0.085 -7.853 -13.724 1.00 0.00 H new ATOM 0 HB2 LEU A 94 1.450 -7.145 -11.196 1.00 0.00 H new ATOM 0 HB3 LEU A 94 1.387 -8.742 -11.916 1.00 0.00 H new ATOM 0 HG LEU A 94 2.575 -6.258 -13.191 1.00 0.00 H new ATOM 0 HD11 LEU A 94 4.714 -7.449 -12.927 1.00 0.00 H new ATOM 0 HD12 LEU A 94 3.930 -7.145 -11.359 1.00 0.00 H new ATOM 0 HD13 LEU A 94 3.871 -8.769 -12.084 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.355 -7.790 -14.959 1.00 0.00 H new ATOM 0 HD22 LEU A 94 2.458 -9.123 -14.193 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.579 -7.733 -14.873 1.00 0.00 H new ATOM 1496 N GLU A 95 -1.391 -9.128 -11.897 1.00 0.00 N ATOM 1497 CA GLU A 95 -2.441 -9.717 -11.074 1.00 0.00 C ATOM 1498 C GLU A 95 -1.971 -9.885 -9.632 1.00 0.00 C ATOM 1499 O GLU A 95 -1.546 -10.968 -9.229 1.00 0.00 O ATOM 1500 CB GLU A 95 -2.868 -11.070 -11.649 1.00 0.00 C ATOM 1501 CG GLU A 95 -4.268 -11.064 -12.241 1.00 0.00 C ATOM 1502 CD GLU A 95 -4.270 -10.775 -13.729 1.00 0.00 C ATOM 1503 OE1 GLU A 95 -3.962 -9.626 -14.112 1.00 0.00 O ATOM 1504 OE2 GLU A 95 -4.579 -11.697 -14.513 1.00 0.00 O ATOM 0 H GLU A 95 -0.899 -9.794 -12.493 1.00 0.00 H new ATOM 0 HA GLU A 95 -3.297 -9.043 -11.080 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -2.158 -11.368 -12.420 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -2.819 -11.822 -10.862 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -4.739 -12.031 -12.062 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -4.872 -10.315 -11.728 1.00 0.00 H new ATOM 1511 N TYR A 96 -2.051 -8.806 -8.860 1.00 0.00 N ATOM 1512 CA TYR A 96 -1.635 -8.833 -7.463 1.00 0.00 C ATOM 1513 C TYR A 96 -2.673 -9.540 -6.598 1.00 0.00 C ATOM 1514 O TYR A 96 -2.343 -10.436 -5.820 1.00 0.00 O ATOM 1515 CB TYR A 96 -1.411 -7.410 -6.948 1.00 0.00 C ATOM 1516 CG TYR A 96 -0.173 -6.748 -7.511 1.00 0.00 C ATOM 1517 CD1 TYR A 96 1.070 -6.942 -6.921 1.00 0.00 C ATOM 1518 CD2 TYR A 96 -0.248 -5.929 -8.630 1.00 0.00 C ATOM 1519 CE1 TYR A 96 2.204 -6.339 -7.432 1.00 0.00 C ATOM 1520 CE2 TYR A 96 0.882 -5.323 -9.148 1.00 0.00 C ATOM 1521 CZ TYR A 96 2.105 -5.530 -8.544 1.00 0.00 C ATOM 1522 OH TYR A 96 3.231 -4.927 -9.056 1.00 0.00 O ATOM 0 H TYR A 96 -2.400 -7.902 -9.179 1.00 0.00 H new ATOM 0 HA TYR A 96 -0.699 -9.387 -7.401 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -2.282 -6.802 -7.195 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -1.337 -7.434 -5.861 1.00 0.00 H new ATOM 0 HD1 TYR A 96 1.151 -7.574 -6.049 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -1.204 -5.763 -9.103 1.00 0.00 H new ATOM 0 HE1 TYR A 96 3.163 -6.501 -6.962 1.00 0.00 H new ATOM 0 HE2 TYR A 96 0.807 -4.691 -10.021 1.00 0.00 H new ATOM 0 HH TYR A 96 3.890 -4.803 -8.341 1.00 0.00 H new ATOM 1532 N THR A 97 -3.931 -9.131 -6.737 1.00 0.00 N ATOM 1533 CA THR A 97 -5.020 -9.724 -5.969 1.00 0.00 C ATOM 1534 C THR A 97 -5.082 -11.235 -6.176 1.00 0.00 C ATOM 1535 O THR A 97 -5.590 -11.967 -5.327 1.00 0.00 O ATOM 1536 CB THR A 97 -6.354 -9.090 -6.365 1.00 0.00 C ATOM 1537 OG1 THR A 97 -6.341 -8.702 -7.727 1.00 0.00 O ATOM 1538 CG2 THR A 97 -6.702 -7.866 -5.544 1.00 0.00 C ATOM 0 H THR A 97 -4.221 -8.390 -7.375 1.00 0.00 H new ATOM 0 HA THR A 97 -4.829 -9.531 -4.913 1.00 0.00 H new ATOM 0 HB THR A 97 -7.104 -9.859 -6.180 1.00 0.00 H new ATOM 0 HG1 THR A 97 -7.204 -8.300 -7.961 1.00 0.00 H new ATOM 0 HG21 THR A 97 -7.660 -7.465 -5.876 1.00 0.00 H new ATOM 0 HG22 THR A 97 -6.769 -8.141 -4.491 1.00 0.00 H new ATOM 0 HG23 THR A 97 -5.928 -7.109 -5.673 1.00 0.00 H new ATOM 1546 N LYS A 98 -4.564 -11.697 -7.311 1.00 0.00 N ATOM 1547 CA LYS A 98 -4.562 -13.121 -7.629 1.00 0.00 C ATOM 1548 C LYS A 98 -3.880 -13.928 -6.528 1.00 0.00 C ATOM 1549 O LYS A 98 -4.208 -15.093 -6.305 1.00 0.00 O ATOM 1550 CB LYS A 98 -3.858 -13.364 -8.965 1.00 0.00 C ATOM 1551 CG LYS A 98 -3.946 -14.802 -9.448 1.00 0.00 C ATOM 1552 CD LYS A 98 -2.824 -15.134 -10.418 1.00 0.00 C ATOM 1553 CE LYS A 98 -2.958 -14.352 -11.716 1.00 0.00 C ATOM 1554 NZ LYS A 98 -2.791 -15.226 -12.910 1.00 0.00 N ATOM 0 H LYS A 98 -4.140 -11.105 -8.026 1.00 0.00 H new ATOM 0 HA LYS A 98 -5.598 -13.451 -7.705 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -4.293 -12.709 -9.720 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -2.809 -13.086 -8.869 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -3.901 -15.477 -8.593 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -4.908 -14.966 -9.933 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -1.863 -14.910 -9.955 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -2.832 -16.202 -10.633 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -3.936 -13.872 -11.751 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -2.212 -13.558 -11.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -2.889 -14.656 -13.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -1.848 -15.665 -12.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -3.519 -15.969 -12.901 1.00 0.00 H new ATOM 1568 N ASN A 99 -2.929 -13.301 -5.842 1.00 0.00 N ATOM 1569 CA ASN A 99 -2.201 -13.963 -4.764 1.00 0.00 C ATOM 1570 C ASN A 99 -2.517 -13.319 -3.417 1.00 0.00 C ATOM 1571 O ASN A 99 -1.673 -13.284 -2.522 1.00 0.00 O ATOM 1572 CB ASN A 99 -0.696 -13.907 -5.028 1.00 0.00 C ATOM 1573 CG ASN A 99 -0.181 -12.486 -5.143 1.00 0.00 C ATOM 1574 OD1 ASN A 99 0.142 -11.848 -4.141 1.00 0.00 O ATOM 1575 ND2 ASN A 99 -0.101 -11.983 -6.369 1.00 0.00 N ATOM 0 H ASN A 99 -2.645 -12.336 -6.013 1.00 0.00 H new ATOM 0 HA ASN A 99 -2.519 -15.005 -4.731 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -0.169 -14.417 -4.221 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -0.471 -14.447 -5.947 1.00 0.00 H new ATOM 0 HD21 ASN A 99 0.239 -11.032 -6.509 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -0.380 -12.548 -7.171 1.00 0.00 H new ATOM 1582 N VAL A 100 -3.738 -12.812 -3.281 1.00 0.00 N ATOM 1583 CA VAL A 100 -4.165 -12.171 -2.043 1.00 0.00 C ATOM 1584 C VAL A 100 -5.604 -12.543 -1.701 1.00 0.00 C ATOM 1585 O VAL A 100 -6.455 -12.648 -2.584 1.00 0.00 O ATOM 1586 CB VAL A 100 -4.052 -10.637 -2.136 1.00 0.00 C ATOM 1587 CG1 VAL A 100 -4.398 -9.990 -0.803 1.00 0.00 C ATOM 1588 CG2 VAL A 100 -2.657 -10.231 -2.588 1.00 0.00 C ATOM 0 H VAL A 100 -4.449 -12.833 -4.012 1.00 0.00 H new ATOM 0 HA VAL A 100 -3.502 -12.529 -1.256 1.00 0.00 H new ATOM 0 HB VAL A 100 -4.768 -10.285 -2.879 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -4.312 -8.907 -0.891 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -5.419 -10.251 -0.526 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -3.711 -10.347 -0.036 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -2.596 -9.144 -2.648 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -1.922 -10.597 -1.872 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -2.453 -10.661 -3.569 1.00 0.00 H new ATOM 1598 N ASN A 101 -5.867 -12.740 -0.414 1.00 0.00 N ATOM 1599 CA ASN A 101 -7.204 -13.098 0.046 1.00 0.00 C ATOM 1600 C ASN A 101 -7.975 -11.854 0.486 1.00 0.00 C ATOM 1601 O ASN A 101 -7.455 -11.028 1.236 1.00 0.00 O ATOM 1602 CB ASN A 101 -7.118 -14.094 1.203 1.00 0.00 C ATOM 1603 CG ASN A 101 -6.336 -13.548 2.380 1.00 0.00 C ATOM 1604 OD1 ASN A 101 -5.202 -13.091 2.230 1.00 0.00 O ATOM 1605 ND2 ASN A 101 -6.938 -13.593 3.564 1.00 0.00 N ATOM 0 H ASN A 101 -5.173 -12.658 0.329 1.00 0.00 H new ATOM 0 HA ASN A 101 -7.737 -13.562 -0.784 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -8.125 -14.355 1.529 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -6.648 -15.013 0.853 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -6.460 -13.241 4.393 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -7.878 -13.980 3.644 1.00 0.00 H new ATOM 1612 N PRO A 102 -9.229 -11.700 0.025 1.00 0.00 N ATOM 1613 CA PRO A 102 -10.062 -10.546 0.380 1.00 0.00 C ATOM 1614 C PRO A 102 -10.541 -10.600 1.825 1.00 0.00 C ATOM 1615 O PRO A 102 -10.240 -11.543 2.557 1.00 0.00 O ATOM 1616 CB PRO A 102 -11.247 -10.657 -0.580 1.00 0.00 C ATOM 1617 CG PRO A 102 -11.345 -12.110 -0.890 1.00 0.00 C ATOM 1618 CD PRO A 102 -9.935 -12.633 -0.876 1.00 0.00 C ATOM 0 HA PRO A 102 -9.515 -9.607 0.297 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -12.164 -10.287 -0.122 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -11.082 -10.069 -1.483 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -11.960 -12.626 -0.152 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -11.811 -12.271 -1.862 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -9.891 -13.658 -0.507 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -9.498 -12.635 -1.874 1.00 0.00 H new ATOM 1626 N ASN A 103 -11.289 -9.579 2.233 1.00 0.00 N ATOM 1627 CA ASN A 103 -11.815 -9.506 3.592 1.00 0.00 C ATOM 1628 C ASN A 103 -10.683 -9.367 4.606 1.00 0.00 C ATOM 1629 O ASN A 103 -10.536 -10.194 5.507 1.00 0.00 O ATOM 1630 CB ASN A 103 -12.654 -10.746 3.907 1.00 0.00 C ATOM 1631 CG ASN A 103 -13.844 -10.430 4.792 1.00 0.00 C ATOM 1632 OD1 ASN A 103 -14.992 -10.666 4.417 1.00 0.00 O ATOM 1633 ND2 ASN A 103 -13.574 -9.892 5.977 1.00 0.00 N ATOM 0 H ASN A 103 -11.545 -8.789 1.640 1.00 0.00 H new ATOM 0 HA ASN A 103 -12.450 -8.623 3.662 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -13.005 -11.190 2.975 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -12.027 -11.490 4.398 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -14.334 -9.658 6.616 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -12.607 -9.713 6.247 1.00 0.00 H new ATOM 1640 N TRP A 104 -9.884 -8.316 4.453 1.00 0.00 N ATOM 1641 CA TRP A 104 -8.766 -8.067 5.355 1.00 0.00 C ATOM 1642 C TRP A 104 -8.969 -6.768 6.129 1.00 0.00 C ATOM 1643 O TRP A 104 -8.587 -6.662 7.294 1.00 0.00 O ATOM 1644 CB TRP A 104 -7.453 -8.009 4.571 1.00 0.00 C ATOM 1645 CG TRP A 104 -7.480 -7.030 3.436 1.00 0.00 C ATOM 1646 CD1 TRP A 104 -8.119 -7.180 2.240 1.00 0.00 C ATOM 1647 CD2 TRP A 104 -6.834 -5.753 3.389 1.00 0.00 C ATOM 1648 NE1 TRP A 104 -7.913 -6.073 1.453 1.00 0.00 N ATOM 1649 CE2 TRP A 104 -7.127 -5.183 2.137 1.00 0.00 C ATOM 1650 CE3 TRP A 104 -6.037 -5.036 4.286 1.00 0.00 C ATOM 1651 CZ2 TRP A 104 -6.652 -3.929 1.759 1.00 0.00 C ATOM 1652 CZ3 TRP A 104 -5.565 -3.791 3.910 1.00 0.00 C ATOM 1653 CH2 TRP A 104 -5.875 -3.249 2.656 1.00 0.00 C ATOM 0 H TRP A 104 -9.990 -7.623 3.712 1.00 0.00 H new ATOM 0 HA TRP A 104 -8.718 -8.889 6.069 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -6.644 -7.743 5.251 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -7.228 -9.001 4.180 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -8.702 -8.043 1.954 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -8.284 -5.936 0.513 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -5.794 -5.446 5.255 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -6.889 -3.509 0.793 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -4.948 -3.228 4.594 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -5.493 -2.274 2.392 1.00 0.00 H new ATOM 1664 N SER A 105 -9.573 -5.780 5.475 1.00 0.00 N ATOM 1665 CA SER A 105 -9.827 -4.490 6.103 1.00 0.00 C ATOM 1666 C SER A 105 -11.308 -4.325 6.431 1.00 0.00 C ATOM 1667 O SER A 105 -11.838 -3.214 6.415 1.00 0.00 O ATOM 1668 CB SER A 105 -9.367 -3.353 5.188 1.00 0.00 C ATOM 1669 OG SER A 105 -7.954 -3.268 5.150 1.00 0.00 O ATOM 0 H SER A 105 -9.895 -5.849 4.510 1.00 0.00 H new ATOM 0 HA SER A 105 -9.260 -4.451 7.033 1.00 0.00 H new ATOM 0 HB2 SER A 105 -9.752 -3.514 4.181 1.00 0.00 H new ATOM 0 HB3 SER A 105 -9.782 -2.408 5.540 1.00 0.00 H new ATOM 0 HG SER A 105 -7.613 -3.813 4.410 1.00 0.00 H new