USER MOD reduce.3.24.130724 H: found=0, std=0, add=1111, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1112 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 52 TYR OH : rot 12:sc= 0.75 USER MOD Set 1.2: A 56 MET CE :methyl -112:sc= -0.406 (180deg=-0.402) USER MOD Set 1.3: A 62 TYR OH : rot 180:sc= 0 USER MOD Set 1.4: A 136 HIS : no HE2:sc= 0.28 K(o=0.62,f=-0.9) USER MOD Set 2.1: A 26 GLN : amide:sc= 0.192 K(o=0.72,f=-0.13) USER MOD Set 2.2: A 30 TYR OH : rot 102:sc= 0.53 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= -0.22 X(o=-0.22,f=0) USER MOD Single : A 29 THR OG1 : rot 63:sc= 1.28 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 THR OG1 : rot -5:sc= -0.746 USER MOD Single : A 36 SER OG : rot 82:sc= 1.12 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -169:sc= -0.0271 (180deg=-0.217) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0.00686 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0.762 K(o=0.76,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 149:sc= 0.297 (180deg=0.0299) USER MOD Single : A 70 LYS NZ :NH3+ -165:sc= -0.072 (180deg=-0.306) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ -151:sc= 0.981 (180deg=0.474) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ -156:sc= -0.834 (180deg=-2.15!) USER MOD Single : A 90 THR OG1 : rot -20:sc= 0.803 USER MOD Single : A 94 LYS NZ :NH3+ -164:sc= -0.041 (180deg=-0.301) USER MOD Single : A 95 LYS NZ :NH3+ -118:sc= 1.25 (180deg=-0.599) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 ASN : amide:sc= 0.171 K(o=0.17,f=-4.2!) USER MOD Single : A 103 THR OG1 : rot -160:sc= -1.88! USER MOD Single : A 107 THR OG1 : rot -148:sc= 0.117 USER MOD Single : A 110 SER OG : rot -2:sc= 0.729 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 GLN :FLIP amide:sc= 1.09 F(o=-0.45,f=1.1) USER MOD Single : A 117 THR OG1 : rot -169:sc= 0.949 USER MOD Single : A 118 THR OG1 : rot -57:sc= 1.09 USER MOD Single : A 119 CYS SG : rot -22:sc= 0.318 USER MOD Single : A 125 GLN : amide:sc= -0.245 X(o=-0.24,f=-0.72) USER MOD Single : A 127 TYR OH : rot 19:sc= -2.04! USER MOD Single : A 134 ASN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 135 LYS NZ :NH3+ -171:sc= 0.513 (180deg=0.438) USER MOD Single : A 139 ASN : amide:sc= -0.319 X(o=-0.32,f=-0.57) USER MOD Single : A 145 GLN : amide:sc= -0.0898 X(o=-0.09,f=-0.21) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 200 N ILE A 15 11.928 9.891 -15.669 1.00 0.00 N ATOM 201 CA ILE A 15 10.748 9.515 -14.862 1.00 0.00 C ATOM 202 C ILE A 15 10.932 8.111 -14.242 1.00 0.00 C ATOM 203 O ILE A 15 10.664 7.911 -13.062 1.00 0.00 O ATOM 204 CB ILE A 15 9.421 9.578 -15.726 1.00 0.00 C ATOM 205 CG1 ILE A 15 9.134 11.047 -16.196 1.00 0.00 C ATOM 206 CG2 ILE A 15 8.201 8.981 -14.972 1.00 0.00 C ATOM 207 CD1 ILE A 15 8.936 12.063 -15.079 1.00 0.00 C ATOM 0 HA ILE A 15 10.654 10.237 -14.051 1.00 0.00 H new ATOM 0 HB ILE A 15 9.579 8.959 -16.609 1.00 0.00 H new ATOM 0 HG12 ILE A 15 9.962 11.378 -16.823 1.00 0.00 H new ATOM 0 HG13 ILE A 15 8.242 11.042 -16.822 1.00 0.00 H new ATOM 0 HG21 ILE A 15 7.315 9.046 -15.604 1.00 0.00 H new ATOM 0 HG22 ILE A 15 8.398 7.937 -14.730 1.00 0.00 H new ATOM 0 HG23 ILE A 15 8.032 9.541 -14.052 1.00 0.00 H new ATOM 0 HD11 ILE A 15 8.744 13.045 -15.511 1.00 0.00 H new ATOM 0 HD12 ILE A 15 8.088 11.765 -14.463 1.00 0.00 H new ATOM 0 HD13 ILE A 15 9.834 12.106 -14.463 1.00 0.00 H new ATOM 219 N GLU A 16 11.432 7.165 -15.051 1.00 0.00 N ATOM 220 CA GLU A 16 11.683 5.770 -14.624 1.00 0.00 C ATOM 221 C GLU A 16 12.829 5.711 -13.606 1.00 0.00 C ATOM 222 O GLU A 16 12.822 4.877 -12.709 1.00 0.00 O ATOM 223 CB GLU A 16 12.032 4.888 -15.845 1.00 0.00 C ATOM 224 CG GLU A 16 10.915 4.772 -16.893 1.00 0.00 C ATOM 225 CD GLU A 16 11.340 3.939 -18.110 1.00 0.00 C ATOM 226 OE1 GLU A 16 11.920 4.510 -19.063 1.00 0.00 O ATOM 227 OE2 GLU A 16 11.132 2.701 -18.101 1.00 0.00 O ATOM 0 H GLU A 16 11.677 7.342 -16.025 1.00 0.00 H new ATOM 0 HA GLU A 16 10.774 5.393 -14.155 1.00 0.00 H new ATOM 0 HB2 GLU A 16 12.922 5.293 -16.326 1.00 0.00 H new ATOM 0 HB3 GLU A 16 12.287 3.888 -15.493 1.00 0.00 H new ATOM 0 HG2 GLU A 16 10.036 4.319 -16.435 1.00 0.00 H new ATOM 0 HG3 GLU A 16 10.624 5.770 -17.222 1.00 0.00 H new ATOM 234 N LYS A 17 13.817 6.601 -13.793 1.00 0.00 N ATOM 235 CA LYS A 17 14.963 6.758 -12.882 1.00 0.00 C ATOM 236 C LYS A 17 14.481 7.156 -11.478 1.00 0.00 C ATOM 237 O LYS A 17 14.707 6.422 -10.509 1.00 0.00 O ATOM 238 CB LYS A 17 15.916 7.837 -13.450 1.00 0.00 C ATOM 239 CG LYS A 17 17.099 8.237 -12.534 1.00 0.00 C ATOM 240 CD LYS A 17 17.844 9.496 -13.041 1.00 0.00 C ATOM 241 CE LYS A 17 16.893 10.692 -13.256 1.00 0.00 C ATOM 242 NZ LYS A 17 17.613 11.936 -13.623 1.00 0.00 N ATOM 0 H LYS A 17 13.843 7.238 -14.589 1.00 0.00 H new ATOM 0 HA LYS A 17 15.494 5.810 -12.801 1.00 0.00 H new ATOM 0 HB2 LYS A 17 16.319 7.478 -14.397 1.00 0.00 H new ATOM 0 HB3 LYS A 17 15.333 8.731 -13.671 1.00 0.00 H new ATOM 0 HG2 LYS A 17 16.727 8.420 -11.526 1.00 0.00 H new ATOM 0 HG3 LYS A 17 17.801 7.405 -12.469 1.00 0.00 H new ATOM 0 HD2 LYS A 17 18.616 9.773 -12.323 1.00 0.00 H new ATOM 0 HD3 LYS A 17 18.350 9.264 -13.978 1.00 0.00 H new ATOM 0 HE2 LYS A 17 16.178 10.446 -14.041 1.00 0.00 H new ATOM 0 HE3 LYS A 17 16.320 10.864 -12.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 16.928 12.707 -13.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 18.277 12.190 -12.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 18.139 11.785 -14.507 1.00 0.00 H new ATOM 256 N GLN A 18 13.775 8.306 -11.408 1.00 0.00 N ATOM 257 CA GLN A 18 13.322 8.895 -10.137 1.00 0.00 C ATOM 258 C GLN A 18 12.262 7.996 -9.465 1.00 0.00 C ATOM 259 O GLN A 18 12.217 7.909 -8.248 1.00 0.00 O ATOM 260 CB GLN A 18 12.796 10.346 -10.347 1.00 0.00 C ATOM 261 CG GLN A 18 11.498 10.477 -11.165 1.00 0.00 C ATOM 262 CD GLN A 18 11.178 11.919 -11.563 1.00 0.00 C ATOM 263 OE1 GLN A 18 10.492 12.644 -10.841 1.00 0.00 O ATOM 264 NE2 GLN A 18 11.692 12.343 -12.704 1.00 0.00 N ATOM 0 H GLN A 18 13.506 8.847 -12.230 1.00 0.00 H new ATOM 0 HA GLN A 18 14.178 8.956 -9.465 1.00 0.00 H new ATOM 0 HB2 GLN A 18 12.634 10.798 -9.369 1.00 0.00 H new ATOM 0 HB3 GLN A 18 13.575 10.927 -10.841 1.00 0.00 H new ATOM 0 HG2 GLN A 18 11.581 9.869 -12.066 1.00 0.00 H new ATOM 0 HG3 GLN A 18 10.668 10.075 -10.584 1.00 0.00 H new ATOM 0 HE21 GLN A 18 12.255 11.713 -13.275 1.00 0.00 H new ATOM 0 HE22 GLN A 18 11.526 13.300 -13.014 1.00 0.00 H new ATOM 273 N PHE A 19 11.446 7.302 -10.284 1.00 0.00 N ATOM 274 CA PHE A 19 10.427 6.350 -9.796 1.00 0.00 C ATOM 275 C PHE A 19 11.082 5.112 -9.171 1.00 0.00 C ATOM 276 O PHE A 19 10.776 4.763 -8.035 1.00 0.00 O ATOM 277 CB PHE A 19 9.461 5.926 -10.945 1.00 0.00 C ATOM 278 CG PHE A 19 8.564 4.722 -10.612 1.00 0.00 C ATOM 279 CD1 PHE A 19 7.630 4.789 -9.574 1.00 0.00 C ATOM 280 CD2 PHE A 19 8.680 3.512 -11.313 1.00 0.00 C ATOM 281 CE1 PHE A 19 6.853 3.692 -9.248 1.00 0.00 C ATOM 282 CE2 PHE A 19 7.893 2.421 -10.983 1.00 0.00 C ATOM 283 CZ PHE A 19 6.984 2.515 -9.949 1.00 0.00 C ATOM 0 H PHE A 19 11.474 7.385 -11.300 1.00 0.00 H new ATOM 0 HA PHE A 19 9.846 6.858 -9.026 1.00 0.00 H new ATOM 0 HB2 PHE A 19 8.827 6.775 -11.202 1.00 0.00 H new ATOM 0 HB3 PHE A 19 10.051 5.689 -11.830 1.00 0.00 H new ATOM 0 HD1 PHE A 19 7.514 5.709 -9.020 1.00 0.00 H new ATOM 0 HD2 PHE A 19 9.392 3.430 -12.121 1.00 0.00 H new ATOM 0 HE1 PHE A 19 6.140 3.760 -8.439 1.00 0.00 H new ATOM 0 HE2 PHE A 19 7.991 1.498 -11.534 1.00 0.00 H new ATOM 0 HZ PHE A 19 6.374 1.663 -9.689 1.00 0.00 H new ATOM 293 N ALA A 20 11.974 4.458 -9.931 1.00 0.00 N ATOM 294 CA ALA A 20 12.580 3.178 -9.523 1.00 0.00 C ATOM 295 C ALA A 20 13.389 3.338 -8.228 1.00 0.00 C ATOM 296 O ALA A 20 13.313 2.484 -7.341 1.00 0.00 O ATOM 297 CB ALA A 20 13.455 2.603 -10.647 1.00 0.00 C ATOM 0 H ALA A 20 12.294 4.797 -10.838 1.00 0.00 H new ATOM 0 HA ALA A 20 11.772 2.473 -9.328 1.00 0.00 H new ATOM 0 HB1 ALA A 20 13.891 1.658 -10.322 1.00 0.00 H new ATOM 0 HB2 ALA A 20 12.844 2.434 -11.534 1.00 0.00 H new ATOM 0 HB3 ALA A 20 14.252 3.308 -10.884 1.00 0.00 H new ATOM 303 N VAL A 21 14.125 4.465 -8.116 1.00 0.00 N ATOM 304 CA VAL A 21 14.958 4.742 -6.943 1.00 0.00 C ATOM 305 C VAL A 21 14.080 5.000 -5.689 1.00 0.00 C ATOM 306 O VAL A 21 14.293 4.373 -4.656 1.00 0.00 O ATOM 307 CB VAL A 21 15.990 5.914 -7.198 1.00 0.00 C ATOM 308 CG1 VAL A 21 15.311 7.283 -7.424 1.00 0.00 C ATOM 309 CG2 VAL A 21 17.021 5.999 -6.058 1.00 0.00 C ATOM 0 H VAL A 21 14.154 5.194 -8.829 1.00 0.00 H new ATOM 0 HA VAL A 21 15.556 3.851 -6.752 1.00 0.00 H new ATOM 0 HB VAL A 21 16.508 5.668 -8.125 1.00 0.00 H new ATOM 0 HG11 VAL A 21 16.073 8.044 -7.593 1.00 0.00 H new ATOM 0 HG12 VAL A 21 14.657 7.225 -8.294 1.00 0.00 H new ATOM 0 HG13 VAL A 21 14.723 7.547 -6.545 1.00 0.00 H new ATOM 0 HG21 VAL A 21 17.718 6.812 -6.258 1.00 0.00 H new ATOM 0 HG22 VAL A 21 16.507 6.186 -5.115 1.00 0.00 H new ATOM 0 HG23 VAL A 21 17.569 5.059 -5.992 1.00 0.00 H new ATOM 319 N VAL A 22 13.050 5.873 -5.801 1.00 0.00 N ATOM 320 CA VAL A 22 12.154 6.182 -4.667 1.00 0.00 C ATOM 321 C VAL A 22 11.290 4.968 -4.273 1.00 0.00 C ATOM 322 O VAL A 22 10.951 4.809 -3.109 1.00 0.00 O ATOM 323 CB VAL A 22 11.229 7.431 -4.935 1.00 0.00 C ATOM 324 CG1 VAL A 22 12.067 8.696 -5.238 1.00 0.00 C ATOM 325 CG2 VAL A 22 10.163 7.173 -6.033 1.00 0.00 C ATOM 0 H VAL A 22 12.822 6.372 -6.661 1.00 0.00 H new ATOM 0 HA VAL A 22 12.813 6.432 -3.836 1.00 0.00 H new ATOM 0 HB VAL A 22 10.675 7.608 -4.013 1.00 0.00 H new ATOM 0 HG11 VAL A 22 11.400 9.539 -5.418 1.00 0.00 H new ATOM 0 HG12 VAL A 22 12.711 8.918 -4.387 1.00 0.00 H new ATOM 0 HG13 VAL A 22 12.680 8.523 -6.122 1.00 0.00 H new ATOM 0 HG21 VAL A 22 9.558 8.069 -6.171 1.00 0.00 H new ATOM 0 HG22 VAL A 22 10.660 6.922 -6.970 1.00 0.00 H new ATOM 0 HG23 VAL A 22 9.521 6.346 -5.730 1.00 0.00 H new ATOM 335 N ALA A 23 10.968 4.104 -5.252 1.00 0.00 N ATOM 336 CA ALA A 23 10.100 2.937 -5.036 1.00 0.00 C ATOM 337 C ALA A 23 10.815 1.900 -4.161 1.00 0.00 C ATOM 338 O ALA A 23 10.292 1.490 -3.114 1.00 0.00 O ATOM 339 CB ALA A 23 9.681 2.336 -6.390 1.00 0.00 C ATOM 0 H ALA A 23 11.302 4.196 -6.211 1.00 0.00 H new ATOM 0 HA ALA A 23 9.198 3.251 -4.511 1.00 0.00 H new ATOM 0 HB1 ALA A 23 9.038 1.472 -6.221 1.00 0.00 H new ATOM 0 HB2 ALA A 23 9.139 3.084 -6.968 1.00 0.00 H new ATOM 0 HB3 ALA A 23 10.569 2.026 -6.941 1.00 0.00 H new ATOM 345 N VAL A 24 12.039 1.528 -4.582 1.00 0.00 N ATOM 346 CA VAL A 24 12.848 0.519 -3.884 1.00 0.00 C ATOM 347 C VAL A 24 13.307 1.038 -2.508 1.00 0.00 C ATOM 348 O VAL A 24 13.307 0.281 -1.531 1.00 0.00 O ATOM 349 CB VAL A 24 14.093 0.044 -4.742 1.00 0.00 C ATOM 350 CG1 VAL A 24 13.637 -0.566 -6.092 1.00 0.00 C ATOM 351 CG2 VAL A 24 15.123 1.186 -4.968 1.00 0.00 C ATOM 0 H VAL A 24 12.490 1.917 -5.410 1.00 0.00 H new ATOM 0 HA VAL A 24 12.208 -0.351 -3.736 1.00 0.00 H new ATOM 0 HB VAL A 24 14.598 -0.732 -4.167 1.00 0.00 H new ATOM 0 HG11 VAL A 24 14.511 -0.884 -6.661 1.00 0.00 H new ATOM 0 HG12 VAL A 24 12.994 -1.426 -5.904 1.00 0.00 H new ATOM 0 HG13 VAL A 24 13.085 0.182 -6.661 1.00 0.00 H new ATOM 0 HG21 VAL A 24 15.957 0.811 -5.561 1.00 0.00 H new ATOM 0 HG22 VAL A 24 14.643 2.009 -5.497 1.00 0.00 H new ATOM 0 HG23 VAL A 24 15.492 1.539 -4.005 1.00 0.00 H new ATOM 361 N GLU A 25 13.652 2.343 -2.431 1.00 0.00 N ATOM 362 CA GLU A 25 14.233 2.924 -1.214 1.00 0.00 C ATOM 363 C GLU A 25 13.177 3.200 -0.139 1.00 0.00 C ATOM 364 O GLU A 25 13.466 3.022 1.032 1.00 0.00 O ATOM 365 CB GLU A 25 15.060 4.190 -1.511 1.00 0.00 C ATOM 366 CG GLU A 25 16.331 3.923 -2.337 1.00 0.00 C ATOM 367 CD GLU A 25 17.262 5.136 -2.400 1.00 0.00 C ATOM 368 OE1 GLU A 25 16.795 6.236 -2.761 1.00 0.00 O ATOM 369 OE2 GLU A 25 18.454 5.015 -2.048 1.00 0.00 O ATOM 0 H GLU A 25 13.536 3.006 -3.197 1.00 0.00 H new ATOM 0 HA GLU A 25 14.914 2.171 -0.817 1.00 0.00 H new ATOM 0 HB2 GLU A 25 14.434 4.904 -2.046 1.00 0.00 H new ATOM 0 HB3 GLU A 25 15.343 4.657 -0.568 1.00 0.00 H new ATOM 0 HG2 GLU A 25 16.869 3.079 -1.905 1.00 0.00 H new ATOM 0 HG3 GLU A 25 16.047 3.635 -3.349 1.00 0.00 H new ATOM 376 N GLN A 26 11.958 3.624 -0.530 1.00 0.00 N ATOM 377 CA GLN A 26 10.838 3.774 0.436 1.00 0.00 C ATOM 378 C GLN A 26 10.451 2.406 1.006 1.00 0.00 C ATOM 379 O GLN A 26 10.242 2.275 2.212 1.00 0.00 O ATOM 380 CB GLN A 26 9.605 4.476 -0.202 1.00 0.00 C ATOM 381 CG GLN A 26 9.811 5.981 -0.478 1.00 0.00 C ATOM 382 CD GLN A 26 10.063 6.815 0.788 1.00 0.00 C ATOM 383 OE1 GLN A 26 9.126 7.307 1.408 1.00 0.00 O ATOM 384 NE2 GLN A 26 11.326 6.983 1.172 1.00 0.00 N ATOM 0 H GLN A 26 11.721 3.867 -1.492 1.00 0.00 H new ATOM 0 HA GLN A 26 11.182 4.415 1.248 1.00 0.00 H new ATOM 0 HB2 GLN A 26 9.360 3.976 -1.139 1.00 0.00 H new ATOM 0 HB3 GLN A 26 8.747 4.353 0.459 1.00 0.00 H new ATOM 0 HG2 GLN A 26 10.655 6.104 -1.157 1.00 0.00 H new ATOM 0 HG3 GLN A 26 8.931 6.371 -0.989 1.00 0.00 H new ATOM 0 HE21 GLN A 26 12.083 6.561 0.634 1.00 0.00 H new ATOM 0 HE22 GLN A 26 11.537 7.534 2.004 1.00 0.00 H new ATOM 393 N ALA A 27 10.416 1.387 0.127 1.00 0.00 N ATOM 394 CA ALA A 27 10.089 -0.002 0.509 1.00 0.00 C ATOM 395 C ALA A 27 11.098 -0.553 1.543 1.00 0.00 C ATOM 396 O ALA A 27 10.694 -1.149 2.549 1.00 0.00 O ATOM 397 CB ALA A 27 10.035 -0.900 -0.741 1.00 0.00 C ATOM 0 H ALA A 27 10.613 1.502 -0.867 1.00 0.00 H new ATOM 0 HA ALA A 27 9.106 -0.003 0.980 1.00 0.00 H new ATOM 0 HB1 ALA A 27 9.793 -1.921 -0.445 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.270 -0.529 -1.423 1.00 0.00 H new ATOM 0 HB3 ALA A 27 11.004 -0.887 -1.241 1.00 0.00 H new ATOM 403 N GLU A 28 12.411 -0.315 1.302 1.00 0.00 N ATOM 404 CA GLU A 28 13.485 -0.805 2.199 1.00 0.00 C ATOM 405 C GLU A 28 13.573 0.055 3.477 1.00 0.00 C ATOM 406 O GLU A 28 13.928 -0.461 4.527 1.00 0.00 O ATOM 407 CB GLU A 28 14.866 -0.863 1.475 1.00 0.00 C ATOM 408 CG GLU A 28 15.523 0.502 1.194 1.00 0.00 C ATOM 409 CD GLU A 28 16.855 0.404 0.425 1.00 0.00 C ATOM 410 OE1 GLU A 28 17.923 0.291 1.073 1.00 0.00 O ATOM 411 OE2 GLU A 28 16.840 0.428 -0.832 1.00 0.00 O ATOM 0 H GLU A 28 12.750 0.211 0.497 1.00 0.00 H new ATOM 0 HA GLU A 28 13.224 -1.823 2.487 1.00 0.00 H new ATOM 0 HB2 GLU A 28 15.550 -1.458 2.080 1.00 0.00 H new ATOM 0 HB3 GLU A 28 14.739 -1.388 0.528 1.00 0.00 H new ATOM 0 HG2 GLU A 28 14.829 1.118 0.623 1.00 0.00 H new ATOM 0 HG3 GLU A 28 15.698 1.013 2.141 1.00 0.00 H new ATOM 418 N THR A 29 13.233 1.362 3.376 1.00 0.00 N ATOM 419 CA THR A 29 13.245 2.292 4.529 1.00 0.00 C ATOM 420 C THR A 29 12.182 1.870 5.554 1.00 0.00 C ATOM 421 O THR A 29 12.493 1.672 6.729 1.00 0.00 O ATOM 422 CB THR A 29 13.015 3.781 4.078 1.00 0.00 C ATOM 423 OG1 THR A 29 14.139 4.231 3.306 1.00 0.00 O ATOM 424 CG2 THR A 29 12.793 4.757 5.253 1.00 0.00 C ATOM 0 H THR A 29 12.945 1.798 2.500 1.00 0.00 H new ATOM 0 HA THR A 29 14.230 2.241 4.992 1.00 0.00 H new ATOM 0 HB THR A 29 12.101 3.782 3.484 1.00 0.00 H new ATOM 0 HG1 THR A 29 14.208 3.697 2.487 1.00 0.00 H new ATOM 0 HG21 THR A 29 12.641 5.764 4.865 1.00 0.00 H new ATOM 0 HG22 THR A 29 11.914 4.450 5.820 1.00 0.00 H new ATOM 0 HG23 THR A 29 13.667 4.747 5.905 1.00 0.00 H new ATOM 432 N TYR A 30 10.943 1.679 5.067 1.00 0.00 N ATOM 433 CA TYR A 30 9.798 1.280 5.905 1.00 0.00 C ATOM 434 C TYR A 30 10.016 -0.124 6.497 1.00 0.00 C ATOM 435 O TYR A 30 9.639 -0.381 7.642 1.00 0.00 O ATOM 436 CB TYR A 30 8.483 1.341 5.089 1.00 0.00 C ATOM 437 CG TYR A 30 8.089 2.751 4.601 1.00 0.00 C ATOM 438 CD1 TYR A 30 8.296 3.889 5.392 1.00 0.00 C ATOM 439 CD2 TYR A 30 7.493 2.939 3.351 1.00 0.00 C ATOM 440 CE1 TYR A 30 7.924 5.148 4.949 1.00 0.00 C ATOM 441 CE2 TYR A 30 7.117 4.192 2.909 1.00 0.00 C ATOM 442 CZ TYR A 30 7.332 5.292 3.706 1.00 0.00 C ATOM 443 OH TYR A 30 6.943 6.541 3.267 1.00 0.00 O ATOM 0 H TYR A 30 10.707 1.797 4.082 1.00 0.00 H new ATOM 0 HA TYR A 30 9.717 1.983 6.734 1.00 0.00 H new ATOM 0 HB2 TYR A 30 8.578 0.686 4.223 1.00 0.00 H new ATOM 0 HB3 TYR A 30 7.673 0.944 5.701 1.00 0.00 H new ATOM 0 HD1 TYR A 30 8.754 3.783 6.364 1.00 0.00 H new ATOM 0 HD2 TYR A 30 7.322 2.083 2.715 1.00 0.00 H new ATOM 0 HE1 TYR A 30 8.095 6.014 5.571 1.00 0.00 H new ATOM 0 HE2 TYR A 30 6.655 4.308 1.940 1.00 0.00 H new ATOM 0 HH TYR A 30 7.601 6.882 2.626 1.00 0.00 H new ATOM 453 N TRP A 31 10.658 -1.008 5.706 1.00 0.00 N ATOM 454 CA TRP A 31 11.075 -2.347 6.168 1.00 0.00 C ATOM 455 C TRP A 31 12.022 -2.212 7.379 1.00 0.00 C ATOM 456 O TRP A 31 11.756 -2.772 8.440 1.00 0.00 O ATOM 457 CB TRP A 31 11.763 -3.132 5.011 1.00 0.00 C ATOM 458 CG TRP A 31 12.290 -4.504 5.395 1.00 0.00 C ATOM 459 CD1 TRP A 31 13.528 -4.797 5.899 1.00 0.00 C ATOM 460 CD2 TRP A 31 11.594 -5.759 5.319 1.00 0.00 C ATOM 461 NE1 TRP A 31 13.636 -6.136 6.149 1.00 0.00 N ATOM 462 CE2 TRP A 31 12.471 -6.751 5.796 1.00 0.00 C ATOM 463 CE3 TRP A 31 10.316 -6.140 4.898 1.00 0.00 C ATOM 464 CZ2 TRP A 31 12.116 -8.094 5.863 1.00 0.00 C ATOM 465 CZ3 TRP A 31 9.967 -7.476 4.964 1.00 0.00 C ATOM 466 CH2 TRP A 31 10.864 -8.438 5.443 1.00 0.00 C ATOM 0 H TRP A 31 10.901 -0.815 4.734 1.00 0.00 H new ATOM 0 HA TRP A 31 10.193 -2.907 6.477 1.00 0.00 H new ATOM 0 HB2 TRP A 31 11.049 -3.248 4.195 1.00 0.00 H new ATOM 0 HB3 TRP A 31 12.591 -2.535 4.628 1.00 0.00 H new ATOM 0 HD1 TRP A 31 14.309 -4.072 6.074 1.00 0.00 H new ATOM 0 HE1 TRP A 31 14.456 -6.601 6.537 1.00 0.00 H new ATOM 0 HE3 TRP A 31 9.616 -5.405 4.529 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 12.806 -8.838 6.234 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 8.984 -7.783 4.640 1.00 0.00 H new ATOM 0 HH2 TRP A 31 10.559 -9.473 5.481 1.00 0.00 H new ATOM 477 N LYS A 32 13.110 -1.426 7.207 1.00 0.00 N ATOM 478 CA LYS A 32 14.162 -1.272 8.237 1.00 0.00 C ATOM 479 C LYS A 32 13.650 -0.518 9.474 1.00 0.00 C ATOM 480 O LYS A 32 14.204 -0.677 10.563 1.00 0.00 O ATOM 481 CB LYS A 32 15.435 -0.583 7.668 1.00 0.00 C ATOM 482 CG LYS A 32 16.141 -1.359 6.526 1.00 0.00 C ATOM 483 CD LYS A 32 16.504 -2.824 6.883 1.00 0.00 C ATOM 484 CE LYS A 32 17.522 -2.957 8.028 1.00 0.00 C ATOM 485 NZ LYS A 32 17.808 -4.382 8.352 1.00 0.00 N ATOM 0 H LYS A 32 13.282 -0.886 6.359 1.00 0.00 H new ATOM 0 HA LYS A 32 14.436 -2.280 8.549 1.00 0.00 H new ATOM 0 HB2 LYS A 32 15.162 0.406 7.301 1.00 0.00 H new ATOM 0 HB3 LYS A 32 16.146 -0.436 8.481 1.00 0.00 H new ATOM 0 HG2 LYS A 32 15.494 -1.360 5.649 1.00 0.00 H new ATOM 0 HG3 LYS A 32 17.052 -0.828 6.250 1.00 0.00 H new ATOM 0 HD2 LYS A 32 15.593 -3.356 7.157 1.00 0.00 H new ATOM 0 HD3 LYS A 32 16.905 -3.314 5.996 1.00 0.00 H new ATOM 0 HE2 LYS A 32 18.449 -2.454 7.751 1.00 0.00 H new ATOM 0 HE3 LYS A 32 17.139 -2.452 8.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 18.498 -4.430 9.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 16.928 -4.856 8.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 18.197 -4.857 7.513 1.00 0.00 H new ATOM 499 N LEU A 33 12.585 0.282 9.303 1.00 0.00 N ATOM 500 CA LEU A 33 11.897 0.941 10.422 1.00 0.00 C ATOM 501 C LEU A 33 11.177 -0.115 11.285 1.00 0.00 C ATOM 502 O LEU A 33 11.371 -0.153 12.505 1.00 0.00 O ATOM 503 CB LEU A 33 10.899 2.019 9.899 1.00 0.00 C ATOM 504 CG LEU A 33 11.535 3.328 9.324 1.00 0.00 C ATOM 505 CD1 LEU A 33 10.456 4.275 8.745 1.00 0.00 C ATOM 506 CD2 LEU A 33 12.396 4.035 10.394 1.00 0.00 C ATOM 0 H LEU A 33 12.180 0.489 8.390 1.00 0.00 H new ATOM 0 HA LEU A 33 12.634 1.451 11.042 1.00 0.00 H new ATOM 0 HB2 LEU A 33 10.283 1.567 9.121 1.00 0.00 H new ATOM 0 HB3 LEU A 33 10.231 2.293 10.716 1.00 0.00 H new ATOM 0 HG LEU A 33 12.191 3.048 8.500 1.00 0.00 H new ATOM 0 HD11 LEU A 33 10.933 5.174 8.354 1.00 0.00 H new ATOM 0 HD12 LEU A 33 9.921 3.769 7.941 1.00 0.00 H new ATOM 0 HD13 LEU A 33 9.753 4.550 9.531 1.00 0.00 H new ATOM 0 HD21 LEU A 33 12.828 4.942 9.972 1.00 0.00 H new ATOM 0 HD22 LEU A 33 11.773 4.294 11.250 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.196 3.368 10.716 1.00 0.00 H new ATOM 518 N LEU A 34 10.364 -0.979 10.626 1.00 0.00 N ATOM 519 CA LEU A 34 9.614 -2.064 11.305 1.00 0.00 C ATOM 520 C LEU A 34 10.574 -3.039 12.021 1.00 0.00 C ATOM 521 O LEU A 34 10.361 -3.367 13.185 1.00 0.00 O ATOM 522 CB LEU A 34 8.675 -2.831 10.309 1.00 0.00 C ATOM 523 CG LEU A 34 7.214 -2.278 10.144 1.00 0.00 C ATOM 524 CD1 LEU A 34 7.181 -0.841 9.583 1.00 0.00 C ATOM 525 CD2 LEU A 34 6.344 -3.243 9.297 1.00 0.00 C ATOM 0 H LEU A 34 10.211 -0.943 9.618 1.00 0.00 H new ATOM 0 HA LEU A 34 8.980 -1.598 12.059 1.00 0.00 H new ATOM 0 HB2 LEU A 34 9.150 -2.833 9.328 1.00 0.00 H new ATOM 0 HB3 LEU A 34 8.610 -3.869 10.634 1.00 0.00 H new ATOM 0 HG LEU A 34 6.782 -2.225 11.143 1.00 0.00 H new ATOM 0 HD11 LEU A 34 6.147 -0.510 9.490 1.00 0.00 H new ATOM 0 HD12 LEU A 34 7.716 -0.174 10.259 1.00 0.00 H new ATOM 0 HD13 LEU A 34 7.657 -0.822 8.603 1.00 0.00 H new ATOM 0 HD21 LEU A 34 5.338 -2.835 9.199 1.00 0.00 H new ATOM 0 HD22 LEU A 34 6.787 -3.358 8.308 1.00 0.00 H new ATOM 0 HD23 LEU A 34 6.295 -4.215 9.788 1.00 0.00 H new ATOM 537 N THR A 35 11.647 -3.458 11.324 1.00 0.00 N ATOM 538 CA THR A 35 12.625 -4.435 11.851 1.00 0.00 C ATOM 539 C THR A 35 13.323 -3.936 13.142 1.00 0.00 C ATOM 540 O THR A 35 13.722 -4.741 13.991 1.00 0.00 O ATOM 541 CB THR A 35 13.701 -4.780 10.774 1.00 0.00 C ATOM 542 OG1 THR A 35 14.386 -3.587 10.371 1.00 0.00 O ATOM 543 CG2 THR A 35 13.103 -5.459 9.528 1.00 0.00 C ATOM 0 H THR A 35 11.862 -3.131 10.382 1.00 0.00 H new ATOM 0 HA THR A 35 12.061 -5.333 12.103 1.00 0.00 H new ATOM 0 HB THR A 35 14.392 -5.485 11.235 1.00 0.00 H new ATOM 0 HG1 THR A 35 13.973 -2.811 10.804 1.00 0.00 H new ATOM 0 HG21 THR A 35 13.898 -5.675 8.814 1.00 0.00 H new ATOM 0 HG22 THR A 35 12.614 -6.389 9.819 1.00 0.00 H new ATOM 0 HG23 THR A 35 12.372 -4.794 9.067 1.00 0.00 H new ATOM 551 N SER A 36 13.451 -2.605 13.280 1.00 0.00 N ATOM 552 CA SER A 36 14.051 -1.976 14.468 1.00 0.00 C ATOM 553 C SER A 36 13.011 -1.878 15.598 1.00 0.00 C ATOM 554 O SER A 36 13.242 -2.347 16.716 1.00 0.00 O ATOM 555 CB SER A 36 14.582 -0.567 14.113 1.00 0.00 C ATOM 556 OG SER A 36 15.498 -0.611 13.031 1.00 0.00 O ATOM 0 H SER A 36 13.142 -1.937 12.573 1.00 0.00 H new ATOM 0 HA SER A 36 14.884 -2.592 14.808 1.00 0.00 H new ATOM 0 HB2 SER A 36 13.746 0.083 13.856 1.00 0.00 H new ATOM 0 HB3 SER A 36 15.069 -0.131 14.985 1.00 0.00 H new ATOM 0 HG SER A 36 15.004 -0.635 12.185 1.00 0.00 H new ATOM 562 N VAL A 37 11.858 -1.261 15.277 1.00 0.00 N ATOM 563 CA VAL A 37 10.761 -1.002 16.234 1.00 0.00 C ATOM 564 C VAL A 37 9.405 -1.324 15.561 1.00 0.00 C ATOM 565 O VAL A 37 9.250 -1.072 14.364 1.00 0.00 O ATOM 566 CB VAL A 37 10.760 0.495 16.755 1.00 0.00 C ATOM 567 CG1 VAL A 37 11.981 0.780 17.667 1.00 0.00 C ATOM 568 CG2 VAL A 37 10.693 1.504 15.577 1.00 0.00 C ATOM 0 H VAL A 37 11.658 -0.924 14.335 1.00 0.00 H new ATOM 0 HA VAL A 37 10.916 -1.647 17.099 1.00 0.00 H new ATOM 0 HB VAL A 37 9.861 0.629 17.357 1.00 0.00 H new ATOM 0 HG11 VAL A 37 11.948 1.815 18.006 1.00 0.00 H new ATOM 0 HG12 VAL A 37 11.954 0.115 18.530 1.00 0.00 H new ATOM 0 HG13 VAL A 37 12.901 0.611 17.107 1.00 0.00 H new ATOM 0 HG21 VAL A 37 10.694 2.521 15.969 1.00 0.00 H new ATOM 0 HG22 VAL A 37 11.558 1.364 14.928 1.00 0.00 H new ATOM 0 HG23 VAL A 37 9.780 1.336 15.006 1.00 0.00 H new ATOM 578 N PRO A 38 8.410 -1.900 16.318 1.00 0.00 N ATOM 579 CA PRO A 38 7.061 -2.247 15.783 1.00 0.00 C ATOM 580 C PRO A 38 6.386 -1.108 14.977 1.00 0.00 C ATOM 581 O PRO A 38 6.473 0.069 15.354 1.00 0.00 O ATOM 582 CB PRO A 38 6.262 -2.595 17.059 1.00 0.00 C ATOM 583 CG PRO A 38 7.292 -3.135 17.995 1.00 0.00 C ATOM 584 CD PRO A 38 8.536 -2.304 17.748 1.00 0.00 C ATOM 0 HA PRO A 38 7.114 -3.058 15.057 1.00 0.00 H new ATOM 0 HB2 PRO A 38 5.769 -1.716 17.473 1.00 0.00 H new ATOM 0 HB3 PRO A 38 5.484 -3.330 16.854 1.00 0.00 H new ATOM 0 HG2 PRO A 38 6.963 -3.052 19.031 1.00 0.00 H new ATOM 0 HG3 PRO A 38 7.481 -4.191 17.804 1.00 0.00 H new ATOM 0 HD2 PRO A 38 8.576 -1.437 18.407 1.00 0.00 H new ATOM 0 HD3 PRO A 38 9.444 -2.880 17.923 1.00 0.00 H new ATOM 592 N GLY A 39 5.692 -1.487 13.880 1.00 0.00 N ATOM 593 CA GLY A 39 5.093 -0.531 12.936 1.00 0.00 C ATOM 594 C GLY A 39 3.734 0.013 13.368 1.00 0.00 C ATOM 595 O GLY A 39 2.834 0.179 12.539 1.00 0.00 O ATOM 0 H GLY A 39 5.535 -2.463 13.629 1.00 0.00 H new ATOM 0 HA2 GLY A 39 5.779 0.305 12.800 1.00 0.00 H new ATOM 0 HA3 GLY A 39 4.985 -1.016 11.966 1.00 0.00 H new ATOM 599 N SER A 40 3.598 0.302 14.673 1.00 0.00 N ATOM 600 CA SER A 40 2.364 0.844 15.265 1.00 0.00 C ATOM 601 C SER A 40 2.429 2.386 15.314 1.00 0.00 C ATOM 602 O SER A 40 1.424 3.062 15.061 1.00 0.00 O ATOM 603 CB SER A 40 2.166 0.252 16.681 1.00 0.00 C ATOM 604 OG SER A 40 0.921 0.625 17.246 1.00 0.00 O ATOM 0 H SER A 40 4.347 0.165 15.352 1.00 0.00 H new ATOM 0 HA SER A 40 1.511 0.563 14.648 1.00 0.00 H new ATOM 0 HB2 SER A 40 2.230 -0.835 16.631 1.00 0.00 H new ATOM 0 HB3 SER A 40 2.974 0.589 17.331 1.00 0.00 H new ATOM 0 HG SER A 40 0.835 0.230 18.139 1.00 0.00 H new ATOM 610 N LYS A 41 3.618 2.938 15.665 1.00 0.00 N ATOM 611 CA LYS A 41 3.839 4.407 15.685 1.00 0.00 C ATOM 612 C LYS A 41 4.312 4.908 14.310 1.00 0.00 C ATOM 613 O LYS A 41 4.163 6.094 13.986 1.00 0.00 O ATOM 614 CB LYS A 41 4.868 4.841 16.775 1.00 0.00 C ATOM 615 CG LYS A 41 6.363 4.496 16.498 1.00 0.00 C ATOM 616 CD LYS A 41 6.765 3.053 16.865 1.00 0.00 C ATOM 617 CE LYS A 41 6.643 2.778 18.375 1.00 0.00 C ATOM 618 NZ LYS A 41 7.400 3.775 19.199 1.00 0.00 N ATOM 0 H LYS A 41 4.435 2.391 15.937 1.00 0.00 H new ATOM 0 HA LYS A 41 2.878 4.859 15.930 1.00 0.00 H new ATOM 0 HB2 LYS A 41 4.786 5.919 16.911 1.00 0.00 H new ATOM 0 HB3 LYS A 41 4.580 4.378 17.719 1.00 0.00 H new ATOM 0 HG2 LYS A 41 6.571 4.660 15.441 1.00 0.00 H new ATOM 0 HG3 LYS A 41 6.992 5.188 17.057 1.00 0.00 H new ATOM 0 HD2 LYS A 41 6.134 2.352 16.318 1.00 0.00 H new ATOM 0 HD3 LYS A 41 7.792 2.872 16.547 1.00 0.00 H new ATOM 0 HE2 LYS A 41 5.591 2.797 18.661 1.00 0.00 H new ATOM 0 HE3 LYS A 41 7.014 1.776 18.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 7.445 3.448 20.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 8.365 3.875 18.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 6.917 4.695 19.161 1.00 0.00 H new ATOM 632 N LEU A 42 4.892 3.983 13.523 1.00 0.00 N ATOM 633 CA LEU A 42 5.567 4.299 12.259 1.00 0.00 C ATOM 634 C LEU A 42 4.552 4.695 11.182 1.00 0.00 C ATOM 635 O LEU A 42 3.801 3.858 10.668 1.00 0.00 O ATOM 636 CB LEU A 42 6.435 3.093 11.825 1.00 0.00 C ATOM 637 CG LEU A 42 7.614 2.764 12.796 1.00 0.00 C ATOM 638 CD1 LEU A 42 8.261 1.418 12.454 1.00 0.00 C ATOM 639 CD2 LEU A 42 8.659 3.907 12.808 1.00 0.00 C ATOM 0 H LEU A 42 4.903 2.989 13.752 1.00 0.00 H new ATOM 0 HA LEU A 42 6.223 5.158 12.401 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.796 2.214 11.737 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.842 3.292 10.833 1.00 0.00 H new ATOM 0 HG LEU A 42 7.202 2.680 13.802 1.00 0.00 H new ATOM 0 HD11 LEU A 42 9.077 1.220 13.149 1.00 0.00 H new ATOM 0 HD12 LEU A 42 7.517 0.626 12.533 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.650 1.449 11.436 1.00 0.00 H new ATOM 0 HD21 LEU A 42 9.469 3.652 13.492 1.00 0.00 H new ATOM 0 HD22 LEU A 42 9.061 4.043 11.804 1.00 0.00 H new ATOM 0 HD23 LEU A 42 8.184 4.831 13.137 1.00 0.00 H new ATOM 651 N ARG A 43 4.533 5.998 10.888 1.00 0.00 N ATOM 652 CA ARG A 43 3.625 6.612 9.922 1.00 0.00 C ATOM 653 C ARG A 43 4.322 6.774 8.558 1.00 0.00 C ATOM 654 O ARG A 43 5.455 7.269 8.485 1.00 0.00 O ATOM 655 CB ARG A 43 3.148 7.989 10.462 1.00 0.00 C ATOM 656 CG ARG A 43 2.273 7.946 11.748 1.00 0.00 C ATOM 657 CD ARG A 43 1.018 7.048 11.594 1.00 0.00 C ATOM 658 NE ARG A 43 -0.130 7.512 12.405 1.00 0.00 N ATOM 659 CZ ARG A 43 -1.184 8.208 11.930 1.00 0.00 C ATOM 660 NH1 ARG A 43 -1.244 8.595 10.659 1.00 0.00 N ATOM 661 NH2 ARG A 43 -2.173 8.539 12.737 1.00 0.00 N ATOM 0 H ARG A 43 5.164 6.669 11.327 1.00 0.00 H new ATOM 0 HA ARG A 43 2.758 5.966 9.783 1.00 0.00 H new ATOM 0 HB2 ARG A 43 4.026 8.603 10.663 1.00 0.00 H new ATOM 0 HB3 ARG A 43 2.582 8.490 9.677 1.00 0.00 H new ATOM 0 HG2 ARG A 43 2.876 7.580 12.579 1.00 0.00 H new ATOM 0 HG3 ARG A 43 1.960 8.959 12.003 1.00 0.00 H new ATOM 0 HD2 ARG A 43 0.726 7.019 10.544 1.00 0.00 H new ATOM 0 HD3 ARG A 43 1.271 6.028 11.883 1.00 0.00 H new ATOM 0 HE ARG A 43 -0.124 7.288 13.400 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -0.483 8.367 10.020 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -2.051 9.120 10.323 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -2.141 8.269 13.720 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -2.970 9.065 12.378 1.00 0.00 H new ATOM 675 N LEU A 44 3.637 6.337 7.488 1.00 0.00 N ATOM 676 CA LEU A 44 4.105 6.492 6.095 1.00 0.00 C ATOM 677 C LEU A 44 3.758 7.923 5.610 1.00 0.00 C ATOM 678 O LEU A 44 4.508 8.552 4.853 1.00 0.00 O ATOM 679 CB LEU A 44 3.424 5.419 5.186 1.00 0.00 C ATOM 680 CG LEU A 44 3.342 3.960 5.762 1.00 0.00 C ATOM 681 CD1 LEU A 44 2.593 3.012 4.803 1.00 0.00 C ATOM 682 CD2 LEU A 44 4.732 3.402 6.126 1.00 0.00 C ATOM 0 H LEU A 44 2.737 5.863 7.563 1.00 0.00 H new ATOM 0 HA LEU A 44 5.184 6.347 6.042 1.00 0.00 H new ATOM 0 HB2 LEU A 44 2.411 5.755 4.963 1.00 0.00 H new ATOM 0 HB3 LEU A 44 3.964 5.382 4.240 1.00 0.00 H new ATOM 0 HG LEU A 44 2.767 4.019 6.686 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.556 2.012 5.235 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.578 3.378 4.649 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.115 2.975 3.847 1.00 0.00 H new ATOM 0 HD21 LEU A 44 4.627 2.391 6.520 1.00 0.00 H new ATOM 0 HD22 LEU A 44 5.360 3.380 5.235 1.00 0.00 H new ATOM 0 HD23 LEU A 44 5.194 4.039 6.880 1.00 0.00 H new ATOM 694 N THR A 45 2.597 8.413 6.093 1.00 0.00 N ATOM 695 CA THR A 45 2.071 9.775 5.859 1.00 0.00 C ATOM 696 C THR A 45 1.782 10.427 7.231 1.00 0.00 C ATOM 697 O THR A 45 2.514 10.183 8.190 1.00 0.00 O ATOM 698 CB THR A 45 0.767 9.718 4.973 1.00 0.00 C ATOM 699 OG1 THR A 45 -0.171 8.764 5.494 1.00 0.00 O ATOM 700 CG2 THR A 45 1.083 9.402 3.516 1.00 0.00 C ATOM 0 H THR A 45 1.978 7.851 6.677 1.00 0.00 H new ATOM 0 HA THR A 45 2.805 10.373 5.319 1.00 0.00 H new ATOM 0 HB THR A 45 0.315 10.709 5.010 1.00 0.00 H new ATOM 0 HG1 THR A 45 -0.971 8.749 4.928 1.00 0.00 H new ATOM 0 HG21 THR A 45 0.157 9.372 2.941 1.00 0.00 H new ATOM 0 HG22 THR A 45 1.738 10.173 3.110 1.00 0.00 H new ATOM 0 HG23 THR A 45 1.580 8.434 3.453 1.00 0.00 H new ATOM 708 N LYS A 46 0.765 11.296 7.307 1.00 0.00 N ATOM 709 CA LYS A 46 0.199 11.776 8.584 1.00 0.00 C ATOM 710 C LYS A 46 -1.264 11.281 8.733 1.00 0.00 C ATOM 711 O LYS A 46 -1.885 11.418 9.793 1.00 0.00 O ATOM 712 CB LYS A 46 0.288 13.327 8.615 1.00 0.00 C ATOM 713 CG LYS A 46 -0.125 13.979 9.949 1.00 0.00 C ATOM 714 CD LYS A 46 0.099 15.504 9.955 1.00 0.00 C ATOM 715 CE LYS A 46 -0.232 16.146 11.307 1.00 0.00 C ATOM 716 NZ LYS A 46 0.064 17.599 11.318 1.00 0.00 N ATOM 0 H LYS A 46 0.307 11.690 6.485 1.00 0.00 H new ATOM 0 HA LYS A 46 0.764 11.377 9.426 1.00 0.00 H new ATOM 0 HB2 LYS A 46 1.312 13.621 8.386 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -0.343 13.728 7.822 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -1.177 13.769 10.142 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.445 13.528 10.762 1.00 0.00 H new ATOM 0 HD2 LYS A 46 1.138 15.715 9.702 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -0.517 15.960 9.180 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -1.286 15.989 11.535 1.00 0.00 H new ATOM 0 HE3 LYS A 46 0.341 15.653 12.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -0.174 17.995 12.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 1.075 17.749 11.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -0.501 18.074 10.586 1.00 0.00 H new ATOM 730 N PHE A 47 -1.790 10.653 7.665 1.00 0.00 N ATOM 731 CA PHE A 47 -3.225 10.326 7.532 1.00 0.00 C ATOM 732 C PHE A 47 -3.424 8.801 7.416 1.00 0.00 C ATOM 733 O PHE A 47 -4.466 8.343 6.981 1.00 0.00 O ATOM 734 CB PHE A 47 -3.798 11.087 6.289 1.00 0.00 C ATOM 735 CG PHE A 47 -3.495 12.587 6.317 1.00 0.00 C ATOM 736 CD1 PHE A 47 -4.219 13.446 7.146 1.00 0.00 C ATOM 737 CD2 PHE A 47 -2.467 13.133 5.545 1.00 0.00 C ATOM 738 CE1 PHE A 47 -3.924 14.798 7.199 1.00 0.00 C ATOM 739 CE2 PHE A 47 -2.177 14.484 5.594 1.00 0.00 C ATOM 740 CZ PHE A 47 -2.903 15.317 6.423 1.00 0.00 C ATOM 0 H PHE A 47 -1.230 10.356 6.866 1.00 0.00 H new ATOM 0 HA PHE A 47 -3.768 10.647 8.421 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -3.380 10.654 5.380 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -4.877 10.940 6.245 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -5.020 13.051 7.754 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -1.889 12.489 4.899 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -4.492 15.449 7.847 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -1.383 14.888 4.984 1.00 0.00 H new ATOM 0 HZ PHE A 47 -2.674 16.372 6.465 1.00 0.00 H new ATOM 750 N ASP A 48 -2.423 8.034 7.867 1.00 0.00 N ATOM 751 CA ASP A 48 -2.386 6.549 7.753 1.00 0.00 C ATOM 752 C ASP A 48 -3.613 5.867 8.374 1.00 0.00 C ATOM 753 O ASP A 48 -4.196 4.943 7.784 1.00 0.00 O ATOM 754 CB ASP A 48 -1.118 6.012 8.449 1.00 0.00 C ATOM 755 CG ASP A 48 0.144 6.650 7.882 1.00 0.00 C ATOM 756 OD1 ASP A 48 0.528 7.736 8.362 1.00 0.00 O ATOM 757 OD2 ASP A 48 0.717 6.120 6.920 1.00 0.00 O ATOM 0 H ASP A 48 -1.600 8.421 8.329 1.00 0.00 H new ATOM 0 HA ASP A 48 -2.383 6.316 6.688 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -1.178 6.210 9.519 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -1.066 4.930 8.328 1.00 0.00 H new ATOM 762 N ASP A 49 -3.983 6.357 9.566 1.00 0.00 N ATOM 763 CA ASP A 49 -5.085 5.819 10.371 1.00 0.00 C ATOM 764 C ASP A 49 -6.427 5.922 9.613 1.00 0.00 C ATOM 765 O ASP A 49 -7.170 4.937 9.525 1.00 0.00 O ATOM 766 CB ASP A 49 -5.142 6.558 11.743 1.00 0.00 C ATOM 767 CG ASP A 49 -5.397 8.076 11.639 1.00 0.00 C ATOM 768 OD1 ASP A 49 -4.552 8.794 11.049 1.00 0.00 O ATOM 769 OD2 ASP A 49 -6.432 8.564 12.149 1.00 0.00 O ATOM 0 H ASP A 49 -3.516 7.151 10.003 1.00 0.00 H new ATOM 0 HA ASP A 49 -4.905 4.760 10.557 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -5.929 6.111 12.351 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -4.201 6.395 12.269 1.00 0.00 H new ATOM 774 N GLU A 50 -6.694 7.104 9.019 1.00 0.00 N ATOM 775 CA GLU A 50 -7.944 7.357 8.271 1.00 0.00 C ATOM 776 C GLU A 50 -7.909 6.705 6.870 1.00 0.00 C ATOM 777 O GLU A 50 -8.965 6.404 6.321 1.00 0.00 O ATOM 778 CB GLU A 50 -8.245 8.877 8.142 1.00 0.00 C ATOM 779 CG GLU A 50 -7.107 9.692 7.503 1.00 0.00 C ATOM 780 CD GLU A 50 -7.578 10.910 6.707 1.00 0.00 C ATOM 781 OE1 GLU A 50 -8.020 10.723 5.552 1.00 0.00 O ATOM 782 OE2 GLU A 50 -7.494 12.053 7.210 1.00 0.00 O ATOM 0 H GLU A 50 -6.058 7.901 9.043 1.00 0.00 H new ATOM 0 HA GLU A 50 -8.748 6.899 8.847 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -9.149 9.008 7.547 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -8.454 9.280 9.133 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -6.429 10.026 8.288 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -6.535 9.040 6.843 1.00 0.00 H new ATOM 789 N ILE A 51 -6.695 6.495 6.287 1.00 0.00 N ATOM 790 CA ILE A 51 -6.556 5.769 4.993 1.00 0.00 C ATOM 791 C ILE A 51 -7.111 4.346 5.146 1.00 0.00 C ATOM 792 O ILE A 51 -7.872 3.871 4.301 1.00 0.00 O ATOM 793 CB ILE A 51 -5.070 5.731 4.454 1.00 0.00 C ATOM 794 CG1 ILE A 51 -4.584 7.171 4.092 1.00 0.00 C ATOM 795 CG2 ILE A 51 -4.929 4.780 3.225 1.00 0.00 C ATOM 796 CD1 ILE A 51 -3.108 7.279 3.737 1.00 0.00 C ATOM 0 H ILE A 51 -5.812 6.813 6.686 1.00 0.00 H new ATOM 0 HA ILE A 51 -7.132 6.319 4.249 1.00 0.00 H new ATOM 0 HB ILE A 51 -4.438 5.336 5.250 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -5.173 7.537 3.251 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -4.789 7.831 4.935 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -3.894 4.780 2.882 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -5.216 3.769 3.513 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -5.578 5.127 2.421 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.865 8.315 3.501 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -2.505 6.949 4.583 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.895 6.650 2.872 1.00 0.00 H new ATOM 808 N TYR A 52 -6.748 3.714 6.270 1.00 0.00 N ATOM 809 CA TYR A 52 -7.253 2.394 6.671 1.00 0.00 C ATOM 810 C TYR A 52 -8.793 2.407 6.863 1.00 0.00 C ATOM 811 O TYR A 52 -9.490 1.525 6.353 1.00 0.00 O ATOM 812 CB TYR A 52 -6.528 1.951 7.975 1.00 0.00 C ATOM 813 CG TYR A 52 -7.140 0.737 8.691 1.00 0.00 C ATOM 814 CD1 TYR A 52 -7.121 -0.524 8.106 1.00 0.00 C ATOM 815 CD2 TYR A 52 -7.741 0.858 9.946 1.00 0.00 C ATOM 816 CE1 TYR A 52 -7.671 -1.621 8.741 1.00 0.00 C ATOM 817 CE2 TYR A 52 -8.294 -0.234 10.585 1.00 0.00 C ATOM 818 CZ TYR A 52 -8.257 -1.474 9.979 1.00 0.00 C ATOM 819 OH TYR A 52 -8.805 -2.571 10.610 1.00 0.00 O ATOM 0 H TYR A 52 -6.085 4.111 6.936 1.00 0.00 H new ATOM 0 HA TYR A 52 -7.042 1.677 5.878 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -5.490 1.723 7.734 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -6.517 2.792 8.668 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -6.667 -0.649 7.134 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -7.774 1.825 10.426 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -7.642 -2.591 8.268 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -8.754 -0.119 11.555 1.00 0.00 H new ATOM 0 HH TYR A 52 -8.526 -3.388 10.146 1.00 0.00 H new ATOM 829 N GLU A 53 -9.302 3.419 7.599 1.00 0.00 N ATOM 830 CA GLU A 53 -10.737 3.501 7.988 1.00 0.00 C ATOM 831 C GLU A 53 -11.666 3.736 6.772 1.00 0.00 C ATOM 832 O GLU A 53 -12.653 3.028 6.617 1.00 0.00 O ATOM 833 CB GLU A 53 -10.939 4.608 9.059 1.00 0.00 C ATOM 834 CG GLU A 53 -10.180 4.342 10.367 1.00 0.00 C ATOM 835 CD GLU A 53 -10.286 5.502 11.377 1.00 0.00 C ATOM 836 OE1 GLU A 53 -9.564 6.510 11.218 1.00 0.00 O ATOM 837 OE2 GLU A 53 -11.077 5.409 12.340 1.00 0.00 O ATOM 0 H GLU A 53 -8.740 4.199 7.940 1.00 0.00 H new ATOM 0 HA GLU A 53 -11.015 2.537 8.414 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -10.614 5.564 8.648 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -12.003 4.700 9.278 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -10.568 3.433 10.826 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -9.129 4.161 10.140 1.00 0.00 H new ATOM 844 N ASN A 54 -11.320 4.712 5.909 1.00 0.00 N ATOM 845 CA ASN A 54 -12.128 5.061 4.704 1.00 0.00 C ATOM 846 C ASN A 54 -12.066 3.940 3.644 1.00 0.00 C ATOM 847 O ASN A 54 -13.041 3.726 2.914 1.00 0.00 O ATOM 848 CB ASN A 54 -11.677 6.409 4.074 1.00 0.00 C ATOM 849 CG ASN A 54 -12.112 7.651 4.866 1.00 0.00 C ATOM 850 OD1 ASN A 54 -13.186 8.205 4.624 1.00 0.00 O ATOM 851 ND2 ASN A 54 -11.287 8.107 5.797 1.00 0.00 N ATOM 0 H ASN A 54 -10.481 5.282 6.018 1.00 0.00 H new ATOM 0 HA ASN A 54 -13.159 5.171 5.040 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -10.591 6.410 3.986 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -12.079 6.477 3.063 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -11.534 8.937 6.335 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -10.405 7.628 5.976 1.00 0.00 H new ATOM 858 N PHE A 55 -10.910 3.245 3.562 1.00 0.00 N ATOM 859 CA PHE A 55 -10.741 2.052 2.697 1.00 0.00 C ATOM 860 C PHE A 55 -11.667 0.922 3.194 1.00 0.00 C ATOM 861 O PHE A 55 -12.305 0.238 2.398 1.00 0.00 O ATOM 862 CB PHE A 55 -9.247 1.595 2.697 1.00 0.00 C ATOM 863 CG PHE A 55 -8.868 0.435 1.751 1.00 0.00 C ATOM 864 CD1 PHE A 55 -9.559 0.201 0.559 1.00 0.00 C ATOM 865 CD2 PHE A 55 -7.795 -0.406 2.050 1.00 0.00 C ATOM 866 CE1 PHE A 55 -9.197 -0.831 -0.289 1.00 0.00 C ATOM 867 CE2 PHE A 55 -7.436 -1.442 1.199 1.00 0.00 C ATOM 868 CZ PHE A 55 -8.137 -1.653 0.032 1.00 0.00 C ATOM 0 H PHE A 55 -10.072 3.491 4.089 1.00 0.00 H new ATOM 0 HA PHE A 55 -11.015 2.302 1.672 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -8.630 2.456 2.441 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -8.982 1.303 3.713 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -10.391 0.837 0.295 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -7.234 -0.248 2.959 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -9.746 -0.993 -1.205 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -6.605 -2.084 1.452 1.00 0.00 H new ATOM 0 HZ PHE A 55 -7.857 -2.460 -0.630 1.00 0.00 H new ATOM 878 N MET A 56 -11.741 0.780 4.526 1.00 0.00 N ATOM 879 CA MET A 56 -12.586 -0.220 5.207 1.00 0.00 C ATOM 880 C MET A 56 -14.089 0.040 4.946 1.00 0.00 C ATOM 881 O MET A 56 -14.857 -0.893 4.679 1.00 0.00 O ATOM 882 CB MET A 56 -12.272 -0.195 6.727 1.00 0.00 C ATOM 883 CG MET A 56 -13.043 -1.215 7.562 1.00 0.00 C ATOM 884 SD MET A 56 -12.641 -2.926 7.148 1.00 0.00 S ATOM 885 CE MET A 56 -10.899 -3.038 7.581 1.00 0.00 C ATOM 0 H MET A 56 -11.209 1.363 5.172 1.00 0.00 H new ATOM 0 HA MET A 56 -12.361 -1.208 4.807 1.00 0.00 H new ATOM 0 HB2 MET A 56 -11.205 -0.367 6.865 1.00 0.00 H new ATOM 0 HB3 MET A 56 -12.486 0.803 7.111 1.00 0.00 H new ATOM 0 HG2 MET A 56 -12.832 -1.044 8.618 1.00 0.00 H new ATOM 0 HG3 MET A 56 -14.112 -1.056 7.421 1.00 0.00 H new ATOM 0 HE1 MET A 56 -10.306 -3.160 6.675 1.00 0.00 H new ATOM 0 HE2 MET A 56 -10.593 -2.127 8.095 1.00 0.00 H new ATOM 0 HE3 MET A 56 -10.741 -3.895 8.236 1.00 0.00 H new ATOM 895 N GLU A 57 -14.482 1.320 5.024 1.00 0.00 N ATOM 896 CA GLU A 57 -15.880 1.763 4.843 1.00 0.00 C ATOM 897 C GLU A 57 -16.355 1.569 3.387 1.00 0.00 C ATOM 898 O GLU A 57 -17.348 0.873 3.140 1.00 0.00 O ATOM 899 CB GLU A 57 -16.029 3.248 5.268 1.00 0.00 C ATOM 900 CG GLU A 57 -15.742 3.511 6.752 1.00 0.00 C ATOM 901 CD GLU A 57 -15.791 5.003 7.115 1.00 0.00 C ATOM 902 OE1 GLU A 57 -14.797 5.716 6.873 1.00 0.00 O ATOM 903 OE2 GLU A 57 -16.838 5.475 7.613 1.00 0.00 O ATOM 0 H GLU A 57 -13.836 2.086 5.216 1.00 0.00 H new ATOM 0 HA GLU A 57 -16.512 1.144 5.480 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -15.354 3.856 4.666 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -17.043 3.579 5.042 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -16.469 2.971 7.359 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -14.759 3.113 7.003 1.00 0.00 H new ATOM 910 N ARG A 58 -15.612 2.171 2.437 1.00 0.00 N ATOM 911 CA ARG A 58 -15.998 2.210 1.003 1.00 0.00 C ATOM 912 C ARG A 58 -15.729 0.864 0.299 1.00 0.00 C ATOM 913 O ARG A 58 -16.344 0.562 -0.732 1.00 0.00 O ATOM 914 CB ARG A 58 -15.287 3.392 0.263 1.00 0.00 C ATOM 915 CG ARG A 58 -15.947 4.787 0.474 1.00 0.00 C ATOM 916 CD ARG A 58 -15.887 5.307 1.929 1.00 0.00 C ATOM 917 NE ARG A 58 -16.734 6.504 2.128 1.00 0.00 N ATOM 918 CZ ARG A 58 -17.167 6.964 3.315 1.00 0.00 C ATOM 919 NH1 ARG A 58 -16.700 6.465 4.457 1.00 0.00 N ATOM 920 NH2 ARG A 58 -18.040 7.958 3.354 1.00 0.00 N ATOM 0 H ARG A 58 -14.730 2.643 2.636 1.00 0.00 H new ATOM 0 HA ARG A 58 -17.073 2.384 0.959 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -14.251 3.441 0.599 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -15.266 3.173 -0.805 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -15.457 5.510 -0.178 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -16.990 4.733 0.163 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -16.209 4.518 2.609 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -14.855 5.547 2.185 1.00 0.00 H new ATOM 0 HE ARG A 58 -17.013 7.023 1.295 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -16.002 5.721 4.441 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -17.040 6.826 5.348 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -18.381 8.371 2.486 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -18.372 8.311 4.252 1.00 0.00 H new ATOM 934 N PHE A 59 -14.797 0.066 0.851 1.00 0.00 N ATOM 935 CA PHE A 59 -14.515 -1.304 0.377 1.00 0.00 C ATOM 936 C PHE A 59 -14.645 -2.261 1.583 1.00 0.00 C ATOM 937 O PHE A 59 -13.674 -2.479 2.310 1.00 0.00 O ATOM 938 CB PHE A 59 -13.093 -1.405 -0.263 1.00 0.00 C ATOM 939 CG PHE A 59 -12.831 -0.454 -1.441 1.00 0.00 C ATOM 940 CD1 PHE A 59 -12.509 0.893 -1.223 1.00 0.00 C ATOM 941 CD2 PHE A 59 -12.885 -0.904 -2.763 1.00 0.00 C ATOM 942 CE1 PHE A 59 -12.255 1.748 -2.279 1.00 0.00 C ATOM 943 CE2 PHE A 59 -12.626 -0.042 -3.817 1.00 0.00 C ATOM 944 CZ PHE A 59 -12.312 1.280 -3.575 1.00 0.00 C ATOM 0 H PHE A 59 -14.217 0.352 1.639 1.00 0.00 H new ATOM 0 HA PHE A 59 -15.228 -1.578 -0.400 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -12.350 -1.211 0.511 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -12.938 -2.429 -0.603 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -12.459 1.269 -0.212 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -13.131 -1.936 -2.966 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -12.012 2.783 -2.089 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -12.670 -0.407 -4.833 1.00 0.00 H new ATOM 0 HZ PHE A 59 -12.111 1.947 -4.400 1.00 0.00 H new ATOM 954 N PRO A 60 -15.868 -2.818 1.854 1.00 0.00 N ATOM 955 CA PRO A 60 -16.094 -3.752 2.988 1.00 0.00 C ATOM 956 C PRO A 60 -15.702 -5.212 2.651 1.00 0.00 C ATOM 957 O PRO A 60 -15.955 -6.134 3.432 1.00 0.00 O ATOM 958 CB PRO A 60 -17.614 -3.601 3.230 1.00 0.00 C ATOM 959 CG PRO A 60 -18.182 -3.386 1.857 1.00 0.00 C ATOM 960 CD PRO A 60 -17.139 -2.573 1.097 1.00 0.00 C ATOM 0 HA PRO A 60 -15.482 -3.523 3.861 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -18.033 -4.490 3.700 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -17.832 -2.760 3.888 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -18.374 -4.337 1.360 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -19.132 -2.854 1.906 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -17.056 -2.900 0.060 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -17.395 -1.514 1.078 1.00 0.00 H new ATOM 968 N GLU A 61 -15.080 -5.390 1.484 1.00 0.00 N ATOM 969 CA GLU A 61 -14.730 -6.703 0.915 1.00 0.00 C ATOM 970 C GLU A 61 -13.400 -7.252 1.476 1.00 0.00 C ATOM 971 O GLU A 61 -13.297 -8.445 1.787 1.00 0.00 O ATOM 972 CB GLU A 61 -14.672 -6.549 -0.628 1.00 0.00 C ATOM 973 CG GLU A 61 -13.673 -5.466 -1.115 1.00 0.00 C ATOM 974 CD GLU A 61 -13.947 -4.982 -2.539 1.00 0.00 C ATOM 975 OE1 GLU A 61 -13.461 -5.612 -3.503 1.00 0.00 O ATOM 976 OE2 GLU A 61 -14.680 -3.980 -2.700 1.00 0.00 O ATOM 0 H GLU A 61 -14.797 -4.610 0.891 1.00 0.00 H new ATOM 0 HA GLU A 61 -15.489 -7.433 1.196 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -14.397 -7.507 -1.069 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -15.668 -6.303 -0.996 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -13.713 -4.614 -0.436 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -12.661 -5.867 -1.064 1.00 0.00 H new ATOM 983 N TYR A 62 -12.394 -6.366 1.630 1.00 0.00 N ATOM 984 CA TYR A 62 -11.012 -6.775 1.967 1.00 0.00 C ATOM 985 C TYR A 62 -10.833 -6.968 3.495 1.00 0.00 C ATOM 986 O TYR A 62 -9.778 -7.440 3.925 1.00 0.00 O ATOM 987 CB TYR A 62 -9.980 -5.721 1.433 1.00 0.00 C ATOM 988 CG TYR A 62 -9.775 -4.521 2.375 1.00 0.00 C ATOM 989 CD1 TYR A 62 -10.733 -3.521 2.497 1.00 0.00 C ATOM 990 CD2 TYR A 62 -8.636 -4.427 3.188 1.00 0.00 C ATOM 991 CE1 TYR A 62 -10.565 -2.481 3.385 1.00 0.00 C ATOM 992 CE2 TYR A 62 -8.471 -3.384 4.069 1.00 0.00 C ATOM 993 CZ TYR A 62 -9.437 -2.417 4.169 1.00 0.00 C ATOM 994 OH TYR A 62 -9.265 -1.369 5.048 1.00 0.00 O ATOM 0 H TYR A 62 -12.513 -5.358 1.526 1.00 0.00 H new ATOM 0 HA TYR A 62 -10.825 -7.733 1.482 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -9.021 -6.214 1.273 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -10.316 -5.356 0.463 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -11.623 -3.560 1.886 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -7.873 -5.189 3.121 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -11.321 -1.714 3.466 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -7.583 -3.327 4.680 1.00 0.00 H new ATOM 0 HH TYR A 62 -8.416 -1.478 5.525 1.00 0.00 H new ATOM 1004 N LYS A 63 -11.863 -6.575 4.295 1.00 0.00 N ATOM 1005 CA LYS A 63 -11.789 -6.535 5.783 1.00 0.00 C ATOM 1006 C LYS A 63 -11.374 -7.887 6.390 1.00 0.00 C ATOM 1007 O LYS A 63 -10.759 -7.934 7.465 1.00 0.00 O ATOM 1008 CB LYS A 63 -13.149 -6.081 6.378 1.00 0.00 C ATOM 1009 CG LYS A 63 -14.340 -7.033 6.104 1.00 0.00 C ATOM 1010 CD LYS A 63 -15.651 -6.545 6.760 1.00 0.00 C ATOM 1011 CE LYS A 63 -16.846 -7.468 6.471 1.00 0.00 C ATOM 1012 NZ LYS A 63 -18.096 -6.950 7.086 1.00 0.00 N ATOM 0 H LYS A 63 -12.766 -6.278 3.927 1.00 0.00 H new ATOM 0 HA LYS A 63 -11.015 -5.812 6.043 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -13.036 -5.968 7.456 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -13.392 -5.097 5.978 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -14.488 -7.124 5.028 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -14.099 -8.028 6.478 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -15.507 -6.473 7.838 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -15.879 -5.541 6.401 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -16.982 -7.563 5.394 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -16.637 -8.466 6.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -18.882 -7.596 6.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -17.974 -6.883 8.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -18.308 -6.008 6.701 1.00 0.00 H new ATOM 1026 N ASP A 64 -11.722 -8.977 5.678 1.00 0.00 N ATOM 1027 CA ASP A 64 -11.302 -10.337 6.031 1.00 0.00 C ATOM 1028 C ASP A 64 -9.774 -10.442 5.877 1.00 0.00 C ATOM 1029 O ASP A 64 -9.215 -9.980 4.880 1.00 0.00 O ATOM 1030 CB ASP A 64 -12.022 -11.376 5.135 1.00 0.00 C ATOM 1031 CG ASP A 64 -11.675 -12.837 5.481 1.00 0.00 C ATOM 1032 OD1 ASP A 64 -12.289 -13.400 6.416 1.00 0.00 O ATOM 1033 OD2 ASP A 64 -10.790 -13.427 4.824 1.00 0.00 O ATOM 0 H ASP A 64 -12.304 -8.933 4.841 1.00 0.00 H new ATOM 0 HA ASP A 64 -11.574 -10.549 7.065 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -13.099 -11.236 5.225 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -11.762 -11.187 4.093 1.00 0.00 H new ATOM 1038 N VAL A 65 -9.118 -11.047 6.869 1.00 0.00 N ATOM 1039 CA VAL A 65 -7.647 -11.098 6.952 1.00 0.00 C ATOM 1040 C VAL A 65 -7.009 -11.839 5.752 1.00 0.00 C ATOM 1041 O VAL A 65 -5.935 -11.441 5.280 1.00 0.00 O ATOM 1042 CB VAL A 65 -7.200 -11.711 8.327 1.00 0.00 C ATOM 1043 CG1 VAL A 65 -5.684 -12.018 8.383 1.00 0.00 C ATOM 1044 CG2 VAL A 65 -7.625 -10.777 9.494 1.00 0.00 C ATOM 0 H VAL A 65 -9.588 -11.518 7.642 1.00 0.00 H new ATOM 0 HA VAL A 65 -7.278 -10.074 6.898 1.00 0.00 H new ATOM 0 HB VAL A 65 -7.709 -12.669 8.434 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -5.434 -12.440 9.357 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -5.429 -12.733 7.601 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -5.120 -11.097 8.231 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -7.310 -11.213 10.442 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -7.155 -9.801 9.369 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -8.709 -10.661 9.491 1.00 0.00 H new ATOM 1054 N GLU A 66 -7.705 -12.862 5.223 1.00 0.00 N ATOM 1055 CA GLU A 66 -7.224 -13.634 4.058 1.00 0.00 C ATOM 1056 C GLU A 66 -7.314 -12.820 2.746 1.00 0.00 C ATOM 1057 O GLU A 66 -6.674 -13.163 1.747 1.00 0.00 O ATOM 1058 CB GLU A 66 -7.974 -14.989 3.943 1.00 0.00 C ATOM 1059 CG GLU A 66 -7.869 -15.885 5.201 1.00 0.00 C ATOM 1060 CD GLU A 66 -6.414 -16.136 5.660 1.00 0.00 C ATOM 1061 OE1 GLU A 66 -5.720 -16.977 5.043 1.00 0.00 O ATOM 1062 OE2 GLU A 66 -5.954 -15.490 6.632 1.00 0.00 O ATOM 0 H GLU A 66 -8.606 -13.176 5.584 1.00 0.00 H new ATOM 0 HA GLU A 66 -6.168 -13.849 4.221 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -9.026 -14.792 3.739 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -7.580 -15.537 3.087 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -8.423 -15.420 6.016 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -8.347 -16.843 4.996 1.00 0.00 H new ATOM 1069 N ARG A 67 -8.113 -11.742 2.767 1.00 0.00 N ATOM 1070 CA ARG A 67 -8.283 -10.834 1.618 1.00 0.00 C ATOM 1071 C ARG A 67 -7.247 -9.684 1.641 1.00 0.00 C ATOM 1072 O ARG A 67 -6.846 -9.199 0.578 1.00 0.00 O ATOM 1073 CB ARG A 67 -9.727 -10.263 1.605 1.00 0.00 C ATOM 1074 CG ARG A 67 -10.844 -11.330 1.660 1.00 0.00 C ATOM 1075 CD ARG A 67 -10.806 -12.313 0.482 1.00 0.00 C ATOM 1076 NE ARG A 67 -11.731 -13.447 0.667 1.00 0.00 N ATOM 1077 CZ ARG A 67 -11.945 -14.428 -0.228 1.00 0.00 C ATOM 1078 NH1 ARG A 67 -11.370 -14.402 -1.430 1.00 0.00 N ATOM 1079 NH2 ARG A 67 -12.747 -15.433 0.090 1.00 0.00 N ATOM 0 H ARG A 67 -8.662 -11.473 3.583 1.00 0.00 H new ATOM 0 HA ARG A 67 -8.114 -11.408 0.707 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -9.844 -9.590 2.454 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -9.859 -9.665 0.703 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -10.758 -11.888 2.592 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -11.813 -10.831 1.676 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -11.062 -11.785 -0.437 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -9.791 -12.691 0.360 1.00 0.00 H new ATOM 0 HE ARG A 67 -12.250 -13.491 1.544 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -10.755 -13.629 -1.685 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -11.545 -15.155 -2.095 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -13.195 -15.458 1.006 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -12.916 -16.182 -0.581 1.00 0.00 H new ATOM 1093 N VAL A 68 -6.825 -9.244 2.850 1.00 0.00 N ATOM 1094 CA VAL A 68 -5.910 -8.082 3.002 1.00 0.00 C ATOM 1095 C VAL A 68 -4.415 -8.497 2.979 1.00 0.00 C ATOM 1096 O VAL A 68 -3.559 -7.723 2.521 1.00 0.00 O ATOM 1097 CB VAL A 68 -6.232 -7.260 4.313 1.00 0.00 C ATOM 1098 CG1 VAL A 68 -5.998 -8.081 5.598 1.00 0.00 C ATOM 1099 CG2 VAL A 68 -5.440 -5.934 4.366 1.00 0.00 C ATOM 0 H VAL A 68 -7.101 -9.673 3.733 1.00 0.00 H new ATOM 0 HA VAL A 68 -6.085 -7.441 2.138 1.00 0.00 H new ATOM 0 HB VAL A 68 -7.295 -7.022 4.267 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -6.234 -7.469 6.469 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -6.640 -8.962 5.589 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -4.955 -8.393 5.646 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -5.689 -5.398 5.282 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.371 -6.148 4.349 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.701 -5.320 3.504 1.00 0.00 H new ATOM 1109 N LYS A 69 -4.114 -9.723 3.466 1.00 0.00 N ATOM 1110 CA LYS A 69 -2.723 -10.225 3.606 1.00 0.00 C ATOM 1111 C LYS A 69 -2.026 -10.342 2.234 1.00 0.00 C ATOM 1112 O LYS A 69 -0.813 -10.158 2.129 1.00 0.00 O ATOM 1113 CB LYS A 69 -2.714 -11.588 4.354 1.00 0.00 C ATOM 1114 CG LYS A 69 -3.371 -12.752 3.583 1.00 0.00 C ATOM 1115 CD LYS A 69 -3.716 -13.974 4.460 1.00 0.00 C ATOM 1116 CE LYS A 69 -2.523 -14.632 5.155 1.00 0.00 C ATOM 1117 NZ LYS A 69 -2.950 -15.846 5.903 1.00 0.00 N ATOM 0 H LYS A 69 -4.822 -10.390 3.772 1.00 0.00 H new ATOM 0 HA LYS A 69 -2.160 -9.502 4.196 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -1.682 -11.856 4.579 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -3.227 -11.467 5.308 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -4.283 -12.390 3.108 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -2.700 -13.069 2.785 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -4.434 -13.665 5.220 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -4.211 -14.720 3.838 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -1.769 -14.902 4.415 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -2.059 -13.922 5.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -2.173 -16.537 5.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -3.195 -15.584 6.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -3.780 -16.266 5.438 1.00 0.00 H new ATOM 1131 N LYS A 70 -2.820 -10.628 1.185 1.00 0.00 N ATOM 1132 CA LYS A 70 -2.335 -10.666 -0.202 1.00 0.00 C ATOM 1133 C LYS A 70 -3.474 -10.307 -1.165 1.00 0.00 C ATOM 1134 O LYS A 70 -4.652 -10.454 -0.830 1.00 0.00 O ATOM 1135 CB LYS A 70 -1.686 -12.049 -0.575 1.00 0.00 C ATOM 1136 CG LYS A 70 -2.654 -13.193 -0.981 1.00 0.00 C ATOM 1137 CD LYS A 70 -3.612 -13.628 0.145 1.00 0.00 C ATOM 1138 CE LYS A 70 -4.649 -14.661 -0.323 1.00 0.00 C ATOM 1139 NZ LYS A 70 -5.470 -14.148 -1.453 1.00 0.00 N ATOM 0 H LYS A 70 -3.814 -10.838 1.278 1.00 0.00 H new ATOM 0 HA LYS A 70 -1.543 -9.923 -0.296 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -0.990 -11.886 -1.398 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -1.098 -12.389 0.278 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -3.242 -12.871 -1.841 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -2.069 -14.055 -1.300 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -3.033 -14.048 0.967 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -4.129 -12.751 0.535 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.139 -15.574 -0.630 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -5.301 -14.924 0.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -6.309 -14.751 -1.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -5.770 -13.173 -1.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -4.905 -14.161 -2.326 1.00 0.00 H new ATOM 1153 N PHE A 71 -3.093 -9.840 -2.357 1.00 0.00 N ATOM 1154 CA PHE A 71 -4.022 -9.525 -3.459 1.00 0.00 C ATOM 1155 C PHE A 71 -3.383 -9.967 -4.788 1.00 0.00 C ATOM 1156 O PHE A 71 -2.170 -10.209 -4.851 1.00 0.00 O ATOM 1157 CB PHE A 71 -4.352 -8.000 -3.479 1.00 0.00 C ATOM 1158 CG PHE A 71 -3.131 -7.093 -3.682 1.00 0.00 C ATOM 1159 CD1 PHE A 71 -2.655 -6.810 -4.965 1.00 0.00 C ATOM 1160 CD2 PHE A 71 -2.446 -6.544 -2.596 1.00 0.00 C ATOM 1161 CE1 PHE A 71 -1.545 -6.019 -5.159 1.00 0.00 C ATOM 1162 CE2 PHE A 71 -1.329 -5.749 -2.790 1.00 0.00 C ATOM 1163 CZ PHE A 71 -0.880 -5.488 -4.074 1.00 0.00 C ATOM 0 H PHE A 71 -2.116 -9.665 -2.593 1.00 0.00 H new ATOM 0 HA PHE A 71 -4.960 -10.061 -3.314 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -5.071 -7.806 -4.275 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -4.837 -7.733 -2.540 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -3.168 -7.220 -5.822 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -2.792 -6.742 -1.592 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -1.195 -5.815 -6.160 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -0.808 -5.333 -1.940 1.00 0.00 H new ATOM 0 HZ PHE A 71 -0.009 -4.868 -4.225 1.00 0.00 H new ATOM 1173 N THR A 72 -4.187 -10.040 -5.855 1.00 0.00 N ATOM 1174 CA THR A 72 -3.691 -10.346 -7.207 1.00 0.00 C ATOM 1175 C THR A 72 -3.890 -9.099 -8.105 1.00 0.00 C ATOM 1176 O THR A 72 -4.706 -8.223 -7.807 1.00 0.00 O ATOM 1177 CB THR A 72 -4.414 -11.601 -7.819 1.00 0.00 C ATOM 1178 OG1 THR A 72 -4.531 -12.641 -6.829 1.00 0.00 O ATOM 1179 CG2 THR A 72 -3.672 -12.175 -9.041 1.00 0.00 C ATOM 0 H THR A 72 -5.195 -9.890 -5.809 1.00 0.00 H new ATOM 0 HA THR A 72 -2.631 -10.592 -7.149 1.00 0.00 H new ATOM 0 HB THR A 72 -5.398 -11.262 -8.143 1.00 0.00 H new ATOM 0 HG1 THR A 72 -4.984 -13.416 -7.221 1.00 0.00 H new ATOM 0 HG21 THR A 72 -4.215 -13.040 -9.423 1.00 0.00 H new ATOM 0 HG22 THR A 72 -3.608 -11.414 -9.819 1.00 0.00 H new ATOM 0 HG23 THR A 72 -2.667 -12.478 -8.747 1.00 0.00 H new ATOM 1187 N GLU A 73 -3.120 -9.035 -9.193 1.00 0.00 N ATOM 1188 CA GLU A 73 -3.136 -7.924 -10.157 1.00 0.00 C ATOM 1189 C GLU A 73 -4.383 -7.966 -11.066 1.00 0.00 C ATOM 1190 O GLU A 73 -4.830 -6.930 -11.550 1.00 0.00 O ATOM 1191 CB GLU A 73 -1.841 -7.983 -11.011 1.00 0.00 C ATOM 1192 CG GLU A 73 -1.665 -9.302 -11.795 1.00 0.00 C ATOM 1193 CD GLU A 73 -0.328 -9.394 -12.537 1.00 0.00 C ATOM 1194 OE1 GLU A 73 -0.240 -8.933 -13.697 1.00 0.00 O ATOM 1195 OE2 GLU A 73 0.638 -9.931 -11.968 1.00 0.00 O ATOM 0 H GLU A 73 -2.453 -9.767 -9.437 1.00 0.00 H new ATOM 0 HA GLU A 73 -3.179 -6.986 -9.604 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -1.844 -7.151 -11.716 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -0.980 -7.843 -10.357 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -1.747 -10.141 -11.104 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -2.479 -9.400 -12.514 1.00 0.00 H new ATOM 1202 N GLU A 74 -4.946 -9.175 -11.267 1.00 0.00 N ATOM 1203 CA GLU A 74 -6.024 -9.417 -12.251 1.00 0.00 C ATOM 1204 C GLU A 74 -7.305 -8.610 -11.935 1.00 0.00 C ATOM 1205 O GLU A 74 -7.944 -8.077 -12.852 1.00 0.00 O ATOM 1206 CB GLU A 74 -6.343 -10.931 -12.349 1.00 0.00 C ATOM 1207 CG GLU A 74 -6.685 -11.599 -11.009 1.00 0.00 C ATOM 1208 CD GLU A 74 -7.239 -13.021 -11.158 1.00 0.00 C ATOM 1209 OE1 GLU A 74 -8.378 -13.168 -11.661 1.00 0.00 O ATOM 1210 OE2 GLU A 74 -6.549 -13.997 -10.781 1.00 0.00 O ATOM 0 H GLU A 74 -4.667 -10.011 -10.753 1.00 0.00 H new ATOM 0 HA GLU A 74 -5.658 -9.068 -13.217 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -7.180 -11.069 -13.033 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -5.486 -11.442 -12.787 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -5.789 -11.630 -10.388 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -7.417 -10.986 -10.483 1.00 0.00 H new ATOM 1217 N GLU A 75 -7.660 -8.508 -10.633 1.00 0.00 N ATOM 1218 CA GLU A 75 -8.849 -7.741 -10.195 1.00 0.00 C ATOM 1219 C GLU A 75 -8.579 -6.232 -10.178 1.00 0.00 C ATOM 1220 O GLU A 75 -9.515 -5.464 -10.019 1.00 0.00 O ATOM 1221 CB GLU A 75 -9.361 -8.184 -8.788 1.00 0.00 C ATOM 1222 CG GLU A 75 -8.336 -8.029 -7.617 1.00 0.00 C ATOM 1223 CD GLU A 75 -7.592 -9.323 -7.234 1.00 0.00 C ATOM 1224 OE1 GLU A 75 -7.363 -10.172 -8.118 1.00 0.00 O ATOM 1225 OE2 GLU A 75 -7.244 -9.500 -6.043 1.00 0.00 O ATOM 0 H GLU A 75 -7.142 -8.945 -9.871 1.00 0.00 H new ATOM 0 HA GLU A 75 -9.624 -7.959 -10.929 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -10.252 -7.605 -8.546 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -9.666 -9.229 -8.844 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -7.602 -7.273 -7.893 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -8.863 -7.656 -6.739 1.00 0.00 H new ATOM 1232 N LEU A 76 -7.302 -5.824 -10.327 1.00 0.00 N ATOM 1233 CA LEU A 76 -6.884 -4.409 -10.254 1.00 0.00 C ATOM 1234 C LEU A 76 -6.818 -3.772 -11.655 1.00 0.00 C ATOM 1235 O LEU A 76 -7.108 -2.585 -11.827 1.00 0.00 O ATOM 1236 CB LEU A 76 -5.498 -4.304 -9.572 1.00 0.00 C ATOM 1237 CG LEU A 76 -5.393 -4.883 -8.130 1.00 0.00 C ATOM 1238 CD1 LEU A 76 -3.974 -4.682 -7.570 1.00 0.00 C ATOM 1239 CD2 LEU A 76 -6.466 -4.283 -7.192 1.00 0.00 C ATOM 0 H LEU A 76 -6.530 -6.468 -10.502 1.00 0.00 H new ATOM 0 HA LEU A 76 -7.626 -3.869 -9.666 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -4.768 -4.815 -10.200 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -5.211 -3.253 -9.540 1.00 0.00 H new ATOM 0 HG LEU A 76 -5.587 -5.954 -8.184 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -3.919 -5.093 -6.562 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -3.255 -5.193 -8.210 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -3.742 -3.617 -7.541 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -6.359 -4.712 -6.196 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -6.338 -3.202 -7.137 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -7.458 -4.511 -7.581 1.00 0.00 H new ATOM 1251 N LYS A 77 -6.427 -4.587 -12.646 1.00 0.00 N ATOM 1252 CA LYS A 77 -6.172 -4.133 -14.029 1.00 0.00 C ATOM 1253 C LYS A 77 -7.467 -4.009 -14.859 1.00 0.00 C ATOM 1254 O LYS A 77 -7.438 -3.547 -16.011 1.00 0.00 O ATOM 1255 CB LYS A 77 -5.175 -5.097 -14.698 1.00 0.00 C ATOM 1256 CG LYS A 77 -3.816 -5.164 -13.964 1.00 0.00 C ATOM 1257 CD LYS A 77 -2.741 -5.881 -14.787 1.00 0.00 C ATOM 1258 CE LYS A 77 -3.070 -7.362 -15.042 1.00 0.00 C ATOM 1259 NZ LYS A 77 -1.994 -8.048 -15.799 1.00 0.00 N ATOM 0 H LYS A 77 -6.277 -5.587 -12.513 1.00 0.00 H new ATOM 0 HA LYS A 77 -5.744 -3.131 -13.986 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -5.612 -6.095 -14.735 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -5.010 -4.783 -15.729 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -3.480 -4.153 -13.735 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -3.945 -5.680 -13.013 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -2.622 -5.371 -15.743 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -1.786 -5.811 -14.267 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -3.223 -7.869 -14.089 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -4.006 -7.435 -15.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -2.404 -8.821 -16.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -1.528 -7.368 -16.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -1.295 -8.436 -15.134 1.00 0.00 H new ATOM 1273 N THR A 78 -8.600 -4.414 -14.268 1.00 0.00 N ATOM 1274 CA THR A 78 -9.914 -4.332 -14.918 1.00 0.00 C ATOM 1275 C THR A 78 -10.499 -2.913 -14.762 1.00 0.00 C ATOM 1276 O THR A 78 -10.159 -2.212 -13.800 1.00 0.00 O ATOM 1277 CB THR A 78 -10.894 -5.395 -14.319 1.00 0.00 C ATOM 1278 OG1 THR A 78 -12.133 -5.377 -15.033 1.00 0.00 O ATOM 1279 CG2 THR A 78 -11.176 -5.180 -12.818 1.00 0.00 C ATOM 0 H THR A 78 -8.631 -4.807 -13.327 1.00 0.00 H new ATOM 0 HA THR A 78 -9.787 -4.544 -15.980 1.00 0.00 H new ATOM 0 HB THR A 78 -10.402 -6.362 -14.425 1.00 0.00 H new ATOM 0 HG1 THR A 78 -12.739 -6.046 -14.653 1.00 0.00 H new ATOM 0 HG21 THR A 78 -11.862 -5.949 -12.463 1.00 0.00 H new ATOM 0 HG22 THR A 78 -10.242 -5.241 -12.260 1.00 0.00 H new ATOM 0 HG23 THR A 78 -11.624 -4.198 -12.669 1.00 0.00 H new ATOM 1287 N LYS A 79 -11.390 -2.521 -15.706 1.00 0.00 N ATOM 1288 CA LYS A 79 -12.092 -1.202 -15.708 1.00 0.00 C ATOM 1289 C LYS A 79 -12.689 -0.878 -14.333 1.00 0.00 C ATOM 1290 O LYS A 79 -12.587 0.255 -13.850 1.00 0.00 O ATOM 1291 CB LYS A 79 -13.251 -1.213 -16.750 1.00 0.00 C ATOM 1292 CG LYS A 79 -14.179 0.040 -16.732 1.00 0.00 C ATOM 1293 CD LYS A 79 -15.554 -0.228 -17.388 1.00 0.00 C ATOM 1294 CE LYS A 79 -16.531 0.948 -17.211 1.00 0.00 C ATOM 1295 NZ LYS A 79 -17.895 0.644 -17.710 1.00 0.00 N ATOM 0 H LYS A 79 -11.647 -3.112 -16.496 1.00 0.00 H new ATOM 0 HA LYS A 79 -11.352 -0.444 -15.964 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -12.820 -1.311 -17.746 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -13.862 -2.099 -16.579 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -14.329 0.362 -15.701 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -13.686 0.860 -17.253 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -15.414 -0.423 -18.451 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -15.991 -1.127 -16.954 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -16.586 1.212 -16.155 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -16.142 1.819 -17.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -18.510 1.470 -17.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -17.851 0.418 -18.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -18.281 -0.170 -17.190 1.00 0.00 H new ATOM 1309 N GLU A 80 -13.303 -1.916 -13.734 1.00 0.00 N ATOM 1310 CA GLU A 80 -14.030 -1.818 -12.462 1.00 0.00 C ATOM 1311 C GLU A 80 -13.123 -1.225 -11.379 1.00 0.00 C ATOM 1312 O GLU A 80 -13.469 -0.237 -10.737 1.00 0.00 O ATOM 1313 CB GLU A 80 -14.534 -3.219 -12.014 1.00 0.00 C ATOM 1314 CG GLU A 80 -15.186 -4.071 -13.124 1.00 0.00 C ATOM 1315 CD GLU A 80 -16.306 -3.352 -13.893 1.00 0.00 C ATOM 1316 OE1 GLU A 80 -17.392 -3.132 -13.314 1.00 0.00 O ATOM 1317 OE2 GLU A 80 -16.112 -3.024 -15.091 1.00 0.00 O ATOM 0 H GLU A 80 -13.306 -2.857 -14.128 1.00 0.00 H new ATOM 0 HA GLU A 80 -14.890 -1.164 -12.607 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -13.693 -3.774 -11.599 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -15.256 -3.087 -11.209 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -14.415 -4.379 -13.830 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -15.591 -4.979 -12.679 1.00 0.00 H new ATOM 1324 N ALA A 81 -11.924 -1.821 -11.246 1.00 0.00 N ATOM 1325 CA ALA A 81 -10.954 -1.442 -10.232 1.00 0.00 C ATOM 1326 C ALA A 81 -10.236 -0.146 -10.579 1.00 0.00 C ATOM 1327 O ALA A 81 -9.908 0.596 -9.692 1.00 0.00 O ATOM 1328 CB ALA A 81 -9.951 -2.546 -10.006 1.00 0.00 C ATOM 0 H ALA A 81 -11.610 -2.582 -11.848 1.00 0.00 H new ATOM 0 HA ALA A 81 -11.512 -1.275 -9.310 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -9.236 -2.238 -9.243 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -10.469 -3.446 -9.675 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -9.422 -2.753 -10.936 1.00 0.00 H new ATOM 1334 N LYS A 82 -9.991 0.116 -11.871 1.00 0.00 N ATOM 1335 CA LYS A 82 -9.340 1.373 -12.313 1.00 0.00 C ATOM 1336 C LYS A 82 -10.190 2.593 -11.886 1.00 0.00 C ATOM 1337 O LYS A 82 -9.661 3.610 -11.410 1.00 0.00 O ATOM 1338 CB LYS A 82 -9.112 1.347 -13.844 1.00 0.00 C ATOM 1339 CG LYS A 82 -8.125 0.249 -14.317 1.00 0.00 C ATOM 1340 CD LYS A 82 -7.997 0.188 -15.857 1.00 0.00 C ATOM 1341 CE LYS A 82 -7.433 1.491 -16.461 1.00 0.00 C ATOM 1342 NZ LYS A 82 -7.504 1.500 -17.943 1.00 0.00 N ATOM 0 H LYS A 82 -10.231 -0.520 -12.632 1.00 0.00 H new ATOM 0 HA LYS A 82 -8.366 1.461 -11.832 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -10.071 1.198 -14.341 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -8.736 2.320 -14.161 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -7.143 0.436 -13.882 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -8.459 -0.720 -13.945 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -7.349 -0.645 -16.131 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -8.976 -0.014 -16.291 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -7.989 2.342 -16.067 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -6.396 1.615 -16.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -7.114 2.394 -18.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -6.952 0.704 -18.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -8.495 1.408 -18.244 1.00 0.00 H new ATOM 1356 N GLU A 83 -11.523 2.439 -12.005 1.00 0.00 N ATOM 1357 CA GLU A 83 -12.488 3.424 -11.504 1.00 0.00 C ATOM 1358 C GLU A 83 -12.582 3.390 -9.963 1.00 0.00 C ATOM 1359 O GLU A 83 -12.727 4.433 -9.353 1.00 0.00 O ATOM 1360 CB GLU A 83 -13.883 3.213 -12.144 1.00 0.00 C ATOM 1361 CG GLU A 83 -13.984 3.691 -13.610 1.00 0.00 C ATOM 1362 CD GLU A 83 -15.419 3.725 -14.174 1.00 0.00 C ATOM 1363 OE1 GLU A 83 -16.372 3.994 -13.403 1.00 0.00 O ATOM 1364 OE2 GLU A 83 -15.592 3.529 -15.398 1.00 0.00 O ATOM 0 H GLU A 83 -11.955 1.629 -12.450 1.00 0.00 H new ATOM 0 HA GLU A 83 -12.127 4.411 -11.793 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -14.134 2.153 -12.101 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -14.628 3.742 -11.549 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -13.554 4.690 -13.684 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -13.377 3.036 -14.235 1.00 0.00 H new ATOM 1371 N ARG A 84 -12.487 2.196 -9.344 1.00 0.00 N ATOM 1372 CA ARG A 84 -12.482 2.060 -7.858 1.00 0.00 C ATOM 1373 C ARG A 84 -11.291 2.819 -7.240 1.00 0.00 C ATOM 1374 O ARG A 84 -11.438 3.455 -6.207 1.00 0.00 O ATOM 1375 CB ARG A 84 -12.431 0.573 -7.426 1.00 0.00 C ATOM 1376 CG ARG A 84 -13.755 -0.199 -7.613 1.00 0.00 C ATOM 1377 CD ARG A 84 -13.619 -1.690 -7.258 1.00 0.00 C ATOM 1378 NE ARG A 84 -14.907 -2.407 -7.321 1.00 0.00 N ATOM 1379 CZ ARG A 84 -15.259 -3.428 -6.519 1.00 0.00 C ATOM 1380 NH1 ARG A 84 -14.431 -3.863 -5.574 1.00 0.00 N ATOM 1381 NH2 ARG A 84 -16.443 -3.999 -6.661 1.00 0.00 N ATOM 0 H ARG A 84 -12.412 1.309 -9.842 1.00 0.00 H new ATOM 0 HA ARG A 84 -13.411 2.496 -7.492 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -11.649 0.070 -7.995 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -12.143 0.523 -6.376 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -14.527 0.252 -6.989 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -14.086 -0.103 -8.647 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -12.912 -2.160 -7.942 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -13.203 -1.785 -6.255 1.00 0.00 H new ATOM 0 HE ARG A 84 -15.581 -2.106 -8.025 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -13.519 -3.422 -5.452 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -14.707 -4.638 -4.971 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -17.088 -3.665 -7.378 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -16.712 -4.773 -6.054 1.00 0.00 H new ATOM 1395 N TRP A 85 -10.139 2.732 -7.922 1.00 0.00 N ATOM 1396 CA TRP A 85 -8.889 3.435 -7.568 1.00 0.00 C ATOM 1397 C TRP A 85 -9.076 4.957 -7.719 1.00 0.00 C ATOM 1398 O TRP A 85 -8.466 5.735 -6.989 1.00 0.00 O ATOM 1399 CB TRP A 85 -7.701 2.966 -8.472 1.00 0.00 C ATOM 1400 CG TRP A 85 -7.163 1.557 -8.227 1.00 0.00 C ATOM 1401 CD1 TRP A 85 -7.813 0.472 -7.688 1.00 0.00 C ATOM 1402 CD2 TRP A 85 -5.836 1.094 -8.542 1.00 0.00 C ATOM 1403 NE1 TRP A 85 -6.977 -0.616 -7.664 1.00 0.00 N ATOM 1404 CE2 TRP A 85 -5.761 -0.257 -8.172 1.00 0.00 C ATOM 1405 CE3 TRP A 85 -4.703 1.702 -9.095 1.00 0.00 C ATOM 1406 CZ2 TRP A 85 -4.609 -1.013 -8.341 1.00 0.00 C ATOM 1407 CZ3 TRP A 85 -3.555 0.947 -9.261 1.00 0.00 C ATOM 1408 CH2 TRP A 85 -3.516 -0.401 -8.883 1.00 0.00 C ATOM 0 H TRP A 85 -10.045 2.156 -8.758 1.00 0.00 H new ATOM 0 HA TRP A 85 -8.653 3.195 -6.531 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -8.019 3.032 -9.512 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -6.879 3.670 -8.345 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -8.834 0.475 -7.335 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -7.224 -1.544 -7.322 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -4.724 2.742 -9.387 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -4.579 -2.053 -8.053 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -2.675 1.405 -9.689 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -2.606 -0.966 -9.023 1.00 0.00 H new ATOM 1419 N ARG A 86 -9.903 5.360 -8.707 1.00 0.00 N ATOM 1420 CA ARG A 86 -10.253 6.773 -8.942 1.00 0.00 C ATOM 1421 C ARG A 86 -11.140 7.332 -7.813 1.00 0.00 C ATOM 1422 O ARG A 86 -10.848 8.395 -7.278 1.00 0.00 O ATOM 1423 CB ARG A 86 -10.945 6.941 -10.314 1.00 0.00 C ATOM 1424 CG ARG A 86 -11.348 8.390 -10.653 1.00 0.00 C ATOM 1425 CD ARG A 86 -11.858 8.541 -12.091 1.00 0.00 C ATOM 1426 NE ARG A 86 -12.168 9.943 -12.422 1.00 0.00 N ATOM 1427 CZ ARG A 86 -11.394 10.760 -13.160 1.00 0.00 C ATOM 1428 NH1 ARG A 86 -10.224 10.348 -13.663 1.00 0.00 N ATOM 1429 NH2 ARG A 86 -11.799 12.001 -13.391 1.00 0.00 N ATOM 0 H ARG A 86 -10.345 4.715 -9.362 1.00 0.00 H new ATOM 0 HA ARG A 86 -9.326 7.347 -8.947 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -10.276 6.572 -11.092 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -11.837 6.314 -10.336 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -12.123 8.719 -9.961 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -10.490 9.046 -10.505 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -11.106 8.162 -12.784 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -12.751 7.931 -12.225 1.00 0.00 H new ATOM 0 HE ARG A 86 -13.042 10.326 -12.062 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -9.901 9.396 -13.490 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -9.655 10.986 -14.219 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -12.688 12.326 -13.011 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -11.222 12.630 -13.949 1.00 0.00 H new ATOM 1443 N LYS A 87 -12.230 6.606 -7.461 1.00 0.00 N ATOM 1444 CA LYS A 87 -13.110 6.981 -6.318 1.00 0.00 C ATOM 1445 C LYS A 87 -12.316 6.962 -4.991 1.00 0.00 C ATOM 1446 O LYS A 87 -12.572 7.763 -4.091 1.00 0.00 O ATOM 1447 CB LYS A 87 -14.357 6.047 -6.194 1.00 0.00 C ATOM 1448 CG LYS A 87 -15.530 6.319 -7.176 1.00 0.00 C ATOM 1449 CD LYS A 87 -15.235 5.917 -8.637 1.00 0.00 C ATOM 1450 CE LYS A 87 -16.461 6.030 -9.557 1.00 0.00 C ATOM 1451 NZ LYS A 87 -16.169 5.522 -10.921 1.00 0.00 N ATOM 0 H LYS A 87 -12.523 5.759 -7.949 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.469 7.991 -6.518 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -14.027 5.018 -6.334 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -14.740 6.123 -5.176 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -16.411 5.777 -6.832 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -15.777 7.380 -7.145 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -14.437 6.549 -9.027 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -14.867 4.891 -8.657 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -17.291 5.468 -9.129 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -16.778 7.071 -9.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -16.822 5.960 -11.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -15.190 5.760 -11.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -16.291 4.489 -10.940 1.00 0.00 H new ATOM 1465 N PHE A 88 -11.353 6.033 -4.911 1.00 0.00 N ATOM 1466 CA PHE A 88 -10.467 5.857 -3.750 1.00 0.00 C ATOM 1467 C PHE A 88 -9.553 7.093 -3.603 1.00 0.00 C ATOM 1468 O PHE A 88 -9.346 7.601 -2.505 1.00 0.00 O ATOM 1469 CB PHE A 88 -9.643 4.552 -3.953 1.00 0.00 C ATOM 1470 CG PHE A 88 -8.902 4.022 -2.741 1.00 0.00 C ATOM 1471 CD1 PHE A 88 -9.479 4.074 -1.475 1.00 0.00 C ATOM 1472 CD2 PHE A 88 -7.638 3.441 -2.870 1.00 0.00 C ATOM 1473 CE1 PHE A 88 -8.817 3.578 -0.381 1.00 0.00 C ATOM 1474 CE2 PHE A 88 -6.981 2.939 -1.770 1.00 0.00 C ATOM 1475 CZ PHE A 88 -7.571 3.012 -0.524 1.00 0.00 C ATOM 0 H PHE A 88 -11.164 5.371 -5.664 1.00 0.00 H new ATOM 0 HA PHE A 88 -11.046 5.766 -2.831 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -10.319 3.774 -4.306 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.917 4.728 -4.747 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -10.459 4.510 -1.353 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -7.172 3.385 -3.843 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -9.275 3.632 0.596 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -6.006 2.489 -1.881 1.00 0.00 H new ATOM 0 HZ PHE A 88 -7.053 2.624 0.341 1.00 0.00 H new ATOM 1485 N PHE A 89 -9.040 7.565 -4.752 1.00 0.00 N ATOM 1486 CA PHE A 89 -8.281 8.821 -4.863 1.00 0.00 C ATOM 1487 C PHE A 89 -9.142 10.034 -4.450 1.00 0.00 C ATOM 1488 O PHE A 89 -8.680 10.862 -3.672 1.00 0.00 O ATOM 1489 CB PHE A 89 -7.733 8.994 -6.320 1.00 0.00 C ATOM 1490 CG PHE A 89 -7.373 10.435 -6.726 1.00 0.00 C ATOM 1491 CD1 PHE A 89 -6.461 11.185 -5.982 1.00 0.00 C ATOM 1492 CD2 PHE A 89 -7.962 11.041 -7.845 1.00 0.00 C ATOM 1493 CE1 PHE A 89 -6.153 12.484 -6.338 1.00 0.00 C ATOM 1494 CE2 PHE A 89 -7.648 12.342 -8.199 1.00 0.00 C ATOM 1495 CZ PHE A 89 -6.745 13.063 -7.445 1.00 0.00 C ATOM 0 H PHE A 89 -9.143 7.077 -5.642 1.00 0.00 H new ATOM 0 HA PHE A 89 -7.436 8.771 -4.177 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -6.846 8.371 -6.432 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -8.479 8.614 -7.018 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -5.990 10.744 -5.116 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -8.671 10.484 -8.440 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -5.446 13.050 -5.749 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -8.110 12.792 -9.065 1.00 0.00 H new ATOM 0 HZ PHE A 89 -6.501 14.079 -7.719 1.00 0.00 H new ATOM 1505 N THR A 90 -10.384 10.130 -4.969 1.00 0.00 N ATOM 1506 CA THR A 90 -11.254 11.315 -4.747 1.00 0.00 C ATOM 1507 C THR A 90 -11.602 11.517 -3.248 1.00 0.00 C ATOM 1508 O THR A 90 -12.066 12.591 -2.845 1.00 0.00 O ATOM 1509 CB THR A 90 -12.553 11.286 -5.623 1.00 0.00 C ATOM 1510 OG1 THR A 90 -13.369 10.151 -5.292 1.00 0.00 O ATOM 1511 CG2 THR A 90 -12.230 11.263 -7.140 1.00 0.00 C ATOM 0 H THR A 90 -10.811 9.404 -5.545 1.00 0.00 H new ATOM 0 HA THR A 90 -10.667 12.175 -5.070 1.00 0.00 H new ATOM 0 HB THR A 90 -13.100 12.203 -5.403 1.00 0.00 H new ATOM 0 HG1 THR A 90 -12.823 9.477 -4.837 1.00 0.00 H new ATOM 0 HG21 THR A 90 -13.159 11.243 -7.710 1.00 0.00 H new ATOM 0 HG22 THR A 90 -11.661 12.154 -7.404 1.00 0.00 H new ATOM 0 HG23 THR A 90 -11.642 10.375 -7.373 1.00 0.00 H new ATOM 1519 N ILE A 91 -11.387 10.465 -2.437 1.00 0.00 N ATOM 1520 CA ILE A 91 -11.451 10.547 -0.968 1.00 0.00 C ATOM 1521 C ILE A 91 -10.185 11.267 -0.422 1.00 0.00 C ATOM 1522 O ILE A 91 -10.280 12.237 0.340 1.00 0.00 O ATOM 1523 CB ILE A 91 -11.567 9.103 -0.336 1.00 0.00 C ATOM 1524 CG1 ILE A 91 -12.800 8.332 -0.909 1.00 0.00 C ATOM 1525 CG2 ILE A 91 -11.628 9.151 1.211 1.00 0.00 C ATOM 1526 CD1 ILE A 91 -12.881 6.864 -0.491 1.00 0.00 C ATOM 0 H ILE A 91 -11.163 9.532 -2.784 1.00 0.00 H new ATOM 0 HA ILE A 91 -12.336 11.119 -0.690 1.00 0.00 H new ATOM 0 HB ILE A 91 -10.662 8.562 -0.614 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -13.710 8.839 -0.588 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -12.772 8.386 -1.997 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -11.707 8.137 1.604 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -10.723 9.620 1.596 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -12.497 9.730 1.523 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -13.766 6.408 -0.934 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -11.991 6.338 -0.836 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -12.944 6.798 0.595 1.00 0.00 H new ATOM 1538 N PHE A 92 -8.997 10.801 -0.863 1.00 0.00 N ATOM 1539 CA PHE A 92 -7.687 11.207 -0.285 1.00 0.00 C ATOM 1540 C PHE A 92 -6.955 12.248 -1.142 1.00 0.00 C ATOM 1541 O PHE A 92 -5.782 12.539 -0.904 1.00 0.00 O ATOM 1542 CB PHE A 92 -6.795 9.971 -0.062 1.00 0.00 C ATOM 1543 CG PHE A 92 -7.454 8.910 0.798 1.00 0.00 C ATOM 1544 CD1 PHE A 92 -7.640 9.097 2.170 1.00 0.00 C ATOM 1545 CD2 PHE A 92 -7.906 7.735 0.229 1.00 0.00 C ATOM 1546 CE1 PHE A 92 -8.258 8.123 2.928 1.00 0.00 C ATOM 1547 CE2 PHE A 92 -8.516 6.770 0.977 1.00 0.00 C ATOM 1548 CZ PHE A 92 -8.694 6.955 2.328 1.00 0.00 C ATOM 0 H PHE A 92 -8.913 10.133 -1.629 1.00 0.00 H new ATOM 0 HA PHE A 92 -7.897 11.681 0.674 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -6.536 9.538 -1.028 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -5.862 10.283 0.408 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -7.299 10.008 2.640 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -7.774 7.577 -0.831 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -8.401 8.272 3.988 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -8.859 5.860 0.507 1.00 0.00 H new ATOM 0 HZ PHE A 92 -9.174 6.189 2.920 1.00 0.00 H new ATOM 1558 N GLU A 93 -7.663 12.832 -2.116 1.00 0.00 N ATOM 1559 CA GLU A 93 -7.160 13.979 -2.895 1.00 0.00 C ATOM 1560 C GLU A 93 -6.992 15.214 -1.982 1.00 0.00 C ATOM 1561 O GLU A 93 -6.224 16.125 -2.280 1.00 0.00 O ATOM 1562 CB GLU A 93 -8.139 14.314 -4.058 1.00 0.00 C ATOM 1563 CG GLU A 93 -9.587 14.597 -3.618 1.00 0.00 C ATOM 1564 CD GLU A 93 -10.415 15.320 -4.694 1.00 0.00 C ATOM 1565 OE1 GLU A 93 -10.957 14.652 -5.600 1.00 0.00 O ATOM 1566 OE2 GLU A 93 -10.495 16.570 -4.659 1.00 0.00 O ATOM 0 H GLU A 93 -8.597 12.527 -2.389 1.00 0.00 H new ATOM 0 HA GLU A 93 -6.190 13.712 -3.314 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -7.760 15.184 -4.595 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -8.144 13.482 -4.762 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -10.074 13.655 -3.365 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -9.573 15.202 -2.711 1.00 0.00 H new ATOM 1573 N LYS A 94 -7.732 15.204 -0.864 1.00 0.00 N ATOM 1574 CA LYS A 94 -7.858 16.334 0.065 1.00 0.00 C ATOM 1575 C LYS A 94 -6.737 16.341 1.134 1.00 0.00 C ATOM 1576 O LYS A 94 -6.595 17.324 1.874 1.00 0.00 O ATOM 1577 CB LYS A 94 -9.245 16.227 0.757 1.00 0.00 C ATOM 1578 CG LYS A 94 -10.439 16.000 -0.204 1.00 0.00 C ATOM 1579 CD LYS A 94 -10.734 17.214 -1.101 1.00 0.00 C ATOM 1580 CE LYS A 94 -11.323 18.397 -0.324 1.00 0.00 C ATOM 1581 NZ LYS A 94 -12.616 18.046 0.317 1.00 0.00 N ATOM 0 H LYS A 94 -8.273 14.389 -0.574 1.00 0.00 H new ATOM 0 HA LYS A 94 -7.765 17.264 -0.496 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -9.214 15.407 1.475 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -9.423 17.141 1.324 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -10.232 15.134 -0.832 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -11.328 15.764 0.381 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -9.813 17.530 -1.592 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -11.429 16.919 -1.887 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -10.615 18.720 0.439 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -11.469 19.239 -1.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -13.112 18.916 0.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -13.204 17.513 -0.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -12.439 17.463 1.159 1.00 0.00 H new ATOM 1595 N LYS A 95 -5.951 15.241 1.222 1.00 0.00 N ATOM 1596 CA LYS A 95 -4.943 15.054 2.294 1.00 0.00 C ATOM 1597 C LYS A 95 -3.620 14.467 1.754 1.00 0.00 C ATOM 1598 O LYS A 95 -2.533 14.887 2.178 1.00 0.00 O ATOM 1599 CB LYS A 95 -5.504 14.201 3.494 1.00 0.00 C ATOM 1600 CG LYS A 95 -6.293 12.905 3.159 1.00 0.00 C ATOM 1601 CD LYS A 95 -7.742 13.168 2.673 1.00 0.00 C ATOM 1602 CE LYS A 95 -8.596 13.967 3.676 1.00 0.00 C ATOM 1603 NZ LYS A 95 -8.950 13.184 4.878 1.00 0.00 N ATOM 0 H LYS A 95 -5.996 14.466 0.560 1.00 0.00 H new ATOM 0 HA LYS A 95 -4.719 16.048 2.682 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -4.663 13.925 4.130 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -6.154 14.845 4.086 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -5.755 12.351 2.389 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -6.325 12.270 4.045 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -7.706 13.709 1.728 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -8.228 12.213 2.475 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -8.051 14.862 3.978 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -9.509 14.301 3.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -9.984 13.084 4.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -8.514 12.242 4.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -8.602 13.674 5.727 1.00 0.00 H new ATOM 1617 N ILE A 96 -3.707 13.488 0.840 1.00 0.00 N ATOM 1618 CA ILE A 96 -2.518 12.867 0.220 1.00 0.00 C ATOM 1619 C ILE A 96 -2.227 13.540 -1.137 1.00 0.00 C ATOM 1620 O ILE A 96 -3.002 13.400 -2.089 1.00 0.00 O ATOM 1621 CB ILE A 96 -2.688 11.310 0.035 1.00 0.00 C ATOM 1622 CG1 ILE A 96 -3.198 10.638 1.354 1.00 0.00 C ATOM 1623 CG2 ILE A 96 -1.361 10.658 -0.441 1.00 0.00 C ATOM 1624 CD1 ILE A 96 -2.315 10.845 2.575 1.00 0.00 C ATOM 0 H ILE A 96 -4.593 13.105 0.510 1.00 0.00 H new ATOM 0 HA ILE A 96 -1.674 13.019 0.893 1.00 0.00 H new ATOM 0 HB ILE A 96 -3.440 11.147 -0.737 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -4.193 11.023 1.577 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.302 9.567 1.179 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -1.506 9.584 -0.561 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -1.064 11.093 -1.395 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -0.581 10.839 0.299 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -2.757 10.340 3.434 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -1.325 10.433 2.382 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -2.229 11.911 2.786 1.00 0.00 H new ATOM 1636 N GLU A 97 -1.108 14.280 -1.188 1.00 0.00 N ATOM 1637 CA GLU A 97 -0.654 15.010 -2.389 1.00 0.00 C ATOM 1638 C GLU A 97 -0.008 14.043 -3.392 1.00 0.00 C ATOM 1639 O GLU A 97 -0.317 14.039 -4.589 1.00 0.00 O ATOM 1640 CB GLU A 97 0.387 16.093 -1.979 1.00 0.00 C ATOM 1641 CG GLU A 97 -0.057 17.017 -0.828 1.00 0.00 C ATOM 1642 CD GLU A 97 -1.351 17.791 -1.126 1.00 0.00 C ATOM 1643 OE1 GLU A 97 -1.295 18.788 -1.877 1.00 0.00 O ATOM 1644 OE2 GLU A 97 -2.430 17.398 -0.623 1.00 0.00 O ATOM 0 H GLU A 97 -0.484 14.391 -0.389 1.00 0.00 H new ATOM 0 HA GLU A 97 -1.517 15.483 -2.857 1.00 0.00 H new ATOM 0 HB2 GLU A 97 1.313 15.595 -1.690 1.00 0.00 H new ATOM 0 HB3 GLU A 97 0.614 16.706 -2.851 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -0.200 16.419 0.072 1.00 0.00 H new ATOM 0 HG3 GLU A 97 0.741 17.728 -0.615 1.00 0.00 H new ATOM 1651 N ASP A 98 0.875 13.200 -2.850 1.00 0.00 N ATOM 1652 CA ASP A 98 1.779 12.329 -3.619 1.00 0.00 C ATOM 1653 C ASP A 98 1.130 10.962 -3.908 1.00 0.00 C ATOM 1654 O ASP A 98 1.826 9.953 -3.993 1.00 0.00 O ATOM 1655 CB ASP A 98 3.092 12.130 -2.804 1.00 0.00 C ATOM 1656 CG ASP A 98 3.770 13.441 -2.381 1.00 0.00 C ATOM 1657 OD1 ASP A 98 3.439 13.961 -1.290 1.00 0.00 O ATOM 1658 OD2 ASP A 98 4.640 13.942 -3.124 1.00 0.00 O ATOM 0 H ASP A 98 0.987 13.099 -1.841 1.00 0.00 H new ATOM 0 HA ASP A 98 1.994 12.802 -4.577 1.00 0.00 H new ATOM 0 HB2 ASP A 98 2.869 11.544 -1.912 1.00 0.00 H new ATOM 0 HB3 ASP A 98 3.793 11.547 -3.401 1.00 0.00 H new ATOM 1663 N TYR A 99 -0.197 10.942 -4.122 1.00 0.00 N ATOM 1664 CA TYR A 99 -0.978 9.685 -4.241 1.00 0.00 C ATOM 1665 C TYR A 99 -0.450 8.770 -5.377 1.00 0.00 C ATOM 1666 O TYR A 99 -0.498 7.549 -5.267 1.00 0.00 O ATOM 1667 CB TYR A 99 -2.486 9.999 -4.458 1.00 0.00 C ATOM 1668 CG TYR A 99 -2.857 10.464 -5.876 1.00 0.00 C ATOM 1669 CD1 TYR A 99 -2.561 11.756 -6.320 1.00 0.00 C ATOM 1670 CD2 TYR A 99 -3.500 9.598 -6.775 1.00 0.00 C ATOM 1671 CE1 TYR A 99 -2.892 12.164 -7.596 1.00 0.00 C ATOM 1672 CE2 TYR A 99 -3.832 10.005 -8.055 1.00 0.00 C ATOM 1673 CZ TYR A 99 -3.526 11.290 -8.462 1.00 0.00 C ATOM 1674 OH TYR A 99 -3.857 11.712 -9.733 1.00 0.00 O ATOM 0 H TYR A 99 -0.761 11.787 -4.218 1.00 0.00 H new ATOM 0 HA TYR A 99 -0.856 9.142 -3.304 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -3.065 9.106 -4.222 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -2.786 10.770 -3.749 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -2.065 12.446 -5.653 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -3.740 8.593 -6.461 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -2.656 13.167 -7.919 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -4.327 9.324 -8.731 1.00 0.00 H new ATOM 0 HH TYR A 99 -4.295 10.981 -10.217 1.00 0.00 H new ATOM 1684 N ASN A 100 0.077 9.400 -6.447 1.00 0.00 N ATOM 1685 CA ASN A 100 0.547 8.719 -7.672 1.00 0.00 C ATOM 1686 C ASN A 100 2.069 8.867 -7.862 1.00 0.00 C ATOM 1687 O ASN A 100 2.587 8.609 -8.959 1.00 0.00 O ATOM 1688 CB ASN A 100 -0.191 9.305 -8.908 1.00 0.00 C ATOM 1689 CG ASN A 100 0.130 10.787 -9.177 1.00 0.00 C ATOM 1690 OD1 ASN A 100 0.326 11.581 -8.250 1.00 0.00 O ATOM 1691 ND2 ASN A 100 0.193 11.168 -10.445 1.00 0.00 N ATOM 0 H ASN A 100 0.190 10.413 -6.485 1.00 0.00 H new ATOM 0 HA ASN A 100 0.325 7.657 -7.570 1.00 0.00 H new ATOM 0 HB2 ASN A 100 0.073 8.720 -9.789 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -1.266 9.196 -8.763 1.00 0.00 H new ATOM 0 HD21 ASN A 100 0.408 12.138 -10.676 1.00 0.00 H new ATOM 0 HD22 ASN A 100 0.027 10.491 -11.190 1.00 0.00 H new ATOM 1698 N PHE A 101 2.776 9.262 -6.785 1.00 0.00 N ATOM 1699 CA PHE A 101 4.239 9.526 -6.827 1.00 0.00 C ATOM 1700 C PHE A 101 5.005 8.223 -7.144 1.00 0.00 C ATOM 1701 O PHE A 101 6.090 8.250 -7.730 1.00 0.00 O ATOM 1702 CB PHE A 101 4.709 10.127 -5.474 1.00 0.00 C ATOM 1703 CG PHE A 101 6.136 10.692 -5.454 1.00 0.00 C ATOM 1704 CD1 PHE A 101 6.382 12.029 -5.781 1.00 0.00 C ATOM 1705 CD2 PHE A 101 7.230 9.895 -5.102 1.00 0.00 C ATOM 1706 CE1 PHE A 101 7.665 12.544 -5.758 1.00 0.00 C ATOM 1707 CE2 PHE A 101 8.514 10.414 -5.080 1.00 0.00 C ATOM 1708 CZ PHE A 101 8.731 11.737 -5.407 1.00 0.00 C ATOM 0 H PHE A 101 2.359 9.408 -5.866 1.00 0.00 H new ATOM 0 HA PHE A 101 4.450 10.247 -7.616 1.00 0.00 H new ATOM 0 HB2 PHE A 101 4.019 10.923 -5.192 1.00 0.00 H new ATOM 0 HB3 PHE A 101 4.634 9.354 -4.709 1.00 0.00 H new ATOM 0 HD1 PHE A 101 5.557 12.669 -6.056 1.00 0.00 H new ATOM 0 HD2 PHE A 101 7.071 8.859 -4.843 1.00 0.00 H new ATOM 0 HE1 PHE A 101 7.835 13.579 -6.015 1.00 0.00 H new ATOM 0 HE2 PHE A 101 9.346 9.782 -4.807 1.00 0.00 H new ATOM 0 HZ PHE A 101 9.732 12.141 -5.389 1.00 0.00 H new ATOM 1718 N GLY A 102 4.405 7.088 -6.736 1.00 0.00 N ATOM 1719 CA GLY A 102 4.918 5.765 -7.058 1.00 0.00 C ATOM 1720 C GLY A 102 5.717 5.170 -5.915 1.00 0.00 C ATOM 1721 O GLY A 102 6.723 5.749 -5.482 1.00 0.00 O ATOM 0 H GLY A 102 3.553 7.075 -6.175 1.00 0.00 H new ATOM 0 HA2 GLY A 102 4.087 5.104 -7.302 1.00 0.00 H new ATOM 0 HA3 GLY A 102 5.547 5.827 -7.946 1.00 0.00 H new ATOM 1725 N THR A 103 5.236 4.034 -5.392 1.00 0.00 N ATOM 1726 CA THR A 103 5.926 3.262 -4.350 1.00 0.00 C ATOM 1727 C THR A 103 5.778 1.756 -4.639 1.00 0.00 C ATOM 1728 O THR A 103 4.751 1.301 -5.182 1.00 0.00 O ATOM 1729 CB THR A 103 5.390 3.629 -2.922 1.00 0.00 C ATOM 1730 OG1 THR A 103 5.613 5.028 -2.683 1.00 0.00 O ATOM 1731 CG2 THR A 103 6.062 2.827 -1.793 1.00 0.00 C ATOM 0 H THR A 103 4.350 3.622 -5.683 1.00 0.00 H new ATOM 0 HA THR A 103 6.986 3.517 -4.366 1.00 0.00 H new ATOM 0 HB THR A 103 4.329 3.380 -2.910 1.00 0.00 H new ATOM 0 HG1 THR A 103 5.585 5.204 -1.719 1.00 0.00 H new ATOM 0 HG21 THR A 103 5.645 3.131 -0.833 1.00 0.00 H new ATOM 0 HG22 THR A 103 5.883 1.763 -1.946 1.00 0.00 H new ATOM 0 HG23 THR A 103 7.135 3.019 -1.799 1.00 0.00 H new ATOM 1739 N LEU A 104 6.829 1.004 -4.293 1.00 0.00 N ATOM 1740 CA LEU A 104 6.915 -0.437 -4.515 1.00 0.00 C ATOM 1741 C LEU A 104 6.209 -1.151 -3.342 1.00 0.00 C ATOM 1742 O LEU A 104 6.668 -1.089 -2.196 1.00 0.00 O ATOM 1743 CB LEU A 104 8.421 -0.823 -4.650 1.00 0.00 C ATOM 1744 CG LEU A 104 8.767 -2.120 -5.450 1.00 0.00 C ATOM 1745 CD1 LEU A 104 10.271 -2.165 -5.801 1.00 0.00 C ATOM 1746 CD2 LEU A 104 8.343 -3.397 -4.699 1.00 0.00 C ATOM 0 H LEU A 104 7.658 1.391 -3.842 1.00 0.00 H new ATOM 0 HA LEU A 104 6.415 -0.745 -5.433 1.00 0.00 H new ATOM 0 HB2 LEU A 104 8.941 0.011 -5.122 1.00 0.00 H new ATOM 0 HB3 LEU A 104 8.832 -0.928 -3.646 1.00 0.00 H new ATOM 0 HG LEU A 104 8.195 -2.087 -6.377 1.00 0.00 H new ATOM 0 HD11 LEU A 104 10.488 -3.077 -6.358 1.00 0.00 H new ATOM 0 HD12 LEU A 104 10.529 -1.298 -6.410 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.859 -2.152 -4.883 1.00 0.00 H new ATOM 0 HD21 LEU A 104 8.604 -4.272 -5.294 1.00 0.00 H new ATOM 0 HD22 LEU A 104 8.859 -3.443 -3.740 1.00 0.00 H new ATOM 0 HD23 LEU A 104 7.266 -3.380 -4.531 1.00 0.00 H new ATOM 1758 N LEU A 105 5.084 -1.804 -3.658 1.00 0.00 N ATOM 1759 CA LEU A 105 4.223 -2.499 -2.686 1.00 0.00 C ATOM 1760 C LEU A 105 4.372 -4.012 -2.856 1.00 0.00 C ATOM 1761 O LEU A 105 4.311 -4.517 -3.976 1.00 0.00 O ATOM 1762 CB LEU A 105 2.742 -2.079 -2.910 1.00 0.00 C ATOM 1763 CG LEU A 105 1.642 -2.802 -2.056 1.00 0.00 C ATOM 1764 CD1 LEU A 105 1.825 -2.564 -0.541 1.00 0.00 C ATOM 1765 CD2 LEU A 105 0.222 -2.393 -2.513 1.00 0.00 C ATOM 0 H LEU A 105 4.737 -1.867 -4.615 1.00 0.00 H new ATOM 0 HA LEU A 105 4.522 -2.226 -1.674 1.00 0.00 H new ATOM 0 HB2 LEU A 105 2.665 -1.009 -2.720 1.00 0.00 H new ATOM 0 HB3 LEU A 105 2.505 -2.234 -3.963 1.00 0.00 H new ATOM 0 HG LEU A 105 1.762 -3.872 -2.228 1.00 0.00 H new ATOM 0 HD11 LEU A 105 1.039 -3.085 0.007 1.00 0.00 H new ATOM 0 HD12 LEU A 105 2.798 -2.943 -0.228 1.00 0.00 H new ATOM 0 HD13 LEU A 105 1.767 -1.496 -0.331 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -0.519 -2.910 -1.903 1.00 0.00 H new ATOM 0 HD22 LEU A 105 0.099 -1.316 -2.399 1.00 0.00 H new ATOM 0 HD23 LEU A 105 0.084 -2.665 -3.560 1.00 0.00 H new ATOM 1777 N ARG A 106 4.585 -4.717 -1.743 1.00 0.00 N ATOM 1778 CA ARG A 106 4.525 -6.184 -1.712 1.00 0.00 C ATOM 1779 C ARG A 106 3.061 -6.642 -1.899 1.00 0.00 C ATOM 1780 O ARG A 106 2.151 -6.092 -1.273 1.00 0.00 O ATOM 1781 CB ARG A 106 5.131 -6.737 -0.383 1.00 0.00 C ATOM 1782 CG ARG A 106 4.621 -6.043 0.908 1.00 0.00 C ATOM 1783 CD ARG A 106 5.158 -6.680 2.202 1.00 0.00 C ATOM 1784 NE ARG A 106 6.617 -6.903 2.128 1.00 0.00 N ATOM 1785 CZ ARG A 106 7.245 -8.017 2.519 1.00 0.00 C ATOM 1786 NH1 ARG A 106 6.594 -8.964 3.173 1.00 0.00 N ATOM 1787 NH2 ARG A 106 8.530 -8.176 2.263 1.00 0.00 N ATOM 0 H ARG A 106 4.803 -4.292 -0.842 1.00 0.00 H new ATOM 0 HA ARG A 106 5.123 -6.586 -2.530 1.00 0.00 H new ATOM 0 HB2 ARG A 106 4.911 -7.802 -0.316 1.00 0.00 H new ATOM 0 HB3 ARG A 106 6.216 -6.638 -0.427 1.00 0.00 H new ATOM 0 HG2 ARG A 106 4.909 -4.992 0.884 1.00 0.00 H new ATOM 0 HG3 ARG A 106 3.532 -6.075 0.922 1.00 0.00 H new ATOM 0 HD2 ARG A 106 4.930 -6.034 3.049 1.00 0.00 H new ATOM 0 HD3 ARG A 106 4.652 -7.629 2.379 1.00 0.00 H new ATOM 0 HE ARG A 106 7.190 -6.149 1.749 1.00 0.00 H new ATOM 0 HH11 ARG A 106 5.603 -8.849 3.384 1.00 0.00 H new ATOM 0 HH12 ARG A 106 7.083 -9.810 3.466 1.00 0.00 H new ATOM 0 HH21 ARG A 106 9.045 -7.449 1.767 1.00 0.00 H new ATOM 0 HH22 ARG A 106 9.008 -9.026 2.562 1.00 0.00 H new ATOM 1801 N THR A 107 2.836 -7.611 -2.804 1.00 0.00 N ATOM 1802 CA THR A 107 1.506 -8.208 -3.009 1.00 0.00 C ATOM 1803 C THR A 107 1.093 -8.993 -1.753 1.00 0.00 C ATOM 1804 O THR A 107 -0.020 -8.831 -1.247 1.00 0.00 O ATOM 1805 CB THR A 107 1.470 -9.138 -4.271 1.00 0.00 C ATOM 1806 OG1 THR A 107 2.417 -10.212 -4.124 1.00 0.00 O ATOM 1807 CG2 THR A 107 1.775 -8.355 -5.566 1.00 0.00 C ATOM 0 H THR A 107 3.562 -7.998 -3.407 1.00 0.00 H new ATOM 0 HA THR A 107 0.797 -7.399 -3.184 1.00 0.00 H new ATOM 0 HB THR A 107 0.462 -9.545 -4.349 1.00 0.00 H new ATOM 0 HG1 THR A 107 2.762 -10.467 -5.005 1.00 0.00 H new ATOM 0 HG21 THR A 107 1.741 -9.034 -6.418 1.00 0.00 H new ATOM 0 HG22 THR A 107 1.033 -7.568 -5.699 1.00 0.00 H new ATOM 0 HG23 THR A 107 2.767 -7.910 -5.497 1.00 0.00 H new ATOM 1815 N ASP A 108 2.052 -9.787 -1.235 1.00 0.00 N ATOM 1816 CA ASP A 108 1.864 -10.661 -0.064 1.00 0.00 C ATOM 1817 C ASP A 108 2.605 -10.080 1.161 1.00 0.00 C ATOM 1818 O ASP A 108 3.700 -9.525 1.022 1.00 0.00 O ATOM 1819 CB ASP A 108 2.383 -12.081 -0.401 1.00 0.00 C ATOM 1820 CG ASP A 108 2.110 -13.109 0.711 1.00 0.00 C ATOM 1821 OD1 ASP A 108 1.024 -13.724 0.712 1.00 0.00 O ATOM 1822 OD2 ASP A 108 2.971 -13.305 1.590 1.00 0.00 O ATOM 0 H ASP A 108 2.993 -9.838 -1.626 1.00 0.00 H new ATOM 0 HA ASP A 108 0.804 -10.720 0.183 1.00 0.00 H new ATOM 0 HB2 ASP A 108 1.914 -12.422 -1.324 1.00 0.00 H new ATOM 0 HB3 ASP A 108 3.456 -12.033 -0.587 1.00 0.00 H new ATOM 1827 N ALA A 109 2.004 -10.255 2.354 1.00 0.00 N ATOM 1828 CA ALA A 109 2.491 -9.670 3.622 1.00 0.00 C ATOM 1829 C ALA A 109 3.672 -10.459 4.211 1.00 0.00 C ATOM 1830 O ALA A 109 4.604 -9.861 4.752 1.00 0.00 O ATOM 1831 CB ALA A 109 1.354 -9.612 4.648 1.00 0.00 C ATOM 0 H ALA A 109 1.157 -10.812 2.467 1.00 0.00 H new ATOM 0 HA ALA A 109 2.842 -8.663 3.396 1.00 0.00 H new ATOM 0 HB1 ALA A 109 1.724 -9.180 5.577 1.00 0.00 H new ATOM 0 HB2 ALA A 109 0.544 -8.996 4.259 1.00 0.00 H new ATOM 0 HB3 ALA A 109 0.984 -10.619 4.839 1.00 0.00 H new ATOM 1837 N SER A 110 3.622 -11.802 4.099 1.00 0.00 N ATOM 1838 CA SER A 110 4.652 -12.702 4.673 1.00 0.00 C ATOM 1839 C SER A 110 5.795 -12.970 3.664 1.00 0.00 C ATOM 1840 O SER A 110 6.675 -13.799 3.921 1.00 0.00 O ATOM 1841 CB SER A 110 4.000 -14.026 5.136 1.00 0.00 C ATOM 1842 OG SER A 110 3.329 -14.692 4.079 1.00 0.00 O ATOM 0 H SER A 110 2.873 -12.294 3.612 1.00 0.00 H new ATOM 0 HA SER A 110 5.094 -12.208 5.538 1.00 0.00 H new ATOM 0 HB2 SER A 110 4.767 -14.682 5.547 1.00 0.00 H new ATOM 0 HB3 SER A 110 3.293 -13.819 5.939 1.00 0.00 H new ATOM 0 HG SER A 110 3.391 -14.154 3.262 1.00 0.00 H new ATOM 1848 N ALA A 111 5.789 -12.224 2.545 1.00 0.00 N ATOM 1849 CA ALA A 111 6.730 -12.404 1.424 1.00 0.00 C ATOM 1850 C ALA A 111 8.065 -11.663 1.651 1.00 0.00 C ATOM 1851 O ALA A 111 8.306 -11.102 2.724 1.00 0.00 O ATOM 1852 CB ALA A 111 6.056 -11.911 0.142 1.00 0.00 C ATOM 0 H ALA A 111 5.121 -11.468 2.391 1.00 0.00 H new ATOM 0 HA ALA A 111 6.975 -13.463 1.345 1.00 0.00 H new ATOM 0 HB1 ALA A 111 6.738 -12.036 -0.699 1.00 0.00 H new ATOM 0 HB2 ALA A 111 5.149 -12.488 -0.037 1.00 0.00 H new ATOM 0 HB3 ALA A 111 5.800 -10.857 0.248 1.00 0.00 H new ATOM 1858 N GLU A 112 8.932 -11.667 0.619 1.00 0.00 N ATOM 1859 CA GLU A 112 10.216 -10.932 0.617 1.00 0.00 C ATOM 1860 C GLU A 112 10.198 -9.809 -0.469 1.00 0.00 C ATOM 1861 O GLU A 112 9.437 -8.844 -0.338 1.00 0.00 O ATOM 1862 CB GLU A 112 11.440 -11.923 0.497 1.00 0.00 C ATOM 1863 CG GLU A 112 11.170 -13.272 -0.224 1.00 0.00 C ATOM 1864 CD GLU A 112 10.664 -13.127 -1.669 1.00 0.00 C ATOM 1865 OE1 GLU A 112 11.472 -12.811 -2.571 1.00 0.00 O ATOM 1866 OE2 GLU A 112 9.458 -13.315 -1.902 1.00 0.00 O ATOM 0 H GLU A 112 8.761 -12.184 -0.244 1.00 0.00 H new ATOM 0 HA GLU A 112 10.346 -10.428 1.575 1.00 0.00 H new ATOM 0 HB2 GLU A 112 12.245 -11.410 -0.029 1.00 0.00 H new ATOM 0 HB3 GLU A 112 11.804 -12.140 1.501 1.00 0.00 H new ATOM 0 HG2 GLU A 112 12.089 -13.858 -0.230 1.00 0.00 H new ATOM 0 HG3 GLU A 112 10.436 -13.837 0.351 1.00 0.00 H new ATOM 1873 N TYR A 113 10.997 -9.943 -1.547 1.00 0.00 N ATOM 1874 CA TYR A 113 11.192 -8.885 -2.565 1.00 0.00 C ATOM 1875 C TYR A 113 11.512 -9.535 -3.928 1.00 0.00 C ATOM 1876 O TYR A 113 12.618 -9.406 -4.480 1.00 0.00 O ATOM 1877 CB TYR A 113 12.286 -7.860 -2.095 1.00 0.00 C ATOM 1878 CG TYR A 113 13.544 -8.496 -1.460 1.00 0.00 C ATOM 1879 CD1 TYR A 113 13.605 -8.757 -0.084 1.00 0.00 C ATOM 1880 CD2 TYR A 113 14.656 -8.849 -2.228 1.00 0.00 C ATOM 1881 CE1 TYR A 113 14.720 -9.341 0.493 1.00 0.00 C ATOM 1882 CE2 TYR A 113 15.773 -9.438 -1.654 1.00 0.00 C ATOM 1883 CZ TYR A 113 15.801 -9.683 -0.294 1.00 0.00 C ATOM 1884 OH TYR A 113 16.907 -10.281 0.281 1.00 0.00 O ATOM 0 H TYR A 113 11.529 -10.792 -1.739 1.00 0.00 H new ATOM 0 HA TYR A 113 10.274 -8.311 -2.688 1.00 0.00 H new ATOM 0 HB2 TYR A 113 12.593 -7.260 -2.952 1.00 0.00 H new ATOM 0 HB3 TYR A 113 11.838 -7.178 -1.373 1.00 0.00 H new ATOM 0 HD1 TYR A 113 12.763 -8.497 0.540 1.00 0.00 H new ATOM 0 HD2 TYR A 113 14.646 -8.659 -3.291 1.00 0.00 H new ATOM 0 HE1 TYR A 113 14.744 -9.528 1.556 1.00 0.00 H new ATOM 0 HE2 TYR A 113 16.620 -9.705 -2.269 1.00 0.00 H new ATOM 0 HH TYR A 113 17.579 -10.459 -0.410 1.00 0.00 H new ATOM 1894 N GLY A 114 10.519 -10.281 -4.437 1.00 0.00 N ATOM 1895 CA GLY A 114 10.612 -10.968 -5.731 1.00 0.00 C ATOM 1896 C GLY A 114 9.493 -10.557 -6.682 1.00 0.00 C ATOM 1897 O GLY A 114 8.469 -10.027 -6.240 1.00 0.00 O ATOM 0 H GLY A 114 9.628 -10.424 -3.961 1.00 0.00 H new ATOM 0 HA2 GLY A 114 11.576 -10.747 -6.189 1.00 0.00 H new ATOM 0 HA3 GLY A 114 10.574 -12.046 -5.572 1.00 0.00 H new ATOM 1901 N GLN A 115 9.676 -10.859 -7.983 1.00 0.00 N ATOM 1902 CA GLN A 115 8.801 -10.381 -9.088 1.00 0.00 C ATOM 1903 C GLN A 115 7.300 -10.741 -8.896 1.00 0.00 C ATOM 1904 O GLN A 115 6.425 -9.964 -9.286 1.00 0.00 O ATOM 1905 CB GLN A 115 9.329 -10.933 -10.448 1.00 0.00 C ATOM 1906 CG GLN A 115 9.464 -12.477 -10.511 1.00 0.00 C ATOM 1907 CD GLN A 115 10.020 -13.035 -11.831 1.00 0.00 C ATOM 1908 OE1 GLN A 115 10.885 -12.288 -12.500 1.00 0.00 O flip ATOM 1909 NE2 GLN A 115 9.691 -14.155 -12.235 1.00 0.00 N flip ATOM 0 H GLN A 115 10.443 -11.448 -8.306 1.00 0.00 H new ATOM 0 HA GLN A 115 8.847 -9.292 -9.081 1.00 0.00 H new ATOM 0 HB2 GLN A 115 8.657 -10.608 -11.242 1.00 0.00 H new ATOM 0 HB3 GLN A 115 10.303 -10.488 -10.652 1.00 0.00 H new ATOM 0 HG2 GLN A 115 10.112 -12.802 -9.697 1.00 0.00 H new ATOM 0 HG3 GLN A 115 8.483 -12.918 -10.334 1.00 0.00 H new ATOM 0 HE21 GLN A 115 9.023 -14.713 -11.703 1.00 0.00 H new ATOM 0 HE22 GLN A 115 10.087 -14.522 -13.100 1.00 0.00 H new ATOM 1918 N PHE A 116 7.020 -11.911 -8.289 1.00 0.00 N ATOM 1919 CA PHE A 116 5.633 -12.380 -8.037 1.00 0.00 C ATOM 1920 C PHE A 116 5.073 -11.776 -6.736 1.00 0.00 C ATOM 1921 O PHE A 116 3.877 -11.463 -6.633 1.00 0.00 O ATOM 1922 CB PHE A 116 5.592 -13.932 -7.958 1.00 0.00 C ATOM 1923 CG PHE A 116 6.071 -14.636 -9.226 1.00 0.00 C ATOM 1924 CD1 PHE A 116 5.306 -14.604 -10.393 1.00 0.00 C ATOM 1925 CD2 PHE A 116 7.278 -15.336 -9.249 1.00 0.00 C ATOM 1926 CE1 PHE A 116 5.734 -15.246 -11.541 1.00 0.00 C ATOM 1927 CE2 PHE A 116 7.704 -15.978 -10.396 1.00 0.00 C ATOM 1928 CZ PHE A 116 6.933 -15.932 -11.541 1.00 0.00 C ATOM 0 H PHE A 116 7.738 -12.556 -7.960 1.00 0.00 H new ATOM 0 HA PHE A 116 5.011 -12.048 -8.868 1.00 0.00 H new ATOM 0 HB2 PHE A 116 6.208 -14.258 -7.120 1.00 0.00 H new ATOM 0 HB3 PHE A 116 4.571 -14.247 -7.745 1.00 0.00 H new ATOM 0 HD1 PHE A 116 4.367 -14.071 -10.400 1.00 0.00 H new ATOM 0 HD2 PHE A 116 7.887 -15.376 -8.358 1.00 0.00 H new ATOM 0 HE1 PHE A 116 5.131 -15.211 -12.437 1.00 0.00 H new ATOM 0 HE2 PHE A 116 8.640 -16.516 -10.397 1.00 0.00 H new ATOM 0 HZ PHE A 116 7.268 -16.433 -12.437 1.00 0.00 H new ATOM 1938 N THR A 117 5.968 -11.595 -5.755 1.00 0.00 N ATOM 1939 CA THR A 117 5.606 -11.211 -4.384 1.00 0.00 C ATOM 1940 C THR A 117 5.559 -9.685 -4.190 1.00 0.00 C ATOM 1941 O THR A 117 5.204 -9.214 -3.104 1.00 0.00 O ATOM 1942 CB THR A 117 6.612 -11.841 -3.378 1.00 0.00 C ATOM 1943 OG1 THR A 117 7.955 -11.467 -3.720 1.00 0.00 O ATOM 1944 CG2 THR A 117 6.502 -13.379 -3.339 1.00 0.00 C ATOM 0 H THR A 117 6.972 -11.712 -5.892 1.00 0.00 H new ATOM 0 HA THR A 117 4.601 -11.590 -4.197 1.00 0.00 H new ATOM 0 HB THR A 117 6.361 -11.459 -2.388 1.00 0.00 H new ATOM 0 HG1 THR A 117 8.587 -11.998 -3.192 1.00 0.00 H new ATOM 0 HG21 THR A 117 7.222 -13.777 -2.624 1.00 0.00 H new ATOM 0 HG22 THR A 117 5.494 -13.664 -3.036 1.00 0.00 H new ATOM 0 HG23 THR A 117 6.712 -13.784 -4.329 1.00 0.00 H new ATOM 1952 N THR A 118 5.923 -8.918 -5.235 1.00 0.00 N ATOM 1953 CA THR A 118 5.854 -7.442 -5.224 1.00 0.00 C ATOM 1954 C THR A 118 5.183 -6.916 -6.509 1.00 0.00 C ATOM 1955 O THR A 118 4.966 -7.672 -7.464 1.00 0.00 O ATOM 1956 CB THR A 118 7.268 -6.788 -5.052 1.00 0.00 C ATOM 1957 OG1 THR A 118 8.168 -7.257 -6.061 1.00 0.00 O ATOM 1958 CG2 THR A 118 7.871 -7.042 -3.653 1.00 0.00 C ATOM 0 H THR A 118 6.274 -9.303 -6.112 1.00 0.00 H new ATOM 0 HA THR A 118 5.249 -7.159 -4.363 1.00 0.00 H new ATOM 0 HB THR A 118 7.129 -5.712 -5.160 1.00 0.00 H new ATOM 0 HG1 THR A 118 8.227 -8.234 -6.018 1.00 0.00 H new ATOM 0 HG21 THR A 118 8.850 -6.568 -3.587 1.00 0.00 H new ATOM 0 HG22 THR A 118 7.213 -6.623 -2.892 1.00 0.00 H new ATOM 0 HG23 THR A 118 7.976 -8.115 -3.491 1.00 0.00 H new ATOM 1966 N CYS A 119 4.861 -5.611 -6.506 1.00 0.00 N ATOM 1967 CA CYS A 119 4.186 -4.919 -7.611 1.00 0.00 C ATOM 1968 C CYS A 119 4.457 -3.410 -7.500 1.00 0.00 C ATOM 1969 O CYS A 119 4.451 -2.848 -6.396 1.00 0.00 O ATOM 1970 CB CYS A 119 2.663 -5.194 -7.575 1.00 0.00 C ATOM 1971 SG CYS A 119 1.848 -4.666 -6.047 1.00 0.00 S ATOM 0 H CYS A 119 5.068 -4.998 -5.718 1.00 0.00 H new ATOM 0 HA CYS A 119 4.575 -5.291 -8.559 1.00 0.00 H new ATOM 0 HB2 CYS A 119 2.194 -4.686 -8.418 1.00 0.00 H new ATOM 0 HB3 CYS A 119 2.495 -6.262 -7.713 1.00 0.00 H new ATOM 0 HG CYS A 119 2.727 -4.581 -5.093 1.00 0.00 H new ATOM 1977 N PHE A 120 4.721 -2.771 -8.645 1.00 0.00 N ATOM 1978 CA PHE A 120 4.927 -1.320 -8.733 1.00 0.00 C ATOM 1979 C PHE A 120 3.558 -0.634 -8.874 1.00 0.00 C ATOM 1980 O PHE A 120 2.891 -0.791 -9.905 1.00 0.00 O ATOM 1981 CB PHE A 120 5.835 -0.980 -9.944 1.00 0.00 C ATOM 1982 CG PHE A 120 7.234 -1.590 -9.880 1.00 0.00 C ATOM 1983 CD1 PHE A 120 7.492 -2.865 -10.393 1.00 0.00 C ATOM 1984 CD2 PHE A 120 8.297 -0.883 -9.316 1.00 0.00 C ATOM 1985 CE1 PHE A 120 8.762 -3.409 -10.343 1.00 0.00 C ATOM 1986 CE2 PHE A 120 9.565 -1.427 -9.267 1.00 0.00 C ATOM 1987 CZ PHE A 120 9.798 -2.689 -9.778 1.00 0.00 C ATOM 0 H PHE A 120 4.798 -3.249 -9.543 1.00 0.00 H new ATOM 0 HA PHE A 120 5.422 -0.961 -7.830 1.00 0.00 H new ATOM 0 HB2 PHE A 120 5.345 -1.322 -10.856 1.00 0.00 H new ATOM 0 HB3 PHE A 120 5.928 0.103 -10.019 1.00 0.00 H new ATOM 0 HD1 PHE A 120 6.687 -3.433 -10.835 1.00 0.00 H new ATOM 0 HD2 PHE A 120 8.125 0.104 -8.912 1.00 0.00 H new ATOM 0 HE1 PHE A 120 8.944 -4.395 -10.745 1.00 0.00 H new ATOM 0 HE2 PHE A 120 10.376 -0.865 -8.828 1.00 0.00 H new ATOM 0 HZ PHE A 120 10.790 -3.113 -9.736 1.00 0.00 H new ATOM 1997 N VAL A 121 3.125 0.088 -7.823 1.00 0.00 N ATOM 1998 CA VAL A 121 1.829 0.807 -7.808 1.00 0.00 C ATOM 1999 C VAL A 121 2.030 2.279 -7.412 1.00 0.00 C ATOM 2000 O VAL A 121 3.159 2.747 -7.207 1.00 0.00 O ATOM 2001 CB VAL A 121 0.773 0.145 -6.821 1.00 0.00 C ATOM 2002 CG1 VAL A 121 0.240 -1.209 -7.349 1.00 0.00 C ATOM 2003 CG2 VAL A 121 1.361 0.009 -5.396 1.00 0.00 C ATOM 0 H VAL A 121 3.660 0.192 -6.961 1.00 0.00 H new ATOM 0 HA VAL A 121 1.431 0.742 -8.821 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.085 0.815 -6.771 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -0.478 -1.619 -6.639 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -0.248 -1.057 -8.312 1.00 0.00 H new ATOM 0 HG13 VAL A 121 1.070 -1.905 -7.469 1.00 0.00 H new ATOM 0 HG21 VAL A 121 0.620 -0.446 -4.739 1.00 0.00 H new ATOM 0 HG22 VAL A 121 2.252 -0.618 -5.428 1.00 0.00 H new ATOM 0 HG23 VAL A 121 1.626 0.996 -5.016 1.00 0.00 H new ATOM 2013 N VAL A 122 0.901 2.997 -7.344 1.00 0.00 N ATOM 2014 CA VAL A 122 0.827 4.349 -6.784 1.00 0.00 C ATOM 2015 C VAL A 122 0.943 4.286 -5.243 1.00 0.00 C ATOM 2016 O VAL A 122 0.706 3.225 -4.639 1.00 0.00 O ATOM 2017 CB VAL A 122 -0.513 5.057 -7.226 1.00 0.00 C ATOM 2018 CG1 VAL A 122 -0.616 5.105 -8.771 1.00 0.00 C ATOM 2019 CG2 VAL A 122 -1.763 4.380 -6.597 1.00 0.00 C ATOM 0 H VAL A 122 0.003 2.649 -7.681 1.00 0.00 H new ATOM 0 HA VAL A 122 1.658 4.941 -7.168 1.00 0.00 H new ATOM 0 HB VAL A 122 -0.487 6.080 -6.851 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -1.546 5.596 -9.059 1.00 0.00 H new ATOM 0 HG12 VAL A 122 0.229 5.663 -9.175 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -0.604 4.090 -9.168 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -2.663 4.899 -6.928 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -1.809 3.337 -6.912 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -1.695 4.428 -5.510 1.00 0.00 H new ATOM 2029 N ARG A 123 1.298 5.422 -4.617 1.00 0.00 N ATOM 2030 CA ARG A 123 1.464 5.506 -3.150 1.00 0.00 C ATOM 2031 C ARG A 123 0.166 5.148 -2.407 1.00 0.00 C ATOM 2032 O ARG A 123 0.219 4.508 -1.365 1.00 0.00 O ATOM 2033 CB ARG A 123 1.924 6.915 -2.695 1.00 0.00 C ATOM 2034 CG ARG A 123 3.405 7.262 -2.981 1.00 0.00 C ATOM 2035 CD ARG A 123 3.871 8.475 -2.154 1.00 0.00 C ATOM 2036 NE ARG A 123 5.280 8.836 -2.341 1.00 0.00 N ATOM 2037 CZ ARG A 123 5.913 9.787 -1.628 1.00 0.00 C ATOM 2038 NH1 ARG A 123 5.293 10.441 -0.643 1.00 0.00 N ATOM 2039 NH2 ARG A 123 7.165 10.075 -1.900 1.00 0.00 N ATOM 0 H ARG A 123 1.477 6.300 -5.105 1.00 0.00 H new ATOM 0 HA ARG A 123 2.237 4.780 -2.897 1.00 0.00 H new ATOM 0 HB2 ARG A 123 1.295 7.658 -3.185 1.00 0.00 H new ATOM 0 HB3 ARG A 123 1.749 7.006 -1.623 1.00 0.00 H new ATOM 0 HG2 ARG A 123 4.032 6.401 -2.751 1.00 0.00 H new ATOM 0 HG3 ARG A 123 3.532 7.474 -4.043 1.00 0.00 H new ATOM 0 HD2 ARG A 123 3.252 9.334 -2.413 1.00 0.00 H new ATOM 0 HD3 ARG A 123 3.700 8.266 -1.098 1.00 0.00 H new ATOM 0 HE ARG A 123 5.812 8.337 -3.054 1.00 0.00 H new ATOM 0 HH11 ARG A 123 4.322 10.224 -0.419 1.00 0.00 H new ATOM 0 HH12 ARG A 123 5.790 11.158 -0.115 1.00 0.00 H new ATOM 0 HH21 ARG A 123 7.652 9.580 -2.647 1.00 0.00 H new ATOM 0 HH22 ARG A 123 7.651 10.794 -1.364 1.00 0.00 H new ATOM 2053 N LEU A 124 -0.982 5.569 -2.964 1.00 0.00 N ATOM 2054 CA LEU A 124 -2.307 5.388 -2.320 1.00 0.00 C ATOM 2055 C LEU A 124 -2.619 3.882 -2.095 1.00 0.00 C ATOM 2056 O LEU A 124 -3.168 3.508 -1.056 1.00 0.00 O ATOM 2057 CB LEU A 124 -3.438 6.092 -3.161 1.00 0.00 C ATOM 2058 CG LEU A 124 -4.516 6.898 -2.350 1.00 0.00 C ATOM 2059 CD1 LEU A 124 -5.286 6.016 -1.366 1.00 0.00 C ATOM 2060 CD2 LEU A 124 -3.872 8.092 -1.625 1.00 0.00 C ATOM 0 H LEU A 124 -1.025 6.042 -3.867 1.00 0.00 H new ATOM 0 HA LEU A 124 -2.276 5.864 -1.340 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -2.964 6.773 -3.868 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -3.951 5.330 -3.747 1.00 0.00 H new ATOM 0 HG LEU A 124 -5.241 7.276 -3.071 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -6.018 6.621 -0.831 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -5.799 5.224 -1.912 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -4.590 5.574 -0.653 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -4.636 8.636 -1.070 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -3.110 7.730 -0.934 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -3.413 8.757 -2.356 1.00 0.00 H new ATOM 2072 N GLN A 125 -2.239 3.032 -3.074 1.00 0.00 N ATOM 2073 CA GLN A 125 -2.415 1.564 -2.978 1.00 0.00 C ATOM 2074 C GLN A 125 -1.460 0.957 -1.951 1.00 0.00 C ATOM 2075 O GLN A 125 -1.842 0.016 -1.228 1.00 0.00 O ATOM 2076 CB GLN A 125 -2.212 0.885 -4.352 1.00 0.00 C ATOM 2077 CG GLN A 125 -3.333 1.164 -5.358 1.00 0.00 C ATOM 2078 CD GLN A 125 -4.718 0.722 -4.867 1.00 0.00 C ATOM 2079 OE1 GLN A 125 -4.864 -0.240 -4.114 1.00 0.00 O ATOM 2080 NE2 GLN A 125 -5.744 1.421 -5.304 1.00 0.00 N ATOM 0 H GLN A 125 -1.806 3.339 -3.945 1.00 0.00 H new ATOM 0 HA GLN A 125 -3.438 1.383 -2.649 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -1.266 1.222 -4.776 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -2.130 -0.192 -4.205 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -3.357 2.232 -5.577 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -3.107 0.652 -6.293 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -5.592 2.214 -5.928 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -6.691 1.170 -5.019 1.00 0.00 H new ATOM 2089 N PHE A 126 -0.215 1.484 -1.914 1.00 0.00 N ATOM 2090 CA PHE A 126 0.782 1.077 -0.918 1.00 0.00 C ATOM 2091 C PHE A 126 0.216 1.283 0.495 1.00 0.00 C ATOM 2092 O PHE A 126 0.188 0.360 1.295 1.00 0.00 O ATOM 2093 CB PHE A 126 2.111 1.857 -1.101 1.00 0.00 C ATOM 2094 CG PHE A 126 3.194 1.479 -0.088 1.00 0.00 C ATOM 2095 CD1 PHE A 126 3.919 0.297 -0.228 1.00 0.00 C ATOM 2096 CD2 PHE A 126 3.475 2.289 1.011 1.00 0.00 C ATOM 2097 CE1 PHE A 126 4.883 -0.064 0.691 1.00 0.00 C ATOM 2098 CE2 PHE A 126 4.442 1.927 1.927 1.00 0.00 C ATOM 2099 CZ PHE A 126 5.143 0.751 1.769 1.00 0.00 C ATOM 0 H PHE A 126 0.116 2.193 -2.568 1.00 0.00 H new ATOM 0 HA PHE A 126 1.004 0.019 -1.060 1.00 0.00 H new ATOM 0 HB2 PHE A 126 2.490 1.679 -2.107 1.00 0.00 H new ATOM 0 HB3 PHE A 126 1.909 2.925 -1.021 1.00 0.00 H new ATOM 0 HD1 PHE A 126 3.723 -0.348 -1.071 1.00 0.00 H new ATOM 0 HD2 PHE A 126 2.929 3.211 1.147 1.00 0.00 H new ATOM 0 HE1 PHE A 126 5.433 -0.985 0.564 1.00 0.00 H new ATOM 0 HE2 PHE A 126 4.650 2.568 2.771 1.00 0.00 H new ATOM 0 HZ PHE A 126 5.896 0.469 2.490 1.00 0.00 H new ATOM 2109 N TYR A 127 -0.304 2.494 0.740 1.00 0.00 N ATOM 2110 CA TYR A 127 -0.870 2.886 2.042 1.00 0.00 C ATOM 2111 C TYR A 127 -2.069 1.996 2.411 1.00 0.00 C ATOM 2112 O TYR A 127 -2.178 1.529 3.539 1.00 0.00 O ATOM 2113 CB TYR A 127 -1.305 4.377 2.014 1.00 0.00 C ATOM 2114 CG TYR A 127 -0.189 5.377 1.681 1.00 0.00 C ATOM 2115 CD1 TYR A 127 1.131 5.148 2.075 1.00 0.00 C ATOM 2116 CD2 TYR A 127 -0.458 6.551 0.965 1.00 0.00 C ATOM 2117 CE1 TYR A 127 2.136 6.039 1.772 1.00 0.00 C ATOM 2118 CE2 TYR A 127 0.548 7.446 0.661 1.00 0.00 C ATOM 2119 CZ TYR A 127 1.845 7.183 1.068 1.00 0.00 C ATOM 2120 OH TYR A 127 2.851 8.080 0.784 1.00 0.00 O ATOM 0 H TYR A 127 -0.345 3.234 0.039 1.00 0.00 H new ATOM 0 HA TYR A 127 -0.097 2.754 2.800 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -2.104 4.492 1.282 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -1.724 4.635 2.987 1.00 0.00 H new ATOM 0 HD1 TYR A 127 1.369 4.252 2.630 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -1.469 6.759 0.646 1.00 0.00 H new ATOM 0 HE1 TYR A 127 3.150 5.840 2.087 1.00 0.00 H new ATOM 0 HE2 TYR A 127 0.325 8.347 0.109 1.00 0.00 H new ATOM 0 HH TYR A 127 3.720 7.636 0.872 1.00 0.00 H new ATOM 2130 N ALA A 128 -2.933 1.740 1.423 1.00 0.00 N ATOM 2131 CA ALA A 128 -4.189 1.003 1.622 1.00 0.00 C ATOM 2132 C ALA A 128 -3.956 -0.397 2.238 1.00 0.00 C ATOM 2133 O ALA A 128 -4.337 -0.658 3.394 1.00 0.00 O ATOM 2134 CB ALA A 128 -4.912 0.887 0.281 1.00 0.00 C ATOM 0 H ALA A 128 -2.782 2.038 0.459 1.00 0.00 H new ATOM 0 HA ALA A 128 -4.803 1.557 2.332 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -5.846 0.342 0.417 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -5.127 1.884 -0.104 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -4.280 0.353 -0.428 1.00 0.00 H new ATOM 2140 N PHE A 129 -3.266 -1.262 1.479 1.00 0.00 N ATOM 2141 CA PHE A 129 -3.051 -2.663 1.867 1.00 0.00 C ATOM 2142 C PHE A 129 -2.027 -2.786 3.006 1.00 0.00 C ATOM 2143 O PHE A 129 -2.277 -3.512 3.971 1.00 0.00 O ATOM 2144 CB PHE A 129 -2.619 -3.506 0.643 1.00 0.00 C ATOM 2145 CG PHE A 129 -3.737 -3.696 -0.375 1.00 0.00 C ATOM 2146 CD1 PHE A 129 -4.728 -4.659 -0.161 1.00 0.00 C ATOM 2147 CD2 PHE A 129 -3.811 -2.913 -1.529 1.00 0.00 C ATOM 2148 CE1 PHE A 129 -5.751 -4.833 -1.071 1.00 0.00 C ATOM 2149 CE2 PHE A 129 -4.839 -3.089 -2.438 1.00 0.00 C ATOM 2150 CZ PHE A 129 -5.808 -4.048 -2.208 1.00 0.00 C ATOM 0 H PHE A 129 -2.844 -1.012 0.585 1.00 0.00 H new ATOM 0 HA PHE A 129 -3.999 -3.053 2.239 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -1.771 -3.023 0.157 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -2.276 -4.483 0.984 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -4.693 -5.274 0.726 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -3.057 -2.162 -1.714 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -6.508 -5.583 -0.895 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -4.885 -2.477 -3.327 1.00 0.00 H new ATOM 0 HZ PHE A 129 -6.611 -4.184 -2.918 1.00 0.00 H new ATOM 2160 N GLU A 130 -0.904 -2.039 2.903 1.00 0.00 N ATOM 2161 CA GLU A 130 0.238 -2.173 3.838 1.00 0.00 C ATOM 2162 C GLU A 130 -0.178 -1.805 5.279 1.00 0.00 C ATOM 2163 O GLU A 130 0.072 -2.573 6.206 1.00 0.00 O ATOM 2164 CB GLU A 130 1.454 -1.301 3.396 1.00 0.00 C ATOM 2165 CG GLU A 130 2.823 -1.768 3.936 1.00 0.00 C ATOM 2166 CD GLU A 130 3.282 -3.099 3.304 1.00 0.00 C ATOM 2167 OE1 GLU A 130 3.917 -3.068 2.225 1.00 0.00 O ATOM 2168 OE2 GLU A 130 2.957 -4.180 3.847 1.00 0.00 O ATOM 0 H GLU A 130 -0.764 -1.334 2.179 1.00 0.00 H new ATOM 0 HA GLU A 130 0.545 -3.219 3.816 1.00 0.00 H new ATOM 0 HB2 GLU A 130 1.495 -1.288 2.307 1.00 0.00 H new ATOM 0 HB3 GLU A 130 1.283 -0.275 3.721 1.00 0.00 H new ATOM 0 HG2 GLU A 130 3.570 -0.999 3.739 1.00 0.00 H new ATOM 0 HG3 GLU A 130 2.763 -1.884 5.018 1.00 0.00 H new ATOM 2175 N ILE A 131 -0.850 -0.640 5.438 1.00 0.00 N ATOM 2176 CA ILE A 131 -1.302 -0.142 6.762 1.00 0.00 C ATOM 2177 C ILE A 131 -2.384 -1.065 7.342 1.00 0.00 C ATOM 2178 O ILE A 131 -2.358 -1.386 8.538 1.00 0.00 O ATOM 2179 CB ILE A 131 -1.857 1.333 6.670 1.00 0.00 C ATOM 2180 CG1 ILE A 131 -0.748 2.312 6.174 1.00 0.00 C ATOM 2181 CG2 ILE A 131 -2.467 1.824 8.014 1.00 0.00 C ATOM 2182 CD1 ILE A 131 -1.265 3.679 5.748 1.00 0.00 C ATOM 0 H ILE A 131 -1.093 -0.024 4.662 1.00 0.00 H new ATOM 0 HA ILE A 131 -0.435 -0.140 7.422 1.00 0.00 H new ATOM 0 HB ILE A 131 -2.666 1.322 5.940 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -0.015 2.445 6.970 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -0.226 1.855 5.333 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -2.834 2.844 7.896 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -3.293 1.172 8.299 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -1.702 1.801 8.791 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -0.430 4.297 5.418 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -1.975 3.561 4.930 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -1.761 4.160 6.592 1.00 0.00 H new ATOM 2194 N ALA A 132 -3.319 -1.503 6.473 1.00 0.00 N ATOM 2195 CA ALA A 132 -4.431 -2.379 6.878 1.00 0.00 C ATOM 2196 C ALA A 132 -3.928 -3.690 7.508 1.00 0.00 C ATOM 2197 O ALA A 132 -4.295 -4.029 8.637 1.00 0.00 O ATOM 2198 CB ALA A 132 -5.345 -2.658 5.684 1.00 0.00 C ATOM 0 H ALA A 132 -3.323 -1.261 5.482 1.00 0.00 H new ATOM 0 HA ALA A 132 -5.005 -1.858 7.644 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -6.163 -3.307 5.996 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -5.750 -1.718 5.308 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -4.774 -3.148 4.895 1.00 0.00 H new ATOM 2204 N ARG A 133 -3.043 -4.390 6.786 1.00 0.00 N ATOM 2205 CA ARG A 133 -2.484 -5.679 7.233 1.00 0.00 C ATOM 2206 C ARG A 133 -1.384 -5.476 8.298 1.00 0.00 C ATOM 2207 O ARG A 133 -1.052 -6.408 9.010 1.00 0.00 O ATOM 2208 CB ARG A 133 -1.978 -6.510 6.022 1.00 0.00 C ATOM 2209 CG ARG A 133 -0.792 -5.899 5.258 1.00 0.00 C ATOM 2210 CD ARG A 133 -0.555 -6.568 3.897 1.00 0.00 C ATOM 2211 NE ARG A 133 0.494 -5.879 3.135 1.00 0.00 N ATOM 2212 CZ ARG A 133 0.657 -5.942 1.813 1.00 0.00 C ATOM 2213 NH1 ARG A 133 -0.070 -6.775 1.055 1.00 0.00 N ATOM 2214 NH2 ARG A 133 1.572 -5.179 1.260 1.00 0.00 N ATOM 0 H ARG A 133 -2.693 -4.083 5.878 1.00 0.00 H new ATOM 0 HA ARG A 133 -3.282 -6.249 7.709 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -1.690 -7.500 6.376 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -2.805 -6.649 5.326 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -0.971 -4.834 5.108 1.00 0.00 H new ATOM 0 HG3 ARG A 133 0.110 -5.988 5.864 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -0.273 -7.610 4.047 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -1.482 -6.568 3.324 1.00 0.00 H new ATOM 0 HE ARG A 133 1.153 -5.304 3.661 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -0.768 -7.380 1.488 1.00 0.00 H new ATOM 0 HH12 ARG A 133 0.075 -6.803 0.046 1.00 0.00 H new ATOM 0 HH21 ARG A 133 2.137 -4.558 1.840 1.00 0.00 H new ATOM 0 HH22 ARG A 133 1.718 -5.207 0.251 1.00 0.00 H new ATOM 2228 N ASN A 134 -0.824 -4.250 8.407 1.00 0.00 N ATOM 2229 CA ASN A 134 0.137 -3.905 9.488 1.00 0.00 C ATOM 2230 C ASN A 134 -0.608 -3.915 10.839 1.00 0.00 C ATOM 2231 O ASN A 134 -0.152 -4.519 11.815 1.00 0.00 O ATOM 2232 CB ASN A 134 0.793 -2.509 9.237 1.00 0.00 C ATOM 2233 CG ASN A 134 2.072 -2.237 10.057 1.00 0.00 C ATOM 2234 OD1 ASN A 134 2.288 -2.808 11.125 1.00 0.00 O ATOM 2235 ND2 ASN A 134 2.927 -1.339 9.565 1.00 0.00 N ATOM 0 H ASN A 134 -1.018 -3.483 7.763 1.00 0.00 H new ATOM 0 HA ASN A 134 0.938 -4.644 9.501 1.00 0.00 H new ATOM 0 HB2 ASN A 134 1.032 -2.421 8.177 1.00 0.00 H new ATOM 0 HB3 ASN A 134 0.061 -1.734 9.464 1.00 0.00 H new ATOM 0 HD21 ASN A 134 3.780 -1.114 10.076 1.00 0.00 H new ATOM 0 HD22 ASN A 134 2.727 -0.878 8.677 1.00 0.00 H new ATOM 2242 N LYS A 135 -1.790 -3.268 10.841 1.00 0.00 N ATOM 2243 CA LYS A 135 -2.665 -3.162 12.024 1.00 0.00 C ATOM 2244 C LYS A 135 -3.364 -4.500 12.328 1.00 0.00 C ATOM 2245 O LYS A 135 -3.664 -4.802 13.487 1.00 0.00 O ATOM 2246 CB LYS A 135 -3.711 -2.038 11.808 1.00 0.00 C ATOM 2247 CG LYS A 135 -3.095 -0.634 11.598 1.00 0.00 C ATOM 2248 CD LYS A 135 -4.158 0.474 11.451 1.00 0.00 C ATOM 2249 CE LYS A 135 -5.063 0.592 12.689 1.00 0.00 C ATOM 2250 NZ LYS A 135 -5.922 1.791 12.627 1.00 0.00 N ATOM 0 H LYS A 135 -2.166 -2.801 10.016 1.00 0.00 H new ATOM 0 HA LYS A 135 -2.045 -2.912 12.885 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -4.323 -2.288 10.941 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -4.377 -2.006 12.670 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -2.446 -0.398 12.441 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -2.467 -0.648 10.707 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -3.661 1.428 11.276 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -4.772 0.269 10.574 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -5.687 -0.298 12.770 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -4.447 0.632 13.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -6.404 1.920 13.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -5.338 2.627 12.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -6.631 1.672 11.875 1.00 0.00 H new ATOM 2264 N HIS A 136 -3.623 -5.300 11.274 1.00 0.00 N ATOM 2265 CA HIS A 136 -4.181 -6.660 11.421 1.00 0.00 C ATOM 2266 C HIS A 136 -3.063 -7.676 11.768 1.00 0.00 C ATOM 2267 O HIS A 136 -3.344 -8.856 11.980 1.00 0.00 O ATOM 2268 CB HIS A 136 -4.972 -7.077 10.140 1.00 0.00 C ATOM 2269 CG HIS A 136 -6.390 -6.559 10.075 1.00 0.00 C ATOM 2270 ND1 HIS A 136 -7.474 -7.323 10.446 1.00 0.00 N ATOM 2271 CD2 HIS A 136 -6.901 -5.366 9.672 1.00 0.00 C ATOM 2272 CE1 HIS A 136 -8.582 -6.627 10.279 1.00 0.00 C ATOM 2273 NE2 HIS A 136 -8.266 -5.434 9.807 1.00 0.00 N ATOM 0 H HIS A 136 -3.453 -5.026 10.306 1.00 0.00 H new ATOM 0 HA HIS A 136 -4.888 -6.658 12.251 1.00 0.00 H new ATOM 0 HB2 HIS A 136 -4.430 -6.722 9.264 1.00 0.00 H new ATOM 0 HB3 HIS A 136 -4.994 -8.165 10.082 1.00 0.00 H new ATOM 0 HD1 HIS A 136 -7.427 -8.280 10.796 1.00 0.00 H new ATOM 0 HD2 HIS A 136 -6.337 -4.519 9.311 1.00 0.00 H new ATOM 0 HE1 HIS A 136 -9.582 -6.975 10.493 1.00 0.00 H new ATOM 2282 N GLY A 137 -1.794 -7.200 11.802 1.00 0.00 N ATOM 2283 CA GLY A 137 -0.666 -7.974 12.346 1.00 0.00 C ATOM 2284 C GLY A 137 0.007 -8.915 11.350 1.00 0.00 C ATOM 2285 O GLY A 137 0.838 -9.730 11.738 1.00 0.00 O ATOM 0 H GLY A 137 -1.532 -6.277 11.455 1.00 0.00 H new ATOM 0 HA2 GLY A 137 0.081 -7.279 12.729 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -1.021 -8.560 13.194 1.00 0.00 H new ATOM 2289 N LEU A 138 -0.344 -8.801 10.063 1.00 0.00 N ATOM 2290 CA LEU A 138 0.298 -9.585 8.979 1.00 0.00 C ATOM 2291 C LEU A 138 1.725 -9.069 8.667 1.00 0.00 C ATOM 2292 O LEU A 138 2.515 -9.774 8.035 1.00 0.00 O ATOM 2293 CB LEU A 138 -0.562 -9.583 7.680 1.00 0.00 C ATOM 2294 CG LEU A 138 -1.968 -10.262 7.741 1.00 0.00 C ATOM 2295 CD1 LEU A 138 -1.902 -11.658 8.376 1.00 0.00 C ATOM 2296 CD2 LEU A 138 -3.001 -9.365 8.434 1.00 0.00 C ATOM 0 H LEU A 138 -1.075 -8.169 9.736 1.00 0.00 H new ATOM 0 HA LEU A 138 0.374 -10.610 9.341 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -0.703 -8.547 7.372 1.00 0.00 H new ATOM 0 HB3 LEU A 138 0.014 -10.073 6.895 1.00 0.00 H new ATOM 0 HG LEU A 138 -2.303 -10.399 6.713 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -2.900 -12.095 8.399 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -1.241 -12.294 7.788 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -1.518 -11.577 9.393 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -3.966 -9.872 8.457 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -2.676 -9.157 9.453 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -3.096 -8.428 7.885 1.00 0.00 H new ATOM 2308 N ASN A 139 2.040 -7.836 9.106 1.00 0.00 N ATOM 2309 CA ASN A 139 3.398 -7.244 8.978 1.00 0.00 C ATOM 2310 C ASN A 139 4.136 -7.249 10.337 1.00 0.00 C ATOM 2311 O ASN A 139 5.172 -6.589 10.496 1.00 0.00 O ATOM 2312 CB ASN A 139 3.305 -5.803 8.400 1.00 0.00 C ATOM 2313 CG ASN A 139 2.724 -5.740 6.981 1.00 0.00 C ATOM 2314 OD1 ASN A 139 2.800 -6.700 6.213 1.00 0.00 O ATOM 2315 ND2 ASN A 139 2.157 -4.597 6.621 1.00 0.00 N ATOM 0 H ASN A 139 1.367 -7.218 9.559 1.00 0.00 H new ATOM 0 HA ASN A 139 3.976 -7.856 8.286 1.00 0.00 H new ATOM 0 HB2 ASN A 139 2.688 -5.195 9.062 1.00 0.00 H new ATOM 0 HB3 ASN A 139 4.300 -5.359 8.395 1.00 0.00 H new ATOM 0 HD21 ASN A 139 1.768 -4.494 5.684 1.00 0.00 H new ATOM 0 HD22 ASN A 139 2.110 -3.821 7.281 1.00 0.00 H new ATOM 2322 N ASP A 140 3.612 -8.034 11.301 1.00 0.00 N ATOM 2323 CA ASP A 140 4.205 -8.175 12.650 1.00 0.00 C ATOM 2324 C ASP A 140 5.547 -8.925 12.593 1.00 0.00 C ATOM 2325 O ASP A 140 6.484 -8.568 13.300 1.00 0.00 O ATOM 2326 CB ASP A 140 3.218 -8.908 13.602 1.00 0.00 C ATOM 2327 CG ASP A 140 3.821 -9.301 14.972 1.00 0.00 C ATOM 2328 OD1 ASP A 140 3.917 -8.435 15.868 1.00 0.00 O ATOM 2329 OD2 ASP A 140 4.196 -10.480 15.153 1.00 0.00 O ATOM 0 H ASP A 140 2.766 -8.588 11.168 1.00 0.00 H new ATOM 0 HA ASP A 140 4.394 -7.175 13.039 1.00 0.00 H new ATOM 0 HB2 ASP A 140 2.352 -8.268 13.771 1.00 0.00 H new ATOM 0 HB3 ASP A 140 2.856 -9.809 13.106 1.00 0.00 H new ATOM 2334 N TRP A 141 5.631 -9.957 11.732 1.00 0.00 N ATOM 2335 CA TRP A 141 6.829 -10.828 11.625 1.00 0.00 C ATOM 2336 C TRP A 141 8.099 -10.035 11.232 1.00 0.00 C ATOM 2337 O TRP A 141 9.222 -10.430 11.574 1.00 0.00 O ATOM 2338 CB TRP A 141 6.569 -11.974 10.610 1.00 0.00 C ATOM 2339 CG TRP A 141 6.434 -11.495 9.184 1.00 0.00 C ATOM 2340 CD1 TRP A 141 5.359 -10.870 8.625 1.00 0.00 C ATOM 2341 CD2 TRP A 141 7.429 -11.575 8.154 1.00 0.00 C ATOM 2342 NE1 TRP A 141 5.626 -10.548 7.329 1.00 0.00 N ATOM 2343 CE2 TRP A 141 6.886 -10.977 7.013 1.00 0.00 C ATOM 2344 CE3 TRP A 141 8.726 -12.091 8.094 1.00 0.00 C ATOM 2345 CZ2 TRP A 141 7.590 -10.875 5.821 1.00 0.00 C ATOM 2346 CZ3 TRP A 141 9.421 -11.999 6.906 1.00 0.00 C ATOM 2347 CH2 TRP A 141 8.852 -11.392 5.784 1.00 0.00 C ATOM 0 H TRP A 141 4.879 -10.214 11.093 1.00 0.00 H new ATOM 0 HA TRP A 141 7.011 -11.254 12.612 1.00 0.00 H new ATOM 0 HB2 TRP A 141 7.386 -12.693 10.668 1.00 0.00 H new ATOM 0 HB3 TRP A 141 5.659 -12.502 10.895 1.00 0.00 H new ATOM 0 HD1 TRP A 141 4.431 -10.661 9.136 1.00 0.00 H new ATOM 0 HE1 TRP A 141 4.989 -10.065 6.696 1.00 0.00 H new ATOM 0 HE3 TRP A 141 9.176 -12.553 8.961 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 7.154 -10.403 4.953 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 10.421 -12.403 6.842 1.00 0.00 H new ATOM 0 HH2 TRP A 141 9.422 -11.331 4.869 1.00 0.00 H new ATOM 2358 N ILE A 142 7.885 -8.912 10.527 1.00 0.00 N ATOM 2359 CA ILE A 142 8.955 -8.046 10.012 1.00 0.00 C ATOM 2360 C ILE A 142 9.756 -7.405 11.163 1.00 0.00 C ATOM 2361 O ILE A 142 10.965 -7.220 11.051 1.00 0.00 O ATOM 2362 CB ILE A 142 8.348 -6.936 9.073 1.00 0.00 C ATOM 2363 CG1 ILE A 142 7.537 -7.604 7.917 1.00 0.00 C ATOM 2364 CG2 ILE A 142 9.437 -5.984 8.509 1.00 0.00 C ATOM 2365 CD1 ILE A 142 6.724 -6.655 7.058 1.00 0.00 C ATOM 0 H ILE A 142 6.950 -8.577 10.296 1.00 0.00 H new ATOM 0 HA ILE A 142 9.643 -8.661 9.432 1.00 0.00 H new ATOM 0 HB ILE A 142 7.677 -6.322 9.673 1.00 0.00 H new ATOM 0 HG12 ILE A 142 8.232 -8.144 7.274 1.00 0.00 H new ATOM 0 HG13 ILE A 142 6.863 -8.343 8.349 1.00 0.00 H new ATOM 0 HG21 ILE A 142 8.970 -5.236 7.868 1.00 0.00 H new ATOM 0 HG22 ILE A 142 9.948 -5.487 9.333 1.00 0.00 H new ATOM 0 HG23 ILE A 142 10.159 -6.560 7.929 1.00 0.00 H new ATOM 0 HD11 ILE A 142 6.200 -7.220 6.287 1.00 0.00 H new ATOM 0 HD12 ILE A 142 5.998 -6.132 7.681 1.00 0.00 H new ATOM 0 HD13 ILE A 142 7.388 -5.930 6.588 1.00 0.00 H new ATOM 2377 N VAL A 143 9.081 -7.145 12.295 1.00 0.00 N ATOM 2378 CA VAL A 143 9.684 -6.414 13.427 1.00 0.00 C ATOM 2379 C VAL A 143 10.761 -7.252 14.160 1.00 0.00 C ATOM 2380 O VAL A 143 11.560 -6.704 14.928 1.00 0.00 O ATOM 2381 CB VAL A 143 8.591 -5.880 14.433 1.00 0.00 C ATOM 2382 CG1 VAL A 143 7.420 -5.212 13.657 1.00 0.00 C ATOM 2383 CG2 VAL A 143 8.097 -6.974 15.418 1.00 0.00 C ATOM 0 H VAL A 143 8.114 -7.430 12.453 1.00 0.00 H new ATOM 0 HA VAL A 143 10.188 -5.547 13.000 1.00 0.00 H new ATOM 0 HB VAL A 143 9.061 -5.119 15.056 1.00 0.00 H new ATOM 0 HG11 VAL A 143 6.675 -4.849 14.365 1.00 0.00 H new ATOM 0 HG12 VAL A 143 7.802 -4.376 13.071 1.00 0.00 H new ATOM 0 HG13 VAL A 143 6.962 -5.943 12.990 1.00 0.00 H new ATOM 0 HG21 VAL A 143 7.347 -6.550 16.086 1.00 0.00 H new ATOM 0 HG22 VAL A 143 7.658 -7.798 14.856 1.00 0.00 H new ATOM 0 HG23 VAL A 143 8.939 -7.342 16.005 1.00 0.00 H new ATOM 2393 N GLY A 144 10.781 -8.576 13.896 1.00 0.00 N ATOM 2394 CA GLY A 144 11.761 -9.492 14.502 1.00 0.00 C ATOM 2395 C GLY A 144 12.743 -10.077 13.489 1.00 0.00 C ATOM 2396 O GLY A 144 13.387 -11.097 13.767 1.00 0.00 O ATOM 0 H GLY A 144 10.124 -9.033 13.263 1.00 0.00 H new ATOM 0 HA2 GLY A 144 12.318 -8.960 15.273 1.00 0.00 H new ATOM 0 HA3 GLY A 144 11.231 -10.306 14.996 1.00 0.00 H new ATOM 2400 N GLN A 145 12.861 -9.431 12.312 1.00 0.00 N ATOM 2401 CA GLN A 145 13.759 -9.891 11.225 1.00 0.00 C ATOM 2402 C GLN A 145 15.246 -9.651 11.552 1.00 0.00 C ATOM 2403 O GLN A 145 15.601 -8.709 12.274 1.00 0.00 O ATOM 2404 CB GLN A 145 13.393 -9.216 9.868 1.00 0.00 C ATOM 2405 CG GLN A 145 12.152 -9.804 9.170 1.00 0.00 C ATOM 2406 CD GLN A 145 12.352 -11.260 8.745 1.00 0.00 C ATOM 2407 OE1 GLN A 145 12.021 -12.190 9.481 1.00 0.00 O ATOM 2408 NE2 GLN A 145 12.923 -11.467 7.567 1.00 0.00 N ATOM 0 H GLN A 145 12.343 -8.582 12.085 1.00 0.00 H new ATOM 0 HA GLN A 145 13.610 -10.967 11.136 1.00 0.00 H new ATOM 0 HB2 GLN A 145 13.226 -8.153 10.040 1.00 0.00 H new ATOM 0 HB3 GLN A 145 14.246 -9.300 9.194 1.00 0.00 H new ATOM 0 HG2 GLN A 145 11.297 -9.740 9.843 1.00 0.00 H new ATOM 0 HG3 GLN A 145 11.914 -9.203 8.293 1.00 0.00 H new ATOM 0 HE21 GLN A 145 13.185 -10.674 6.981 1.00 0.00 H new ATOM 0 HE22 GLN A 145 13.100 -12.419 7.246 1.00 0.00 H new ATOM 2417 N LYS A 146 16.090 -10.518 10.968 1.00 0.00 N ATOM 2418 CA LYS A 146 17.554 -10.479 11.113 1.00 0.00 C ATOM 2419 C LYS A 146 18.135 -9.182 10.495 1.00 0.00 C ATOM 2420 O LYS A 146 17.885 -8.933 9.293 1.00 0.00 O ATOM 2421 CB LYS A 146 18.185 -11.719 10.427 1.00 0.00 C ATOM 2422 CG LYS A 146 17.751 -13.082 11.017 1.00 0.00 C ATOM 2423 CD LYS A 146 18.376 -14.285 10.272 1.00 0.00 C ATOM 2424 CE LYS A 146 19.916 -14.262 10.290 1.00 0.00 C ATOM 2425 NZ LYS A 146 20.501 -15.391 9.524 1.00 0.00 N ATOM 2426 OXT LYS A 146 18.820 -8.417 11.203 1.00 0.00 O ATOM 0 H LYS A 146 15.767 -11.279 10.371 1.00 0.00 H new ATOM 0 HA LYS A 146 17.795 -10.492 12.176 1.00 0.00 H new ATOM 0 HB2 LYS A 146 17.928 -11.700 9.368 1.00 0.00 H new ATOM 0 HB3 LYS A 146 19.270 -11.640 10.493 1.00 0.00 H new ATOM 0 HG2 LYS A 146 18.035 -13.124 12.068 1.00 0.00 H new ATOM 0 HG3 LYS A 146 16.665 -13.161 10.977 1.00 0.00 H new ATOM 0 HD2 LYS A 146 18.025 -15.211 10.728 1.00 0.00 H new ATOM 0 HD3 LYS A 146 18.029 -14.287 9.239 1.00 0.00 H new ATOM 0 HE2 LYS A 146 20.269 -13.319 9.872 1.00 0.00 H new ATOM 0 HE3 LYS A 146 20.267 -14.304 11.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 21.539 -15.336 9.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 20.186 -16.292 9.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 20.188 -15.337 8.534 1.00 0.00 H new