USER MOD reduce.3.24.130724 H: found=0, std=0, add=1029, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1029 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 117 LYS NZ :NH3+ 173:sc= 1.13 (180deg=0.928) USER MOD Set 1.2: A 157 ASN : amide:sc= 0.121 K(o=1.3,f=-3.7!) USER MOD Set 2.1: A 131 HIS : +bothHN:sc= -2.16 K(o=-6,f=-9.7!) USER MOD Set 2.2: A 141 GLN : amide:sc= -0.335 K(o=-6,f=-9) USER MOD Set 2.3: A 142 CYS SG : rot 19:sc= -1.06! USER MOD Set 2.4: A 143 CYS SG : rot 158:sc= -0.172 USER MOD Set 2.5: A 145 GLN :FLIP amide:sc= 1.02 F(o=-12!,f=-6) USER MOD Set 2.6: A 153 CYS SG : rot -139:sc= -3.29! USER MOD Set 3.1: A 136 THR OG1 : rot 180:sc= 0.599 USER MOD Set 3.2: A 139 SER OG : rot 151:sc= 0.662 USER MOD Set 4.1: A 123 ASN : amide:sc= -0.935 K(o=-1.8,f=-3.8) USER MOD Set 4.2: A 125 ASN : amide:sc= -0.819 K(o=-1.8,f=-7.6!) USER MOD Set 5.1: A 105 SER OG : rot -160:sc= -0.358 USER MOD Set 5.2: A 108 SER OG : rot -95:sc= 0.117 USER MOD Set 6.1: A 91 GLN : amide:sc= 0.382 K(o=1.4,f=0.77) USER MOD Set 6.2: A 100 TYR OH : rot 45:sc= 0.991 USER MOD Set 7.1: A 94 HIS : no HE2:sc= -0.456 X(o=-0.55,f=-0.6) USER MOD Set 7.2: A 97 ASN : amide:sc= -0.0979 K(o=-0.55,f=-3.2!) USER MOD Set 8.1: A 76 LYS NZ :NH3+ -166:sc= -0.366 (180deg=-0.489) USER MOD Set 8.2: A 130 TYR OH : rot 15:sc= -0.327 USER MOD Set 9.1: A 71 CYS SG : rot -4:sc= -2.24! USER MOD Set 9.2: A 127 MET CE :methyl -174:sc= -0.288 (180deg=-0.49) USER MOD Single : A 15 THR OG1 : rot 180:sc= -0.0691 USER MOD Single : A 23 LYS NZ :NH3+ -169:sc= 0.3 (180deg=0.151) USER MOD Single : A 25 SER OG : rot 80:sc= 0.102 USER MOD Single : A 35 ASN :FLIP amide:sc= 0 F(o=-2.4!,f=0) USER MOD Single : A 36 TYR OH : rot 180:sc= -0.0945 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.242 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 MET CE :methyl -158:sc= -0.228 (180deg=-0.823) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot -28:sc= 0.228 USER MOD Single : A 68 LYS NZ :NH3+ -141:sc= 0.488 (180deg=-0.167) USER MOD Single : A 70 LYS NZ :NH3+ -143:sc= 0 (180deg=-1.47!) USER MOD Single : A 84 CYS SG : rot 180:sc= -1.83 USER MOD Single : A 85 GLN : amide:sc= -0.202 X(o=-0.2,f=-0.42) USER MOD Single : A 86 ASN : amide:sc= 0.0547 K(o=0.055,f=-3.8!) USER MOD Single : A 87 LYS NZ :NH3+ -134:sc= 0.338 (180deg=-0.0543) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 154:sc= 0.0818 USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 114 LYS NZ :NH3+ -127:sc= 0.741 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 LYS NZ :NH3+ 155:sc= 0.951 (180deg=0.201) USER MOD Single : A 122 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 124 ASN : amide:sc=-0.00299 K(o=-0.003,f=-1.6) USER MOD Single : A 129 LYS NZ :NH3+ -168:sc=-0.00776 (180deg=-0.145) USER MOD Single : A 133 LYS NZ :NH3+ 172:sc=-0.00179 (180deg=-0.0786) USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 146 THR OG1 : rot -34:sc= 0.54 USER MOD Single : A 148 LYS NZ :NH3+ -137:sc= 1.28 (180deg=-0.567) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 TYR OH : rot 35:sc= 0.359 USER MOD ----------------------------------------------------------------- ATOM 229 N THR A 15 -9.758 -1.149 15.071 1.00 40.52 N ATOM 230 CA THR A 15 -9.507 -1.078 13.625 1.00 13.03 C ATOM 231 C THR A 15 -10.135 0.193 13.005 1.00 33.41 C ATOM 232 O THR A 15 -10.989 0.864 13.609 1.00 72.44 O ATOM 233 CB THR A 15 -10.038 -2.371 12.899 1.00 13.13 C ATOM 234 OG1 THR A 15 -9.707 -2.346 11.489 1.00 21.11 O ATOM 235 CG2 THR A 15 -11.559 -2.548 13.067 1.00 35.02 C ATOM 0 HA THR A 15 -8.428 -1.022 13.480 1.00 13.03 H new ATOM 0 HB THR A 15 -9.543 -3.219 13.372 1.00 13.13 H new ATOM 0 HG1 THR A 15 -10.045 -3.159 11.059 1.00 21.11 H new ATOM 0 HG21 THR A 15 -11.879 -3.452 12.550 1.00 35.02 H new ATOM 0 HG22 THR A 15 -11.801 -2.631 14.127 1.00 35.02 H new ATOM 0 HG23 THR A 15 -12.075 -1.686 12.644 1.00 35.02 H new ATOM 243 N ILE A 16 -9.663 0.502 11.802 1.00 4.15 N ATOM 244 CA ILE A 16 -10.137 1.597 10.947 1.00 72.35 C ATOM 245 C ILE A 16 -10.827 0.964 9.730 1.00 45.25 C ATOM 246 O ILE A 16 -11.914 1.389 9.309 1.00 33.04 O ATOM 247 CB ILE A 16 -8.929 2.495 10.462 1.00 3.02 C ATOM 248 CG1 ILE A 16 -8.185 3.129 11.675 1.00 71.43 C ATOM 249 CG2 ILE A 16 -9.385 3.583 9.453 1.00 32.01 C ATOM 250 CD1 ILE A 16 -6.953 3.932 11.304 1.00 44.35 C ATOM 0 H ILE A 16 -8.904 -0.026 11.372 1.00 4.15 H new ATOM 0 HA ILE A 16 -10.824 2.234 11.504 1.00 72.35 H new ATOM 0 HB ILE A 16 -8.230 1.844 9.937 1.00 3.02 H new ATOM 0 HG12 ILE A 16 -8.878 3.777 12.212 1.00 71.43 H new ATOM 0 HG13 ILE A 16 -7.893 2.335 12.362 1.00 71.43 H new ATOM 0 HG21 ILE A 16 -8.525 4.177 9.145 1.00 32.01 H new ATOM 0 HG22 ILE A 16 -9.828 3.106 8.579 1.00 32.01 H new ATOM 0 HG23 ILE A 16 -10.123 4.231 9.926 1.00 32.01 H new ATOM 0 HD11 ILE A 16 -6.497 4.337 12.207 1.00 44.35 H new ATOM 0 HD12 ILE A 16 -6.238 3.286 10.795 1.00 44.35 H new ATOM 0 HD13 ILE A 16 -7.238 4.751 10.643 1.00 44.35 H new ATOM 262 N LEU A 17 -10.173 -0.085 9.202 1.00 54.02 N ATOM 263 CA LEU A 17 -10.597 -0.783 7.990 1.00 54.52 C ATOM 264 C LEU A 17 -9.838 -2.111 7.862 1.00 52.34 C ATOM 265 O LEU A 17 -8.639 -2.177 8.151 1.00 15.30 O ATOM 266 CB LEU A 17 -10.349 0.107 6.739 1.00 43.41 C ATOM 267 CG LEU A 17 -10.714 -0.516 5.355 1.00 61.22 C ATOM 268 CD1 LEU A 17 -12.185 -0.971 5.296 1.00 72.44 C ATOM 269 CD2 LEU A 17 -10.377 0.467 4.224 1.00 51.31 C ATOM 0 H LEU A 17 -9.325 -0.472 9.615 1.00 54.02 H new ATOM 0 HA LEU A 17 -11.665 -0.992 8.056 1.00 54.52 H new ATOM 0 HB2 LEU A 17 -10.918 1.029 6.858 1.00 43.41 H new ATOM 0 HB3 LEU A 17 -9.295 0.383 6.721 1.00 43.41 H new ATOM 0 HG LEU A 17 -10.109 -1.413 5.220 1.00 61.22 H new ATOM 0 HD11 LEU A 17 -12.395 -1.398 4.315 1.00 72.44 H new ATOM 0 HD12 LEU A 17 -12.365 -1.722 6.065 1.00 72.44 H new ATOM 0 HD13 LEU A 17 -12.838 -0.115 5.466 1.00 72.44 H new ATOM 0 HD21 LEU A 17 -10.636 0.020 3.264 1.00 51.31 H new ATOM 0 HD22 LEU A 17 -10.944 1.388 4.361 1.00 51.31 H new ATOM 0 HD23 LEU A 17 -9.311 0.692 4.243 1.00 51.31 H new ATOM 281 N GLU A 18 -10.557 -3.154 7.434 1.00 61.43 N ATOM 282 CA GLU A 18 -9.998 -4.486 7.166 1.00 72.33 C ATOM 283 C GLU A 18 -10.602 -5.054 5.865 1.00 73.13 C ATOM 284 O GLU A 18 -11.760 -4.766 5.531 1.00 10.35 O ATOM 285 CB GLU A 18 -10.231 -5.449 8.367 1.00 43.34 C ATOM 286 CG GLU A 18 -11.698 -5.796 8.706 1.00 13.24 C ATOM 287 CD GLU A 18 -12.545 -4.596 9.165 1.00 50.23 C ATOM 288 OE1 GLU A 18 -12.439 -4.202 10.338 1.00 44.54 O ATOM 289 OE2 GLU A 18 -13.302 -4.022 8.346 1.00 32.54 O ATOM 0 H GLU A 18 -11.561 -3.097 7.261 1.00 61.43 H new ATOM 0 HA GLU A 18 -8.920 -4.392 7.037 1.00 72.33 H new ATOM 0 HB2 GLU A 18 -9.700 -6.379 8.165 1.00 43.34 H new ATOM 0 HB3 GLU A 18 -9.773 -5.006 9.252 1.00 43.34 H new ATOM 0 HG2 GLU A 18 -12.166 -6.241 7.828 1.00 13.24 H new ATOM 0 HG3 GLU A 18 -11.708 -6.553 9.490 1.00 13.24 H new ATOM 296 N GLU A 19 -9.800 -5.849 5.134 1.00 53.42 N ATOM 297 CA GLU A 19 -10.190 -6.440 3.836 1.00 34.21 C ATOM 298 C GLU A 19 -9.259 -7.607 3.484 1.00 33.33 C ATOM 299 O GLU A 19 -8.112 -7.680 3.965 1.00 71.44 O ATOM 300 CB GLU A 19 -10.137 -5.349 2.720 1.00 22.24 C ATOM 301 CG GLU A 19 -10.423 -5.794 1.263 1.00 45.31 C ATOM 302 CD GLU A 19 -11.881 -6.186 0.993 1.00 44.53 C ATOM 303 OE1 GLU A 19 -12.684 -5.301 0.621 1.00 52.21 O ATOM 304 OE2 GLU A 19 -12.240 -7.370 1.147 1.00 51.32 O ATOM 0 H GLU A 19 -8.856 -6.103 5.427 1.00 53.42 H new ATOM 0 HA GLU A 19 -11.209 -6.820 3.911 1.00 34.21 H new ATOM 0 HB2 GLU A 19 -10.853 -4.569 2.979 1.00 22.24 H new ATOM 0 HB3 GLU A 19 -9.147 -4.893 2.743 1.00 22.24 H new ATOM 0 HG2 GLU A 19 -10.147 -4.984 0.588 1.00 45.31 H new ATOM 0 HG3 GLU A 19 -9.781 -6.642 1.023 1.00 45.31 H new ATOM 311 N ILE A 20 -9.767 -8.512 2.636 1.00 62.25 N ATOM 312 CA ILE A 20 -9.001 -9.596 2.042 1.00 25.22 C ATOM 313 C ILE A 20 -8.261 -9.036 0.800 1.00 14.24 C ATOM 314 O ILE A 20 -8.842 -8.880 -0.279 1.00 42.32 O ATOM 315 CB ILE A 20 -9.965 -10.791 1.675 1.00 61.12 C ATOM 316 CG1 ILE A 20 -10.648 -11.367 2.954 1.00 44.43 C ATOM 317 CG2 ILE A 20 -9.243 -11.908 0.905 1.00 72.11 C ATOM 318 CD1 ILE A 20 -9.687 -11.973 3.972 1.00 72.51 C ATOM 0 H ILE A 20 -10.744 -8.503 2.343 1.00 62.25 H new ATOM 0 HA ILE A 20 -8.262 -9.987 2.742 1.00 25.22 H new ATOM 0 HB ILE A 20 -10.733 -10.386 1.016 1.00 61.12 H new ATOM 0 HG12 ILE A 20 -11.213 -10.570 3.438 1.00 44.43 H new ATOM 0 HG13 ILE A 20 -11.366 -12.130 2.654 1.00 44.43 H new ATOM 0 HG21 ILE A 20 -9.949 -12.707 0.676 1.00 72.11 H new ATOM 0 HG22 ILE A 20 -8.836 -11.506 -0.023 1.00 72.11 H new ATOM 0 HG23 ILE A 20 -8.432 -12.305 1.515 1.00 72.11 H new ATOM 0 HD11 ILE A 20 -10.251 -12.347 4.827 1.00 72.51 H new ATOM 0 HD12 ILE A 20 -9.139 -12.795 3.511 1.00 72.51 H new ATOM 0 HD13 ILE A 20 -8.984 -11.211 4.307 1.00 72.51 H new ATOM 330 N LEU A 21 -7.000 -8.645 1.015 1.00 44.22 N ATOM 331 CA LEU A 21 -6.124 -8.072 -0.026 1.00 62.12 C ATOM 332 C LEU A 21 -5.024 -9.083 -0.376 1.00 64.23 C ATOM 333 O LEU A 21 -4.539 -9.793 0.507 1.00 53.43 O ATOM 334 CB LEU A 21 -5.470 -6.763 0.486 1.00 3.44 C ATOM 335 CG LEU A 21 -6.426 -5.613 0.926 1.00 71.30 C ATOM 336 CD1 LEU A 21 -5.653 -4.494 1.652 1.00 15.10 C ATOM 337 CD2 LEU A 21 -7.197 -5.045 -0.271 1.00 3.11 C ATOM 0 H LEU A 21 -6.549 -8.716 1.927 1.00 44.22 H new ATOM 0 HA LEU A 21 -6.721 -7.850 -0.910 1.00 62.12 H new ATOM 0 HB2 LEU A 21 -4.831 -7.014 1.333 1.00 3.44 H new ATOM 0 HB3 LEU A 21 -4.821 -6.380 -0.301 1.00 3.44 H new ATOM 0 HG LEU A 21 -7.148 -6.036 1.625 1.00 71.30 H new ATOM 0 HD11 LEU A 21 -6.346 -3.706 1.947 1.00 15.10 H new ATOM 0 HD12 LEU A 21 -5.169 -4.903 2.539 1.00 15.10 H new ATOM 0 HD13 LEU A 21 -4.897 -4.081 0.984 1.00 15.10 H new ATOM 0 HD21 LEU A 21 -7.856 -4.245 0.067 1.00 3.11 H new ATOM 0 HD22 LEU A 21 -6.493 -4.650 -1.003 1.00 3.11 H new ATOM 0 HD23 LEU A 21 -7.792 -5.835 -0.729 1.00 3.11 H new ATOM 349 N ILE A 22 -4.603 -9.117 -1.648 1.00 44.21 N ATOM 350 CA ILE A 22 -3.560 -10.054 -2.103 1.00 70.43 C ATOM 351 C ILE A 22 -2.197 -9.336 -2.144 1.00 50.45 C ATOM 352 O ILE A 22 -1.990 -8.414 -2.930 1.00 3.41 O ATOM 353 CB ILE A 22 -3.921 -10.681 -3.507 1.00 61.24 C ATOM 354 CG1 ILE A 22 -5.197 -11.571 -3.371 1.00 74.53 C ATOM 355 CG2 ILE A 22 -2.735 -11.482 -4.098 1.00 63.23 C ATOM 356 CD1 ILE A 22 -5.654 -12.279 -4.639 1.00 54.11 C ATOM 0 H ILE A 22 -4.967 -8.508 -2.381 1.00 44.21 H new ATOM 0 HA ILE A 22 -3.499 -10.879 -1.393 1.00 70.43 H new ATOM 0 HB ILE A 22 -4.129 -9.870 -4.205 1.00 61.24 H new ATOM 0 HG12 ILE A 22 -5.011 -12.324 -2.605 1.00 74.53 H new ATOM 0 HG13 ILE A 22 -6.015 -10.946 -3.012 1.00 74.53 H new ATOM 0 HG21 ILE A 22 -3.022 -11.898 -5.064 1.00 63.23 H new ATOM 0 HG22 ILE A 22 -1.878 -10.821 -4.228 1.00 63.23 H new ATOM 0 HG23 ILE A 22 -2.469 -12.292 -3.419 1.00 63.23 H new ATOM 0 HD11 ILE A 22 -6.547 -12.867 -4.426 1.00 54.11 H new ATOM 0 HD12 ILE A 22 -5.881 -11.540 -5.407 1.00 54.11 H new ATOM 0 HD13 ILE A 22 -4.862 -12.938 -4.993 1.00 54.11 H new ATOM 368 N LYS A 23 -1.282 -9.790 -1.279 1.00 63.44 N ATOM 369 CA LYS A 23 0.079 -9.253 -1.173 1.00 61.53 C ATOM 370 C LYS A 23 0.986 -9.927 -2.223 1.00 33.33 C ATOM 371 O LYS A 23 1.046 -11.160 -2.303 1.00 62.22 O ATOM 372 CB LYS A 23 0.636 -9.535 0.254 1.00 4.12 C ATOM 373 CG LYS A 23 2.124 -9.144 0.458 1.00 52.43 C ATOM 374 CD LYS A 23 2.755 -9.794 1.713 1.00 74.21 C ATOM 375 CE LYS A 23 4.280 -9.565 1.793 1.00 3.12 C ATOM 376 NZ LYS A 23 4.993 -10.038 0.560 1.00 74.33 N ATOM 0 H LYS A 23 -1.469 -10.550 -0.625 1.00 63.44 H new ATOM 0 HA LYS A 23 0.060 -8.178 -1.351 1.00 61.53 H new ATOM 0 HB2 LYS A 23 0.029 -8.993 0.980 1.00 4.12 H new ATOM 0 HB3 LYS A 23 0.520 -10.597 0.471 1.00 4.12 H new ATOM 0 HG2 LYS A 23 2.695 -9.438 -0.423 1.00 52.43 H new ATOM 0 HG3 LYS A 23 2.201 -8.060 0.540 1.00 52.43 H new ATOM 0 HD2 LYS A 23 2.282 -9.386 2.606 1.00 74.21 H new ATOM 0 HD3 LYS A 23 2.551 -10.865 1.705 1.00 74.21 H new ATOM 0 HE2 LYS A 23 4.478 -8.503 1.940 1.00 3.12 H new ATOM 0 HE3 LYS A 23 4.678 -10.087 2.663 1.00 3.12 H new ATOM 0 HZ1 LYS A 23 6.019 -10.038 0.731 1.00 74.33 H new ATOM 0 HZ2 LYS A 23 4.681 -11.002 0.327 1.00 74.33 H new ATOM 0 HZ3 LYS A 23 4.774 -9.402 -0.233 1.00 74.33 H new ATOM 390 N ARG A 24 1.690 -9.110 -3.013 1.00 15.23 N ATOM 391 CA ARG A 24 2.690 -9.590 -3.978 1.00 51.11 C ATOM 392 C ARG A 24 4.037 -9.802 -3.252 1.00 23.40 C ATOM 393 O ARG A 24 4.306 -9.165 -2.220 1.00 51.13 O ATOM 394 CB ARG A 24 2.853 -8.562 -5.135 1.00 32.43 C ATOM 395 CG ARG A 24 3.694 -9.060 -6.334 1.00 21.14 C ATOM 396 CD ARG A 24 3.935 -7.969 -7.405 1.00 42.22 C ATOM 397 NE ARG A 24 4.315 -8.553 -8.705 1.00 21.10 N ATOM 398 CZ ARG A 24 4.896 -7.891 -9.730 1.00 73.52 C ATOM 399 NH1 ARG A 24 5.202 -6.601 -9.638 1.00 61.31 N ATOM 400 NH2 ARG A 24 5.125 -8.536 -10.860 1.00 14.33 N ATOM 0 H ARG A 24 1.584 -8.096 -3.003 1.00 15.23 H new ATOM 0 HA ARG A 24 2.360 -10.537 -4.405 1.00 51.11 H new ATOM 0 HB2 ARG A 24 1.863 -8.282 -5.495 1.00 32.43 H new ATOM 0 HB3 ARG A 24 3.314 -7.658 -4.737 1.00 32.43 H new ATOM 0 HG2 ARG A 24 4.656 -9.421 -5.970 1.00 21.14 H new ATOM 0 HG3 ARG A 24 3.189 -9.908 -6.796 1.00 21.14 H new ATOM 0 HD2 ARG A 24 3.031 -7.371 -7.525 1.00 42.22 H new ATOM 0 HD3 ARG A 24 4.721 -7.294 -7.066 1.00 42.22 H new ATOM 0 HE ARG A 24 4.122 -9.545 -8.843 1.00 21.10 H new ATOM 0 HH11 ARG A 24 4.999 -6.089 -8.780 1.00 61.31 H new ATOM 0 HH12 ARG A 24 5.640 -6.123 -10.426 1.00 61.31 H new ATOM 0 HH21 ARG A 24 4.864 -9.518 -10.949 1.00 14.33 H new ATOM 0 HH22 ARG A 24 5.563 -8.052 -11.644 1.00 14.33 H new ATOM 414 N SER A 25 4.864 -10.710 -3.782 1.00 71.41 N ATOM 415 CA SER A 25 6.236 -10.924 -3.318 1.00 75.42 C ATOM 416 C SER A 25 7.154 -10.486 -4.465 1.00 11.33 C ATOM 417 O SER A 25 7.252 -11.185 -5.476 1.00 40.20 O ATOM 418 CB SER A 25 6.441 -12.414 -2.960 1.00 45.01 C ATOM 419 OG SER A 25 5.453 -12.845 -2.036 1.00 62.34 O ATOM 0 H SER A 25 4.595 -11.322 -4.553 1.00 71.41 H new ATOM 0 HA SER A 25 6.458 -10.350 -2.418 1.00 75.42 H new ATOM 0 HB2 SER A 25 6.391 -13.021 -3.864 1.00 45.01 H new ATOM 0 HB3 SER A 25 7.434 -12.558 -2.533 1.00 45.01 H new ATOM 0 HG SER A 25 4.621 -13.041 -2.515 1.00 62.34 H new ATOM 583 N ASN A 35 5.185 -14.502 -5.969 1.00 13.21 N ATOM 584 CA ASN A 35 4.002 -15.169 -5.438 1.00 42.11 C ATOM 585 C ASN A 35 2.977 -14.096 -5.047 1.00 30.24 C ATOM 586 O ASN A 35 3.287 -13.170 -4.288 1.00 1.23 O ATOM 587 CB ASN A 35 4.389 -16.045 -4.203 1.00 75.25 C ATOM 588 CG ASN A 35 3.344 -17.119 -3.792 1.00 22.10 C ATOM 589 OD1 ASN A 35 2.052 -16.908 -4.040 1.00 61.43 O flip ATOM 590 ND2 ASN A 35 3.711 -18.163 -3.243 1.00 24.50 N flip ATOM 0 HA ASN A 35 3.570 -15.828 -6.191 1.00 42.11 H new ATOM 0 HB2 ASN A 35 5.334 -16.545 -4.416 1.00 75.25 H new ATOM 0 HB3 ASN A 35 4.562 -15.386 -3.352 1.00 75.25 H new ATOM 0 HD21 ASN A 35 4.701 -18.320 -3.055 1.00 24.50 H new ATOM 0 HD22 ASN A 35 3.024 -18.868 -2.977 1.00 24.50 H new ATOM 597 N TYR A 36 1.768 -14.236 -5.583 1.00 50.35 N ATOM 598 CA TYR A 36 0.600 -13.472 -5.166 1.00 22.14 C ATOM 599 C TYR A 36 -0.108 -14.317 -4.120 1.00 11.13 C ATOM 600 O TYR A 36 -0.717 -15.341 -4.448 1.00 61.43 O ATOM 601 CB TYR A 36 -0.316 -13.181 -6.386 1.00 11.12 C ATOM 602 CG TYR A 36 0.359 -12.304 -7.445 1.00 71.14 C ATOM 603 CD1 TYR A 36 1.338 -12.826 -8.301 1.00 21.20 C ATOM 604 CD2 TYR A 36 0.044 -10.953 -7.573 1.00 33.22 C ATOM 605 CE1 TYR A 36 1.975 -12.033 -9.231 1.00 40.11 C ATOM 606 CE2 TYR A 36 0.674 -10.164 -8.513 1.00 51.33 C ATOM 607 CZ TYR A 36 1.639 -10.705 -9.335 1.00 2.41 C ATOM 608 OH TYR A 36 2.284 -9.904 -10.250 1.00 0.31 O ATOM 0 H TYR A 36 1.571 -14.897 -6.334 1.00 50.35 H new ATOM 0 HA TYR A 36 0.875 -12.503 -4.750 1.00 22.14 H new ATOM 0 HB2 TYR A 36 -0.616 -14.125 -6.841 1.00 11.12 H new ATOM 0 HB3 TYR A 36 -1.226 -12.690 -6.041 1.00 11.12 H new ATOM 0 HD1 TYR A 36 1.599 -13.872 -8.230 1.00 21.20 H new ATOM 0 HD2 TYR A 36 -0.704 -10.517 -6.927 1.00 33.22 H new ATOM 0 HE1 TYR A 36 2.734 -12.453 -9.874 1.00 40.11 H new ATOM 0 HE2 TYR A 36 0.411 -9.121 -8.605 1.00 51.33 H new ATOM 0 HH TYR A 36 1.927 -8.993 -10.196 1.00 0.31 H new ATOM 618 N LYS A 37 0.054 -13.932 -2.855 1.00 33.13 N ATOM 619 CA LYS A 37 -0.501 -14.663 -1.713 1.00 43.32 C ATOM 620 C LYS A 37 -1.527 -13.772 -1.008 1.00 20.51 C ATOM 621 O LYS A 37 -1.295 -12.575 -0.828 1.00 5.12 O ATOM 622 CB LYS A 37 0.640 -15.114 -0.757 1.00 54.24 C ATOM 623 CG LYS A 37 0.175 -15.998 0.428 1.00 33.33 C ATOM 624 CD LYS A 37 -0.565 -17.290 -0.005 1.00 1.14 C ATOM 625 CE LYS A 37 0.317 -18.276 -0.788 1.00 71.02 C ATOM 626 NZ LYS A 37 -0.487 -19.410 -1.323 1.00 43.53 N ATOM 0 H LYS A 37 0.578 -13.098 -2.590 1.00 33.13 H new ATOM 0 HA LYS A 37 -1.007 -15.567 -2.051 1.00 43.32 H new ATOM 0 HB2 LYS A 37 1.384 -15.664 -1.334 1.00 54.24 H new ATOM 0 HB3 LYS A 37 1.136 -14.228 -0.360 1.00 54.24 H new ATOM 0 HG2 LYS A 37 1.043 -16.272 1.027 1.00 33.33 H new ATOM 0 HG3 LYS A 37 -0.483 -15.412 1.070 1.00 33.33 H new ATOM 0 HD2 LYS A 37 -0.954 -17.790 0.882 1.00 1.14 H new ATOM 0 HD3 LYS A 37 -1.423 -17.018 -0.619 1.00 1.14 H new ATOM 0 HE2 LYS A 37 0.808 -17.755 -1.610 1.00 71.02 H new ATOM 0 HE3 LYS A 37 1.104 -18.659 -0.138 1.00 71.02 H new ATOM 0 HZ1 LYS A 37 0.134 -20.059 -1.847 1.00 43.53 H new ATOM 0 HZ2 LYS A 37 -0.935 -19.920 -0.535 1.00 43.53 H new ATOM 0 HZ3 LYS A 37 -1.222 -19.044 -1.961 1.00 43.53 H new ATOM 640 N GLU A 38 -2.636 -14.384 -0.577 1.00 4.33 N ATOM 641 CA GLU A 38 -3.833 -13.667 -0.119 1.00 42.54 C ATOM 642 C GLU A 38 -3.811 -13.528 1.420 1.00 31.31 C ATOM 643 O GLU A 38 -3.610 -14.510 2.143 1.00 2.53 O ATOM 644 CB GLU A 38 -5.087 -14.420 -0.621 1.00 23.31 C ATOM 645 CG GLU A 38 -6.420 -13.706 -0.357 1.00 50.01 C ATOM 646 CD GLU A 38 -7.609 -14.421 -1.012 1.00 70.34 C ATOM 647 OE1 GLU A 38 -8.184 -15.334 -0.386 1.00 3.15 O ATOM 648 OE2 GLU A 38 -7.961 -14.091 -2.168 1.00 13.42 O ATOM 0 H GLU A 38 -2.729 -15.399 -0.536 1.00 4.33 H new ATOM 0 HA GLU A 38 -3.854 -12.657 -0.529 1.00 42.54 H new ATOM 0 HB2 GLU A 38 -4.987 -14.587 -1.694 1.00 23.31 H new ATOM 0 HB3 GLU A 38 -5.117 -15.401 -0.147 1.00 23.31 H new ATOM 0 HG2 GLU A 38 -6.587 -13.641 0.718 1.00 50.01 H new ATOM 0 HG3 GLU A 38 -6.362 -12.685 -0.733 1.00 50.01 H new ATOM 655 N ARG A 39 -3.983 -12.284 1.894 1.00 31.43 N ATOM 656 CA ARG A 39 -3.834 -11.889 3.316 1.00 45.14 C ATOM 657 C ARG A 39 -5.111 -11.171 3.795 1.00 53.41 C ATOM 658 O ARG A 39 -5.834 -10.562 2.999 1.00 43.41 O ATOM 659 CB ARG A 39 -2.618 -10.914 3.502 1.00 42.54 C ATOM 660 CG ARG A 39 -1.215 -11.541 3.658 1.00 2.44 C ATOM 661 CD ARG A 39 -0.744 -12.434 2.484 1.00 15.52 C ATOM 662 NE ARG A 39 0.728 -12.588 2.432 1.00 41.13 N ATOM 663 CZ ARG A 39 1.514 -13.100 3.402 1.00 43.54 C ATOM 664 NH1 ARG A 39 1.016 -13.543 4.551 1.00 33.13 N ATOM 665 NH2 ARG A 39 2.823 -13.151 3.215 1.00 14.31 N ATOM 0 H ARG A 39 -4.236 -11.502 1.290 1.00 31.43 H new ATOM 0 HA ARG A 39 -3.664 -12.794 3.900 1.00 45.14 H new ATOM 0 HB2 ARG A 39 -2.592 -10.242 2.644 1.00 42.54 H new ATOM 0 HB3 ARG A 39 -2.811 -10.300 4.382 1.00 42.54 H new ATOM 0 HG2 ARG A 39 -0.491 -10.737 3.792 1.00 2.44 H new ATOM 0 HG3 ARG A 39 -1.203 -12.137 4.571 1.00 2.44 H new ATOM 0 HD2 ARG A 39 -1.204 -13.418 2.575 1.00 15.52 H new ATOM 0 HD3 ARG A 39 -1.093 -12.005 1.545 1.00 15.52 H new ATOM 0 HE ARG A 39 1.193 -12.277 1.579 1.00 41.13 H new ATOM 0 HH11 ARG A 39 0.011 -13.502 4.721 1.00 33.13 H new ATOM 0 HH12 ARG A 39 1.639 -13.924 5.263 1.00 33.13 H new ATOM 0 HH21 ARG A 39 3.228 -12.805 2.345 1.00 14.31 H new ATOM 0 HH22 ARG A 39 3.427 -13.536 3.941 1.00 14.31 H new ATOM 679 N LEU A 40 -5.365 -11.249 5.109 1.00 63.33 N ATOM 680 CA LEU A 40 -6.329 -10.380 5.800 1.00 4.41 C ATOM 681 C LEU A 40 -5.561 -9.178 6.385 1.00 71.21 C ATOM 682 O LEU A 40 -4.893 -9.306 7.418 1.00 4.00 O ATOM 683 CB LEU A 40 -7.082 -11.163 6.915 1.00 23.53 C ATOM 684 CG LEU A 40 -8.077 -10.329 7.801 1.00 73.04 C ATOM 685 CD1 LEU A 40 -9.181 -9.652 6.960 1.00 11.51 C ATOM 686 CD2 LEU A 40 -8.684 -11.207 8.912 1.00 45.31 C ATOM 0 H LEU A 40 -4.906 -11.920 5.725 1.00 63.33 H new ATOM 0 HA LEU A 40 -7.083 -10.026 5.096 1.00 4.41 H new ATOM 0 HB2 LEU A 40 -7.639 -11.975 6.447 1.00 23.53 H new ATOM 0 HB3 LEU A 40 -6.342 -11.621 7.571 1.00 23.53 H new ATOM 0 HG LEU A 40 -7.502 -9.530 8.269 1.00 73.04 H new ATOM 0 HD11 LEU A 40 -9.844 -9.088 7.616 1.00 11.51 H new ATOM 0 HD12 LEU A 40 -8.725 -8.976 6.237 1.00 11.51 H new ATOM 0 HD13 LEU A 40 -9.755 -10.414 6.433 1.00 11.51 H new ATOM 0 HD21 LEU A 40 -9.370 -10.610 9.514 1.00 45.31 H new ATOM 0 HD22 LEU A 40 -9.226 -12.039 8.463 1.00 45.31 H new ATOM 0 HD23 LEU A 40 -7.887 -11.593 9.547 1.00 45.31 H new ATOM 698 N PHE A 41 -5.603 -8.041 5.677 1.00 23.00 N ATOM 699 CA PHE A 41 -4.991 -6.785 6.144 1.00 45.04 C ATOM 700 C PHE A 41 -5.988 -6.039 7.053 1.00 52.45 C ATOM 701 O PHE A 41 -7.068 -5.657 6.607 1.00 23.11 O ATOM 702 CB PHE A 41 -4.571 -5.880 4.947 1.00 52.21 C ATOM 703 CG PHE A 41 -3.245 -6.248 4.272 1.00 1.01 C ATOM 704 CD1 PHE A 41 -3.180 -7.219 3.270 1.00 41.22 C ATOM 705 CD2 PHE A 41 -2.058 -5.605 4.636 1.00 13.42 C ATOM 706 CE1 PHE A 41 -1.977 -7.534 2.660 1.00 54.23 C ATOM 707 CE2 PHE A 41 -0.858 -5.921 4.024 1.00 64.11 C ATOM 708 CZ PHE A 41 -0.817 -6.888 3.037 1.00 4.01 C ATOM 0 H PHE A 41 -6.060 -7.964 4.768 1.00 23.00 H new ATOM 0 HA PHE A 41 -4.090 -7.026 6.708 1.00 45.04 H new ATOM 0 HB2 PHE A 41 -5.361 -5.911 4.197 1.00 52.21 H new ATOM 0 HB3 PHE A 41 -4.506 -4.850 5.299 1.00 52.21 H new ATOM 0 HD1 PHE A 41 -4.081 -7.732 2.966 1.00 41.22 H new ATOM 0 HD2 PHE A 41 -2.078 -4.849 5.407 1.00 13.42 H new ATOM 0 HE1 PHE A 41 -1.947 -8.288 1.887 1.00 54.23 H new ATOM 0 HE2 PHE A 41 0.048 -5.412 4.318 1.00 64.11 H new ATOM 0 HZ PHE A 41 0.120 -7.137 2.562 1.00 4.01 H new ATOM 718 N VAL A 42 -5.619 -5.881 8.330 1.00 74.24 N ATOM 719 CA VAL A 42 -6.355 -5.079 9.315 1.00 30.22 C ATOM 720 C VAL A 42 -5.504 -3.850 9.671 1.00 65.33 C ATOM 721 O VAL A 42 -4.354 -3.994 10.096 1.00 34.50 O ATOM 722 CB VAL A 42 -6.672 -5.913 10.618 1.00 50.42 C ATOM 723 CG1 VAL A 42 -7.377 -5.048 11.694 1.00 71.43 C ATOM 724 CG2 VAL A 42 -7.505 -7.170 10.276 1.00 72.42 C ATOM 0 H VAL A 42 -4.782 -6.317 8.716 1.00 74.24 H new ATOM 0 HA VAL A 42 -7.308 -4.773 8.885 1.00 30.22 H new ATOM 0 HB VAL A 42 -5.722 -6.240 11.040 1.00 50.42 H new ATOM 0 HG11 VAL A 42 -7.579 -5.657 12.575 1.00 71.43 H new ATOM 0 HG12 VAL A 42 -6.733 -4.213 11.969 1.00 71.43 H new ATOM 0 HG13 VAL A 42 -8.316 -4.665 11.295 1.00 71.43 H new ATOM 0 HG21 VAL A 42 -7.711 -7.729 11.189 1.00 72.42 H new ATOM 0 HG22 VAL A 42 -8.445 -6.869 9.814 1.00 72.42 H new ATOM 0 HG23 VAL A 42 -6.946 -7.799 9.583 1.00 72.42 H new ATOM 734 N LEU A 43 -6.073 -2.655 9.494 1.00 70.42 N ATOM 735 CA LEU A 43 -5.403 -1.377 9.781 1.00 51.32 C ATOM 736 C LEU A 43 -5.941 -0.821 11.100 1.00 31.31 C ATOM 737 O LEU A 43 -7.127 -0.535 11.201 1.00 32.05 O ATOM 738 CB LEU A 43 -5.672 -0.366 8.629 1.00 34.05 C ATOM 739 CG LEU A 43 -5.166 1.103 8.851 1.00 63.41 C ATOM 740 CD1 LEU A 43 -3.628 1.181 8.918 1.00 61.04 C ATOM 741 CD2 LEU A 43 -5.744 2.055 7.783 1.00 43.15 C ATOM 0 H LEU A 43 -7.024 -2.543 9.143 1.00 70.42 H new ATOM 0 HA LEU A 43 -4.328 -1.536 9.861 1.00 51.32 H new ATOM 0 HB2 LEU A 43 -5.208 -0.753 7.721 1.00 34.05 H new ATOM 0 HB3 LEU A 43 -6.746 -0.333 8.449 1.00 34.05 H new ATOM 0 HG LEU A 43 -5.536 1.433 9.822 1.00 63.41 H new ATOM 0 HD11 LEU A 43 -3.323 2.216 9.072 1.00 61.04 H new ATOM 0 HD12 LEU A 43 -3.268 0.569 9.745 1.00 61.04 H new ATOM 0 HD13 LEU A 43 -3.204 0.813 7.984 1.00 61.04 H new ATOM 0 HD21 LEU A 43 -5.377 3.066 7.960 1.00 43.15 H new ATOM 0 HD22 LEU A 43 -5.431 1.724 6.793 1.00 43.15 H new ATOM 0 HD23 LEU A 43 -6.832 2.048 7.840 1.00 43.15 H new ATOM 753 N THR A 44 -5.082 -0.717 12.113 1.00 72.23 N ATOM 754 CA THR A 44 -5.390 0.018 13.351 1.00 24.42 C ATOM 755 C THR A 44 -4.826 1.446 13.251 1.00 71.13 C ATOM 756 O THR A 44 -4.145 1.789 12.273 1.00 23.02 O ATOM 757 CB THR A 44 -4.809 -0.715 14.607 1.00 0.30 C ATOM 758 OG1 THR A 44 -3.385 -0.866 14.480 1.00 11.30 O ATOM 759 CG2 THR A 44 -5.458 -2.097 14.813 1.00 42.21 C ATOM 0 H THR A 44 -4.153 -1.137 12.104 1.00 72.23 H new ATOM 0 HA THR A 44 -6.473 0.063 13.470 1.00 24.42 H new ATOM 0 HB THR A 44 -5.037 -0.100 15.478 1.00 0.30 H new ATOM 0 HG1 THR A 44 -3.033 -1.324 15.272 1.00 11.30 H new ATOM 0 HG21 THR A 44 -5.028 -2.573 15.694 1.00 42.21 H new ATOM 0 HG22 THR A 44 -6.532 -1.977 14.953 1.00 42.21 H new ATOM 0 HG23 THR A 44 -5.274 -2.720 13.938 1.00 42.21 H new ATOM 767 N LYS A 45 -5.087 2.270 14.278 1.00 21.32 N ATOM 768 CA LYS A 45 -4.637 3.683 14.315 1.00 65.21 C ATOM 769 C LYS A 45 -3.124 3.798 14.621 1.00 3.01 C ATOM 770 O LYS A 45 -2.559 4.900 14.597 1.00 62.11 O ATOM 771 CB LYS A 45 -5.454 4.478 15.369 1.00 24.22 C ATOM 772 CG LYS A 45 -6.989 4.335 15.234 1.00 51.01 C ATOM 773 CD LYS A 45 -7.763 5.202 16.260 1.00 70.31 C ATOM 774 CE LYS A 45 -7.489 4.795 17.722 1.00 2.35 C ATOM 775 NZ LYS A 45 -8.144 5.728 18.689 1.00 32.45 N ATOM 0 H LYS A 45 -5.612 1.984 15.104 1.00 21.32 H new ATOM 0 HA LYS A 45 -4.809 4.108 13.326 1.00 65.21 H new ATOM 0 HB2 LYS A 45 -5.157 4.148 16.364 1.00 24.22 H new ATOM 0 HB3 LYS A 45 -5.192 5.533 15.292 1.00 24.22 H new ATOM 0 HG2 LYS A 45 -7.289 4.619 14.225 1.00 51.01 H new ATOM 0 HG3 LYS A 45 -7.265 3.289 15.366 1.00 51.01 H new ATOM 0 HD2 LYS A 45 -7.490 6.248 16.123 1.00 70.31 H new ATOM 0 HD3 LYS A 45 -8.832 5.123 16.061 1.00 70.31 H new ATOM 0 HE2 LYS A 45 -7.852 3.781 17.892 1.00 2.35 H new ATOM 0 HE3 LYS A 45 -6.414 4.782 17.901 1.00 2.35 H new ATOM 0 HZ1 LYS A 45 -7.937 5.422 19.661 1.00 32.45 H new ATOM 0 HZ2 LYS A 45 -7.779 6.691 18.544 1.00 32.45 H new ATOM 0 HZ3 LYS A 45 -9.173 5.721 18.535 1.00 32.45 H new ATOM 789 N SER A 46 -2.483 2.652 14.922 1.00 52.43 N ATOM 790 CA SER A 46 -1.064 2.584 15.301 1.00 2.05 C ATOM 791 C SER A 46 -0.244 1.772 14.277 1.00 53.14 C ATOM 792 O SER A 46 0.893 2.131 13.969 1.00 3.34 O ATOM 793 CB SER A 46 -0.951 1.942 16.706 1.00 70.21 C ATOM 794 OG SER A 46 -1.717 2.661 17.662 1.00 31.24 O ATOM 0 H SER A 46 -2.942 1.741 14.908 1.00 52.43 H new ATOM 0 HA SER A 46 -0.656 3.595 15.317 1.00 2.05 H new ATOM 0 HB2 SER A 46 -1.293 0.908 16.665 1.00 70.21 H new ATOM 0 HB3 SER A 46 0.094 1.920 17.016 1.00 70.21 H new ATOM 0 HG SER A 46 -1.629 2.234 18.540 1.00 31.24 H new ATOM 800 N MET A 47 -0.832 0.679 13.741 1.00 3.22 N ATOM 801 CA MET A 47 -0.111 -0.282 12.861 1.00 73.44 C ATOM 802 C MET A 47 -1.031 -0.819 11.741 1.00 61.35 C ATOM 803 O MET A 47 -2.227 -0.526 11.704 1.00 10.10 O ATOM 804 CB MET A 47 0.457 -1.479 13.697 1.00 23.44 C ATOM 805 CG MET A 47 1.474 -1.097 14.789 1.00 5.33 C ATOM 806 SD MET A 47 1.983 -2.495 15.811 1.00 23.33 S ATOM 807 CE MET A 47 0.415 -3.060 16.470 1.00 74.21 C ATOM 0 H MET A 47 -1.809 0.435 13.901 1.00 3.22 H new ATOM 0 HA MET A 47 0.717 0.256 12.399 1.00 73.44 H new ATOM 0 HB2 MET A 47 -0.377 -2.000 14.167 1.00 23.44 H new ATOM 0 HB3 MET A 47 0.930 -2.185 13.014 1.00 23.44 H new ATOM 0 HG2 MET A 47 2.355 -0.660 14.319 1.00 5.33 H new ATOM 0 HG3 MET A 47 1.039 -0.328 15.428 1.00 5.33 H new ATOM 0 HE1 MET A 47 0.588 -3.630 17.383 1.00 74.21 H new ATOM 0 HE2 MET A 47 -0.217 -2.200 16.693 1.00 74.21 H new ATOM 0 HE3 MET A 47 -0.081 -3.694 15.735 1.00 74.21 H new ATOM 817 N LEU A 48 -0.434 -1.626 10.846 1.00 73.04 N ATOM 818 CA LEU A 48 -1.126 -2.315 9.742 1.00 54.34 C ATOM 819 C LEU A 48 -0.665 -3.784 9.745 1.00 64.43 C ATOM 820 O LEU A 48 0.438 -4.104 9.298 1.00 23.11 O ATOM 821 CB LEU A 48 -0.812 -1.619 8.379 1.00 71.13 C ATOM 822 CG LEU A 48 -1.300 -2.355 7.080 1.00 64.23 C ATOM 823 CD1 LEU A 48 -2.826 -2.588 7.084 1.00 21.32 C ATOM 824 CD2 LEU A 48 -0.853 -1.593 5.812 1.00 13.14 C ATOM 0 H LEU A 48 0.567 -1.822 10.871 1.00 73.04 H new ATOM 0 HA LEU A 48 -2.207 -2.269 9.877 1.00 54.34 H new ATOM 0 HB2 LEU A 48 -1.258 -0.625 8.394 1.00 71.13 H new ATOM 0 HB3 LEU A 48 0.267 -1.483 8.307 1.00 71.13 H new ATOM 0 HG LEU A 48 -0.829 -3.338 7.069 1.00 64.23 H new ATOM 0 HD11 LEU A 48 -3.118 -3.100 6.167 1.00 21.32 H new ATOM 0 HD12 LEU A 48 -3.098 -3.200 7.944 1.00 21.32 H new ATOM 0 HD13 LEU A 48 -3.340 -1.629 7.144 1.00 21.32 H new ATOM 0 HD21 LEU A 48 -1.203 -2.123 4.926 1.00 13.14 H new ATOM 0 HD22 LEU A 48 -1.275 -0.588 5.824 1.00 13.14 H new ATOM 0 HD23 LEU A 48 0.235 -1.530 5.790 1.00 13.14 H new ATOM 836 N THR A 49 -1.512 -4.656 10.280 1.00 1.02 N ATOM 837 CA THR A 49 -1.206 -6.077 10.477 1.00 74.10 C ATOM 838 C THR A 49 -1.800 -6.914 9.332 1.00 25.41 C ATOM 839 O THR A 49 -2.900 -6.615 8.868 1.00 54.44 O ATOM 840 CB THR A 49 -1.799 -6.542 11.851 1.00 42.15 C ATOM 841 OG1 THR A 49 -1.438 -5.594 12.874 1.00 2.51 O ATOM 842 CG2 THR A 49 -1.322 -7.942 12.272 1.00 45.53 C ATOM 0 H THR A 49 -2.447 -4.396 10.596 1.00 1.02 H new ATOM 0 HA THR A 49 -0.125 -6.219 10.479 1.00 74.10 H new ATOM 0 HB THR A 49 -2.881 -6.593 11.728 1.00 42.15 H new ATOM 0 HG1 THR A 49 -1.810 -5.883 13.734 1.00 2.51 H new ATOM 0 HG21 THR A 49 -1.768 -8.205 13.231 1.00 45.53 H new ATOM 0 HG22 THR A 49 -1.623 -8.671 11.519 1.00 45.53 H new ATOM 0 HG23 THR A 49 -0.236 -7.944 12.364 1.00 45.53 H new ATOM 850 N TYR A 50 -1.078 -7.950 8.871 1.00 13.13 N ATOM 851 CA TYR A 50 -1.625 -8.895 7.879 1.00 60.24 C ATOM 852 C TYR A 50 -1.452 -10.339 8.350 1.00 32.40 C ATOM 853 O TYR A 50 -0.370 -10.744 8.783 1.00 22.14 O ATOM 854 CB TYR A 50 -1.033 -8.682 6.465 1.00 0.43 C ATOM 855 CG TYR A 50 0.495 -8.801 6.321 1.00 60.43 C ATOM 856 CD1 TYR A 50 1.330 -7.714 6.589 1.00 31.31 C ATOM 857 CD2 TYR A 50 1.102 -9.984 5.873 1.00 63.53 C ATOM 858 CE1 TYR A 50 2.697 -7.804 6.425 1.00 32.43 C ATOM 859 CE2 TYR A 50 2.468 -10.072 5.702 1.00 54.01 C ATOM 860 CZ TYR A 50 3.263 -8.984 5.977 1.00 43.45 C ATOM 861 OH TYR A 50 4.628 -9.076 5.802 1.00 63.24 O ATOM 0 H TYR A 50 -0.123 -8.154 9.165 1.00 13.13 H new ATOM 0 HA TYR A 50 -2.692 -8.690 7.797 1.00 60.24 H new ATOM 0 HB2 TYR A 50 -1.494 -9.406 5.793 1.00 0.43 H new ATOM 0 HB3 TYR A 50 -1.330 -7.692 6.119 1.00 0.43 H new ATOM 0 HD1 TYR A 50 0.897 -6.785 6.931 1.00 31.31 H new ATOM 0 HD2 TYR A 50 0.486 -10.845 5.657 1.00 63.53 H new ATOM 0 HE1 TYR A 50 3.325 -6.954 6.646 1.00 32.43 H new ATOM 0 HE2 TYR A 50 2.912 -10.993 5.353 1.00 54.01 H new ATOM 0 HH TYR A 50 4.857 -9.974 5.484 1.00 63.24 H new ATOM 871 N TYR A 51 -2.552 -11.088 8.262 1.00 74.11 N ATOM 872 CA TYR A 51 -2.624 -12.492 8.672 1.00 22.05 C ATOM 873 C TYR A 51 -2.649 -13.379 7.422 1.00 31.01 C ATOM 874 O TYR A 51 -3.299 -13.030 6.433 1.00 15.32 O ATOM 875 CB TYR A 51 -3.917 -12.708 9.510 1.00 70.23 C ATOM 876 CG TYR A 51 -4.094 -11.678 10.641 1.00 61.51 C ATOM 877 CD1 TYR A 51 -3.460 -11.844 11.872 1.00 22.32 C ATOM 878 CD2 TYR A 51 -4.869 -10.523 10.465 1.00 61.43 C ATOM 879 CE1 TYR A 51 -3.589 -10.908 12.882 1.00 10.21 C ATOM 880 CE2 TYR A 51 -4.990 -9.583 11.468 1.00 51.30 C ATOM 881 CZ TYR A 51 -4.354 -9.779 12.674 1.00 42.04 C ATOM 882 OH TYR A 51 -4.464 -8.831 13.671 1.00 12.32 O ATOM 0 H TYR A 51 -3.434 -10.730 7.897 1.00 74.11 H new ATOM 0 HA TYR A 51 -1.756 -12.754 9.277 1.00 22.05 H new ATOM 0 HB2 TYR A 51 -4.782 -12.661 8.848 1.00 70.23 H new ATOM 0 HB3 TYR A 51 -3.899 -13.709 9.940 1.00 70.23 H new ATOM 0 HD1 TYR A 51 -2.855 -12.723 12.040 1.00 22.32 H new ATOM 0 HD2 TYR A 51 -5.381 -10.366 9.527 1.00 61.43 H new ATOM 0 HE1 TYR A 51 -3.093 -11.060 13.829 1.00 10.21 H new ATOM 0 HE2 TYR A 51 -5.583 -8.695 11.308 1.00 51.30 H new ATOM 0 HH TYR A 51 -5.037 -8.098 13.364 1.00 12.32 H new ATOM 1081 N PHE A 63 3.327 -7.101 10.979 1.00 73.32 N ATOM 1082 CA PHE A 63 2.702 -5.768 11.004 1.00 72.13 C ATOM 1083 C PHE A 63 3.718 -4.708 10.565 1.00 4.41 C ATOM 1084 O PHE A 63 4.931 -4.893 10.719 1.00 24.53 O ATOM 1085 CB PHE A 63 2.094 -5.436 12.406 1.00 13.22 C ATOM 1086 CG PHE A 63 3.066 -5.509 13.583 1.00 51.01 C ATOM 1087 CD1 PHE A 63 3.254 -6.703 14.284 1.00 30.33 C ATOM 1088 CD2 PHE A 63 3.784 -4.386 13.995 1.00 32.24 C ATOM 1089 CE1 PHE A 63 4.123 -6.767 15.358 1.00 34.10 C ATOM 1090 CE2 PHE A 63 4.652 -4.453 15.066 1.00 20.45 C ATOM 1091 CZ PHE A 63 4.824 -5.643 15.747 1.00 75.44 C ATOM 0 HA PHE A 63 1.871 -5.766 10.299 1.00 72.13 H new ATOM 0 HB2 PHE A 63 1.671 -4.432 12.370 1.00 13.22 H new ATOM 0 HB3 PHE A 63 1.269 -6.123 12.596 1.00 13.22 H new ATOM 0 HD1 PHE A 63 2.713 -7.588 13.983 1.00 30.33 H new ATOM 0 HD2 PHE A 63 3.659 -3.451 13.469 1.00 32.24 H new ATOM 0 HE1 PHE A 63 4.253 -7.696 15.892 1.00 34.10 H new ATOM 0 HE2 PHE A 63 5.198 -3.573 15.373 1.00 20.45 H new ATOM 0 HZ PHE A 63 5.506 -5.694 16.583 1.00 75.44 H new ATOM 1101 N ILE A 64 3.202 -3.589 10.048 1.00 73.21 N ATOM 1102 CA ILE A 64 3.996 -2.418 9.657 1.00 64.23 C ATOM 1103 C ILE A 64 3.399 -1.216 10.393 1.00 61.41 C ATOM 1104 O ILE A 64 2.201 -0.948 10.271 1.00 31.12 O ATOM 1105 CB ILE A 64 3.987 -2.153 8.096 1.00 62.31 C ATOM 1106 CG1 ILE A 64 4.531 -3.392 7.306 1.00 55.03 C ATOM 1107 CG2 ILE A 64 4.800 -0.876 7.748 1.00 62.12 C ATOM 1108 CD1 ILE A 64 4.522 -3.246 5.789 1.00 63.23 C ATOM 0 H ILE A 64 2.202 -3.468 9.886 1.00 73.21 H new ATOM 0 HA ILE A 64 5.039 -2.590 9.923 1.00 64.23 H new ATOM 0 HB ILE A 64 2.953 -1.992 7.792 1.00 62.31 H new ATOM 0 HG12 ILE A 64 5.553 -3.590 7.630 1.00 55.03 H new ATOM 0 HG13 ILE A 64 3.936 -4.265 7.575 1.00 55.03 H new ATOM 0 HG21 ILE A 64 4.780 -0.714 6.670 1.00 62.12 H new ATOM 0 HG22 ILE A 64 4.360 -0.016 8.252 1.00 62.12 H new ATOM 0 HG23 ILE A 64 5.832 -1.001 8.077 1.00 62.12 H new ATOM 0 HD11 ILE A 64 4.917 -4.154 5.334 1.00 63.23 H new ATOM 0 HD12 ILE A 64 3.501 -3.082 5.445 1.00 63.23 H new ATOM 0 HD13 ILE A 64 5.142 -2.397 5.501 1.00 63.23 H new ATOM 1120 N ASP A 65 4.239 -0.496 11.134 1.00 70.45 N ATOM 1121 CA ASP A 65 3.796 0.638 11.951 1.00 32.13 C ATOM 1122 C ASP A 65 3.468 1.817 11.021 1.00 25.23 C ATOM 1123 O ASP A 65 4.171 2.021 10.020 1.00 23.53 O ATOM 1124 CB ASP A 65 4.889 1.009 12.977 1.00 33.54 C ATOM 1125 CG ASP A 65 4.496 2.173 13.902 1.00 43.55 C ATOM 1126 OD1 ASP A 65 3.781 1.933 14.895 1.00 41.23 O ATOM 1127 OD2 ASP A 65 4.906 3.324 13.645 1.00 41.23 O ATOM 0 H ASP A 65 5.241 -0.679 11.187 1.00 70.45 H new ATOM 0 HA ASP A 65 2.899 0.375 12.512 1.00 32.13 H new ATOM 0 HB2 ASP A 65 5.117 0.134 13.585 1.00 33.54 H new ATOM 0 HB3 ASP A 65 5.802 1.273 12.443 1.00 33.54 H new ATOM 1132 N VAL A 66 2.394 2.560 11.343 1.00 14.45 N ATOM 1133 CA VAL A 66 1.895 3.675 10.510 1.00 40.52 C ATOM 1134 C VAL A 66 2.974 4.763 10.330 1.00 60.52 C ATOM 1135 O VAL A 66 3.156 5.282 9.219 1.00 73.21 O ATOM 1136 CB VAL A 66 0.557 4.288 11.100 1.00 54.41 C ATOM 1137 CG1 VAL A 66 0.127 5.572 10.350 1.00 71.02 C ATOM 1138 CG2 VAL A 66 -0.587 3.240 11.070 1.00 50.21 C ATOM 0 H VAL A 66 1.845 2.406 12.189 1.00 14.45 H new ATOM 0 HA VAL A 66 1.663 3.269 9.525 1.00 40.52 H new ATOM 0 HB VAL A 66 0.759 4.563 12.135 1.00 54.41 H new ATOM 0 HG11 VAL A 66 -0.794 5.958 10.787 1.00 71.02 H new ATOM 0 HG12 VAL A 66 0.912 6.323 10.436 1.00 71.02 H new ATOM 0 HG13 VAL A 66 -0.040 5.340 9.298 1.00 71.02 H new ATOM 0 HG21 VAL A 66 -1.496 3.681 11.479 1.00 50.21 H new ATOM 0 HG22 VAL A 66 -0.767 2.927 10.041 1.00 50.21 H new ATOM 0 HG23 VAL A 66 -0.303 2.374 11.668 1.00 50.21 H new ATOM 1148 N SER A 67 3.736 5.047 11.404 1.00 1.34 N ATOM 1149 CA SER A 67 4.797 6.075 11.389 1.00 1.22 C ATOM 1150 C SER A 67 6.097 5.545 10.733 1.00 74.05 C ATOM 1151 O SER A 67 7.045 6.308 10.535 1.00 13.52 O ATOM 1152 CB SER A 67 5.062 6.599 12.829 1.00 51.23 C ATOM 1153 OG SER A 67 5.970 7.698 12.845 1.00 30.11 O ATOM 0 H SER A 67 3.635 4.574 12.302 1.00 1.34 H new ATOM 0 HA SER A 67 4.450 6.909 10.779 1.00 1.22 H new ATOM 0 HB2 SER A 67 4.118 6.903 13.282 1.00 51.23 H new ATOM 0 HB3 SER A 67 5.463 5.790 13.440 1.00 51.23 H new ATOM 0 HG SER A 67 6.579 7.630 12.080 1.00 30.11 H new ATOM 1159 N LYS A 68 6.146 4.232 10.406 1.00 61.33 N ATOM 1160 CA LYS A 68 7.259 3.642 9.626 1.00 45.21 C ATOM 1161 C LYS A 68 7.002 3.724 8.109 1.00 10.01 C ATOM 1162 O LYS A 68 7.917 3.466 7.314 1.00 44.03 O ATOM 1163 CB LYS A 68 7.509 2.163 10.048 1.00 65.15 C ATOM 1164 CG LYS A 68 8.096 1.938 11.473 1.00 21.21 C ATOM 1165 CD LYS A 68 9.634 2.155 11.597 1.00 60.21 C ATOM 1166 CE LYS A 68 10.074 3.629 11.522 1.00 13.31 C ATOM 1167 NZ LYS A 68 11.540 3.791 11.716 1.00 60.41 N ATOM 0 H LYS A 68 5.426 3.560 10.671 1.00 61.33 H new ATOM 0 HA LYS A 68 8.151 4.228 9.847 1.00 45.21 H new ATOM 0 HB2 LYS A 68 6.564 1.624 9.979 1.00 65.15 H new ATOM 0 HB3 LYS A 68 8.187 1.711 9.324 1.00 65.15 H new ATOM 0 HG2 LYS A 68 7.593 2.612 12.167 1.00 21.21 H new ATOM 0 HG3 LYS A 68 7.862 0.922 11.789 1.00 21.21 H new ATOM 0 HD2 LYS A 68 9.973 1.734 12.544 1.00 60.21 H new ATOM 0 HD3 LYS A 68 10.133 1.598 10.804 1.00 60.21 H new ATOM 0 HE2 LYS A 68 9.790 4.042 10.554 1.00 13.31 H new ATOM 0 HE3 LYS A 68 9.544 4.203 12.282 1.00 13.31 H new ATOM 0 HZ1 LYS A 68 11.723 4.640 12.289 1.00 60.41 H new ATOM 0 HZ2 LYS A 68 11.920 2.955 12.205 1.00 60.41 H new ATOM 0 HZ3 LYS A 68 12.004 3.892 10.791 1.00 60.41 H new ATOM 1181 N ILE A 69 5.771 4.087 7.707 1.00 62.32 N ATOM 1182 CA ILE A 69 5.398 4.205 6.284 1.00 2.33 C ATOM 1183 C ILE A 69 5.919 5.536 5.695 1.00 4.13 C ATOM 1184 O ILE A 69 5.719 6.612 6.271 1.00 15.43 O ATOM 1185 CB ILE A 69 3.840 4.098 6.075 1.00 30.23 C ATOM 1186 CG1 ILE A 69 3.299 2.744 6.630 1.00 22.24 C ATOM 1187 CG2 ILE A 69 3.464 4.269 4.583 1.00 4.35 C ATOM 1188 CD1 ILE A 69 1.781 2.570 6.556 1.00 15.02 C ATOM 0 H ILE A 69 5.012 4.305 8.352 1.00 62.32 H new ATOM 0 HA ILE A 69 5.864 3.372 5.758 1.00 2.33 H new ATOM 0 HB ILE A 69 3.371 4.908 6.633 1.00 30.23 H new ATOM 0 HG12 ILE A 69 3.769 1.930 6.079 1.00 22.24 H new ATOM 0 HG13 ILE A 69 3.610 2.646 7.670 1.00 22.24 H new ATOM 0 HG21 ILE A 69 2.383 4.190 4.469 1.00 4.35 H new ATOM 0 HG22 ILE A 69 3.796 5.247 4.234 1.00 4.35 H new ATOM 0 HG23 ILE A 69 3.948 3.490 3.994 1.00 4.35 H new ATOM 0 HD11 ILE A 69 1.506 1.598 6.966 1.00 15.02 H new ATOM 0 HD12 ILE A 69 1.296 3.357 7.133 1.00 15.02 H new ATOM 0 HD13 ILE A 69 1.458 2.630 5.517 1.00 15.02 H new ATOM 1200 N LYS A 70 6.612 5.419 4.553 1.00 21.11 N ATOM 1201 CA LYS A 70 7.128 6.554 3.772 1.00 43.22 C ATOM 1202 C LYS A 70 6.019 7.164 2.881 1.00 65.31 C ATOM 1203 O LYS A 70 5.733 8.352 2.979 1.00 20.43 O ATOM 1204 CB LYS A 70 8.328 6.085 2.902 1.00 33.04 C ATOM 1205 CG LYS A 70 9.494 5.442 3.698 1.00 65.24 C ATOM 1206 CD LYS A 70 10.191 6.438 4.645 1.00 53.32 C ATOM 1207 CE LYS A 70 11.362 5.828 5.421 1.00 62.54 C ATOM 1208 NZ LYS A 70 12.127 6.872 6.173 1.00 61.14 N ATOM 0 H LYS A 70 6.834 4.514 4.138 1.00 21.11 H new ATOM 0 HA LYS A 70 7.465 7.328 4.461 1.00 43.22 H new ATOM 0 HB2 LYS A 70 7.967 5.365 2.167 1.00 33.04 H new ATOM 0 HB3 LYS A 70 8.713 6.941 2.347 1.00 33.04 H new ATOM 0 HG2 LYS A 70 9.112 4.602 4.279 1.00 65.24 H new ATOM 0 HG3 LYS A 70 10.227 5.039 2.999 1.00 65.24 H new ATOM 0 HD2 LYS A 70 10.553 7.286 4.064 1.00 53.32 H new ATOM 0 HD3 LYS A 70 9.459 6.826 5.353 1.00 53.32 H new ATOM 0 HE2 LYS A 70 10.987 5.078 6.118 1.00 62.54 H new ATOM 0 HE3 LYS A 70 12.030 5.314 4.729 1.00 62.54 H new ATOM 0 HZ1 LYS A 70 13.141 6.642 6.151 1.00 61.14 H new ATOM 0 HZ2 LYS A 70 11.973 7.801 5.732 1.00 61.14 H new ATOM 0 HZ3 LYS A 70 11.800 6.899 7.160 1.00 61.14 H new ATOM 1222 N CYS A 71 5.429 6.354 1.975 1.00 73.03 N ATOM 1223 CA CYS A 71 4.322 6.814 1.088 1.00 5.42 C ATOM 1224 C CYS A 71 3.347 5.670 0.752 1.00 11.52 C ATOM 1225 O CYS A 71 3.778 4.536 0.555 1.00 33.30 O ATOM 1226 CB CYS A 71 4.897 7.406 -0.230 1.00 44.15 C ATOM 1227 SG CYS A 71 6.035 8.788 0.016 1.00 24.31 S ATOM 0 H CYS A 71 5.695 5.380 1.834 1.00 73.03 H new ATOM 0 HA CYS A 71 3.772 7.584 1.629 1.00 5.42 H new ATOM 0 HB2 CYS A 71 5.414 6.616 -0.775 1.00 44.15 H new ATOM 0 HB3 CYS A 71 4.070 7.738 -0.858 1.00 44.15 H new ATOM 0 HG CYS A 71 6.084 9.090 1.279 1.00 24.31 H new ATOM 1233 N VAL A 72 2.032 5.982 0.689 1.00 64.23 N ATOM 1234 CA VAL A 72 1.007 5.068 0.133 1.00 20.44 C ATOM 1235 C VAL A 72 0.262 5.772 -1.008 1.00 64.23 C ATOM 1236 O VAL A 72 -0.356 6.821 -0.798 1.00 3.51 O ATOM 1237 CB VAL A 72 -0.056 4.569 1.183 1.00 73.30 C ATOM 1238 CG1 VAL A 72 -1.097 3.630 0.510 1.00 33.35 C ATOM 1239 CG2 VAL A 72 0.617 3.868 2.377 1.00 73.34 C ATOM 0 H VAL A 72 1.653 6.869 1.020 1.00 64.23 H new ATOM 0 HA VAL A 72 1.550 4.188 -0.212 1.00 20.44 H new ATOM 0 HB VAL A 72 -0.579 5.446 1.565 1.00 73.30 H new ATOM 0 HG11 VAL A 72 -1.821 3.297 1.254 1.00 33.35 H new ATOM 0 HG12 VAL A 72 -1.614 4.169 -0.284 1.00 33.35 H new ATOM 0 HG13 VAL A 72 -0.587 2.764 0.088 1.00 33.35 H new ATOM 0 HG21 VAL A 72 -0.146 3.537 3.082 1.00 73.34 H new ATOM 0 HG22 VAL A 72 1.182 3.006 2.022 1.00 73.34 H new ATOM 0 HG23 VAL A 72 1.292 4.564 2.874 1.00 73.34 H new ATOM 1249 N GLU A 73 0.311 5.163 -2.195 1.00 73.42 N ATOM 1250 CA GLU A 73 -0.416 5.622 -3.387 1.00 5.33 C ATOM 1251 C GLU A 73 -0.524 4.446 -4.368 1.00 73.33 C ATOM 1252 O GLU A 73 0.259 3.500 -4.276 1.00 33.11 O ATOM 1253 CB GLU A 73 0.293 6.852 -4.038 1.00 21.34 C ATOM 1254 CG GLU A 73 -0.497 7.518 -5.186 1.00 42.43 C ATOM 1255 CD GLU A 73 -1.901 7.997 -4.765 1.00 14.35 C ATOM 1256 OE1 GLU A 73 -2.010 9.096 -4.184 1.00 44.14 O ATOM 1257 OE2 GLU A 73 -2.898 7.278 -5.022 1.00 63.32 O ATOM 0 H GLU A 73 0.865 4.323 -2.360 1.00 73.42 H new ATOM 0 HA GLU A 73 -1.416 5.953 -3.108 1.00 5.33 H new ATOM 0 HB2 GLU A 73 0.482 7.597 -3.265 1.00 21.34 H new ATOM 0 HB3 GLU A 73 1.264 6.535 -4.419 1.00 21.34 H new ATOM 0 HG2 GLU A 73 0.071 8.368 -5.563 1.00 42.43 H new ATOM 0 HG3 GLU A 73 -0.594 6.810 -6.009 1.00 42.43 H new ATOM 1264 N ILE A 74 -1.498 4.492 -5.289 1.00 13.35 N ATOM 1265 CA ILE A 74 -1.650 3.446 -6.313 1.00 24.11 C ATOM 1266 C ILE A 74 -0.611 3.588 -7.422 1.00 12.50 C ATOM 1267 O ILE A 74 0.008 4.647 -7.604 1.00 62.24 O ATOM 1268 CB ILE A 74 -3.085 3.396 -6.938 1.00 31.10 C ATOM 1269 CG1 ILE A 74 -3.506 4.790 -7.490 1.00 70.13 C ATOM 1270 CG2 ILE A 74 -4.093 2.851 -5.917 1.00 44.25 C ATOM 1271 CD1 ILE A 74 -4.869 4.821 -8.160 1.00 24.03 C ATOM 0 H ILE A 74 -2.190 5.239 -5.346 1.00 13.35 H new ATOM 0 HA ILE A 74 -1.489 2.504 -5.788 1.00 24.11 H new ATOM 0 HB ILE A 74 -3.072 2.712 -7.787 1.00 31.10 H new ATOM 0 HG12 ILE A 74 -3.503 5.507 -6.669 1.00 70.13 H new ATOM 0 HG13 ILE A 74 -2.756 5.124 -8.207 1.00 70.13 H new ATOM 0 HG21 ILE A 74 -5.086 2.822 -6.366 1.00 44.25 H new ATOM 0 HG22 ILE A 74 -3.800 1.844 -5.618 1.00 44.25 H new ATOM 0 HG23 ILE A 74 -4.110 3.499 -5.041 1.00 44.25 H new ATOM 0 HD11 ILE A 74 -5.078 5.831 -8.513 1.00 24.03 H new ATOM 0 HD12 ILE A 74 -4.875 4.133 -9.005 1.00 24.03 H new ATOM 0 HD13 ILE A 74 -5.634 4.522 -7.443 1.00 24.03 H new ATOM 1283 N VAL A 75 -0.472 2.501 -8.174 1.00 33.41 N ATOM 1284 CA VAL A 75 0.520 2.347 -9.222 1.00 13.14 C ATOM 1285 C VAL A 75 -0.208 2.347 -10.565 1.00 34.02 C ATOM 1286 O VAL A 75 -1.083 1.494 -10.795 1.00 63.31 O ATOM 1287 CB VAL A 75 1.305 0.998 -9.046 1.00 61.31 C ATOM 1288 CG1 VAL A 75 2.432 0.863 -10.085 1.00 44.23 C ATOM 1289 CG2 VAL A 75 1.846 0.863 -7.609 1.00 75.41 C ATOM 0 H VAL A 75 -1.067 1.680 -8.064 1.00 33.41 H new ATOM 0 HA VAL A 75 1.238 3.166 -9.173 1.00 13.14 H new ATOM 0 HB VAL A 75 0.606 0.180 -9.220 1.00 61.31 H new ATOM 0 HG11 VAL A 75 2.955 -0.082 -9.934 1.00 44.23 H new ATOM 0 HG12 VAL A 75 2.007 0.886 -11.088 1.00 44.23 H new ATOM 0 HG13 VAL A 75 3.134 1.689 -9.969 1.00 44.23 H new ATOM 0 HG21 VAL A 75 2.386 -0.079 -7.510 1.00 75.41 H new ATOM 0 HG22 VAL A 75 2.520 1.692 -7.395 1.00 75.41 H new ATOM 0 HG23 VAL A 75 1.015 0.880 -6.904 1.00 75.41 H new ATOM 1299 N LYS A 76 0.119 3.318 -11.430 1.00 12.42 N ATOM 1300 CA LYS A 76 -0.395 3.358 -12.801 1.00 51.04 C ATOM 1301 C LYS A 76 0.285 2.233 -13.591 1.00 2.42 C ATOM 1302 O LYS A 76 1.430 2.365 -14.023 1.00 33.42 O ATOM 1303 CB LYS A 76 -0.165 4.763 -13.427 1.00 0.44 C ATOM 1304 CG LYS A 76 -1.101 5.857 -12.845 1.00 21.24 C ATOM 1305 CD LYS A 76 -0.836 7.265 -13.426 1.00 22.41 C ATOM 1306 CE LYS A 76 0.479 7.886 -12.925 1.00 62.30 C ATOM 1307 NZ LYS A 76 0.461 8.121 -11.455 1.00 1.20 N ATOM 0 H LYS A 76 0.743 4.091 -11.199 1.00 12.42 H new ATOM 0 HA LYS A 76 -1.473 3.195 -12.822 1.00 51.04 H new ATOM 0 HB2 LYS A 76 0.872 5.059 -13.267 1.00 0.44 H new ATOM 0 HB3 LYS A 76 -0.316 4.702 -14.505 1.00 0.44 H new ATOM 0 HG2 LYS A 76 -2.137 5.580 -13.041 1.00 21.24 H new ATOM 0 HG3 LYS A 76 -0.980 5.890 -11.762 1.00 21.24 H new ATOM 0 HD2 LYS A 76 -0.811 7.204 -14.514 1.00 22.41 H new ATOM 0 HD3 LYS A 76 -1.665 7.922 -13.163 1.00 22.41 H new ATOM 0 HE2 LYS A 76 1.310 7.227 -13.177 1.00 62.30 H new ATOM 0 HE3 LYS A 76 0.654 8.830 -13.441 1.00 62.30 H new ATOM 0 HZ1 LYS A 76 1.250 8.746 -11.194 1.00 1.20 H new ATOM 0 HZ2 LYS A 76 -0.439 8.568 -11.186 1.00 1.20 H new ATOM 0 HZ3 LYS A 76 0.559 7.213 -10.957 1.00 1.20 H new ATOM 1382 N ILE A 82 -2.752 -7.472 -15.336 1.00 22.01 N ATOM 1383 CA ILE A 82 -2.510 -7.789 -13.922 1.00 12.30 C ATOM 1384 C ILE A 82 -2.514 -9.325 -13.732 1.00 11.04 C ATOM 1385 O ILE A 82 -3.494 -9.983 -14.102 1.00 23.10 O ATOM 1386 CB ILE A 82 -3.590 -7.115 -12.984 1.00 4.22 C ATOM 1387 CG1 ILE A 82 -3.423 -5.563 -12.955 1.00 35.42 C ATOM 1388 CG2 ILE A 82 -3.559 -7.694 -11.546 1.00 11.04 C ATOM 1389 CD1 ILE A 82 -2.147 -5.057 -12.290 1.00 53.52 C ATOM 0 HA ILE A 82 -1.537 -7.388 -13.640 1.00 12.30 H new ATOM 0 HB ILE A 82 -4.566 -7.349 -13.409 1.00 4.22 H new ATOM 0 HG12 ILE A 82 -3.451 -5.192 -13.980 1.00 35.42 H new ATOM 0 HG13 ILE A 82 -4.279 -5.132 -12.436 1.00 35.42 H new ATOM 0 HG21 ILE A 82 -4.318 -7.201 -10.939 1.00 11.04 H new ATOM 0 HG22 ILE A 82 -3.761 -8.765 -11.580 1.00 11.04 H new ATOM 0 HG23 ILE A 82 -2.576 -7.524 -11.107 1.00 11.04 H new ATOM 0 HD11 ILE A 82 -2.127 -3.968 -12.322 1.00 53.52 H new ATOM 0 HD12 ILE A 82 -2.121 -5.390 -11.252 1.00 53.52 H new ATOM 0 HD13 ILE A 82 -1.280 -5.451 -12.820 1.00 53.52 H new ATOM 1401 N PRO A 83 -1.412 -9.919 -13.167 1.00 12.10 N ATOM 1402 CA PRO A 83 -1.299 -11.381 -12.903 1.00 64.51 C ATOM 1403 C PRO A 83 -1.980 -11.788 -11.570 1.00 24.24 C ATOM 1404 O PRO A 83 -1.409 -12.534 -10.755 1.00 62.01 O ATOM 1405 CB PRO A 83 0.249 -11.600 -12.878 1.00 70.43 C ATOM 1406 CG PRO A 83 0.858 -10.257 -13.208 1.00 71.01 C ATOM 1407 CD PRO A 83 -0.159 -9.243 -12.767 1.00 2.45 C ATOM 0 HA PRO A 83 -1.805 -11.997 -13.646 1.00 64.51 H new ATOM 0 HB2 PRO A 83 0.579 -11.950 -11.900 1.00 70.43 H new ATOM 0 HB3 PRO A 83 0.549 -12.355 -13.604 1.00 70.43 H new ATOM 0 HG2 PRO A 83 1.805 -10.116 -12.688 1.00 71.01 H new ATOM 0 HG3 PRO A 83 1.064 -10.170 -14.275 1.00 71.01 H new ATOM 0 HD2 PRO A 83 -0.116 -9.053 -11.695 1.00 2.45 H new ATOM 0 HD3 PRO A 83 -0.029 -8.283 -13.266 1.00 2.45 H new ATOM 1415 N CYS A 84 -3.217 -11.303 -11.393 1.00 34.13 N ATOM 1416 CA CYS A 84 -4.039 -11.543 -10.194 1.00 40.43 C ATOM 1417 C CYS A 84 -5.514 -11.179 -10.486 1.00 41.30 C ATOM 1418 O CYS A 84 -5.798 -10.389 -11.403 1.00 73.11 O ATOM 1419 CB CYS A 84 -3.505 -10.706 -9.002 1.00 13.02 C ATOM 1420 SG CYS A 84 -4.412 -10.942 -7.459 1.00 61.24 S ATOM 0 H CYS A 84 -3.684 -10.723 -12.090 1.00 34.13 H new ATOM 0 HA CYS A 84 -3.981 -12.599 -9.930 1.00 40.43 H new ATOM 0 HB2 CYS A 84 -2.458 -10.959 -8.836 1.00 13.02 H new ATOM 0 HB3 CYS A 84 -3.539 -9.650 -9.271 1.00 13.02 H new ATOM 0 HG CYS A 84 -3.886 -10.201 -6.529 1.00 61.24 H new ATOM 1426 N GLN A 85 -6.449 -11.778 -9.712 1.00 44.43 N ATOM 1427 CA GLN A 85 -7.883 -11.399 -9.739 1.00 71.34 C ATOM 1428 C GLN A 85 -8.057 -9.968 -9.186 1.00 62.42 C ATOM 1429 O GLN A 85 -8.808 -9.153 -9.743 1.00 24.51 O ATOM 1430 CB GLN A 85 -8.755 -12.410 -8.927 1.00 4.21 C ATOM 1431 CG GLN A 85 -8.319 -12.607 -7.454 1.00 23.11 C ATOM 1432 CD GLN A 85 -9.266 -13.473 -6.618 1.00 25.03 C ATOM 1433 OE1 GLN A 85 -10.481 -13.508 -6.841 1.00 41.51 O ATOM 1434 NE2 GLN A 85 -8.719 -14.174 -5.637 1.00 64.54 N ATOM 0 H GLN A 85 -6.235 -12.530 -9.057 1.00 44.43 H new ATOM 0 HA GLN A 85 -8.225 -11.427 -10.774 1.00 71.34 H new ATOM 0 HB2 GLN A 85 -9.790 -12.069 -8.942 1.00 4.21 H new ATOM 0 HB3 GLN A 85 -8.730 -13.376 -9.431 1.00 4.21 H new ATOM 0 HG2 GLN A 85 -7.327 -13.059 -7.440 1.00 23.11 H new ATOM 0 HG3 GLN A 85 -8.230 -11.629 -6.981 1.00 23.11 H new ATOM 0 HE21 GLN A 85 -7.713 -14.126 -5.475 1.00 64.54 H new ATOM 0 HE22 GLN A 85 -9.304 -14.762 -5.043 1.00 64.54 H new ATOM 1443 N ASN A 86 -7.325 -9.682 -8.092 1.00 24.31 N ATOM 1444 CA ASN A 86 -7.288 -8.359 -7.463 1.00 55.21 C ATOM 1445 C ASN A 86 -6.485 -7.393 -8.349 1.00 53.33 C ATOM 1446 O ASN A 86 -5.406 -7.734 -8.833 1.00 31.34 O ATOM 1447 CB ASN A 86 -6.664 -8.426 -6.044 1.00 74.24 C ATOM 1448 CG ASN A 86 -7.555 -9.077 -4.986 1.00 21.32 C ATOM 1449 OD1 ASN A 86 -8.335 -9.983 -5.269 1.00 11.13 O ATOM 1450 ND2 ASN A 86 -7.449 -8.606 -3.751 1.00 5.00 N ATOM 0 H ASN A 86 -6.740 -10.372 -7.621 1.00 24.31 H new ATOM 0 HA ASN A 86 -8.311 -7.998 -7.359 1.00 55.21 H new ATOM 0 HB2 ASN A 86 -5.726 -8.978 -6.100 1.00 74.24 H new ATOM 0 HB3 ASN A 86 -6.419 -7.414 -5.721 1.00 74.24 H new ATOM 0 HD21 ASN A 86 -8.024 -8.997 -3.005 1.00 5.00 H new ATOM 0 HD22 ASN A 86 -6.792 -7.853 -3.547 1.00 5.00 H new ATOM 1457 N LYS A 87 -7.034 -6.196 -8.531 1.00 75.42 N ATOM 1458 CA LYS A 87 -6.506 -5.160 -9.434 1.00 63.53 C ATOM 1459 C LYS A 87 -6.236 -3.880 -8.627 1.00 35.23 C ATOM 1460 O LYS A 87 -6.246 -3.917 -7.395 1.00 70.02 O ATOM 1461 CB LYS A 87 -7.548 -4.903 -10.555 1.00 3.42 C ATOM 1462 CG LYS A 87 -7.892 -6.149 -11.410 1.00 42.13 C ATOM 1463 CD LYS A 87 -9.214 -5.996 -12.199 1.00 14.13 C ATOM 1464 CE LYS A 87 -10.425 -5.735 -11.276 1.00 21.14 C ATOM 1465 NZ LYS A 87 -10.552 -6.746 -10.187 1.00 10.12 N ATOM 0 H LYS A 87 -7.882 -5.905 -8.044 1.00 75.42 H new ATOM 0 HA LYS A 87 -5.570 -5.483 -9.890 1.00 63.53 H new ATOM 0 HB2 LYS A 87 -8.464 -4.524 -10.102 1.00 3.42 H new ATOM 0 HB3 LYS A 87 -7.170 -4.120 -11.212 1.00 3.42 H new ATOM 0 HG2 LYS A 87 -7.078 -6.338 -12.110 1.00 42.13 H new ATOM 0 HG3 LYS A 87 -7.963 -7.021 -10.759 1.00 42.13 H new ATOM 0 HD2 LYS A 87 -9.117 -5.174 -12.908 1.00 14.13 H new ATOM 0 HD3 LYS A 87 -9.393 -6.900 -12.781 1.00 14.13 H new ATOM 0 HE2 LYS A 87 -10.332 -4.743 -10.835 1.00 21.14 H new ATOM 0 HE3 LYS A 87 -11.337 -5.734 -11.873 1.00 21.14 H new ATOM 0 HZ1 LYS A 87 -11.541 -7.061 -10.119 1.00 10.12 H new ATOM 0 HZ2 LYS A 87 -9.942 -7.562 -10.398 1.00 10.12 H new ATOM 0 HZ3 LYS A 87 -10.261 -6.321 -9.283 1.00 10.12 H new ATOM 1479 N TYR A 88 -5.977 -2.767 -9.343 1.00 72.24 N ATOM 1480 CA TYR A 88 -5.726 -1.430 -8.753 1.00 34.51 C ATOM 1481 C TYR A 88 -4.672 -1.502 -7.619 1.00 44.42 C ATOM 1482 O TYR A 88 -4.966 -1.159 -6.463 1.00 21.33 O ATOM 1483 CB TYR A 88 -7.071 -0.789 -8.288 1.00 42.24 C ATOM 1484 CG TYR A 88 -8.082 -0.621 -9.436 1.00 14.41 C ATOM 1485 CD1 TYR A 88 -8.968 -1.646 -9.786 1.00 32.22 C ATOM 1486 CD2 TYR A 88 -8.117 0.547 -10.202 1.00 10.44 C ATOM 1487 CE1 TYR A 88 -9.845 -1.511 -10.847 1.00 13.40 C ATOM 1488 CE2 TYR A 88 -9.000 0.689 -11.258 1.00 3.14 C ATOM 1489 CZ TYR A 88 -9.858 -0.344 -11.579 1.00 13.13 C ATOM 1490 OH TYR A 88 -10.731 -0.214 -12.641 1.00 11.01 O ATOM 0 H TYR A 88 -5.935 -2.768 -10.362 1.00 72.24 H new ATOM 0 HA TYR A 88 -5.301 -0.780 -9.518 1.00 34.51 H new ATOM 0 HB2 TYR A 88 -7.513 -1.410 -7.509 1.00 42.24 H new ATOM 0 HB3 TYR A 88 -6.869 0.185 -7.843 1.00 42.24 H new ATOM 0 HD1 TYR A 88 -8.967 -2.563 -9.215 1.00 32.22 H new ATOM 0 HD2 TYR A 88 -7.441 1.355 -9.965 1.00 10.44 H new ATOM 0 HE1 TYR A 88 -10.517 -2.317 -11.101 1.00 13.40 H new ATOM 0 HE2 TYR A 88 -9.018 1.605 -11.829 1.00 3.14 H new ATOM 0 HH TYR A 88 -10.616 0.668 -13.053 1.00 11.01 H new ATOM 1500 N PRO A 89 -3.429 -1.993 -7.944 1.00 11.33 N ATOM 1501 CA PRO A 89 -2.410 -2.286 -6.925 1.00 54.52 C ATOM 1502 C PRO A 89 -1.851 -0.999 -6.309 1.00 74.03 C ATOM 1503 O PRO A 89 -1.332 -0.137 -7.027 1.00 14.32 O ATOM 1504 CB PRO A 89 -1.327 -3.067 -7.709 1.00 12.31 C ATOM 1505 CG PRO A 89 -1.457 -2.602 -9.132 1.00 50.45 C ATOM 1506 CD PRO A 89 -2.920 -2.262 -9.329 1.00 1.34 C ATOM 0 HA PRO A 89 -2.803 -2.852 -6.081 1.00 54.52 H new ATOM 0 HB2 PRO A 89 -0.331 -2.860 -7.317 1.00 12.31 H new ATOM 0 HB3 PRO A 89 -1.483 -4.143 -7.631 1.00 12.31 H new ATOM 0 HG2 PRO A 89 -0.826 -1.733 -9.317 1.00 50.45 H new ATOM 0 HG3 PRO A 89 -1.140 -3.380 -9.827 1.00 50.45 H new ATOM 0 HD2 PRO A 89 -3.043 -1.392 -9.974 1.00 1.34 H new ATOM 0 HD3 PRO A 89 -3.460 -3.085 -9.798 1.00 1.34 H new ATOM 1514 N PHE A 90 -2.009 -0.843 -4.990 1.00 12.04 N ATOM 1515 CA PHE A 90 -1.407 0.266 -4.261 1.00 24.44 C ATOM 1516 C PHE A 90 -0.093 -0.195 -3.642 1.00 12.34 C ATOM 1517 O PHE A 90 0.034 -1.340 -3.188 1.00 0.11 O ATOM 1518 CB PHE A 90 -2.376 0.865 -3.204 1.00 33.35 C ATOM 1519 CG PHE A 90 -2.869 -0.083 -2.099 1.00 3.30 C ATOM 1520 CD1 PHE A 90 -3.921 -0.979 -2.328 1.00 54.41 C ATOM 1521 CD2 PHE A 90 -2.304 -0.050 -0.817 1.00 34.21 C ATOM 1522 CE1 PHE A 90 -4.389 -1.802 -1.316 1.00 30.20 C ATOM 1523 CE2 PHE A 90 -2.771 -0.879 0.187 1.00 45.13 C ATOM 1524 CZ PHE A 90 -3.812 -1.751 -0.061 1.00 75.10 C ATOM 0 H PHE A 90 -2.554 -1.479 -4.407 1.00 12.04 H new ATOM 0 HA PHE A 90 -1.199 1.075 -4.961 1.00 24.44 H new ATOM 0 HB2 PHE A 90 -1.879 1.711 -2.729 1.00 33.35 H new ATOM 0 HB3 PHE A 90 -3.247 1.259 -3.727 1.00 33.35 H new ATOM 0 HD1 PHE A 90 -4.374 -1.029 -3.307 1.00 54.41 H new ATOM 0 HD2 PHE A 90 -1.493 0.632 -0.610 1.00 34.21 H new ATOM 0 HE1 PHE A 90 -5.205 -2.483 -1.508 1.00 30.20 H new ATOM 0 HE2 PHE A 90 -2.320 -0.844 1.168 1.00 45.13 H new ATOM 0 HZ PHE A 90 -4.176 -2.394 0.727 1.00 75.10 H new ATOM 1534 N GLN A 91 0.879 0.710 -3.644 1.00 44.02 N ATOM 1535 CA GLN A 91 2.200 0.472 -3.088 1.00 35.43 C ATOM 1536 C GLN A 91 2.270 1.133 -1.710 1.00 63.32 C ATOM 1537 O GLN A 91 1.798 2.265 -1.515 1.00 54.42 O ATOM 1538 CB GLN A 91 3.310 1.027 -4.032 1.00 54.15 C ATOM 1539 CG GLN A 91 3.248 2.547 -4.314 1.00 23.31 C ATOM 1540 CD GLN A 91 4.397 3.077 -5.177 1.00 13.23 C ATOM 1541 OE1 GLN A 91 4.970 2.357 -5.994 1.00 2.04 O ATOM 1542 NE2 GLN A 91 4.736 4.351 -5.014 1.00 54.04 N ATOM 0 H GLN A 91 0.767 1.644 -4.039 1.00 44.02 H new ATOM 0 HA GLN A 91 2.371 -0.600 -2.990 1.00 35.43 H new ATOM 0 HB2 GLN A 91 4.282 0.796 -3.596 1.00 54.15 H new ATOM 0 HB3 GLN A 91 3.253 0.496 -4.982 1.00 54.15 H new ATOM 0 HG2 GLN A 91 2.304 2.774 -4.808 1.00 23.31 H new ATOM 0 HG3 GLN A 91 3.247 3.081 -3.364 1.00 23.31 H new ATOM 0 HE21 GLN A 91 4.245 4.926 -4.330 1.00 54.04 H new ATOM 0 HE22 GLN A 91 5.488 4.754 -5.573 1.00 54.04 H new ATOM 1551 N VAL A 92 2.829 0.394 -0.755 1.00 1.25 N ATOM 1552 CA VAL A 92 3.113 0.889 0.578 1.00 11.21 C ATOM 1553 C VAL A 92 4.631 0.885 0.713 1.00 1.13 C ATOM 1554 O VAL A 92 5.246 -0.163 0.949 1.00 23.22 O ATOM 1555 CB VAL A 92 2.443 0.010 1.710 1.00 12.33 C ATOM 1556 CG1 VAL A 92 2.803 0.543 3.122 1.00 43.05 C ATOM 1557 CG2 VAL A 92 0.910 -0.058 1.516 1.00 41.33 C ATOM 0 H VAL A 92 3.099 -0.580 -0.893 1.00 1.25 H new ATOM 0 HA VAL A 92 2.695 1.887 0.706 1.00 11.21 H new ATOM 0 HB VAL A 92 2.840 -1.002 1.628 1.00 12.33 H new ATOM 0 HG11 VAL A 92 2.328 -0.081 3.879 1.00 43.05 H new ATOM 0 HG12 VAL A 92 3.884 0.516 3.256 1.00 43.05 H new ATOM 0 HG13 VAL A 92 2.450 1.569 3.225 1.00 43.05 H new ATOM 0 HG21 VAL A 92 0.470 -0.667 2.305 1.00 41.33 H new ATOM 0 HG22 VAL A 92 0.493 0.948 1.559 1.00 41.33 H new ATOM 0 HG23 VAL A 92 0.685 -0.503 0.547 1.00 41.33 H new ATOM 1567 N VAL A 93 5.233 2.055 0.494 1.00 43.23 N ATOM 1568 CA VAL A 93 6.654 2.265 0.710 1.00 1.52 C ATOM 1569 C VAL A 93 6.832 2.473 2.208 1.00 71.23 C ATOM 1570 O VAL A 93 6.213 3.372 2.777 1.00 3.34 O ATOM 1571 CB VAL A 93 7.199 3.514 -0.088 1.00 52.44 C ATOM 1572 CG1 VAL A 93 8.735 3.617 0.022 1.00 41.30 C ATOM 1573 CG2 VAL A 93 6.742 3.494 -1.570 1.00 2.15 C ATOM 0 H VAL A 93 4.741 2.884 0.160 1.00 43.23 H new ATOM 0 HA VAL A 93 7.220 1.407 0.349 1.00 1.52 H new ATOM 0 HB VAL A 93 6.769 4.405 0.370 1.00 52.44 H new ATOM 0 HG11 VAL A 93 9.082 4.486 -0.537 1.00 41.30 H new ATOM 0 HG12 VAL A 93 9.019 3.722 1.069 1.00 41.30 H new ATOM 0 HG13 VAL A 93 9.190 2.716 -0.388 1.00 41.30 H new ATOM 0 HG21 VAL A 93 7.138 4.370 -2.085 1.00 2.15 H new ATOM 0 HG22 VAL A 93 7.114 2.590 -2.053 1.00 2.15 H new ATOM 0 HG23 VAL A 93 5.653 3.508 -1.615 1.00 2.15 H new ATOM 1583 N HIS A 94 7.619 1.612 2.844 1.00 31.32 N ATOM 1584 CA HIS A 94 7.850 1.650 4.300 1.00 32.34 C ATOM 1585 C HIS A 94 9.360 1.699 4.598 1.00 20.22 C ATOM 1586 O HIS A 94 10.177 1.686 3.672 1.00 41.51 O ATOM 1587 CB HIS A 94 7.135 0.454 5.000 1.00 63.54 C ATOM 1588 CG HIS A 94 7.483 -0.919 4.459 1.00 45.12 C ATOM 1589 ND1 HIS A 94 8.363 -1.780 5.081 1.00 53.12 N ATOM 1590 CD2 HIS A 94 7.039 -1.582 3.357 1.00 2.32 C ATOM 1591 CE1 HIS A 94 8.449 -2.898 4.387 1.00 62.13 C ATOM 1592 NE2 HIS A 94 7.663 -2.805 3.331 1.00 42.44 N ATOM 0 H HIS A 94 8.121 0.861 2.370 1.00 31.32 H new ATOM 0 HA HIS A 94 7.413 2.560 4.712 1.00 32.34 H new ATOM 0 HB2 HIS A 94 7.377 0.479 6.062 1.00 63.54 H new ATOM 0 HB3 HIS A 94 6.058 0.597 4.915 1.00 63.54 H new ATOM 0 HD1 HIS A 94 8.869 -1.582 5.944 1.00 53.12 H new ATOM 0 HD2 HIS A 94 6.326 -1.214 2.634 1.00 2.32 H new ATOM 0 HE1 HIS A 94 9.062 -3.750 4.641 1.00 62.13 H new ATOM 1601 N ASP A 95 9.696 1.750 5.902 1.00 23.00 N ATOM 1602 CA ASP A 95 11.060 2.021 6.413 1.00 72.01 C ATOM 1603 C ASP A 95 12.100 1.025 5.868 1.00 22.23 C ATOM 1604 O ASP A 95 13.231 1.409 5.544 1.00 33.31 O ATOM 1605 CB ASP A 95 11.024 2.003 7.967 1.00 45.12 C ATOM 1606 CG ASP A 95 12.351 2.418 8.629 1.00 51.44 C ATOM 1607 OD1 ASP A 95 12.550 3.628 8.865 1.00 74.43 O ATOM 1608 OD2 ASP A 95 13.187 1.540 8.939 1.00 52.45 O ATOM 0 H ASP A 95 9.015 1.601 6.647 1.00 23.00 H new ATOM 0 HA ASP A 95 11.374 3.004 6.062 1.00 72.01 H new ATOM 0 HB2 ASP A 95 10.234 2.672 8.310 1.00 45.12 H new ATOM 0 HB3 ASP A 95 10.760 1.000 8.303 1.00 45.12 H new ATOM 1613 N ALA A 96 11.701 -0.251 5.762 1.00 1.53 N ATOM 1614 CA ALA A 96 12.577 -1.318 5.244 1.00 75.22 C ATOM 1615 C ALA A 96 12.727 -1.232 3.713 1.00 24.24 C ATOM 1616 O ALA A 96 13.838 -1.059 3.201 1.00 63.21 O ATOM 1617 CB ALA A 96 12.039 -2.698 5.663 1.00 40.53 C ATOM 0 H ALA A 96 10.771 -0.573 6.030 1.00 1.53 H new ATOM 0 HA ALA A 96 13.568 -1.181 5.677 1.00 75.22 H new ATOM 0 HB1 ALA A 96 12.694 -3.477 5.274 1.00 40.53 H new ATOM 0 HB2 ALA A 96 12.006 -2.761 6.751 1.00 40.53 H new ATOM 0 HB3 ALA A 96 11.035 -2.835 5.261 1.00 40.53 H new ATOM 1623 N ASN A 97 11.595 -1.331 2.999 1.00 43.51 N ATOM 1624 CA ASN A 97 11.566 -1.412 1.522 1.00 1.43 C ATOM 1625 C ASN A 97 10.178 -1.028 0.990 1.00 24.02 C ATOM 1626 O ASN A 97 9.341 -0.530 1.744 1.00 11.43 O ATOM 1627 CB ASN A 97 11.991 -2.839 1.046 1.00 44.44 C ATOM 1628 CG ASN A 97 11.147 -3.998 1.620 1.00 34.34 C ATOM 1629 OD1 ASN A 97 9.926 -3.903 1.789 1.00 42.14 O ATOM 1630 ND2 ASN A 97 11.798 -5.102 1.950 1.00 21.12 N ATOM 0 H ASN A 97 10.669 -1.358 3.426 1.00 43.51 H new ATOM 0 HA ASN A 97 12.284 -0.700 1.115 1.00 1.43 H new ATOM 0 HB2 ASN A 97 11.936 -2.874 -0.042 1.00 44.44 H new ATOM 0 HB3 ASN A 97 13.034 -3.000 1.318 1.00 44.44 H new ATOM 0 HD21 ASN A 97 11.292 -5.892 2.351 1.00 21.12 H new ATOM 0 HD22 ASN A 97 12.806 -5.163 1.804 1.00 21.12 H new ATOM 1637 N THR A 98 9.951 -1.235 -0.316 1.00 51.05 N ATOM 1638 CA THR A 98 8.652 -0.988 -0.959 1.00 52.13 C ATOM 1639 C THR A 98 7.833 -2.302 -1.017 1.00 1.13 C ATOM 1640 O THR A 98 8.390 -3.376 -1.275 1.00 25.00 O ATOM 1641 CB THR A 98 8.860 -0.404 -2.394 1.00 72.52 C ATOM 1642 OG1 THR A 98 9.780 0.707 -2.331 1.00 75.13 O ATOM 1643 CG2 THR A 98 7.539 0.071 -3.029 1.00 41.41 C ATOM 0 H THR A 98 10.665 -1.579 -0.957 1.00 51.05 H new ATOM 0 HA THR A 98 8.097 -0.258 -0.370 1.00 52.13 H new ATOM 0 HB THR A 98 9.261 -1.203 -3.018 1.00 72.52 H new ATOM 0 HG1 THR A 98 10.228 0.810 -3.197 1.00 75.13 H new ATOM 0 HG21 THR A 98 7.736 0.468 -4.025 1.00 41.41 H new ATOM 0 HG22 THR A 98 6.848 -0.769 -3.104 1.00 41.41 H new ATOM 0 HG23 THR A 98 7.097 0.850 -2.409 1.00 41.41 H new ATOM 1651 N LEU A 99 6.517 -2.197 -0.772 1.00 11.54 N ATOM 1652 CA LEU A 99 5.582 -3.345 -0.780 1.00 44.02 C ATOM 1653 C LEU A 99 4.458 -3.081 -1.797 1.00 53.10 C ATOM 1654 O LEU A 99 4.093 -1.926 -2.020 1.00 4.51 O ATOM 1655 CB LEU A 99 4.996 -3.571 0.644 1.00 23.43 C ATOM 1656 CG LEU A 99 4.012 -4.778 0.807 1.00 33.12 C ATOM 1657 CD1 LEU A 99 4.691 -6.109 0.431 1.00 42.13 C ATOM 1658 CD2 LEU A 99 3.414 -4.826 2.232 1.00 53.43 C ATOM 0 H LEU A 99 6.064 -1.308 -0.561 1.00 11.54 H new ATOM 0 HA LEU A 99 6.118 -4.248 -1.072 1.00 44.02 H new ATOM 0 HB2 LEU A 99 5.826 -3.710 1.337 1.00 23.43 H new ATOM 0 HB3 LEU A 99 4.476 -2.663 0.948 1.00 23.43 H new ATOM 0 HG LEU A 99 3.186 -4.628 0.112 1.00 33.12 H new ATOM 0 HD11 LEU A 99 3.981 -6.927 0.555 1.00 42.13 H new ATOM 0 HD12 LEU A 99 5.021 -6.069 -0.607 1.00 42.13 H new ATOM 0 HD13 LEU A 99 5.552 -6.274 1.079 1.00 42.13 H new ATOM 0 HD21 LEU A 99 2.735 -5.675 2.313 1.00 53.43 H new ATOM 0 HD22 LEU A 99 4.218 -4.933 2.960 1.00 53.43 H new ATOM 0 HD23 LEU A 99 2.867 -3.904 2.428 1.00 53.43 H new ATOM 1670 N TYR A 100 3.932 -4.152 -2.424 1.00 64.13 N ATOM 1671 CA TYR A 100 2.858 -4.057 -3.435 1.00 54.43 C ATOM 1672 C TYR A 100 1.683 -4.943 -3.040 1.00 62.41 C ATOM 1673 O TYR A 100 1.846 -6.147 -2.841 1.00 12.21 O ATOM 1674 CB TYR A 100 3.409 -4.416 -4.841 1.00 65.11 C ATOM 1675 CG TYR A 100 4.297 -3.296 -5.383 1.00 4.41 C ATOM 1676 CD1 TYR A 100 3.746 -2.254 -6.123 1.00 71.21 C ATOM 1677 CD2 TYR A 100 5.663 -3.237 -5.094 1.00 15.21 C ATOM 1678 CE1 TYR A 100 4.517 -1.201 -6.547 1.00 43.00 C ATOM 1679 CE2 TYR A 100 6.435 -2.185 -5.532 1.00 3.31 C ATOM 1680 CZ TYR A 100 5.850 -1.170 -6.254 1.00 13.22 C ATOM 1681 OH TYR A 100 6.604 -0.099 -6.665 1.00 33.23 O ATOM 0 H TYR A 100 4.239 -5.108 -2.244 1.00 64.13 H new ATOM 0 HA TYR A 100 2.495 -3.030 -3.479 1.00 54.43 H new ATOM 0 HB2 TYR A 100 3.980 -5.343 -4.786 1.00 65.11 H new ATOM 0 HB3 TYR A 100 2.580 -4.592 -5.527 1.00 65.11 H new ATOM 0 HD1 TYR A 100 2.694 -2.274 -6.368 1.00 71.21 H new ATOM 0 HD2 TYR A 100 6.120 -4.029 -4.518 1.00 15.21 H new ATOM 0 HE1 TYR A 100 4.069 -0.397 -7.112 1.00 43.00 H new ATOM 0 HE2 TYR A 100 7.492 -2.156 -5.311 1.00 3.31 H new ATOM 0 HH TYR A 100 6.123 0.733 -6.473 1.00 33.23 H new ATOM 1691 N ILE A 101 0.503 -4.313 -2.902 1.00 3.35 N ATOM 1692 CA ILE A 101 -0.735 -4.951 -2.434 1.00 14.30 C ATOM 1693 C ILE A 101 -1.862 -4.673 -3.454 1.00 31.22 C ATOM 1694 O ILE A 101 -2.083 -3.523 -3.838 1.00 30.44 O ATOM 1695 CB ILE A 101 -1.166 -4.393 -1.019 1.00 23.35 C ATOM 1696 CG1 ILE A 101 0.043 -4.349 -0.028 1.00 62.31 C ATOM 1697 CG2 ILE A 101 -2.324 -5.234 -0.431 1.00 51.34 C ATOM 1698 CD1 ILE A 101 -0.235 -3.615 1.275 1.00 53.43 C ATOM 0 H ILE A 101 0.384 -3.323 -3.118 1.00 3.35 H new ATOM 0 HA ILE A 101 -0.558 -6.023 -2.341 1.00 14.30 H new ATOM 0 HB ILE A 101 -1.516 -3.370 -1.159 1.00 23.35 H new ATOM 0 HG12 ILE A 101 0.345 -5.371 0.203 1.00 62.31 H new ATOM 0 HG13 ILE A 101 0.887 -3.872 -0.526 1.00 62.31 H new ATOM 0 HG21 ILE A 101 -2.606 -4.834 0.543 1.00 51.34 H new ATOM 0 HG22 ILE A 101 -3.181 -5.192 -1.103 1.00 51.34 H new ATOM 0 HG23 ILE A 101 -2.001 -6.269 -0.318 1.00 51.34 H new ATOM 0 HD11 ILE A 101 0.657 -3.634 1.901 1.00 53.43 H new ATOM 0 HD12 ILE A 101 -0.505 -2.581 1.060 1.00 53.43 H new ATOM 0 HD13 ILE A 101 -1.056 -4.103 1.800 1.00 53.43 H new ATOM 1710 N PHE A 102 -2.555 -5.732 -3.875 1.00 43.35 N ATOM 1711 CA PHE A 102 -3.628 -5.672 -4.878 1.00 33.53 C ATOM 1712 C PHE A 102 -5.004 -5.686 -4.181 1.00 54.22 C ATOM 1713 O PHE A 102 -5.250 -6.518 -3.292 1.00 10.31 O ATOM 1714 CB PHE A 102 -3.484 -6.870 -5.862 1.00 22.34 C ATOM 1715 CG PHE A 102 -2.244 -6.810 -6.767 1.00 32.10 C ATOM 1716 CD1 PHE A 102 -0.954 -6.896 -6.236 1.00 5.41 C ATOM 1717 CD2 PHE A 102 -2.368 -6.649 -8.149 1.00 12.45 C ATOM 1718 CE1 PHE A 102 0.160 -6.823 -7.051 1.00 43.54 C ATOM 1719 CE2 PHE A 102 -1.249 -6.578 -8.961 1.00 63.51 C ATOM 1720 CZ PHE A 102 0.014 -6.661 -8.413 1.00 73.21 C ATOM 0 H PHE A 102 -2.386 -6.675 -3.524 1.00 43.35 H new ATOM 0 HA PHE A 102 -3.549 -4.745 -5.446 1.00 33.53 H new ATOM 0 HB2 PHE A 102 -3.452 -7.795 -5.286 1.00 22.34 H new ATOM 0 HB3 PHE A 102 -4.374 -6.916 -6.490 1.00 22.34 H new ATOM 0 HD1 PHE A 102 -0.825 -7.022 -5.171 1.00 5.41 H new ATOM 0 HD2 PHE A 102 -3.351 -6.579 -8.590 1.00 12.45 H new ATOM 0 HE1 PHE A 102 1.148 -6.893 -6.620 1.00 43.54 H new ATOM 0 HE2 PHE A 102 -1.365 -6.457 -10.028 1.00 63.51 H new ATOM 0 HZ PHE A 102 0.885 -6.599 -9.048 1.00 73.21 H new ATOM 1730 N ALA A 103 -5.884 -4.766 -4.601 1.00 22.54 N ATOM 1731 CA ALA A 103 -7.231 -4.586 -4.028 1.00 42.40 C ATOM 1732 C ALA A 103 -8.300 -5.281 -4.901 1.00 52.41 C ATOM 1733 O ALA A 103 -8.199 -5.225 -6.126 1.00 51.33 O ATOM 1734 CB ALA A 103 -7.526 -3.080 -3.899 1.00 23.22 C ATOM 0 H ALA A 103 -5.680 -4.115 -5.359 1.00 22.54 H new ATOM 0 HA ALA A 103 -7.265 -5.047 -3.041 1.00 42.40 H new ATOM 0 HB1 ALA A 103 -8.521 -2.939 -3.476 1.00 23.22 H new ATOM 0 HB2 ALA A 103 -6.785 -2.619 -3.246 1.00 23.22 H new ATOM 0 HB3 ALA A 103 -7.481 -2.615 -4.884 1.00 23.22 H new ATOM 1740 N PRO A 104 -9.339 -5.955 -4.296 1.00 53.24 N ATOM 1741 CA PRO A 104 -10.433 -6.634 -5.066 1.00 50.23 C ATOM 1742 C PRO A 104 -11.100 -5.737 -6.137 1.00 13.45 C ATOM 1743 O PRO A 104 -11.400 -6.189 -7.250 1.00 61.22 O ATOM 1744 CB PRO A 104 -11.445 -7.021 -3.958 1.00 41.35 C ATOM 1745 CG PRO A 104 -10.602 -7.206 -2.729 1.00 44.41 C ATOM 1746 CD PRO A 104 -9.518 -6.153 -2.824 1.00 23.35 C ATOM 0 HA PRO A 104 -10.051 -7.476 -5.643 1.00 50.23 H new ATOM 0 HB2 PRO A 104 -12.193 -6.241 -3.813 1.00 41.35 H new ATOM 0 HB3 PRO A 104 -11.982 -7.935 -4.212 1.00 41.35 H new ATOM 0 HG2 PRO A 104 -11.195 -7.079 -1.823 1.00 44.41 H new ATOM 0 HG3 PRO A 104 -10.175 -8.208 -2.693 1.00 44.41 H new ATOM 0 HD2 PRO A 104 -9.815 -5.228 -2.329 1.00 23.35 H new ATOM 0 HD3 PRO A 104 -8.595 -6.486 -2.350 1.00 23.35 H new ATOM 1754 N SER A 105 -11.266 -4.451 -5.790 1.00 12.22 N ATOM 1755 CA SER A 105 -12.029 -3.482 -6.594 1.00 72.42 C ATOM 1756 C SER A 105 -11.489 -2.042 -6.378 1.00 70.31 C ATOM 1757 O SER A 105 -10.683 -1.821 -5.463 1.00 33.45 O ATOM 1758 CB SER A 105 -13.519 -3.589 -6.171 1.00 54.52 C ATOM 1759 OG SER A 105 -13.679 -3.346 -4.778 1.00 24.14 O ATOM 0 H SER A 105 -10.872 -4.051 -4.938 1.00 12.22 H new ATOM 0 HA SER A 105 -11.925 -3.704 -7.656 1.00 72.42 H new ATOM 0 HB2 SER A 105 -14.113 -2.872 -6.738 1.00 54.52 H new ATOM 0 HB3 SER A 105 -13.898 -4.581 -6.415 1.00 54.52 H new ATOM 0 HG SER A 105 -14.534 -3.719 -4.477 1.00 24.14 H new ATOM 1765 N PRO A 106 -11.929 -1.023 -7.210 1.00 32.42 N ATOM 1766 CA PRO A 106 -11.660 0.411 -6.928 1.00 11.10 C ATOM 1767 C PRO A 106 -12.492 0.947 -5.737 1.00 10.54 C ATOM 1768 O PRO A 106 -12.323 2.098 -5.335 1.00 25.51 O ATOM 1769 CB PRO A 106 -12.010 1.119 -8.260 1.00 60.22 C ATOM 1770 CG PRO A 106 -13.039 0.236 -8.895 1.00 44.41 C ATOM 1771 CD PRO A 106 -12.667 -1.182 -8.499 1.00 61.03 C ATOM 0 HA PRO A 106 -10.629 0.588 -6.621 1.00 11.10 H new ATOM 0 HB2 PRO A 106 -12.400 2.122 -8.086 1.00 60.22 H new ATOM 0 HB3 PRO A 106 -11.131 1.225 -8.896 1.00 60.22 H new ATOM 0 HG2 PRO A 106 -14.040 0.489 -8.547 1.00 44.41 H new ATOM 0 HG3 PRO A 106 -13.039 0.352 -9.979 1.00 44.41 H new ATOM 0 HD2 PRO A 106 -13.552 -1.806 -8.376 1.00 61.03 H new ATOM 0 HD3 PRO A 106 -12.045 -1.657 -9.258 1.00 61.03 H new ATOM 1779 N GLN A 107 -13.361 0.079 -5.167 1.00 75.13 N ATOM 1780 CA GLN A 107 -14.097 0.365 -3.924 1.00 52.53 C ATOM 1781 C GLN A 107 -13.126 0.193 -2.745 1.00 53.03 C ATOM 1782 O GLN A 107 -12.990 1.082 -1.892 1.00 21.50 O ATOM 1783 CB GLN A 107 -15.307 -0.598 -3.762 1.00 71.24 C ATOM 1784 CG GLN A 107 -16.388 -0.487 -4.860 1.00 34.15 C ATOM 1785 CD GLN A 107 -17.155 0.847 -4.853 1.00 13.44 C ATOM 1786 OE1 GLN A 107 -17.348 1.472 -3.807 1.00 75.33 O ATOM 1787 NE2 GLN A 107 -17.626 1.279 -6.013 1.00 32.25 N ATOM 0 H GLN A 107 -13.568 -0.839 -5.561 1.00 75.13 H new ATOM 0 HA GLN A 107 -14.486 1.383 -3.954 1.00 52.53 H new ATOM 0 HB2 GLN A 107 -14.935 -1.623 -3.743 1.00 71.24 H new ATOM 0 HB3 GLN A 107 -15.774 -0.410 -2.795 1.00 71.24 H new ATOM 0 HG2 GLN A 107 -15.916 -0.618 -5.834 1.00 34.15 H new ATOM 0 HG3 GLN A 107 -17.100 -1.304 -4.738 1.00 34.15 H new ATOM 0 HE21 GLN A 107 -17.453 0.745 -6.864 1.00 32.25 H new ATOM 0 HE22 GLN A 107 -18.161 2.146 -6.055 1.00 32.25 H new ATOM 1796 N SER A 108 -12.436 -0.973 -2.740 1.00 3.13 N ATOM 1797 CA SER A 108 -11.376 -1.278 -1.778 1.00 73.33 C ATOM 1798 C SER A 108 -10.231 -0.257 -1.901 1.00 14.24 C ATOM 1799 O SER A 108 -9.780 0.286 -0.899 1.00 64.03 O ATOM 1800 CB SER A 108 -10.854 -2.713 -2.004 1.00 75.44 C ATOM 1801 OG SER A 108 -11.906 -3.659 -1.951 1.00 61.24 O ATOM 0 H SER A 108 -12.608 -1.723 -3.409 1.00 3.13 H new ATOM 0 HA SER A 108 -11.784 -1.212 -0.770 1.00 73.33 H new ATOM 0 HB2 SER A 108 -10.357 -2.773 -2.972 1.00 75.44 H new ATOM 0 HB3 SER A 108 -10.107 -2.954 -1.247 1.00 75.44 H new ATOM 0 HG SER A 108 -11.967 -4.030 -1.046 1.00 61.24 H new ATOM 1807 N ARG A 109 -9.789 -0.004 -3.155 1.00 24.41 N ATOM 1808 CA ARG A 109 -8.767 1.013 -3.482 1.00 63.21 C ATOM 1809 C ARG A 109 -9.096 2.379 -2.847 1.00 43.51 C ATOM 1810 O ARG A 109 -8.241 2.969 -2.175 1.00 20.33 O ATOM 1811 CB ARG A 109 -8.620 1.132 -5.036 1.00 31.44 C ATOM 1812 CG ARG A 109 -7.559 2.152 -5.550 1.00 3.51 C ATOM 1813 CD ARG A 109 -8.070 3.624 -5.679 1.00 43.42 C ATOM 1814 NE ARG A 109 -6.971 4.607 -5.556 1.00 30.32 N ATOM 1815 CZ ARG A 109 -7.034 5.780 -4.893 1.00 52.24 C ATOM 1816 NH1 ARG A 109 -8.145 6.165 -4.266 1.00 62.04 N ATOM 1817 NH2 ARG A 109 -5.967 6.575 -4.854 1.00 32.33 N ATOM 0 H ARG A 109 -10.135 -0.505 -3.973 1.00 24.41 H new ATOM 0 HA ARG A 109 -7.815 0.691 -3.060 1.00 63.21 H new ATOM 0 HB2 ARG A 109 -8.370 0.148 -5.433 1.00 31.44 H new ATOM 0 HB3 ARG A 109 -9.589 1.407 -5.452 1.00 31.44 H new ATOM 0 HG2 ARG A 109 -6.705 2.137 -4.873 1.00 3.51 H new ATOM 0 HG3 ARG A 109 -7.200 1.821 -6.524 1.00 3.51 H new ATOM 0 HD2 ARG A 109 -8.565 3.753 -6.642 1.00 43.42 H new ATOM 0 HD3 ARG A 109 -8.817 3.817 -4.909 1.00 43.42 H new ATOM 0 HE ARG A 109 -6.088 4.378 -6.013 1.00 30.32 H new ATOM 0 HH11 ARG A 109 -8.972 5.568 -4.281 1.00 62.04 H new ATOM 0 HH12 ARG A 109 -8.168 7.057 -3.771 1.00 62.04 H new ATOM 0 HH21 ARG A 109 -5.106 6.296 -5.324 1.00 32.33 H new ATOM 0 HH22 ARG A 109 -6.011 7.463 -4.354 1.00 32.33 H new ATOM 1831 N ASP A 110 -10.339 2.853 -3.087 1.00 21.53 N ATOM 1832 CA ASP A 110 -10.789 4.197 -2.687 1.00 53.02 C ATOM 1833 C ASP A 110 -10.576 4.431 -1.195 1.00 33.24 C ATOM 1834 O ASP A 110 -9.891 5.372 -0.815 1.00 63.04 O ATOM 1835 CB ASP A 110 -12.287 4.411 -3.053 1.00 71.20 C ATOM 1836 CG ASP A 110 -12.822 5.807 -2.652 1.00 22.44 C ATOM 1837 OD1 ASP A 110 -12.577 6.786 -3.388 1.00 51.32 O ATOM 1838 OD2 ASP A 110 -13.480 5.931 -1.598 1.00 13.24 O ATOM 0 H ASP A 110 -11.057 2.309 -3.565 1.00 21.53 H new ATOM 0 HA ASP A 110 -10.187 4.921 -3.236 1.00 53.02 H new ATOM 0 HB2 ASP A 110 -12.414 4.276 -4.127 1.00 71.20 H new ATOM 0 HB3 ASP A 110 -12.887 3.645 -2.562 1.00 71.20 H new ATOM 1843 N LEU A 111 -11.129 3.527 -0.375 1.00 63.24 N ATOM 1844 CA LEU A 111 -11.144 3.692 1.080 1.00 51.33 C ATOM 1845 C LEU A 111 -9.759 3.376 1.701 1.00 75.22 C ATOM 1846 O LEU A 111 -9.341 4.071 2.619 1.00 31.15 O ATOM 1847 CB LEU A 111 -12.271 2.817 1.701 1.00 61.13 C ATOM 1848 CG LEU A 111 -12.648 3.113 3.192 1.00 52.11 C ATOM 1849 CD1 LEU A 111 -13.070 4.582 3.392 1.00 61.24 C ATOM 1850 CD2 LEU A 111 -13.747 2.148 3.684 1.00 55.04 C ATOM 0 H LEU A 111 -11.574 2.669 -0.700 1.00 63.24 H new ATOM 0 HA LEU A 111 -11.357 4.736 1.310 1.00 51.33 H new ATOM 0 HB2 LEU A 111 -13.168 2.935 1.093 1.00 61.13 H new ATOM 0 HB3 LEU A 111 -11.971 1.772 1.627 1.00 61.13 H new ATOM 0 HG LEU A 111 -11.755 2.947 3.795 1.00 52.11 H new ATOM 0 HD11 LEU A 111 -13.324 4.748 4.439 1.00 61.24 H new ATOM 0 HD12 LEU A 111 -12.247 5.239 3.109 1.00 61.24 H new ATOM 0 HD13 LEU A 111 -13.938 4.799 2.769 1.00 61.24 H new ATOM 0 HD21 LEU A 111 -13.991 2.374 4.722 1.00 55.04 H new ATOM 0 HD22 LEU A 111 -14.638 2.267 3.067 1.00 55.04 H new ATOM 0 HD23 LEU A 111 -13.389 1.121 3.611 1.00 55.04 H new ATOM 1862 N TRP A 112 -9.037 2.354 1.171 1.00 2.45 N ATOM 1863 CA TRP A 112 -7.708 1.938 1.713 1.00 40.03 C ATOM 1864 C TRP A 112 -6.636 3.019 1.532 1.00 25.02 C ATOM 1865 O TRP A 112 -6.083 3.498 2.524 1.00 31.21 O ATOM 1866 CB TRP A 112 -7.218 0.589 1.092 1.00 34.42 C ATOM 1867 CG TRP A 112 -7.711 -0.612 1.854 1.00 70.34 C ATOM 1868 CD1 TRP A 112 -8.785 -1.398 1.564 1.00 23.25 C ATOM 1869 CD2 TRP A 112 -7.148 -1.133 3.070 1.00 31.13 C ATOM 1870 NE1 TRP A 112 -8.938 -2.352 2.529 1.00 44.00 N ATOM 1871 CE2 TRP A 112 -7.934 -2.229 3.451 1.00 73.20 C ATOM 1872 CE3 TRP A 112 -6.044 -0.785 3.861 1.00 43.40 C ATOM 1873 CZ2 TRP A 112 -7.670 -2.972 4.598 1.00 51.01 C ATOM 1874 CZ3 TRP A 112 -5.779 -1.525 4.998 1.00 21.31 C ATOM 1875 CH2 TRP A 112 -6.585 -2.614 5.352 1.00 42.30 C ATOM 0 H TRP A 112 -9.348 1.802 0.372 1.00 2.45 H new ATOM 0 HA TRP A 112 -7.858 1.791 2.783 1.00 40.03 H new ATOM 0 HB2 TRP A 112 -7.559 0.524 0.059 1.00 34.42 H new ATOM 0 HB3 TRP A 112 -6.128 0.578 1.070 1.00 34.42 H new ATOM 0 HD1 TRP A 112 -9.421 -1.284 0.699 1.00 23.25 H new ATOM 0 HE1 TRP A 112 -9.684 -3.047 2.558 1.00 44.00 H new ATOM 0 HE3 TRP A 112 -5.412 0.047 3.587 1.00 43.40 H new ATOM 0 HZ2 TRP A 112 -8.299 -3.802 4.883 1.00 51.01 H new ATOM 0 HZ3 TRP A 112 -4.939 -1.260 5.622 1.00 21.31 H new ATOM 0 HH2 TRP A 112 -6.346 -3.183 6.238 1.00 42.30 H new ATOM 1886 N VAL A 113 -6.370 3.402 0.265 1.00 63.04 N ATOM 1887 CA VAL A 113 -5.309 4.377 -0.075 1.00 64.30 C ATOM 1888 C VAL A 113 -5.557 5.716 0.644 1.00 41.32 C ATOM 1889 O VAL A 113 -4.624 6.323 1.174 1.00 23.13 O ATOM 1890 CB VAL A 113 -5.226 4.599 -1.631 1.00 54.42 C ATOM 1891 CG1 VAL A 113 -4.107 5.600 -2.015 1.00 4.21 C ATOM 1892 CG2 VAL A 113 -5.030 3.252 -2.362 1.00 12.35 C ATOM 0 H VAL A 113 -6.879 3.048 -0.545 1.00 63.04 H new ATOM 0 HA VAL A 113 -4.356 3.970 0.262 1.00 64.30 H new ATOM 0 HB VAL A 113 -6.173 5.035 -1.949 1.00 54.42 H new ATOM 0 HG11 VAL A 113 -4.085 5.724 -3.098 1.00 4.21 H new ATOM 0 HG12 VAL A 113 -4.303 6.563 -1.544 1.00 4.21 H new ATOM 0 HG13 VAL A 113 -3.145 5.218 -1.674 1.00 4.21 H new ATOM 0 HG21 VAL A 113 -4.975 3.426 -3.437 1.00 12.35 H new ATOM 0 HG22 VAL A 113 -4.106 2.785 -2.022 1.00 12.35 H new ATOM 0 HG23 VAL A 113 -5.871 2.594 -2.144 1.00 12.35 H new ATOM 1902 N LYS A 114 -6.845 6.100 0.698 1.00 45.33 N ATOM 1903 CA LYS A 114 -7.330 7.317 1.364 1.00 5.34 C ATOM 1904 C LYS A 114 -7.036 7.300 2.873 1.00 13.11 C ATOM 1905 O LYS A 114 -6.420 8.234 3.384 1.00 72.51 O ATOM 1906 CB LYS A 114 -8.844 7.422 1.120 1.00 71.23 C ATOM 1907 CG LYS A 114 -9.545 8.671 1.690 1.00 55.40 C ATOM 1908 CD LYS A 114 -11.072 8.649 1.424 1.00 12.23 C ATOM 1909 CE LYS A 114 -11.419 8.370 -0.054 1.00 44.43 C ATOM 1910 NZ LYS A 114 -12.864 8.532 -0.349 1.00 44.23 N ATOM 0 H LYS A 114 -7.594 5.557 0.268 1.00 45.33 H new ATOM 0 HA LYS A 114 -6.810 8.181 0.950 1.00 5.34 H new ATOM 0 HB2 LYS A 114 -9.020 7.393 0.045 1.00 71.23 H new ATOM 0 HB3 LYS A 114 -9.321 6.539 1.545 1.00 71.23 H new ATOM 0 HG2 LYS A 114 -9.364 8.731 2.763 1.00 55.40 H new ATOM 0 HG3 LYS A 114 -9.112 9.566 1.244 1.00 55.40 H new ATOM 0 HD2 LYS A 114 -11.534 7.886 2.051 1.00 12.23 H new ATOM 0 HD3 LYS A 114 -11.501 9.607 1.718 1.00 12.23 H new ATOM 0 HE2 LYS A 114 -10.846 9.045 -0.690 1.00 44.43 H new ATOM 0 HE3 LYS A 114 -11.113 7.355 -0.308 1.00 44.43 H new ATOM 0 HZ1 LYS A 114 -13.222 7.672 -0.811 1.00 44.23 H new ATOM 0 HZ2 LYS A 114 -13.384 8.691 0.538 1.00 44.23 H new ATOM 0 HZ3 LYS A 114 -13.000 9.347 -0.981 1.00 44.23 H new ATOM 1924 N LYS A 115 -7.456 6.216 3.571 1.00 22.55 N ATOM 1925 CA LYS A 115 -7.252 6.080 5.029 1.00 42.24 C ATOM 1926 C LYS A 115 -5.757 6.083 5.373 1.00 43.05 C ATOM 1927 O LYS A 115 -5.340 6.789 6.286 1.00 4.51 O ATOM 1928 CB LYS A 115 -7.923 4.792 5.588 1.00 63.32 C ATOM 1929 CG LYS A 115 -9.469 4.830 5.641 1.00 30.05 C ATOM 1930 CD LYS A 115 -10.015 5.964 6.543 1.00 62.25 C ATOM 1931 CE LYS A 115 -11.548 5.961 6.640 1.00 43.24 C ATOM 1932 NZ LYS A 115 -12.052 7.061 7.508 1.00 65.10 N ATOM 0 H LYS A 115 -7.938 5.425 3.145 1.00 22.55 H new ATOM 0 HA LYS A 115 -7.727 6.940 5.501 1.00 42.24 H new ATOM 0 HB2 LYS A 115 -7.616 3.945 4.974 1.00 63.32 H new ATOM 0 HB3 LYS A 115 -7.544 4.610 6.594 1.00 63.32 H new ATOM 0 HG2 LYS A 115 -9.859 4.957 4.631 1.00 30.05 H new ATOM 0 HG3 LYS A 115 -9.838 3.872 6.007 1.00 30.05 H new ATOM 0 HD2 LYS A 115 -9.592 5.863 7.542 1.00 62.25 H new ATOM 0 HD3 LYS A 115 -9.682 6.925 6.152 1.00 62.25 H new ATOM 0 HE2 LYS A 115 -11.975 6.061 5.642 1.00 43.24 H new ATOM 0 HE3 LYS A 115 -11.885 5.003 7.036 1.00 43.24 H new ATOM 0 HZ1 LYS A 115 -13.091 7.024 7.547 1.00 65.10 H new ATOM 0 HZ2 LYS A 115 -11.665 6.951 8.467 1.00 65.10 H new ATOM 0 HZ3 LYS A 115 -11.753 7.977 7.117 1.00 65.10 H new ATOM 1946 N LEU A 116 -4.971 5.327 4.584 1.00 73.54 N ATOM 1947 CA LEU A 116 -3.521 5.174 4.787 1.00 64.11 C ATOM 1948 C LEU A 116 -2.787 6.526 4.658 1.00 63.00 C ATOM 1949 O LEU A 116 -2.037 6.897 5.566 1.00 12.42 O ATOM 1950 CB LEU A 116 -2.956 4.102 3.804 1.00 4.23 C ATOM 1951 CG LEU A 116 -3.357 2.617 4.112 1.00 23.22 C ATOM 1952 CD1 LEU A 116 -2.975 1.666 2.960 1.00 11.32 C ATOM 1953 CD2 LEU A 116 -2.724 2.141 5.436 1.00 23.22 C ATOM 0 H LEU A 116 -5.327 4.803 3.784 1.00 73.54 H new ATOM 0 HA LEU A 116 -3.345 4.824 5.804 1.00 64.11 H new ATOM 0 HB2 LEU A 116 -3.291 4.348 2.796 1.00 4.23 H new ATOM 0 HB3 LEU A 116 -1.868 4.173 3.805 1.00 4.23 H new ATOM 0 HG LEU A 116 -4.442 2.592 4.213 1.00 23.22 H new ATOM 0 HD11 LEU A 116 -3.271 0.648 3.215 1.00 11.32 H new ATOM 0 HD12 LEU A 116 -3.487 1.975 2.048 1.00 11.32 H new ATOM 0 HD13 LEU A 116 -1.897 1.702 2.801 1.00 11.32 H new ATOM 0 HD21 LEU A 116 -3.016 1.109 5.629 1.00 23.22 H new ATOM 0 HD22 LEU A 116 -1.638 2.203 5.363 1.00 23.22 H new ATOM 0 HD23 LEU A 116 -3.070 2.774 6.253 1.00 23.22 H new ATOM 1965 N LYS A 117 -3.014 7.264 3.548 1.00 3.44 N ATOM 1966 CA LYS A 117 -2.409 8.605 3.356 1.00 23.00 C ATOM 1967 C LYS A 117 -2.929 9.664 4.361 1.00 40.23 C ATOM 1968 O LYS A 117 -2.192 10.596 4.710 1.00 45.30 O ATOM 1969 CB LYS A 117 -2.537 9.076 1.882 1.00 33.03 C ATOM 1970 CG LYS A 117 -3.960 9.398 1.371 1.00 60.04 C ATOM 1971 CD LYS A 117 -4.011 9.573 -0.177 1.00 5.14 C ATOM 1972 CE LYS A 117 -3.041 10.652 -0.691 1.00 33.15 C ATOM 1973 NZ LYS A 117 -3.089 10.801 -2.174 1.00 44.42 N ATOM 0 H LYS A 117 -3.607 6.958 2.776 1.00 3.44 H new ATOM 0 HA LYS A 117 -1.347 8.499 3.577 1.00 23.00 H new ATOM 0 HB2 LYS A 117 -1.922 9.967 1.756 1.00 33.03 H new ATOM 0 HB3 LYS A 117 -2.113 8.303 1.241 1.00 33.03 H new ATOM 0 HG2 LYS A 117 -4.639 8.598 1.666 1.00 60.04 H new ATOM 0 HG3 LYS A 117 -4.317 10.310 1.849 1.00 60.04 H new ATOM 0 HD2 LYS A 117 -3.773 8.622 -0.653 1.00 5.14 H new ATOM 0 HD3 LYS A 117 -5.027 9.833 -0.475 1.00 5.14 H new ATOM 0 HE2 LYS A 117 -3.284 11.607 -0.225 1.00 33.15 H new ATOM 0 HE3 LYS A 117 -2.026 10.398 -0.387 1.00 33.15 H new ATOM 0 HZ1 LYS A 117 -2.510 11.616 -2.460 1.00 44.42 H new ATOM 0 HZ2 LYS A 117 -2.718 9.939 -2.622 1.00 44.42 H new ATOM 0 HZ3 LYS A 117 -4.073 10.953 -2.476 1.00 44.42 H new ATOM 1987 N GLU A 118 -4.183 9.512 4.840 1.00 71.14 N ATOM 1988 CA GLU A 118 -4.737 10.368 5.922 1.00 25.20 C ATOM 1989 C GLU A 118 -4.122 10.039 7.300 1.00 22.14 C ATOM 1990 O GLU A 118 -4.066 10.915 8.178 1.00 24.04 O ATOM 1991 CB GLU A 118 -6.289 10.263 5.982 1.00 21.20 C ATOM 1992 CG GLU A 118 -7.036 11.069 4.895 1.00 32.20 C ATOM 1993 CD GLU A 118 -6.813 12.588 5.026 1.00 43.11 C ATOM 1994 OE1 GLU A 118 -7.447 13.215 5.898 1.00 13.03 O ATOM 1995 OE2 GLU A 118 -6.001 13.164 4.277 1.00 22.04 O ATOM 0 H GLU A 118 -4.834 8.806 4.497 1.00 71.14 H new ATOM 0 HA GLU A 118 -4.466 11.395 5.678 1.00 25.20 H new ATOM 0 HB2 GLU A 118 -6.572 9.214 5.895 1.00 21.20 H new ATOM 0 HB3 GLU A 118 -6.625 10.603 6.962 1.00 21.20 H new ATOM 0 HG2 GLU A 118 -6.703 10.740 3.911 1.00 32.20 H new ATOM 0 HG3 GLU A 118 -8.103 10.855 4.958 1.00 32.20 H new ATOM 2002 N GLU A 119 -3.676 8.787 7.489 1.00 43.53 N ATOM 2003 CA GLU A 119 -2.954 8.380 8.704 1.00 52.15 C ATOM 2004 C GLU A 119 -1.533 8.961 8.680 1.00 5.43 C ATOM 2005 O GLU A 119 -1.105 9.641 9.625 1.00 71.41 O ATOM 2006 CB GLU A 119 -2.892 6.827 8.831 1.00 41.33 C ATOM 2007 CG GLU A 119 -4.229 6.128 9.144 1.00 32.31 C ATOM 2008 CD GLU A 119 -4.900 6.650 10.429 1.00 33.02 C ATOM 2009 OE1 GLU A 119 -4.389 6.372 11.529 1.00 3.12 O ATOM 2010 OE2 GLU A 119 -5.940 7.342 10.343 1.00 24.03 O ATOM 0 H GLU A 119 -3.804 8.036 6.811 1.00 43.53 H new ATOM 0 HA GLU A 119 -3.493 8.767 9.568 1.00 52.15 H new ATOM 0 HB2 GLU A 119 -2.500 6.420 7.899 1.00 41.33 H new ATOM 0 HB3 GLU A 119 -2.178 6.573 9.615 1.00 41.33 H new ATOM 0 HG2 GLU A 119 -4.910 6.267 8.304 1.00 32.31 H new ATOM 0 HG3 GLU A 119 -4.057 5.056 9.241 1.00 32.31 H new ATOM 2017 N ILE A 120 -0.827 8.727 7.559 1.00 62.33 N ATOM 2018 CA ILE A 120 0.609 9.022 7.444 1.00 13.22 C ATOM 2019 C ILE A 120 0.887 10.500 7.110 1.00 62.14 C ATOM 2020 O ILE A 120 2.045 10.913 7.105 1.00 24.11 O ATOM 2021 CB ILE A 120 1.325 8.074 6.400 1.00 40.14 C ATOM 2022 CG1 ILE A 120 0.892 8.398 4.936 1.00 62.42 C ATOM 2023 CG2 ILE A 120 1.063 6.585 6.743 1.00 34.13 C ATOM 2024 CD1 ILE A 120 1.593 7.583 3.850 1.00 3.31 C ATOM 0 H ILE A 120 -1.235 8.330 6.713 1.00 62.33 H new ATOM 0 HA ILE A 120 1.032 8.825 8.429 1.00 13.22 H new ATOM 0 HB ILE A 120 2.397 8.257 6.468 1.00 40.14 H new ATOM 0 HG12 ILE A 120 -0.183 8.239 4.849 1.00 62.42 H new ATOM 0 HG13 ILE A 120 1.074 9.456 4.747 1.00 62.42 H new ATOM 0 HG21 ILE A 120 1.564 5.950 6.013 1.00 34.13 H new ATOM 0 HG22 ILE A 120 1.449 6.368 7.739 1.00 34.13 H new ATOM 0 HG23 ILE A 120 -0.009 6.389 6.719 1.00 34.13 H new ATOM 0 HD11 ILE A 120 1.221 7.885 2.871 1.00 3.31 H new ATOM 0 HD12 ILE A 120 2.668 7.759 3.900 1.00 3.31 H new ATOM 0 HD13 ILE A 120 1.391 6.523 4.004 1.00 3.31 H new ATOM 2036 N LYS A 121 -0.163 11.323 6.885 1.00 65.44 N ATOM 2037 CA LYS A 121 0.026 12.779 6.673 1.00 52.41 C ATOM 2038 C LYS A 121 0.497 13.469 7.973 1.00 0.15 C ATOM 2039 O LYS A 121 0.948 14.618 7.947 1.00 3.13 O ATOM 2040 CB LYS A 121 -1.249 13.461 6.107 1.00 13.15 C ATOM 2041 CG LYS A 121 -2.437 13.578 7.083 1.00 34.30 C ATOM 2042 CD LYS A 121 -3.558 14.494 6.531 1.00 55.20 C ATOM 2043 CE LYS A 121 -4.642 14.800 7.579 1.00 64.13 C ATOM 2044 NZ LYS A 121 -5.356 13.575 8.038 1.00 15.53 N ATOM 0 H LYS A 121 -1.134 11.012 6.846 1.00 65.44 H new ATOM 0 HA LYS A 121 0.807 12.895 5.921 1.00 52.41 H new ATOM 0 HB2 LYS A 121 -0.982 14.462 5.767 1.00 13.15 H new ATOM 0 HB3 LYS A 121 -1.577 12.904 5.230 1.00 13.15 H new ATOM 0 HG2 LYS A 121 -2.844 12.586 7.278 1.00 34.30 H new ATOM 0 HG3 LYS A 121 -2.085 13.972 8.036 1.00 34.30 H new ATOM 0 HD2 LYS A 121 -3.119 15.429 6.184 1.00 55.20 H new ATOM 0 HD3 LYS A 121 -4.019 14.017 5.666 1.00 55.20 H new ATOM 0 HE2 LYS A 121 -4.184 15.292 8.437 1.00 64.13 H new ATOM 0 HE3 LYS A 121 -5.363 15.500 7.157 1.00 64.13 H new ATOM 0 HZ1 LYS A 121 -5.745 13.736 8.989 1.00 15.53 H new ATOM 0 HZ2 LYS A 121 -6.131 13.358 7.379 1.00 15.53 H new ATOM 0 HZ3 LYS A 121 -4.691 12.776 8.066 1.00 15.53 H new ATOM 2058 N ASN A 122 0.399 12.732 9.097 1.00 31.44 N ATOM 2059 CA ASN A 122 0.811 13.183 10.443 1.00 14.55 C ATOM 2060 C ASN A 122 2.265 12.750 10.770 1.00 13.00 C ATOM 2061 O ASN A 122 2.790 13.072 11.847 1.00 31.21 O ATOM 2062 CB ASN A 122 -0.177 12.592 11.488 1.00 24.21 C ATOM 2063 CG ASN A 122 -1.644 12.961 11.217 1.00 2.01 C ATOM 2064 OD1 ASN A 122 -1.956 14.051 10.727 1.00 33.23 O ATOM 2065 ND2 ASN A 122 -2.555 12.042 11.501 1.00 22.41 N ATOM 0 H ASN A 122 0.022 11.784 9.095 1.00 31.44 H new ATOM 0 HA ASN A 122 0.785 14.272 10.474 1.00 14.55 H new ATOM 0 HB2 ASN A 122 -0.079 11.506 11.497 1.00 24.21 H new ATOM 0 HB3 ASN A 122 0.101 12.945 12.481 1.00 24.21 H new ATOM 0 HD21 ASN A 122 -3.541 12.227 11.315 1.00 22.41 H new ATOM 0 HD22 ASN A 122 -2.271 11.150 11.905 1.00 22.41 H new ATOM 2072 N ASN A 123 2.901 12.013 9.835 1.00 23.52 N ATOM 2073 CA ASN A 123 4.296 11.511 9.982 1.00 52.41 C ATOM 2074 C ASN A 123 5.337 12.605 9.674 1.00 43.13 C ATOM 2075 O ASN A 123 4.999 13.681 9.163 1.00 64.04 O ATOM 2076 CB ASN A 123 4.546 10.321 9.020 1.00 4.31 C ATOM 2077 CG ASN A 123 3.763 9.046 9.321 1.00 20.44 C ATOM 2078 OD1 ASN A 123 2.760 9.046 10.036 1.00 2.35 O ATOM 2079 ND2 ASN A 123 4.191 7.951 8.719 1.00 25.54 N ATOM 0 H ASN A 123 2.466 11.745 8.952 1.00 23.52 H new ATOM 0 HA ASN A 123 4.409 11.196 11.019 1.00 52.41 H new ATOM 0 HB2 ASN A 123 4.306 10.641 8.006 1.00 4.31 H new ATOM 0 HB3 ASN A 123 5.610 10.083 9.035 1.00 4.31 H new ATOM 0 HD21 ASN A 123 3.687 7.072 8.840 1.00 25.54 H new ATOM 0 HD22 ASN A 123 5.025 7.984 8.133 1.00 25.54 H new ATOM 2086 N ASN A 124 6.614 12.290 9.970 1.00 13.52 N ATOM 2087 CA ASN A 124 7.782 13.142 9.632 1.00 44.11 C ATOM 2088 C ASN A 124 8.745 12.418 8.665 1.00 40.35 C ATOM 2089 O ASN A 124 9.773 12.984 8.279 1.00 75.21 O ATOM 2090 CB ASN A 124 8.529 13.585 10.929 1.00 12.23 C ATOM 2091 CG ASN A 124 8.900 12.447 11.902 1.00 25.45 C ATOM 2092 OD1 ASN A 124 9.065 11.285 11.518 1.00 32.44 O ATOM 2093 ND2 ASN A 124 9.055 12.784 13.174 1.00 74.01 N ATOM 0 H ASN A 124 6.871 11.430 10.455 1.00 13.52 H new ATOM 0 HA ASN A 124 7.412 14.033 9.124 1.00 44.11 H new ATOM 0 HB2 ASN A 124 9.442 14.106 10.642 1.00 12.23 H new ATOM 0 HB3 ASN A 124 7.905 14.304 11.459 1.00 12.23 H new ATOM 0 HD21 ASN A 124 9.316 12.077 13.861 1.00 74.01 H new ATOM 0 HD22 ASN A 124 8.913 13.751 13.466 1.00 74.01 H new ATOM 2100 N ASN A 125 8.399 11.179 8.254 1.00 2.11 N ATOM 2101 CA ASN A 125 9.266 10.343 7.379 1.00 42.41 C ATOM 2102 C ASN A 125 8.655 10.194 5.975 1.00 12.42 C ATOM 2103 O ASN A 125 9.056 9.310 5.214 1.00 30.40 O ATOM 2104 CB ASN A 125 9.521 8.941 8.023 1.00 53.41 C ATOM 2105 CG ASN A 125 8.279 8.038 8.112 1.00 5.34 C ATOM 2106 OD1 ASN A 125 7.150 8.502 8.263 1.00 4.23 O ATOM 2107 ND2 ASN A 125 8.481 6.729 8.032 1.00 13.24 N ATOM 0 H ASN A 125 7.521 10.729 8.513 1.00 2.11 H new ATOM 0 HA ASN A 125 10.225 10.850 7.277 1.00 42.41 H new ATOM 0 HB2 ASN A 125 10.288 8.425 7.445 1.00 53.41 H new ATOM 0 HB3 ASN A 125 9.921 9.085 9.027 1.00 53.41 H new ATOM 0 HD21 ASN A 125 7.692 6.086 8.096 1.00 13.24 H new ATOM 0 HD22 ASN A 125 9.426 6.365 7.907 1.00 13.24 H new ATOM 2114 N ILE A 126 7.731 11.098 5.610 1.00 55.21 N ATOM 2115 CA ILE A 126 7.034 11.023 4.318 1.00 72.55 C ATOM 2116 C ILE A 126 7.901 11.643 3.223 1.00 24.34 C ATOM 2117 O ILE A 126 8.420 12.755 3.386 1.00 42.41 O ATOM 2118 CB ILE A 126 5.636 11.741 4.322 1.00 51.14 C ATOM 2119 CG1 ILE A 126 4.740 11.209 5.468 1.00 45.13 C ATOM 2120 CG2 ILE A 126 4.924 11.584 2.946 1.00 42.11 C ATOM 2121 CD1 ILE A 126 4.478 9.715 5.423 1.00 34.14 C ATOM 0 H ILE A 126 7.451 11.888 6.191 1.00 55.21 H new ATOM 0 HA ILE A 126 6.858 9.964 4.127 1.00 72.55 H new ATOM 0 HB ILE A 126 5.808 12.803 4.494 1.00 51.14 H new ATOM 0 HG12 ILE A 126 5.208 11.454 6.421 1.00 45.13 H new ATOM 0 HG13 ILE A 126 3.785 11.733 5.438 1.00 45.13 H new ATOM 0 HG21 ILE A 126 3.959 12.090 2.976 1.00 42.11 H new ATOM 0 HG22 ILE A 126 5.542 12.026 2.164 1.00 42.11 H new ATOM 0 HG23 ILE A 126 4.772 10.526 2.733 1.00 42.11 H new ATOM 0 HD11 ILE A 126 3.843 9.432 6.262 1.00 34.14 H new ATOM 0 HD12 ILE A 126 3.979 9.461 4.488 1.00 34.14 H new ATOM 0 HD13 ILE A 126 5.424 9.178 5.487 1.00 34.14 H new ATOM 2133 N MET A 127 8.066 10.897 2.129 1.00 34.11 N ATOM 2134 CA MET A 127 8.664 11.410 0.902 1.00 71.12 C ATOM 2135 C MET A 127 7.614 12.278 0.184 1.00 2.32 C ATOM 2136 O MET A 127 6.487 11.824 -0.061 1.00 60.14 O ATOM 2137 CB MET A 127 9.143 10.243 0.000 1.00 32.11 C ATOM 2138 CG MET A 127 10.073 9.235 0.695 1.00 1.31 C ATOM 2139 SD MET A 127 10.697 7.954 -0.419 1.00 62.43 S ATOM 2140 CE MET A 127 9.182 7.250 -1.081 1.00 55.11 C ATOM 0 H MET A 127 7.787 9.918 2.072 1.00 34.11 H new ATOM 0 HA MET A 127 9.541 12.015 1.133 1.00 71.12 H new ATOM 0 HB2 MET A 127 8.270 9.711 -0.377 1.00 32.11 H new ATOM 0 HB3 MET A 127 9.661 10.659 -0.864 1.00 32.11 H new ATOM 0 HG2 MET A 127 10.916 9.770 1.131 1.00 1.31 H new ATOM 0 HG3 MET A 127 9.536 8.762 1.517 1.00 1.31 H new ATOM 0 HE1 MET A 127 9.422 6.383 -1.696 1.00 55.11 H new ATOM 0 HE2 MET A 127 8.534 6.944 -0.260 1.00 55.11 H new ATOM 0 HE3 MET A 127 8.670 7.996 -1.689 1.00 55.11 H new ATOM 2150 N ILE A 128 7.993 13.530 -0.125 1.00 62.11 N ATOM 2151 CA ILE A 128 7.117 14.522 -0.803 1.00 30.23 C ATOM 2152 C ILE A 128 6.684 14.012 -2.206 1.00 0.41 C ATOM 2153 O ILE A 128 5.654 14.428 -2.750 1.00 64.50 O ATOM 2154 CB ILE A 128 7.844 15.927 -0.933 1.00 64.04 C ATOM 2155 CG1 ILE A 128 8.351 16.420 0.457 1.00 71.42 C ATOM 2156 CG2 ILE A 128 6.928 16.993 -1.595 1.00 74.41 C ATOM 2157 CD1 ILE A 128 9.116 17.738 0.439 1.00 12.10 C ATOM 0 H ILE A 128 8.922 13.892 0.087 1.00 62.11 H new ATOM 0 HA ILE A 128 6.225 14.650 -0.190 1.00 30.23 H new ATOM 0 HB ILE A 128 8.706 15.787 -1.586 1.00 64.04 H new ATOM 0 HG12 ILE A 128 7.494 16.525 1.122 1.00 71.42 H new ATOM 0 HG13 ILE A 128 8.994 15.651 0.885 1.00 71.42 H new ATOM 0 HG21 ILE A 128 7.463 17.940 -1.665 1.00 74.41 H new ATOM 0 HG22 ILE A 128 6.646 16.661 -2.594 1.00 74.41 H new ATOM 0 HG23 ILE A 128 6.031 17.127 -0.991 1.00 74.41 H new ATOM 0 HD11 ILE A 128 9.425 17.993 1.453 1.00 12.10 H new ATOM 0 HD12 ILE A 128 9.997 17.639 -0.195 1.00 12.10 H new ATOM 0 HD13 ILE A 128 8.474 18.526 0.046 1.00 12.10 H new ATOM 2169 N LYS A 129 7.485 13.080 -2.760 1.00 74.13 N ATOM 2170 CA LYS A 129 7.282 12.479 -4.090 1.00 14.14 C ATOM 2171 C LYS A 129 7.089 10.948 -3.913 1.00 13.32 C ATOM 2172 O LYS A 129 7.348 10.402 -2.836 1.00 5.42 O ATOM 2173 CB LYS A 129 8.492 12.759 -5.050 1.00 25.02 C ATOM 2174 CG LYS A 129 8.706 14.220 -5.533 1.00 73.54 C ATOM 2175 CD LYS A 129 9.059 15.204 -4.397 1.00 22.10 C ATOM 2176 CE LYS A 129 9.609 16.549 -4.897 1.00 42.33 C ATOM 2177 NZ LYS A 129 10.943 16.394 -5.556 1.00 64.54 N ATOM 0 H LYS A 129 8.310 12.717 -2.282 1.00 74.13 H new ATOM 0 HA LYS A 129 6.400 12.928 -4.546 1.00 14.14 H new ATOM 0 HB2 LYS A 129 9.402 12.436 -4.546 1.00 25.02 H new ATOM 0 HB3 LYS A 129 8.374 12.128 -5.931 1.00 25.02 H new ATOM 0 HG2 LYS A 129 9.504 14.235 -6.275 1.00 73.54 H new ATOM 0 HG3 LYS A 129 7.800 14.565 -6.032 1.00 73.54 H new ATOM 0 HD2 LYS A 129 8.168 15.386 -3.796 1.00 22.10 H new ATOM 0 HD3 LYS A 129 9.797 14.740 -3.742 1.00 22.10 H new ATOM 0 HE2 LYS A 129 8.904 16.990 -5.602 1.00 42.33 H new ATOM 0 HE3 LYS A 129 9.696 17.240 -4.059 1.00 42.33 H new ATOM 0 HZ1 LYS A 129 11.372 17.331 -5.696 1.00 64.54 H new ATOM 0 HZ2 LYS A 129 11.563 15.816 -4.953 1.00 64.54 H new ATOM 0 HZ3 LYS A 129 10.823 15.927 -6.477 1.00 64.54 H new ATOM 2191 N TYR A 130 6.603 10.282 -4.962 1.00 11.30 N ATOM 2192 CA TYR A 130 6.449 8.816 -5.018 1.00 64.34 C ATOM 2193 C TYR A 130 6.838 8.315 -6.425 1.00 2.24 C ATOM 2194 O TYR A 130 7.157 9.111 -7.317 1.00 1.54 O ATOM 2195 CB TYR A 130 4.989 8.384 -4.655 1.00 20.14 C ATOM 2196 CG TYR A 130 3.965 8.524 -5.798 1.00 44.00 C ATOM 2197 CD1 TYR A 130 3.644 9.770 -6.336 1.00 44.45 C ATOM 2198 CD2 TYR A 130 3.332 7.399 -6.344 1.00 24.22 C ATOM 2199 CE1 TYR A 130 2.743 9.893 -7.372 1.00 42.35 C ATOM 2200 CE2 TYR A 130 2.428 7.519 -7.378 1.00 41.24 C ATOM 2201 CZ TYR A 130 2.134 8.764 -7.888 1.00 41.33 C ATOM 2202 OH TYR A 130 1.239 8.883 -8.931 1.00 1.31 O ATOM 0 H TYR A 130 6.298 10.750 -5.816 1.00 11.30 H new ATOM 0 HA TYR A 130 7.112 8.364 -4.280 1.00 64.34 H new ATOM 0 HB2 TYR A 130 5.005 7.345 -4.327 1.00 20.14 H new ATOM 0 HB3 TYR A 130 4.650 8.981 -3.808 1.00 20.14 H new ATOM 0 HD1 TYR A 130 4.111 10.657 -5.933 1.00 44.45 H new ATOM 0 HD2 TYR A 130 3.557 6.420 -5.947 1.00 24.22 H new ATOM 0 HE1 TYR A 130 2.514 10.867 -7.779 1.00 42.35 H new ATOM 0 HE2 TYR A 130 1.952 6.640 -7.787 1.00 41.24 H new ATOM 0 HH TYR A 130 1.326 9.771 -9.337 1.00 1.31 H new ATOM 2212 N HIS A 131 6.820 6.989 -6.595 1.00 42.32 N ATOM 2213 CA HIS A 131 7.086 6.324 -7.883 1.00 31.21 C ATOM 2214 C HIS A 131 5.767 5.731 -8.427 1.00 43.32 C ATOM 2215 O HIS A 131 5.178 4.867 -7.775 1.00 53.54 O ATOM 2216 CB HIS A 131 8.151 5.227 -7.686 1.00 31.11 C ATOM 2217 CG HIS A 131 9.438 5.740 -7.083 1.00 31.23 C ATOM 2218 ND1 HIS A 131 10.518 6.062 -7.860 1.00 71.44 N ATOM 2219 CD2 HIS A 131 9.755 5.952 -5.781 1.00 14.23 C ATOM 2220 CE1 HIS A 131 11.462 6.449 -7.034 1.00 12.04 C ATOM 2221 NE2 HIS A 131 11.045 6.406 -5.760 1.00 73.01 N ATOM 0 H HIS A 131 6.619 6.337 -5.837 1.00 42.32 H new ATOM 0 HA HIS A 131 7.469 7.043 -8.608 1.00 31.21 H new ATOM 0 HB2 HIS A 131 7.743 4.447 -7.043 1.00 31.11 H new ATOM 0 HB3 HIS A 131 8.369 4.765 -8.649 1.00 31.11 H new ATOM 0 HD1 HIS A 131 10.577 6.011 -8.877 1.00 71.44 H new ATOM 0 HD2 HIS A 131 9.113 5.793 -4.927 1.00 14.23 H new ATOM 0 HE1 HIS A 131 12.449 6.762 -7.341 1.00 12.04 H new ATOM 0 HE2 HIS A 131 11.586 6.663 -4.934 1.00 73.01 H new ATOM 2229 N PRO A 132 5.256 6.208 -9.607 1.00 11.33 N ATOM 2230 CA PRO A 132 3.965 5.736 -10.183 1.00 31.22 C ATOM 2231 C PRO A 132 4.032 4.343 -10.849 1.00 24.55 C ATOM 2232 O PRO A 132 3.015 3.871 -11.364 1.00 3.21 O ATOM 2233 CB PRO A 132 3.649 6.831 -11.227 1.00 42.44 C ATOM 2234 CG PRO A 132 4.997 7.281 -11.697 1.00 34.41 C ATOM 2235 CD PRO A 132 5.868 7.269 -10.460 1.00 34.25 C ATOM 0 HA PRO A 132 3.208 5.603 -9.410 1.00 31.22 H new ATOM 0 HB2 PRO A 132 3.050 6.438 -12.049 1.00 42.44 H new ATOM 0 HB3 PRO A 132 3.085 7.653 -10.786 1.00 42.44 H new ATOM 0 HG2 PRO A 132 5.391 6.613 -12.463 1.00 34.41 H new ATOM 0 HG3 PRO A 132 4.949 8.277 -12.136 1.00 34.41 H new ATOM 0 HD2 PRO A 132 6.905 7.039 -10.703 1.00 34.25 H new ATOM 0 HD3 PRO A 132 5.865 8.237 -9.959 1.00 34.25 H new ATOM 2243 N LYS A 133 5.227 3.717 -10.872 1.00 52.54 N ATOM 2244 CA LYS A 133 5.446 2.385 -11.492 1.00 21.12 C ATOM 2245 C LYS A 133 5.969 1.366 -10.448 1.00 73.13 C ATOM 2246 O LYS A 133 6.151 1.705 -9.273 1.00 0.54 O ATOM 2247 CB LYS A 133 6.414 2.509 -12.698 1.00 42.50 C ATOM 2248 CG LYS A 133 5.898 3.386 -13.871 1.00 44.52 C ATOM 2249 CD LYS A 133 4.599 2.848 -14.509 1.00 11.50 C ATOM 2250 CE LYS A 133 4.142 3.676 -15.722 1.00 62.11 C ATOM 2251 NZ LYS A 133 5.120 3.625 -16.848 1.00 11.41 N ATOM 0 H LYS A 133 6.071 4.118 -10.462 1.00 52.54 H new ATOM 0 HA LYS A 133 4.491 2.011 -11.860 1.00 21.12 H new ATOM 0 HB2 LYS A 133 7.359 2.922 -12.344 1.00 42.50 H new ATOM 0 HB3 LYS A 133 6.626 1.510 -13.078 1.00 42.50 H new ATOM 0 HG2 LYS A 133 5.724 4.399 -13.509 1.00 44.52 H new ATOM 0 HG3 LYS A 133 6.672 3.449 -14.636 1.00 44.52 H new ATOM 0 HD2 LYS A 133 4.753 1.814 -14.818 1.00 11.50 H new ATOM 0 HD3 LYS A 133 3.807 2.842 -13.760 1.00 11.50 H new ATOM 0 HE2 LYS A 133 3.176 3.307 -16.067 1.00 62.11 H new ATOM 0 HE3 LYS A 133 3.997 4.712 -15.417 1.00 62.11 H new ATOM 0 HZ1 LYS A 133 4.709 4.083 -17.686 1.00 11.41 H new ATOM 0 HZ2 LYS A 133 5.991 4.123 -16.574 1.00 11.41 H new ATOM 0 HZ3 LYS A 133 5.343 2.634 -17.070 1.00 11.41 H new ATOM 2265 N PHE A 134 6.201 0.111 -10.898 1.00 33.34 N ATOM 2266 CA PHE A 134 6.523 -1.025 -10.006 1.00 74.40 C ATOM 2267 C PHE A 134 8.039 -1.120 -9.744 1.00 51.52 C ATOM 2268 O PHE A 134 8.848 -1.057 -10.672 1.00 72.03 O ATOM 2269 CB PHE A 134 6.015 -2.366 -10.614 1.00 33.42 C ATOM 2270 CG PHE A 134 4.498 -2.479 -10.723 1.00 13.12 C ATOM 2271 CD1 PHE A 134 3.737 -2.862 -9.622 1.00 14.10 C ATOM 2272 CD2 PHE A 134 3.833 -2.205 -11.916 1.00 65.44 C ATOM 2273 CE1 PHE A 134 2.364 -2.966 -9.709 1.00 54.31 C ATOM 2274 CE2 PHE A 134 2.462 -2.309 -12.006 1.00 42.24 C ATOM 2275 CZ PHE A 134 1.726 -2.688 -10.903 1.00 61.53 C ATOM 0 H PHE A 134 6.170 -0.141 -11.886 1.00 33.34 H new ATOM 0 HA PHE A 134 6.016 -0.846 -9.058 1.00 74.40 H new ATOM 0 HB2 PHE A 134 6.447 -2.486 -11.607 1.00 33.42 H new ATOM 0 HB3 PHE A 134 6.385 -3.190 -10.003 1.00 33.42 H new ATOM 0 HD1 PHE A 134 4.229 -3.081 -8.686 1.00 14.10 H new ATOM 0 HD2 PHE A 134 4.401 -1.906 -12.784 1.00 65.44 H new ATOM 0 HE1 PHE A 134 1.789 -3.264 -8.845 1.00 54.31 H new ATOM 0 HE2 PHE A 134 1.964 -2.094 -12.940 1.00 42.24 H new ATOM 0 HZ PHE A 134 0.651 -2.768 -10.972 1.00 61.53 H new ATOM 2285 N TRP A 135 8.401 -1.296 -8.465 1.00 23.51 N ATOM 2286 CA TRP A 135 9.771 -1.580 -8.037 1.00 71.02 C ATOM 2287 C TRP A 135 10.089 -3.056 -8.315 1.00 33.31 C ATOM 2288 O TRP A 135 9.716 -3.955 -7.552 1.00 2.32 O ATOM 2289 CB TRP A 135 9.977 -1.218 -6.540 1.00 42.41 C ATOM 2290 CG TRP A 135 10.182 0.262 -6.295 1.00 63.44 C ATOM 2291 CD1 TRP A 135 9.383 1.289 -6.715 1.00 54.41 C ATOM 2292 CD2 TRP A 135 11.266 0.877 -5.579 1.00 34.11 C ATOM 2293 NE1 TRP A 135 9.905 2.486 -6.310 1.00 51.35 N ATOM 2294 CE2 TRP A 135 11.054 2.265 -5.611 1.00 3.31 C ATOM 2295 CE3 TRP A 135 12.391 0.387 -4.915 1.00 51.24 C ATOM 2296 CZ2 TRP A 135 11.921 3.168 -5.009 1.00 55.22 C ATOM 2297 CZ3 TRP A 135 13.256 1.286 -4.318 1.00 11.44 C ATOM 2298 CH2 TRP A 135 13.013 2.665 -4.368 1.00 22.22 C ATOM 0 H TRP A 135 7.739 -1.244 -7.691 1.00 23.51 H new ATOM 0 HA TRP A 135 10.464 -0.960 -8.606 1.00 71.02 H new ATOM 0 HB2 TRP A 135 9.110 -1.555 -5.971 1.00 42.41 H new ATOM 0 HB3 TRP A 135 10.840 -1.764 -6.159 1.00 42.41 H new ATOM 0 HD1 TRP A 135 8.472 1.172 -7.284 1.00 54.41 H new ATOM 0 HE1 TRP A 135 9.498 3.402 -6.501 1.00 51.35 H new ATOM 0 HE3 TRP A 135 12.583 -0.675 -4.868 1.00 51.24 H new ATOM 0 HZ2 TRP A 135 11.736 4.231 -5.048 1.00 55.22 H new ATOM 0 HZ3 TRP A 135 14.133 0.919 -3.805 1.00 11.44 H new ATOM 0 HH2 TRP A 135 13.705 3.342 -3.889 1.00 22.22 H new ATOM 2309 N THR A 136 10.718 -3.272 -9.465 1.00 35.23 N ATOM 2310 CA THR A 136 11.166 -4.574 -9.936 1.00 41.33 C ATOM 2311 C THR A 136 12.604 -4.410 -10.439 1.00 43.41 C ATOM 2312 O THR A 136 12.876 -3.563 -11.306 1.00 72.30 O ATOM 2313 CB THR A 136 10.189 -5.163 -11.031 1.00 12.21 C ATOM 2314 OG1 THR A 136 10.835 -6.189 -11.805 1.00 73.11 O ATOM 2315 CG2 THR A 136 9.599 -4.089 -11.960 1.00 50.40 C ATOM 0 H THR A 136 10.937 -2.518 -10.116 1.00 35.23 H new ATOM 0 HA THR A 136 11.151 -5.304 -9.127 1.00 41.33 H new ATOM 0 HB THR A 136 9.355 -5.600 -10.482 1.00 12.21 H new ATOM 0 HG1 THR A 136 10.209 -6.537 -12.474 1.00 73.11 H new ATOM 0 HG21 THR A 136 8.938 -4.560 -12.687 1.00 50.40 H new ATOM 0 HG22 THR A 136 9.034 -3.368 -11.370 1.00 50.40 H new ATOM 0 HG23 THR A 136 10.407 -3.576 -12.483 1.00 50.40 H new ATOM 2323 N ASP A 137 13.531 -5.174 -9.830 1.00 3.54 N ATOM 2324 CA ASP A 137 14.977 -5.013 -10.044 1.00 0.33 C ATOM 2325 C ASP A 137 15.377 -5.453 -11.459 1.00 72.03 C ATOM 2326 O ASP A 137 14.998 -6.543 -11.895 1.00 32.51 O ATOM 2327 CB ASP A 137 15.786 -5.818 -8.991 1.00 73.22 C ATOM 2328 CG ASP A 137 15.430 -5.513 -7.524 1.00 65.01 C ATOM 2329 OD1 ASP A 137 15.113 -4.346 -7.201 1.00 23.05 O ATOM 2330 OD2 ASP A 137 15.515 -6.433 -6.672 1.00 24.20 O ATOM 0 H ASP A 137 13.295 -5.920 -9.176 1.00 3.54 H new ATOM 0 HA ASP A 137 15.210 -3.954 -9.930 1.00 0.33 H new ATOM 0 HB2 ASP A 137 15.633 -6.882 -9.173 1.00 73.22 H new ATOM 0 HB3 ASP A 137 16.847 -5.619 -9.141 1.00 73.22 H new ATOM 2335 N GLY A 138 16.146 -4.598 -12.161 1.00 31.13 N ATOM 2336 CA GLY A 138 16.551 -4.869 -13.539 1.00 73.12 C ATOM 2337 C GLY A 138 15.368 -4.821 -14.498 1.00 53.13 C ATOM 2338 O GLY A 138 15.156 -5.749 -15.288 1.00 20.24 O ATOM 0 H GLY A 138 16.495 -3.715 -11.789 1.00 31.13 H new ATOM 0 HA2 GLY A 138 17.299 -4.139 -13.848 1.00 73.12 H new ATOM 0 HA3 GLY A 138 17.022 -5.850 -13.593 1.00 73.12 H new ATOM 2342 N SER A 139 14.593 -3.726 -14.410 1.00 61.33 N ATOM 2343 CA SER A 139 13.353 -3.544 -15.192 1.00 22.12 C ATOM 2344 C SER A 139 13.088 -2.058 -15.490 1.00 33.13 C ATOM 2345 O SER A 139 13.612 -1.159 -14.806 1.00 31.41 O ATOM 2346 CB SER A 139 12.147 -4.155 -14.450 1.00 62.23 C ATOM 2347 OG SER A 139 12.294 -5.556 -14.261 1.00 40.34 O ATOM 0 H SER A 139 14.807 -2.941 -13.795 1.00 61.33 H new ATOM 0 HA SER A 139 13.486 -4.063 -16.141 1.00 22.12 H new ATOM 0 HB2 SER A 139 12.032 -3.668 -13.481 1.00 62.23 H new ATOM 0 HB3 SER A 139 11.236 -3.959 -15.015 1.00 62.23 H new ATOM 0 HG SER A 139 11.823 -5.827 -13.445 1.00 40.34 H new ATOM 2353 N TYR A 140 12.250 -1.828 -16.509 1.00 42.11 N ATOM 2354 CA TYR A 140 11.871 -0.489 -16.962 1.00 65.12 C ATOM 2355 C TYR A 140 10.671 0.022 -16.150 1.00 42.13 C ATOM 2356 O TYR A 140 9.518 -0.115 -16.567 1.00 21.51 O ATOM 2357 CB TYR A 140 11.552 -0.504 -18.485 1.00 21.41 C ATOM 2358 CG TYR A 140 12.629 -1.198 -19.329 1.00 33.01 C ATOM 2359 CD1 TYR A 140 13.924 -0.688 -19.405 1.00 63.04 C ATOM 2360 CD2 TYR A 140 12.355 -2.376 -20.029 1.00 25.22 C ATOM 2361 CE1 TYR A 140 14.899 -1.325 -20.143 1.00 1.12 C ATOM 2362 CE2 TYR A 140 13.326 -3.015 -20.773 1.00 43.50 C ATOM 2363 CZ TYR A 140 14.599 -2.490 -20.824 1.00 22.11 C ATOM 2364 OH TYR A 140 15.576 -3.133 -21.558 1.00 51.02 O ATOM 0 H TYR A 140 11.813 -2.577 -17.046 1.00 42.11 H new ATOM 0 HA TYR A 140 12.707 0.192 -16.800 1.00 65.12 H new ATOM 0 HB2 TYR A 140 10.598 -1.006 -18.643 1.00 21.41 H new ATOM 0 HB3 TYR A 140 11.434 0.522 -18.834 1.00 21.41 H new ATOM 0 HD1 TYR A 140 14.168 0.222 -18.877 1.00 63.04 H new ATOM 0 HD2 TYR A 140 11.361 -2.796 -19.987 1.00 25.22 H new ATOM 0 HE1 TYR A 140 15.897 -0.914 -20.189 1.00 1.12 H new ATOM 0 HE2 TYR A 140 13.090 -3.921 -21.312 1.00 43.50 H new ATOM 0 HH TYR A 140 15.198 -3.937 -21.973 1.00 51.02 H new ATOM 2374 N GLN A 141 10.952 0.547 -14.947 1.00 14.33 N ATOM 2375 CA GLN A 141 9.948 1.259 -14.133 1.00 73.21 C ATOM 2376 C GLN A 141 9.986 2.769 -14.467 1.00 65.20 C ATOM 2377 O GLN A 141 10.464 3.153 -15.545 1.00 44.24 O ATOM 2378 CB GLN A 141 10.164 0.978 -12.620 1.00 43.14 C ATOM 2379 CG GLN A 141 11.587 1.256 -12.066 1.00 31.03 C ATOM 2380 CD GLN A 141 11.596 1.947 -10.694 1.00 3.41 C ATOM 2381 OE1 GLN A 141 11.688 3.171 -10.610 1.00 64.24 O ATOM 2382 NE2 GLN A 141 11.455 1.178 -9.621 1.00 24.13 N ATOM 0 H GLN A 141 11.873 0.492 -14.512 1.00 14.33 H new ATOM 0 HA GLN A 141 8.952 0.890 -14.376 1.00 73.21 H new ATOM 0 HB2 GLN A 141 9.453 1.581 -12.055 1.00 43.14 H new ATOM 0 HB3 GLN A 141 9.920 -0.067 -12.428 1.00 43.14 H new ATOM 0 HG2 GLN A 141 12.128 0.313 -11.990 1.00 31.03 H new ATOM 0 HG3 GLN A 141 12.129 1.878 -12.779 1.00 31.03 H new ATOM 0 HE21 GLN A 141 11.381 0.166 -9.725 1.00 24.13 H new ATOM 0 HE22 GLN A 141 11.420 1.599 -8.693 1.00 24.13 H new ATOM 2391 N CYS A 142 9.462 3.606 -13.552 1.00 24.33 N ATOM 2392 CA CYS A 142 9.293 5.053 -13.752 1.00 42.45 C ATOM 2393 C CYS A 142 10.624 5.769 -14.063 1.00 41.04 C ATOM 2394 O CYS A 142 10.858 6.176 -15.206 1.00 50.43 O ATOM 2395 CB CYS A 142 8.600 5.630 -12.495 1.00 2.03 C ATOM 2396 SG CYS A 142 9.119 4.815 -10.953 1.00 74.53 S ATOM 0 H CYS A 142 9.139 3.288 -12.638 1.00 24.33 H new ATOM 0 HA CYS A 142 8.671 5.226 -14.630 1.00 42.45 H new ATOM 0 HB2 CYS A 142 8.817 6.696 -12.426 1.00 2.03 H new ATOM 0 HB3 CYS A 142 7.520 5.531 -12.605 1.00 2.03 H new ATOM 0 HG CYS A 142 10.238 4.184 -11.151 1.00 74.53 H new ATOM 2401 N CYS A 143 11.490 5.897 -13.053 1.00 32.44 N ATOM 2402 CA CYS A 143 12.799 6.580 -13.184 1.00 21.43 C ATOM 2403 C CYS A 143 13.967 5.577 -13.172 1.00 12.55 C ATOM 2404 O CYS A 143 15.134 5.995 -13.175 1.00 4.34 O ATOM 2405 CB CYS A 143 12.945 7.589 -12.035 1.00 62.33 C ATOM 2406 SG CYS A 143 12.640 6.861 -10.403 1.00 54.02 S ATOM 0 H CYS A 143 11.311 5.533 -12.117 1.00 32.44 H new ATOM 0 HA CYS A 143 12.832 7.097 -14.143 1.00 21.43 H new ATOM 0 HB2 CYS A 143 13.950 8.011 -12.056 1.00 62.33 H new ATOM 0 HB3 CYS A 143 12.250 8.414 -12.194 1.00 62.33 H new ATOM 0 HG CYS A 143 13.217 7.585 -9.490 1.00 54.02 H new ATOM 2411 N ARG A 144 13.621 4.258 -13.115 1.00 60.11 N ATOM 2412 CA ARG A 144 14.578 3.110 -13.112 1.00 64.34 C ATOM 2413 C ARG A 144 15.169 2.889 -11.702 1.00 54.42 C ATOM 2414 O ARG A 144 15.943 1.941 -11.489 1.00 70.12 O ATOM 2415 CB ARG A 144 15.736 3.240 -14.160 1.00 20.13 C ATOM 2416 CG ARG A 144 15.317 3.462 -15.634 1.00 70.52 C ATOM 2417 CD ARG A 144 14.480 2.316 -16.224 1.00 70.34 C ATOM 2418 NE ARG A 144 14.349 2.451 -17.691 1.00 5.42 N ATOM 2419 CZ ARG A 144 13.235 2.798 -18.354 1.00 1.51 C ATOM 2420 NH1 ARG A 144 12.098 3.068 -17.715 1.00 63.12 N ATOM 2421 NH2 ARG A 144 13.260 2.853 -19.675 1.00 10.11 N ATOM 0 H ARG A 144 12.648 3.957 -13.069 1.00 60.11 H new ATOM 0 HA ARG A 144 13.988 2.243 -13.409 1.00 64.34 H new ATOM 0 HB2 ARG A 144 16.376 4.070 -13.859 1.00 20.13 H new ATOM 0 HB3 ARG A 144 16.343 2.336 -14.111 1.00 20.13 H new ATOM 0 HG2 ARG A 144 14.747 4.388 -15.704 1.00 70.52 H new ATOM 0 HG3 ARG A 144 16.213 3.593 -16.240 1.00 70.52 H new ATOM 0 HD2 ARG A 144 14.946 1.360 -15.984 1.00 70.34 H new ATOM 0 HD3 ARG A 144 13.491 2.312 -15.767 1.00 70.34 H new ATOM 0 HE ARG A 144 15.181 2.263 -18.250 1.00 5.42 H new ATOM 0 HH11 ARG A 144 12.060 3.013 -16.697 1.00 63.12 H new ATOM 0 HH12 ARG A 144 11.266 3.329 -18.243 1.00 63.12 H new ATOM 0 HH21 ARG A 144 14.119 2.633 -20.178 1.00 10.11 H new ATOM 0 HH22 ARG A 144 12.420 3.115 -20.190 1.00 10.11 H new ATOM 2435 N GLN A 145 14.770 3.747 -10.741 1.00 41.30 N ATOM 2436 CA GLN A 145 15.303 3.739 -9.370 1.00 13.34 C ATOM 2437 C GLN A 145 14.589 2.662 -8.539 1.00 45.12 C ATOM 2438 O GLN A 145 13.574 2.920 -7.888 1.00 71.12 O ATOM 2439 CB GLN A 145 15.153 5.149 -8.734 1.00 72.00 C ATOM 2440 CG GLN A 145 15.897 6.273 -9.491 1.00 15.22 C ATOM 2441 CD GLN A 145 15.682 7.678 -8.910 1.00 34.11 C ATOM 2442 OE1 GLN A 145 14.484 7.957 -8.402 1.00 73.41 O flip ATOM 2443 NE2 GLN A 145 16.578 8.532 -8.953 1.00 34.50 N flip ATOM 0 H GLN A 145 14.065 4.467 -10.899 1.00 41.30 H new ATOM 0 HA GLN A 145 16.365 3.496 -9.391 1.00 13.34 H new ATOM 0 HB2 GLN A 145 14.094 5.401 -8.684 1.00 72.00 H new ATOM 0 HB3 GLN A 145 15.521 5.113 -7.709 1.00 72.00 H new ATOM 0 HG2 GLN A 145 16.964 6.051 -9.489 1.00 15.22 H new ATOM 0 HG3 GLN A 145 15.573 6.270 -10.532 1.00 15.22 H new ATOM 0 HE21 GLN A 145 17.489 8.296 -9.347 1.00 34.50 H new ATOM 0 HE22 GLN A 145 16.405 9.471 -8.595 1.00 34.50 H new ATOM 2452 N THR A 146 15.116 1.434 -8.620 1.00 13.12 N ATOM 2453 CA THR A 146 14.543 0.248 -7.957 1.00 21.25 C ATOM 2454 C THR A 146 15.532 -0.332 -6.919 1.00 15.42 C ATOM 2455 O THR A 146 15.313 -1.421 -6.375 1.00 22.42 O ATOM 2456 CB THR A 146 14.162 -0.829 -9.038 1.00 1.42 C ATOM 2457 OG1 THR A 146 13.491 -1.951 -8.437 1.00 13.43 O ATOM 2458 CG2 THR A 146 15.390 -1.322 -9.827 1.00 30.55 C ATOM 0 H THR A 146 15.962 1.230 -9.153 1.00 13.12 H new ATOM 0 HA THR A 146 13.640 0.542 -7.422 1.00 21.25 H new ATOM 0 HB THR A 146 13.485 -0.339 -9.738 1.00 1.42 H new ATOM 0 HG1 THR A 146 13.851 -2.105 -7.539 1.00 13.43 H new ATOM 0 HG21 THR A 146 15.077 -2.064 -10.561 1.00 30.55 H new ATOM 0 HG22 THR A 146 15.856 -0.480 -10.338 1.00 30.55 H new ATOM 0 HG23 THR A 146 16.107 -1.771 -9.140 1.00 30.55 H new ATOM 2466 N GLU A 147 16.616 0.424 -6.636 1.00 64.43 N ATOM 2467 CA GLU A 147 17.705 -0.024 -5.744 1.00 15.10 C ATOM 2468 C GLU A 147 17.288 0.086 -4.261 1.00 1.43 C ATOM 2469 O GLU A 147 17.138 -0.929 -3.573 1.00 54.45 O ATOM 2470 CB GLU A 147 19.000 0.791 -6.027 1.00 74.21 C ATOM 2471 CG GLU A 147 19.493 0.736 -7.491 1.00 33.31 C ATOM 2472 CD GLU A 147 20.753 1.585 -7.735 1.00 12.33 C ATOM 2473 OE1 GLU A 147 20.639 2.825 -7.771 1.00 31.53 O ATOM 2474 OE2 GLU A 147 21.862 1.020 -7.875 1.00 73.14 O ATOM 0 H GLU A 147 16.759 1.359 -7.019 1.00 64.43 H new ATOM 0 HA GLU A 147 17.910 -1.075 -5.948 1.00 15.10 H new ATOM 0 HB2 GLU A 147 18.824 1.832 -5.757 1.00 74.21 H new ATOM 0 HB3 GLU A 147 19.794 0.423 -5.377 1.00 74.21 H new ATOM 0 HG2 GLU A 147 19.702 -0.300 -7.759 1.00 33.31 H new ATOM 0 HG3 GLU A 147 18.696 1.081 -8.150 1.00 33.31 H new ATOM 2481 N LYS A 148 17.066 1.326 -3.791 1.00 33.52 N ATOM 2482 CA LYS A 148 16.746 1.610 -2.374 1.00 3.23 C ATOM 2483 C LYS A 148 15.946 2.935 -2.294 1.00 43.43 C ATOM 2484 O LYS A 148 15.913 3.667 -3.290 1.00 54.21 O ATOM 2485 CB LYS A 148 18.061 1.644 -1.528 1.00 74.32 C ATOM 2486 CG LYS A 148 17.907 1.539 0.016 1.00 52.52 C ATOM 2487 CD LYS A 148 17.337 0.174 0.521 1.00 55.33 C ATOM 2488 CE LYS A 148 15.797 0.097 0.530 1.00 4.20 C ATOM 2489 NZ LYS A 148 15.295 -1.260 0.898 1.00 23.51 N ATOM 0 H LYS A 148 17.102 2.160 -4.378 1.00 33.52 H new ATOM 0 HA LYS A 148 16.123 0.821 -1.954 1.00 3.23 H new ATOM 0 HB2 LYS A 148 18.700 0.827 -1.862 1.00 74.32 H new ATOM 0 HB3 LYS A 148 18.586 2.572 -1.754 1.00 74.32 H new ATOM 0 HG2 LYS A 148 18.881 1.704 0.477 1.00 52.52 H new ATOM 0 HG3 LYS A 148 17.252 2.340 0.358 1.00 52.52 H new ATOM 0 HD2 LYS A 148 17.726 -0.625 -0.110 1.00 55.33 H new ATOM 0 HD3 LYS A 148 17.705 -0.009 1.531 1.00 55.33 H new ATOM 0 HE2 LYS A 148 15.404 0.830 1.235 1.00 4.20 H new ATOM 0 HE3 LYS A 148 15.417 0.367 -0.455 1.00 4.20 H new ATOM 0 HZ1 LYS A 148 14.508 -1.521 0.270 1.00 23.51 H new ATOM 0 HZ2 LYS A 148 16.063 -1.954 0.797 1.00 23.51 H new ATOM 0 HZ3 LYS A 148 14.963 -1.252 1.884 1.00 23.51 H new ATOM 2503 N LEU A 149 15.337 3.232 -1.109 1.00 52.42 N ATOM 2504 CA LEU A 149 14.253 4.240 -0.948 1.00 72.43 C ATOM 2505 C LEU A 149 14.610 5.626 -1.545 1.00 53.42 C ATOM 2506 O LEU A 149 15.188 6.491 -0.870 1.00 23.20 O ATOM 2507 CB LEU A 149 13.859 4.401 0.553 1.00 32.55 C ATOM 2508 CG LEU A 149 13.443 3.108 1.325 1.00 12.11 C ATOM 2509 CD1 LEU A 149 13.088 3.422 2.797 1.00 2.34 C ATOM 2510 CD2 LEU A 149 12.286 2.374 0.626 1.00 52.02 C ATOM 0 H LEU A 149 15.589 2.773 -0.234 1.00 52.42 H new ATOM 0 HA LEU A 149 13.404 3.855 -1.512 1.00 72.43 H new ATOM 0 HB2 LEU A 149 14.702 4.851 1.077 1.00 32.55 H new ATOM 0 HB3 LEU A 149 13.033 5.110 0.611 1.00 32.55 H new ATOM 0 HG LEU A 149 14.305 2.441 1.321 1.00 12.11 H new ATOM 0 HD11 LEU A 149 12.803 2.502 3.307 1.00 2.34 H new ATOM 0 HD12 LEU A 149 13.954 3.859 3.295 1.00 2.34 H new ATOM 0 HD13 LEU A 149 12.257 4.127 2.829 1.00 2.34 H new ATOM 0 HD21 LEU A 149 12.026 1.480 1.194 1.00 52.02 H new ATOM 0 HD22 LEU A 149 11.419 3.032 0.569 1.00 52.02 H new ATOM 0 HD23 LEU A 149 12.592 2.088 -0.381 1.00 52.02 H new ATOM 2522 N ALA A 150 14.279 5.796 -2.831 1.00 22.03 N ATOM 2523 CA ALA A 150 14.440 7.066 -3.539 1.00 54.31 C ATOM 2524 C ALA A 150 13.277 8.009 -3.155 1.00 70.51 C ATOM 2525 O ALA A 150 12.139 7.540 -3.068 1.00 13.21 O ATOM 2526 CB ALA A 150 14.485 6.810 -5.059 1.00 1.22 C ATOM 0 H ALA A 150 13.890 5.051 -3.410 1.00 22.03 H new ATOM 0 HA ALA A 150 15.378 7.543 -3.254 1.00 54.31 H new ATOM 0 HB1 ALA A 150 14.605 7.758 -5.584 1.00 1.22 H new ATOM 0 HB2 ALA A 150 15.325 6.156 -5.293 1.00 1.22 H new ATOM 0 HB3 ALA A 150 13.557 6.335 -5.376 1.00 1.22 H new ATOM 2532 N PRO A 151 13.539 9.345 -2.940 1.00 75.44 N ATOM 2533 CA PRO A 151 12.495 10.337 -2.538 1.00 43.05 C ATOM 2534 C PRO A 151 11.290 10.379 -3.500 1.00 15.44 C ATOM 2535 O PRO A 151 10.205 10.824 -3.116 1.00 13.03 O ATOM 2536 CB PRO A 151 13.264 11.693 -2.529 1.00 32.10 C ATOM 2537 CG PRO A 151 14.506 11.442 -3.330 1.00 73.20 C ATOM 2538 CD PRO A 151 14.867 10.001 -3.047 1.00 41.15 C ATOM 0 HA PRO A 151 12.050 10.084 -1.576 1.00 43.05 H new ATOM 0 HB2 PRO A 151 12.664 12.489 -2.970 1.00 32.10 H new ATOM 0 HB3 PRO A 151 13.506 12.002 -1.512 1.00 32.10 H new ATOM 0 HG2 PRO A 151 14.330 11.604 -4.393 1.00 73.20 H new ATOM 0 HG3 PRO A 151 15.310 12.116 -3.034 1.00 73.20 H new ATOM 0 HD2 PRO A 151 15.468 9.570 -3.848 1.00 41.15 H new ATOM 0 HD3 PRO A 151 15.443 9.901 -2.127 1.00 41.15 H new ATOM 2546 N GLY A 152 11.517 9.934 -4.749 1.00 33.11 N ATOM 2547 CA GLY A 152 10.461 9.788 -5.755 1.00 12.32 C ATOM 2548 C GLY A 152 10.777 10.542 -7.033 1.00 51.12 C ATOM 2549 O GLY A 152 11.688 11.382 -7.062 1.00 33.42 O ATOM 0 H GLY A 152 12.442 9.666 -5.085 1.00 33.11 H new ATOM 0 HA2 GLY A 152 10.323 8.731 -5.984 1.00 12.32 H new ATOM 0 HA3 GLY A 152 9.519 10.151 -5.345 1.00 12.32 H new ATOM 2553 N CYS A 153 10.017 10.237 -8.086 1.00 35.34 N ATOM 2554 CA CYS A 153 10.182 10.837 -9.425 1.00 1.40 C ATOM 2555 C CYS A 153 9.017 11.787 -9.755 1.00 62.51 C ATOM 2556 O CYS A 153 9.226 12.851 -10.352 1.00 53.54 O ATOM 2557 CB CYS A 153 10.261 9.701 -10.453 1.00 21.23 C ATOM 2558 SG CYS A 153 8.895 8.511 -10.323 1.00 72.02 S ATOM 0 H CYS A 153 9.257 9.558 -8.039 1.00 35.34 H new ATOM 0 HA CYS A 153 11.096 11.430 -9.450 1.00 1.40 H new ATOM 0 HB2 CYS A 153 10.266 10.129 -11.456 1.00 21.23 H new ATOM 0 HB3 CYS A 153 11.206 9.173 -10.327 1.00 21.23 H new ATOM 0 HG CYS A 153 9.353 7.305 -10.486 1.00 72.02 H new ATOM 2563 N GLU A 154 7.800 11.394 -9.365 1.00 11.45 N ATOM 2564 CA GLU A 154 6.570 12.191 -9.572 1.00 24.44 C ATOM 2565 C GLU A 154 6.053 12.652 -8.216 1.00 23.32 C ATOM 2566 O GLU A 154 6.197 11.926 -7.239 1.00 54.30 O ATOM 2567 CB GLU A 154 5.490 11.360 -10.312 1.00 14.33 C ATOM 2568 CG GLU A 154 5.829 11.052 -11.785 1.00 1.41 C ATOM 2569 CD GLU A 154 5.934 12.320 -12.658 1.00 21.24 C ATOM 2570 OE1 GLU A 154 4.889 12.840 -13.108 1.00 75.21 O ATOM 2571 OE2 GLU A 154 7.063 12.811 -12.893 1.00 72.44 O ATOM 0 H GLU A 154 7.631 10.506 -8.892 1.00 11.45 H new ATOM 0 HA GLU A 154 6.800 13.057 -10.193 1.00 24.44 H new ATOM 0 HB2 GLU A 154 5.343 10.420 -9.780 1.00 14.33 H new ATOM 0 HB3 GLU A 154 4.543 11.899 -10.274 1.00 14.33 H new ATOM 0 HG2 GLU A 154 6.773 10.508 -11.829 1.00 1.41 H new ATOM 0 HG3 GLU A 154 5.064 10.395 -12.198 1.00 1.41 H new ATOM 2578 N LYS A 155 5.455 13.852 -8.163 1.00 64.35 N ATOM 2579 CA LYS A 155 4.987 14.451 -6.897 1.00 72.21 C ATOM 2580 C LYS A 155 3.853 13.607 -6.254 1.00 71.23 C ATOM 2581 O LYS A 155 2.938 13.140 -6.940 1.00 22.14 O ATOM 2582 CB LYS A 155 4.586 15.951 -7.115 1.00 72.04 C ATOM 2583 CG LYS A 155 3.625 16.266 -8.300 1.00 35.22 C ATOM 2584 CD LYS A 155 2.133 15.963 -8.011 1.00 14.22 C ATOM 2585 CE LYS A 155 1.233 16.161 -9.240 1.00 75.53 C ATOM 2586 NZ LYS A 155 -0.155 15.662 -9.007 1.00 15.22 N ATOM 0 H LYS A 155 5.282 14.431 -8.985 1.00 64.35 H new ATOM 0 HA LYS A 155 5.809 14.442 -6.181 1.00 72.21 H new ATOM 0 HB2 LYS A 155 4.121 16.313 -6.198 1.00 72.04 H new ATOM 0 HB3 LYS A 155 5.500 16.528 -7.259 1.00 72.04 H new ATOM 0 HG2 LYS A 155 3.725 17.319 -8.563 1.00 35.22 H new ATOM 0 HG3 LYS A 155 3.939 15.689 -9.170 1.00 35.22 H new ATOM 0 HD2 LYS A 155 2.038 14.936 -7.659 1.00 14.22 H new ATOM 0 HD3 LYS A 155 1.786 16.609 -7.205 1.00 14.22 H new ATOM 0 HE2 LYS A 155 1.199 17.220 -9.497 1.00 75.53 H new ATOM 0 HE3 LYS A 155 1.666 15.640 -10.094 1.00 75.53 H new ATOM 0 HZ1 LYS A 155 -0.727 15.816 -9.862 1.00 15.22 H new ATOM 0 HZ2 LYS A 155 -0.126 14.646 -8.788 1.00 15.22 H new ATOM 0 HZ3 LYS A 155 -0.580 16.177 -8.209 1.00 15.22 H new ATOM 2600 N TYR A 156 3.968 13.372 -4.943 1.00 54.30 N ATOM 2601 CA TYR A 156 2.975 12.617 -4.154 1.00 73.21 C ATOM 2602 C TYR A 156 2.069 13.600 -3.417 1.00 10.45 C ATOM 2603 O TYR A 156 2.542 14.407 -2.602 1.00 70.14 O ATOM 2604 CB TYR A 156 3.700 11.661 -3.167 1.00 10.42 C ATOM 2605 CG TYR A 156 2.828 10.977 -2.099 1.00 75.22 C ATOM 2606 CD1 TYR A 156 1.645 10.302 -2.427 1.00 25.32 C ATOM 2607 CD2 TYR A 156 3.202 11.009 -0.753 1.00 31.35 C ATOM 2608 CE1 TYR A 156 0.877 9.692 -1.452 1.00 31.44 C ATOM 2609 CE2 TYR A 156 2.441 10.398 0.220 1.00 74.31 C ATOM 2610 CZ TYR A 156 1.280 9.741 -0.128 1.00 33.01 C ATOM 2611 OH TYR A 156 0.520 9.136 0.851 1.00 42.31 O ATOM 0 H TYR A 156 4.759 13.702 -4.389 1.00 54.30 H new ATOM 0 HA TYR A 156 2.358 12.007 -4.813 1.00 73.21 H new ATOM 0 HB2 TYR A 156 4.197 10.884 -3.749 1.00 10.42 H new ATOM 0 HB3 TYR A 156 4.481 12.226 -2.658 1.00 10.42 H new ATOM 0 HD1 TYR A 156 1.328 10.257 -3.458 1.00 25.32 H new ATOM 0 HD2 TYR A 156 4.108 11.524 -0.469 1.00 31.35 H new ATOM 0 HE1 TYR A 156 -0.034 9.179 -1.722 1.00 31.44 H new ATOM 0 HE2 TYR A 156 2.754 10.434 1.253 1.00 74.31 H new ATOM 0 HH TYR A 156 0.109 8.323 0.490 1.00 42.31 H new ATOM 2621 N ASN A 157 0.764 13.515 -3.707 1.00 3.54 N ATOM 2622 CA ASN A 157 -0.265 14.387 -3.128 1.00 53.53 C ATOM 2623 C ASN A 157 -0.712 13.847 -1.752 1.00 10.44 C ATOM 2624 O ASN A 157 -1.845 13.395 -1.579 1.00 65.02 O ATOM 2625 CB ASN A 157 -1.454 14.524 -4.139 1.00 2.13 C ATOM 2626 CG ASN A 157 -2.129 13.191 -4.526 1.00 0.33 C ATOM 2627 OD1 ASN A 157 -1.543 12.114 -4.429 1.00 73.44 O ATOM 2628 ND2 ASN A 157 -3.350 13.258 -5.007 1.00 74.31 N ATOM 0 H ASN A 157 0.388 12.828 -4.361 1.00 3.54 H new ATOM 0 HA ASN A 157 0.139 15.384 -2.955 1.00 53.53 H new ATOM 0 HB2 ASN A 157 -2.206 15.184 -3.707 1.00 2.13 H new ATOM 0 HB3 ASN A 157 -1.089 15.007 -5.045 1.00 2.13 H new ATOM 0 HD21 ASN A 157 -3.827 12.408 -5.307 1.00 74.31 H new ATOM 0 HD22 ASN A 157 -3.821 14.160 -5.080 1.00 74.31 H new ATOM 2635 N LEU A 158 0.230 13.880 -0.784 1.00 31.35 N ATOM 2636 CA LEU A 158 -0.004 13.462 0.615 1.00 11.21 C ATOM 2637 C LEU A 158 -1.194 14.234 1.195 1.00 31.43 C ATOM 2638 O LEU A 158 -2.174 13.649 1.673 1.00 45.41 O ATOM 2639 CB LEU A 158 1.261 13.733 1.474 1.00 74.24 C ATOM 2640 CG LEU A 158 1.143 13.387 2.991 1.00 73.23 C ATOM 2641 CD1 LEU A 158 1.041 11.866 3.213 1.00 24.42 C ATOM 2642 CD2 LEU A 158 2.303 14.009 3.790 1.00 10.33 C ATOM 0 H LEU A 158 1.183 14.201 -0.954 1.00 31.35 H new ATOM 0 HA LEU A 158 -0.222 12.394 0.631 1.00 11.21 H new ATOM 0 HB2 LEU A 158 2.090 13.163 1.055 1.00 74.24 H new ATOM 0 HB3 LEU A 158 1.520 14.788 1.381 1.00 74.24 H new ATOM 0 HG LEU A 158 0.218 13.825 3.366 1.00 73.23 H new ATOM 0 HD11 LEU A 158 0.960 11.659 4.280 1.00 24.42 H new ATOM 0 HD12 LEU A 158 0.159 11.482 2.701 1.00 24.42 H new ATOM 0 HD13 LEU A 158 1.932 11.380 2.815 1.00 24.42 H new ATOM 0 HD21 LEU A 158 2.197 13.753 4.844 1.00 10.33 H new ATOM 0 HD22 LEU A 158 3.251 13.622 3.416 1.00 10.33 H new ATOM 0 HD23 LEU A 158 2.283 15.093 3.676 1.00 10.33 H new ATOM 2654 N PHE A 159 -1.077 15.565 1.139 1.00 60.31 N ATOM 2655 CA PHE A 159 -2.188 16.473 1.397 1.00 23.44 C ATOM 2656 C PHE A 159 -2.960 16.643 0.081 1.00 25.30 C ATOM 2657 O PHE A 159 -2.717 17.585 -0.686 1.00 0.14 O ATOM 2658 CB PHE A 159 -1.673 17.822 1.964 1.00 23.04 C ATOM 2659 CG PHE A 159 -0.930 17.673 3.296 1.00 72.31 C ATOM 2660 CD1 PHE A 159 -1.630 17.603 4.502 1.00 40.35 C ATOM 2661 CD2 PHE A 159 0.464 17.582 3.342 1.00 64.11 C ATOM 2662 CE1 PHE A 159 -0.961 17.450 5.705 1.00 11.32 C ATOM 2663 CE2 PHE A 159 1.129 17.425 4.543 1.00 41.21 C ATOM 2664 CZ PHE A 159 0.416 17.359 5.725 1.00 52.12 C ATOM 0 H PHE A 159 -0.203 16.040 0.912 1.00 60.31 H new ATOM 0 HA PHE A 159 -2.858 16.068 2.155 1.00 23.44 H new ATOM 0 HB2 PHE A 159 -1.009 18.285 1.235 1.00 23.04 H new ATOM 0 HB3 PHE A 159 -2.517 18.498 2.100 1.00 23.04 H new ATOM 0 HD1 PHE A 159 -2.708 17.669 4.497 1.00 40.35 H new ATOM 0 HD2 PHE A 159 1.030 17.635 2.424 1.00 64.11 H new ATOM 0 HE1 PHE A 159 -1.518 17.402 6.629 1.00 11.32 H new ATOM 0 HE2 PHE A 159 2.207 17.354 4.558 1.00 41.21 H new ATOM 0 HZ PHE A 159 0.936 17.236 6.664 1.00 52.12 H new