USER MOD reduce.3.24.130724 H: found=0, std=0, add=953, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 952 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 89 HIS : no HE2:sc= -2.86! C(o=-2!,f=-6.2!) USER MOD Set 1.2: A 110 THR OG1 : rot -38:sc= 0.846 USER MOD Set 2.1: A 86 SER OG : rot 91:sc= 1.75 USER MOD Set 2.2: A 108 ASN : amide:sc= 0.51 K(o=2.3,f=0.21) USER MOD Set 3.1: A 65 GLN : amide:sc= 0.473 K(o=1.5,f=-3) USER MOD Set 3.2: A 68 THR OG1 : rot -83:sc= 1 USER MOD Set 4.1: A 36 SER OG : rot 180:sc=-0.00769 USER MOD Set 4.2: A 113 ASN : amide:sc= 1.06 K(o=1.1,f=-0.088) USER MOD Single : A 16 SER OG : rot 26:sc= -1.08 USER MOD Single : A 24 LYS NZ :NH3+ 170:sc= 0.963 (180deg=0.702) USER MOD Single : A 26 MET CE :methyl -143:sc= -0.239 (180deg=-1.88) USER MOD Single : A 28 SER OG : rot 74:sc= 0.105 USER MOD Single : A 29 SER OG : rot 79:sc= 1.24 USER MOD Single : A 30 THR OG1 : rot 68:sc= 0.873 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.0915 USER MOD Single : A 41 ASN : amide:sc= -0.12 K(o=-0.12,f=-2.5!) USER MOD Single : A 46 SER OG : rot 180:sc= -0.04 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 0.883 K(o=0.88,f=-2!) USER MOD Single : A 67 THR OG1 : rot 160:sc= -0.204 USER MOD Single : A 69 THR OG1 : rot -88:sc= 0.992 USER MOD Single : A 73 HIS : no HE2:sc= -0.0816 K(o=-0.082,f=-7.2!) USER MOD Single : A 76 SER OG : rot 150:sc= 0 USER MOD Single : A 84 THR OG1 : rot 164:sc= 0.0225 USER MOD Single : A 95 ASN : amide:sc= -1.19 K(o=-1.2,f=-2.3!) USER MOD Single : A 106 SER OG : rot 180:sc= 0.0669 USER MOD Single : A 111 TYR OH : rot 131:sc= -0.406 USER MOD Single : A 118 ASN : amide:sc= -0.435 X(o=-0.43,f=-0.033) USER MOD Single : A 120 GLN : amide:sc= -0.187 K(o=-0.19,f=-6!) USER MOD Single : A 122 MET CE :methyl -116:sc= -0.599 (180deg=-5.93!) USER MOD Single : A 123 GLN : amide:sc= -1.96! X(o=-2!,f=-1.7) USER MOD Single : A 124 THR OG1 : rot -70:sc= -0.0268 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 132 LYS NZ :NH3+ -150:sc= -1.02 (180deg=-2.4!) USER MOD ----------------------------------------------------------------- ATOM 214 N SER A 16 5.769 17.495 6.419 1.00 2.25 N ATOM 215 CA SER A 16 4.969 18.646 6.741 1.00 15.12 C ATOM 216 C SER A 16 3.752 18.279 7.550 1.00 62.20 C ATOM 217 O SER A 16 3.188 17.215 7.386 1.00 21.23 O ATOM 218 CB SER A 16 4.586 19.383 5.468 1.00 23.42 C ATOM 219 OG SER A 16 5.752 19.795 4.764 1.00 72.01 O ATOM 0 HA SER A 16 5.567 19.310 7.364 1.00 15.12 H new ATOM 0 HB2 SER A 16 3.980 18.736 4.834 1.00 23.42 H new ATOM 0 HB3 SER A 16 3.975 20.252 5.713 1.00 23.42 H new ATOM 0 HG SER A 16 6.499 19.204 4.994 1.00 72.01 H new ATOM 225 N VAL A 17 3.360 19.157 8.422 1.00 54.50 N ATOM 226 CA VAL A 17 2.223 18.906 9.246 1.00 32.02 C ATOM 227 C VAL A 17 0.976 19.273 8.474 1.00 70.12 C ATOM 228 O VAL A 17 0.790 20.431 8.082 1.00 22.53 O ATOM 229 CB VAL A 17 2.272 19.704 10.571 1.00 72.12 C ATOM 230 CG1 VAL A 17 1.149 19.268 11.500 1.00 65.31 C ATOM 231 CG2 VAL A 17 3.626 19.554 11.251 1.00 51.20 C ATOM 0 H VAL A 17 3.814 20.056 8.580 1.00 54.50 H new ATOM 0 HA VAL A 17 2.219 17.848 9.509 1.00 32.02 H new ATOM 0 HB VAL A 17 2.132 20.759 10.335 1.00 72.12 H new ATOM 0 HG11 VAL A 17 1.200 19.840 12.426 1.00 65.31 H new ATOM 0 HG12 VAL A 17 0.188 19.445 11.017 1.00 65.31 H new ATOM 0 HG13 VAL A 17 1.253 18.206 11.723 1.00 65.31 H new ATOM 0 HG21 VAL A 17 3.632 20.125 12.179 1.00 51.20 H new ATOM 0 HG22 VAL A 17 3.808 18.502 11.471 1.00 51.20 H new ATOM 0 HG23 VAL A 17 4.408 19.927 10.590 1.00 51.20 H new ATOM 241 N PHE A 18 0.174 18.293 8.207 1.00 3.42 N ATOM 242 CA PHE A 18 -1.053 18.482 7.513 1.00 31.23 C ATOM 243 C PHE A 18 -2.195 17.971 8.336 1.00 74.31 C ATOM 244 O PHE A 18 -2.240 16.780 8.699 1.00 20.32 O ATOM 245 CB PHE A 18 -1.075 17.757 6.156 1.00 62.11 C ATOM 246 CG PHE A 18 -0.090 18.249 5.135 1.00 41.13 C ATOM 247 CD1 PHE A 18 -0.186 19.529 4.626 1.00 63.53 C ATOM 248 CD2 PHE A 18 0.907 17.420 4.662 1.00 35.32 C ATOM 249 CE1 PHE A 18 0.697 19.973 3.666 1.00 5.21 C ATOM 250 CE2 PHE A 18 1.793 17.855 3.710 1.00 53.35 C ATOM 251 CZ PHE A 18 1.688 19.132 3.211 1.00 72.34 C ATOM 0 H PHE A 18 0.358 17.325 8.470 1.00 3.42 H new ATOM 0 HA PHE A 18 -1.150 19.553 7.337 1.00 31.23 H new ATOM 0 HB2 PHE A 18 -0.891 16.697 6.329 1.00 62.11 H new ATOM 0 HB3 PHE A 18 -2.077 17.842 5.736 1.00 62.11 H new ATOM 0 HD1 PHE A 18 -0.962 20.189 4.984 1.00 63.53 H new ATOM 0 HD2 PHE A 18 0.991 16.414 5.047 1.00 35.32 H new ATOM 0 HE1 PHE A 18 0.612 20.975 3.272 1.00 5.21 H new ATOM 0 HE2 PHE A 18 2.571 17.196 3.353 1.00 53.35 H new ATOM 0 HZ PHE A 18 2.384 19.476 2.461 1.00 72.34 H new ATOM 261 N ARG A 19 -3.075 18.855 8.688 1.00 40.24 N ATOM 262 CA ARG A 19 -4.317 18.465 9.265 1.00 3.44 C ATOM 263 C ARG A 19 -5.209 18.115 8.110 1.00 24.42 C ATOM 264 O ARG A 19 -5.682 18.996 7.391 1.00 60.44 O ATOM 265 CB ARG A 19 -4.937 19.588 10.097 1.00 54.21 C ATOM 266 CG ARG A 19 -6.319 19.248 10.649 1.00 50.13 C ATOM 267 CD ARG A 19 -6.875 20.380 11.488 1.00 3.54 C ATOM 268 NE ARG A 19 -6.935 21.650 10.750 1.00 72.51 N ATOM 269 CZ ARG A 19 -7.279 22.827 11.282 1.00 1.21 C ATOM 270 NH1 ARG A 19 -7.740 22.892 12.534 1.00 71.44 N ATOM 271 NH2 ARG A 19 -7.208 23.925 10.547 1.00 14.50 N ATOM 0 H ARG A 19 -2.951 19.862 8.583 1.00 40.24 H new ATOM 0 HA ARG A 19 -4.179 17.626 9.947 1.00 3.44 H new ATOM 0 HB2 ARG A 19 -4.271 19.824 10.927 1.00 54.21 H new ATOM 0 HB3 ARG A 19 -5.011 20.486 9.483 1.00 54.21 H new ATOM 0 HG2 ARG A 19 -7.000 19.037 9.824 1.00 50.13 H new ATOM 0 HG3 ARG A 19 -6.258 18.342 11.252 1.00 50.13 H new ATOM 0 HD2 ARG A 19 -7.875 20.116 11.832 1.00 3.54 H new ATOM 0 HD3 ARG A 19 -6.256 20.508 12.376 1.00 3.54 H new ATOM 0 HE ARG A 19 -6.696 21.632 9.758 1.00 72.51 H new ATOM 0 HH11 ARG A 19 -7.831 22.041 13.089 1.00 71.44 H new ATOM 0 HH12 ARG A 19 -8.001 23.793 12.935 1.00 71.44 H new ATOM 0 HH21 ARG A 19 -6.892 23.871 9.579 1.00 14.50 H new ATOM 0 HH22 ARG A 19 -7.469 24.825 10.949 1.00 14.50 H new ATOM 285 N ALA A 20 -5.346 16.840 7.873 1.00 31.52 N ATOM 286 CA ALA A 20 -6.128 16.355 6.780 1.00 13.10 C ATOM 287 C ALA A 20 -7.588 16.724 6.967 1.00 11.24 C ATOM 288 O ALA A 20 -8.261 16.188 7.835 1.00 25.21 O ATOM 289 CB ALA A 20 -5.952 14.853 6.644 1.00 53.20 C ATOM 0 H ALA A 20 -4.915 16.108 8.438 1.00 31.52 H new ATOM 0 HA ALA A 20 -5.783 16.824 5.859 1.00 13.10 H new ATOM 0 HB1 ALA A 20 -6.551 14.491 5.809 1.00 53.20 H new ATOM 0 HB2 ALA A 20 -4.902 14.625 6.463 1.00 53.20 H new ATOM 0 HB3 ALA A 20 -6.277 14.364 7.562 1.00 53.20 H new ATOM 295 N ASP A 21 -8.063 17.663 6.152 1.00 41.05 N ATOM 296 CA ASP A 21 -9.462 18.140 6.196 1.00 70.12 C ATOM 297 C ASP A 21 -10.422 16.986 5.929 1.00 14.32 C ATOM 298 O ASP A 21 -11.552 16.965 6.406 1.00 10.44 O ATOM 299 CB ASP A 21 -9.670 19.271 5.175 1.00 44.40 C ATOM 300 CG ASP A 21 -11.059 19.873 5.202 1.00 61.22 C ATOM 301 OD1 ASP A 21 -11.406 20.574 6.174 1.00 1.21 O ATOM 302 OD2 ASP A 21 -11.839 19.682 4.236 1.00 44.24 O ATOM 0 H ASP A 21 -7.496 18.121 5.438 1.00 41.05 H new ATOM 0 HA ASP A 21 -9.669 18.534 7.191 1.00 70.12 H new ATOM 0 HB2 ASP A 21 -8.940 20.058 5.365 1.00 44.40 H new ATOM 0 HB3 ASP A 21 -9.471 18.886 4.175 1.00 44.40 H new ATOM 307 N LEU A 22 -9.902 15.985 5.247 1.00 22.54 N ATOM 308 CA LEU A 22 -10.618 14.766 4.912 1.00 30.51 C ATOM 309 C LEU A 22 -10.984 13.917 6.150 1.00 74.31 C ATOM 310 O LEU A 22 -11.656 12.888 6.031 1.00 40.13 O ATOM 311 CB LEU A 22 -9.901 13.914 3.824 1.00 25.04 C ATOM 312 CG LEU A 22 -8.407 13.581 4.004 1.00 65.14 C ATOM 313 CD1 LEU A 22 -8.088 12.293 3.273 1.00 62.15 C ATOM 314 CD2 LEU A 22 -7.524 14.685 3.410 1.00 55.33 C ATOM 0 H LEU A 22 -8.943 15.996 4.900 1.00 22.54 H new ATOM 0 HA LEU A 22 -11.558 15.104 4.475 1.00 30.51 H new ATOM 0 HB2 LEU A 22 -10.440 12.971 3.735 1.00 25.04 H new ATOM 0 HB3 LEU A 22 -10.010 14.435 2.873 1.00 25.04 H new ATOM 0 HG LEU A 22 -8.209 13.488 5.072 1.00 65.14 H new ATOM 0 HD11 LEU A 22 -7.032 12.055 3.399 1.00 62.15 H new ATOM 0 HD12 LEU A 22 -8.693 11.484 3.681 1.00 62.15 H new ATOM 0 HD13 LEU A 22 -8.309 12.412 2.212 1.00 62.15 H new ATOM 0 HD21 LEU A 22 -6.474 14.426 3.550 1.00 55.33 H new ATOM 0 HD22 LEU A 22 -7.734 14.786 2.345 1.00 55.33 H new ATOM 0 HD23 LEU A 22 -7.735 15.629 3.912 1.00 55.33 H new ATOM 326 N LEU A 23 -10.543 14.347 7.345 1.00 60.31 N ATOM 327 CA LEU A 23 -10.900 13.694 8.594 1.00 33.52 C ATOM 328 C LEU A 23 -12.432 13.654 8.788 1.00 64.44 C ATOM 329 O LEU A 23 -12.965 12.774 9.464 1.00 65.45 O ATOM 330 CB LEU A 23 -10.162 14.362 9.798 1.00 33.14 C ATOM 331 CG LEU A 23 -10.380 15.882 10.085 1.00 34.14 C ATOM 332 CD1 LEU A 23 -11.743 16.175 10.706 1.00 0.42 C ATOM 333 CD2 LEU A 23 -9.270 16.420 10.973 1.00 63.02 C ATOM 0 H LEU A 23 -9.932 15.155 7.461 1.00 60.31 H new ATOM 0 HA LEU A 23 -10.566 12.657 8.549 1.00 33.52 H new ATOM 0 HB2 LEU A 23 -10.444 13.816 10.698 1.00 33.14 H new ATOM 0 HB3 LEU A 23 -9.093 14.207 9.653 1.00 33.14 H new ATOM 0 HG LEU A 23 -10.352 16.391 9.122 1.00 34.14 H new ATOM 0 HD11 LEU A 23 -11.839 17.246 10.884 1.00 0.42 H new ATOM 0 HD12 LEU A 23 -12.530 15.848 10.027 1.00 0.42 H new ATOM 0 HD13 LEU A 23 -11.834 15.641 11.652 1.00 0.42 H new ATOM 0 HD21 LEU A 23 -9.438 17.480 11.163 1.00 63.02 H new ATOM 0 HD22 LEU A 23 -9.266 15.878 11.919 1.00 63.02 H new ATOM 0 HD23 LEU A 23 -8.309 16.288 10.475 1.00 63.02 H new ATOM 345 N LYS A 24 -13.123 14.593 8.145 1.00 44.21 N ATOM 346 CA LYS A 24 -14.577 14.681 8.198 1.00 41.01 C ATOM 347 C LYS A 24 -15.220 13.482 7.504 1.00 44.12 C ATOM 348 O LYS A 24 -16.309 13.036 7.881 1.00 33.04 O ATOM 349 CB LYS A 24 -15.048 15.994 7.570 1.00 21.01 C ATOM 350 CG LYS A 24 -14.609 17.231 8.352 1.00 3.31 C ATOM 351 CD LYS A 24 -14.913 18.532 7.615 1.00 74.43 C ATOM 352 CE LYS A 24 -14.137 18.604 6.317 1.00 14.31 C ATOM 353 NZ LYS A 24 -14.239 19.908 5.647 1.00 62.10 N ATOM 0 H LYS A 24 -12.687 15.315 7.572 1.00 44.21 H new ATOM 0 HA LYS A 24 -14.888 14.666 9.242 1.00 41.01 H new ATOM 0 HB2 LYS A 24 -14.663 16.061 6.553 1.00 21.01 H new ATOM 0 HB3 LYS A 24 -16.136 15.985 7.499 1.00 21.01 H new ATOM 0 HG2 LYS A 24 -15.110 17.241 9.320 1.00 3.31 H new ATOM 0 HG3 LYS A 24 -13.538 17.171 8.548 1.00 3.31 H new ATOM 0 HD2 LYS A 24 -15.981 18.599 7.410 1.00 74.43 H new ATOM 0 HD3 LYS A 24 -14.656 19.382 8.246 1.00 74.43 H new ATOM 0 HE2 LYS A 24 -13.088 18.388 6.517 1.00 14.31 H new ATOM 0 HE3 LYS A 24 -14.499 17.828 5.642 1.00 14.31 H new ATOM 0 HZ1 LYS A 24 -13.558 19.949 4.862 1.00 62.10 H new ATOM 0 HZ2 LYS A 24 -15.202 20.033 5.276 1.00 62.10 H new ATOM 0 HZ3 LYS A 24 -14.029 20.666 6.328 1.00 62.10 H new ATOM 367 N GLU A 25 -14.531 12.931 6.523 1.00 22.02 N ATOM 368 CA GLU A 25 -15.022 11.767 5.821 1.00 5.14 C ATOM 369 C GLU A 25 -14.946 10.535 6.700 1.00 1.31 C ATOM 370 O GLU A 25 -15.730 9.605 6.542 1.00 33.11 O ATOM 371 CB GLU A 25 -14.304 11.522 4.490 1.00 61.21 C ATOM 372 CG GLU A 25 -14.615 12.532 3.386 1.00 23.43 C ATOM 373 CD GLU A 25 -13.955 13.876 3.562 1.00 24.35 C ATOM 374 OE1 GLU A 25 -14.454 14.722 4.331 1.00 45.24 O ATOM 375 OE2 GLU A 25 -12.952 14.130 2.888 1.00 41.45 O ATOM 0 H GLU A 25 -13.628 13.274 6.196 1.00 22.02 H new ATOM 0 HA GLU A 25 -16.066 11.971 5.582 1.00 5.14 H new ATOM 0 HB2 GLU A 25 -13.229 11.524 4.670 1.00 61.21 H new ATOM 0 HB3 GLU A 25 -14.565 10.526 4.133 1.00 61.21 H new ATOM 0 HG2 GLU A 25 -14.305 12.112 2.429 1.00 23.43 H new ATOM 0 HG3 GLU A 25 -15.694 12.675 3.336 1.00 23.43 H new ATOM 382 N MET A 26 -14.022 10.541 7.657 1.00 31.02 N ATOM 383 CA MET A 26 -13.900 9.427 8.599 1.00 25.20 C ATOM 384 C MET A 26 -15.141 9.373 9.457 1.00 64.44 C ATOM 385 O MET A 26 -15.696 8.308 9.704 1.00 45.12 O ATOM 386 CB MET A 26 -12.678 9.563 9.511 1.00 34.14 C ATOM 387 CG MET A 26 -11.337 9.604 8.805 1.00 44.01 C ATOM 388 SD MET A 26 -9.952 9.504 9.963 1.00 41.14 S ATOM 389 CE MET A 26 -10.279 10.878 11.066 1.00 13.31 C ATOM 0 H MET A 26 -13.352 11.296 7.802 1.00 31.02 H new ATOM 0 HA MET A 26 -13.780 8.514 8.015 1.00 25.20 H new ATOM 0 HB2 MET A 26 -12.786 10.473 10.101 1.00 34.14 H new ATOM 0 HB3 MET A 26 -12.675 8.728 10.211 1.00 34.14 H new ATOM 0 HG2 MET A 26 -11.276 8.778 8.096 1.00 44.01 H new ATOM 0 HG3 MET A 26 -11.260 10.526 8.228 1.00 44.01 H new ATOM 0 HE1 MET A 26 -9.337 11.346 11.353 1.00 13.31 H new ATOM 0 HE2 MET A 26 -10.909 11.609 10.559 1.00 13.31 H new ATOM 0 HE3 MET A 26 -10.790 10.515 11.958 1.00 13.31 H new ATOM 399 N GLU A 27 -15.605 10.554 9.849 1.00 64.41 N ATOM 400 CA GLU A 27 -16.790 10.710 10.682 1.00 24.13 C ATOM 401 C GLU A 27 -18.006 10.154 9.949 1.00 22.32 C ATOM 402 O GLU A 27 -18.848 9.486 10.535 1.00 73.04 O ATOM 403 CB GLU A 27 -17.022 12.185 10.978 1.00 51.44 C ATOM 404 CG GLU A 27 -15.790 12.915 11.480 1.00 24.13 C ATOM 405 CD GLU A 27 -16.048 14.377 11.703 1.00 52.35 C ATOM 406 OE1 GLU A 27 -16.649 15.033 10.818 1.00 43.34 O ATOM 407 OE2 GLU A 27 -15.647 14.907 12.760 1.00 60.20 O ATOM 0 H GLU A 27 -15.164 11.438 9.595 1.00 64.41 H new ATOM 0 HA GLU A 27 -16.641 10.169 11.616 1.00 24.13 H new ATOM 0 HB2 GLU A 27 -17.378 12.675 10.072 1.00 51.44 H new ATOM 0 HB3 GLU A 27 -17.814 12.276 11.722 1.00 51.44 H new ATOM 0 HG2 GLU A 27 -15.455 12.461 12.413 1.00 24.13 H new ATOM 0 HG3 GLU A 27 -14.981 12.796 10.759 1.00 24.13 H new ATOM 414 N SER A 28 -18.061 10.417 8.660 1.00 21.13 N ATOM 415 CA SER A 28 -19.132 9.941 7.815 1.00 41.44 C ATOM 416 C SER A 28 -19.003 8.423 7.558 1.00 15.25 C ATOM 417 O SER A 28 -19.996 7.725 7.348 1.00 5.25 O ATOM 418 CB SER A 28 -19.111 10.724 6.509 1.00 61.12 C ATOM 419 OG SER A 28 -19.174 12.129 6.771 1.00 3.25 O ATOM 0 H SER A 28 -17.359 10.970 8.168 1.00 21.13 H new ATOM 0 HA SER A 28 -20.087 10.099 8.315 1.00 41.44 H new ATOM 0 HB2 SER A 28 -18.203 10.491 5.952 1.00 61.12 H new ATOM 0 HB3 SER A 28 -19.953 10.426 5.885 1.00 61.12 H new ATOM 0 HG SER A 28 -18.309 12.437 7.115 1.00 3.25 H new ATOM 425 N SER A 29 -17.785 7.916 7.602 1.00 43.21 N ATOM 426 CA SER A 29 -17.551 6.503 7.413 1.00 1.45 C ATOM 427 C SER A 29 -17.990 5.729 8.662 1.00 1.23 C ATOM 428 O SER A 29 -18.462 4.578 8.568 1.00 63.44 O ATOM 429 CB SER A 29 -16.080 6.242 7.076 1.00 12.25 C ATOM 430 OG SER A 29 -15.700 6.943 5.889 1.00 42.43 O ATOM 0 H SER A 29 -16.942 8.466 7.768 1.00 43.21 H new ATOM 0 HA SER A 29 -18.146 6.151 6.570 1.00 1.45 H new ATOM 0 HB2 SER A 29 -15.450 6.557 7.908 1.00 12.25 H new ATOM 0 HB3 SER A 29 -15.917 5.173 6.940 1.00 12.25 H new ATOM 0 HG SER A 29 -15.540 7.886 6.103 1.00 42.43 H new ATOM 436 N THR A 30 -17.876 6.400 9.808 1.00 61.54 N ATOM 437 CA THR A 30 -18.275 5.867 11.085 1.00 5.12 C ATOM 438 C THR A 30 -19.774 5.521 11.047 1.00 45.35 C ATOM 439 O THR A 30 -20.610 6.334 10.625 1.00 11.20 O ATOM 440 CB THR A 30 -17.972 6.899 12.194 1.00 53.32 C ATOM 441 OG1 THR A 30 -16.571 7.244 12.149 1.00 45.13 O ATOM 442 CG2 THR A 30 -18.312 6.358 13.577 1.00 40.43 C ATOM 0 H THR A 30 -17.496 7.345 9.862 1.00 61.54 H new ATOM 0 HA THR A 30 -17.715 4.957 11.301 1.00 5.12 H new ATOM 0 HB THR A 30 -18.590 7.779 12.016 1.00 53.32 H new ATOM 0 HG1 THR A 30 -16.384 7.748 11.329 1.00 45.13 H new ATOM 0 HG21 THR A 30 -18.085 7.113 14.329 1.00 40.43 H new ATOM 0 HG22 THR A 30 -19.373 6.111 13.620 1.00 40.43 H new ATOM 0 HG23 THR A 30 -17.722 5.462 13.772 1.00 40.43 H new ATOM 450 N GLY A 31 -20.077 4.312 11.425 1.00 55.04 N ATOM 451 CA GLY A 31 -21.413 3.804 11.363 1.00 63.54 C ATOM 452 C GLY A 31 -21.344 2.417 10.837 1.00 23.23 C ATOM 453 O GLY A 31 -22.008 1.505 11.321 1.00 61.15 O ATOM 0 H GLY A 31 -19.395 3.646 11.788 1.00 55.04 H new ATOM 0 HA2 GLY A 31 -21.873 3.816 12.351 1.00 63.54 H new ATOM 0 HA3 GLY A 31 -22.030 4.428 10.717 1.00 63.54 H new ATOM 457 N THR A 32 -20.524 2.264 9.839 1.00 11.44 N ATOM 458 CA THR A 32 -20.212 0.995 9.293 1.00 21.34 C ATOM 459 C THR A 32 -18.729 0.745 9.535 1.00 51.20 C ATOM 460 O THR A 32 -17.887 1.557 9.141 1.00 11.42 O ATOM 461 CB THR A 32 -20.532 0.947 7.781 1.00 63.34 C ATOM 462 OG1 THR A 32 -21.936 1.231 7.579 1.00 72.52 O ATOM 463 CG2 THR A 32 -20.209 -0.424 7.201 1.00 21.22 C ATOM 0 H THR A 32 -20.048 3.040 9.379 1.00 11.44 H new ATOM 0 HA THR A 32 -20.814 0.222 9.771 1.00 21.34 H new ATOM 0 HB THR A 32 -19.920 1.693 7.274 1.00 63.34 H new ATOM 0 HG1 THR A 32 -22.141 1.203 6.621 1.00 72.52 H new ATOM 0 HG21 THR A 32 -20.443 -0.433 6.136 1.00 21.22 H new ATOM 0 HG22 THR A 32 -19.150 -0.638 7.342 1.00 21.22 H new ATOM 0 HG23 THR A 32 -20.803 -1.183 7.709 1.00 21.22 H new ATOM 471 N ALA A 33 -18.418 -0.321 10.213 1.00 4.35 N ATOM 472 CA ALA A 33 -17.045 -0.659 10.494 1.00 34.30 C ATOM 473 C ALA A 33 -16.513 -1.541 9.375 1.00 65.33 C ATOM 474 O ALA A 33 -17.250 -2.406 8.880 1.00 74.31 O ATOM 475 CB ALA A 33 -16.945 -1.370 11.838 1.00 43.42 C ATOM 0 H ALA A 33 -19.101 -0.980 10.587 1.00 4.35 H new ATOM 0 HA ALA A 33 -16.445 0.249 10.548 1.00 34.30 H new ATOM 0 HB1 ALA A 33 -15.904 -1.621 12.040 1.00 43.42 H new ATOM 0 HB2 ALA A 33 -17.320 -0.715 12.625 1.00 43.42 H new ATOM 0 HB3 ALA A 33 -17.540 -2.283 11.812 1.00 43.42 H new ATOM 481 N PRO A 34 -15.270 -1.330 8.912 1.00 2.23 N ATOM 482 CA PRO A 34 -14.699 -2.149 7.852 1.00 33.31 C ATOM 483 C PRO A 34 -14.326 -3.544 8.361 1.00 12.25 C ATOM 484 O PRO A 34 -13.820 -3.698 9.483 1.00 45.04 O ATOM 485 CB PRO A 34 -13.421 -1.388 7.434 1.00 0.55 C ATOM 486 CG PRO A 34 -13.485 -0.072 8.139 1.00 33.02 C ATOM 487 CD PRO A 34 -14.329 -0.291 9.358 1.00 1.40 C ATOM 0 HA PRO A 34 -15.403 -2.298 7.033 1.00 33.31 H new ATOM 0 HB2 PRO A 34 -12.526 -1.941 7.718 1.00 0.55 H new ATOM 0 HB3 PRO A 34 -13.382 -1.252 6.353 1.00 0.55 H new ATOM 0 HG2 PRO A 34 -12.488 0.272 8.413 1.00 33.02 H new ATOM 0 HG3 PRO A 34 -13.921 0.693 7.496 1.00 33.02 H new ATOM 0 HD2 PRO A 34 -13.734 -0.621 10.209 1.00 1.40 H new ATOM 0 HD3 PRO A 34 -14.845 0.619 9.663 1.00 1.40 H new ATOM 495 N ALA A 35 -14.541 -4.533 7.534 1.00 73.32 N ATOM 496 CA ALA A 35 -14.211 -5.886 7.873 1.00 1.50 C ATOM 497 C ALA A 35 -12.901 -6.227 7.213 1.00 62.31 C ATOM 498 O ALA A 35 -12.719 -5.995 6.008 1.00 71.01 O ATOM 499 CB ALA A 35 -15.309 -6.837 7.425 1.00 3.52 C ATOM 0 H ALA A 35 -14.950 -4.420 6.607 1.00 73.32 H new ATOM 0 HA ALA A 35 -14.119 -5.989 8.954 1.00 1.50 H new ATOM 0 HB1 ALA A 35 -15.037 -7.858 7.692 1.00 3.52 H new ATOM 0 HB2 ALA A 35 -16.245 -6.570 7.916 1.00 3.52 H new ATOM 0 HB3 ALA A 35 -15.433 -6.766 6.344 1.00 3.52 H new ATOM 505 N SER A 36 -11.974 -6.689 7.984 1.00 23.44 N ATOM 506 CA SER A 36 -10.685 -7.023 7.481 1.00 62.50 C ATOM 507 C SER A 36 -10.214 -8.340 8.106 1.00 75.40 C ATOM 508 O SER A 36 -9.992 -8.421 9.310 1.00 50.33 O ATOM 509 CB SER A 36 -9.722 -5.876 7.807 1.00 31.11 C ATOM 510 OG SER A 36 -10.286 -4.627 7.413 1.00 1.12 O ATOM 0 H SER A 36 -12.090 -6.846 8.985 1.00 23.44 H new ATOM 0 HA SER A 36 -10.718 -7.160 6.400 1.00 62.50 H new ATOM 0 HB2 SER A 36 -9.508 -5.865 8.876 1.00 31.11 H new ATOM 0 HB3 SER A 36 -8.773 -6.032 7.294 1.00 31.11 H new ATOM 0 HG SER A 36 -9.661 -3.903 7.628 1.00 1.12 H new ATOM 516 N THR A 37 -10.143 -9.376 7.304 1.00 34.50 N ATOM 517 CA THR A 37 -9.705 -10.688 7.728 1.00 20.22 C ATOM 518 C THR A 37 -9.142 -11.413 6.498 1.00 63.11 C ATOM 519 O THR A 37 -9.652 -11.223 5.388 1.00 53.10 O ATOM 520 CB THR A 37 -10.908 -11.497 8.312 1.00 0.34 C ATOM 521 OG1 THR A 37 -11.540 -10.728 9.359 1.00 74.20 O ATOM 522 CG2 THR A 37 -10.452 -12.834 8.893 1.00 1.41 C ATOM 0 H THR A 37 -10.393 -9.331 6.316 1.00 34.50 H new ATOM 0 HA THR A 37 -8.945 -10.598 8.504 1.00 20.22 H new ATOM 0 HB THR A 37 -11.608 -11.691 7.500 1.00 0.34 H new ATOM 0 HG1 THR A 37 -12.296 -11.233 9.725 1.00 74.20 H new ATOM 0 HG21 THR A 37 -11.313 -13.371 9.290 1.00 1.41 H new ATOM 0 HG22 THR A 37 -9.983 -13.430 8.110 1.00 1.41 H new ATOM 0 HG23 THR A 37 -9.734 -12.657 9.694 1.00 1.41 H new ATOM 530 N GLY A 38 -8.082 -12.183 6.673 1.00 3.31 N ATOM 531 CA GLY A 38 -7.529 -12.920 5.559 1.00 52.42 C ATOM 532 C GLY A 38 -6.024 -12.872 5.537 1.00 30.51 C ATOM 533 O GLY A 38 -5.376 -13.681 4.875 1.00 34.23 O ATOM 0 H GLY A 38 -7.597 -12.311 7.561 1.00 3.31 H new ATOM 0 HA2 GLY A 38 -7.857 -13.958 5.613 1.00 52.42 H new ATOM 0 HA3 GLY A 38 -7.918 -12.511 4.626 1.00 52.42 H new ATOM 537 N ALA A 39 -5.461 -11.959 6.298 1.00 61.53 N ATOM 538 CA ALA A 39 -4.022 -11.788 6.335 1.00 53.11 C ATOM 539 C ALA A 39 -3.409 -12.896 7.156 1.00 53.12 C ATOM 540 O ALA A 39 -2.349 -13.399 6.840 1.00 13.52 O ATOM 541 CB ALA A 39 -3.652 -10.425 6.894 1.00 45.51 C ATOM 0 H ALA A 39 -5.979 -11.321 6.902 1.00 61.53 H new ATOM 0 HA ALA A 39 -3.629 -11.840 5.320 1.00 53.11 H new ATOM 0 HB1 ALA A 39 -2.567 -10.321 6.911 1.00 45.51 H new ATOM 0 HB2 ALA A 39 -4.081 -9.645 6.265 1.00 45.51 H new ATOM 0 HB3 ALA A 39 -4.042 -10.329 7.907 1.00 45.51 H new ATOM 547 N GLU A 40 -4.156 -13.338 8.149 1.00 13.43 N ATOM 548 CA GLU A 40 -3.740 -14.388 9.062 1.00 32.31 C ATOM 549 C GLU A 40 -3.920 -15.780 8.444 1.00 45.23 C ATOM 550 O GLU A 40 -3.679 -16.804 9.091 1.00 73.31 O ATOM 551 CB GLU A 40 -4.504 -14.301 10.403 1.00 1.15 C ATOM 552 CG GLU A 40 -6.038 -14.251 10.294 1.00 34.15 C ATOM 553 CD GLU A 40 -6.591 -12.855 10.043 1.00 12.11 C ATOM 554 OE1 GLU A 40 -6.538 -12.353 8.895 1.00 1.12 O ATOM 555 OE2 GLU A 40 -7.071 -12.225 10.999 1.00 63.32 O ATOM 0 H GLU A 40 -5.087 -12.971 8.349 1.00 13.43 H new ATOM 0 HA GLU A 40 -2.678 -14.236 9.256 1.00 32.31 H new ATOM 0 HB2 GLU A 40 -4.229 -15.161 11.013 1.00 1.15 H new ATOM 0 HB3 GLU A 40 -4.167 -13.412 10.935 1.00 1.15 H new ATOM 0 HG2 GLU A 40 -6.357 -14.909 9.486 1.00 34.15 H new ATOM 0 HG3 GLU A 40 -6.471 -14.643 11.214 1.00 34.15 H new ATOM 562 N ASN A 41 -4.332 -15.813 7.207 1.00 53.12 N ATOM 563 CA ASN A 41 -4.543 -17.061 6.508 1.00 42.11 C ATOM 564 C ASN A 41 -3.271 -17.447 5.792 1.00 75.31 C ATOM 565 O ASN A 41 -2.987 -18.624 5.610 1.00 5.22 O ATOM 566 CB ASN A 41 -5.702 -16.948 5.488 1.00 5.12 C ATOM 567 CG ASN A 41 -7.065 -16.629 6.111 1.00 21.43 C ATOM 568 OD1 ASN A 41 -7.170 -15.968 7.154 1.00 32.11 O ATOM 569 ND2 ASN A 41 -8.113 -17.079 5.478 1.00 43.22 N ATOM 0 H ASN A 41 -4.532 -14.981 6.652 1.00 53.12 H new ATOM 0 HA ASN A 41 -4.812 -17.825 7.237 1.00 42.11 H new ATOM 0 HB2 ASN A 41 -5.457 -16.172 4.763 1.00 5.12 H new ATOM 0 HB3 ASN A 41 -5.778 -17.886 4.938 1.00 5.12 H new ATOM 0 HD21 ASN A 41 -9.048 -16.889 5.840 1.00 43.22 H new ATOM 0 HD22 ASN A 41 -7.998 -17.621 4.621 1.00 43.22 H new ATOM 576 N LEU A 42 -2.484 -16.424 5.435 1.00 24.32 N ATOM 577 CA LEU A 42 -1.232 -16.566 4.674 1.00 4.30 C ATOM 578 C LEU A 42 -1.355 -17.487 3.451 1.00 40.14 C ATOM 579 O LEU A 42 -0.981 -18.664 3.506 1.00 62.54 O ATOM 580 CB LEU A 42 -0.014 -16.975 5.530 1.00 34.01 C ATOM 581 CG LEU A 42 0.589 -15.920 6.472 1.00 31.14 C ATOM 582 CD1 LEU A 42 -0.301 -15.649 7.669 1.00 4.32 C ATOM 583 CD2 LEU A 42 1.975 -16.338 6.913 1.00 32.41 C ATOM 0 H LEU A 42 -2.702 -15.456 5.670 1.00 24.32 H new ATOM 0 HA LEU A 42 -1.045 -15.555 4.312 1.00 4.30 H new ATOM 0 HB2 LEU A 42 -0.303 -17.836 6.133 1.00 34.01 H new ATOM 0 HB3 LEU A 42 0.773 -17.309 4.854 1.00 34.01 H new ATOM 0 HG LEU A 42 0.665 -14.987 5.914 1.00 31.14 H new ATOM 0 HD11 LEU A 42 0.165 -14.898 8.306 1.00 4.32 H new ATOM 0 HD12 LEU A 42 -1.270 -15.284 7.327 1.00 4.32 H new ATOM 0 HD13 LEU A 42 -0.439 -16.570 8.235 1.00 4.32 H new ATOM 0 HD21 LEU A 42 2.389 -15.581 7.579 1.00 32.41 H new ATOM 0 HD22 LEU A 42 1.918 -17.291 7.438 1.00 32.41 H new ATOM 0 HD23 LEU A 42 2.619 -16.443 6.040 1.00 32.41 H new ATOM 595 N PRO A 43 -1.939 -16.992 2.351 1.00 3.23 N ATOM 596 CA PRO A 43 -2.038 -17.774 1.122 1.00 11.22 C ATOM 597 C PRO A 43 -0.662 -17.954 0.454 1.00 12.22 C ATOM 598 O PRO A 43 -0.158 -19.069 0.316 1.00 64.44 O ATOM 599 CB PRO A 43 -2.984 -16.950 0.232 1.00 71.35 C ATOM 600 CG PRO A 43 -2.966 -15.563 0.789 1.00 21.35 C ATOM 601 CD PRO A 43 -2.610 -15.676 2.243 1.00 12.20 C ATOM 0 HA PRO A 43 -2.405 -18.784 1.303 1.00 11.22 H new ATOM 0 HB2 PRO A 43 -2.650 -16.959 -0.806 1.00 71.35 H new ATOM 0 HB3 PRO A 43 -3.992 -17.363 0.246 1.00 71.35 H new ATOM 0 HG2 PRO A 43 -2.239 -14.945 0.261 1.00 21.35 H new ATOM 0 HG3 PRO A 43 -3.938 -15.086 0.666 1.00 21.35 H new ATOM 0 HD2 PRO A 43 -1.951 -14.866 2.556 1.00 12.20 H new ATOM 0 HD3 PRO A 43 -3.497 -15.628 2.875 1.00 12.20 H new ATOM 609 N ALA A 44 -0.048 -16.846 0.081 1.00 72.43 N ATOM 610 CA ALA A 44 1.252 -16.870 -0.578 1.00 73.44 C ATOM 611 C ALA A 44 2.377 -16.540 0.392 1.00 64.50 C ATOM 612 O ALA A 44 3.543 -16.751 0.094 1.00 73.42 O ATOM 613 CB ALA A 44 1.261 -15.876 -1.723 1.00 31.52 C ATOM 0 H ALA A 44 -0.429 -15.911 0.223 1.00 72.43 H new ATOM 0 HA ALA A 44 1.418 -17.878 -0.957 1.00 73.44 H new ATOM 0 HB1 ALA A 44 2.234 -15.896 -2.214 1.00 31.52 H new ATOM 0 HB2 ALA A 44 0.486 -16.142 -2.442 1.00 31.52 H new ATOM 0 HB3 ALA A 44 1.070 -14.875 -1.337 1.00 31.52 H new ATOM 619 N GLY A 45 2.017 -16.020 1.552 1.00 21.15 N ATOM 620 CA GLY A 45 3.027 -15.590 2.513 1.00 73.43 C ATOM 621 C GLY A 45 3.575 -14.222 2.141 1.00 41.41 C ATOM 622 O GLY A 45 4.662 -13.825 2.556 1.00 22.44 O ATOM 0 H GLY A 45 1.051 -15.885 1.852 1.00 21.15 H new ATOM 0 HA2 GLY A 45 2.593 -15.554 3.512 1.00 73.43 H new ATOM 0 HA3 GLY A 45 3.839 -16.316 2.544 1.00 73.43 H new ATOM 626 N SER A 46 2.836 -13.541 1.301 1.00 22.42 N ATOM 627 CA SER A 46 3.130 -12.215 0.833 1.00 11.55 C ATOM 628 C SER A 46 1.786 -11.568 0.544 1.00 22.53 C ATOM 629 O SER A 46 0.763 -12.293 0.504 1.00 25.12 O ATOM 630 CB SER A 46 4.002 -12.295 -0.427 1.00 13.21 C ATOM 631 OG SER A 46 5.193 -13.032 -0.142 1.00 20.12 O ATOM 0 H SER A 46 1.973 -13.917 0.908 1.00 22.42 H new ATOM 0 HA SER A 46 3.686 -11.629 1.565 1.00 11.55 H new ATOM 0 HB2 SER A 46 3.449 -12.776 -1.234 1.00 13.21 H new ATOM 0 HB3 SER A 46 4.257 -11.292 -0.769 1.00 13.21 H new ATOM 0 HG SER A 46 5.747 -13.083 -0.949 1.00 20.12 H new ATOM 637 N ALA A 47 1.746 -10.274 0.348 1.00 63.42 N ATOM 638 CA ALA A 47 0.485 -9.582 0.187 1.00 24.42 C ATOM 639 C ALA A 47 0.645 -8.341 -0.658 1.00 21.30 C ATOM 640 O ALA A 47 1.749 -7.822 -0.796 1.00 42.11 O ATOM 641 CB ALA A 47 -0.104 -9.260 1.529 1.00 35.15 C ATOM 0 H ALA A 47 2.570 -9.675 0.296 1.00 63.42 H new ATOM 0 HA ALA A 47 -0.205 -10.241 -0.339 1.00 24.42 H new ATOM 0 HB1 ALA A 47 -1.052 -8.740 1.395 1.00 35.15 H new ATOM 0 HB2 ALA A 47 -0.272 -10.183 2.084 1.00 35.15 H new ATOM 0 HB3 ALA A 47 0.584 -8.623 2.085 1.00 35.15 H new ATOM 647 N LEU A 48 -0.437 -7.886 -1.242 1.00 54.34 N ATOM 648 CA LEU A 48 -0.387 -6.771 -2.150 1.00 41.13 C ATOM 649 C LEU A 48 -1.267 -5.623 -1.687 1.00 11.04 C ATOM 650 O LEU A 48 -2.233 -5.819 -0.952 1.00 21.45 O ATOM 651 CB LEU A 48 -0.738 -7.228 -3.603 1.00 12.43 C ATOM 652 CG LEU A 48 -2.117 -7.893 -3.861 1.00 63.34 C ATOM 653 CD1 LEU A 48 -3.253 -6.878 -3.871 1.00 53.10 C ATOM 654 CD2 LEU A 48 -2.100 -8.658 -5.164 1.00 31.31 C ATOM 0 H LEU A 48 -1.369 -8.276 -1.102 1.00 54.34 H new ATOM 0 HA LEU A 48 0.635 -6.392 -2.158 1.00 41.13 H new ATOM 0 HB2 LEU A 48 -0.665 -6.355 -4.251 1.00 12.43 H new ATOM 0 HB3 LEU A 48 0.033 -7.929 -3.925 1.00 12.43 H new ATOM 0 HG LEU A 48 -2.297 -8.583 -3.037 1.00 63.34 H new ATOM 0 HD11 LEU A 48 -4.197 -7.391 -4.055 1.00 53.10 H new ATOM 0 HD12 LEU A 48 -3.297 -6.372 -2.907 1.00 53.10 H new ATOM 0 HD13 LEU A 48 -3.079 -6.145 -4.658 1.00 53.10 H new ATOM 0 HD21 LEU A 48 -3.075 -9.118 -5.329 1.00 31.31 H new ATOM 0 HD22 LEU A 48 -1.877 -7.975 -5.984 1.00 31.31 H new ATOM 0 HD23 LEU A 48 -1.336 -9.434 -5.120 1.00 31.31 H new ATOM 666 N LEU A 49 -0.929 -4.448 -2.099 1.00 63.40 N ATOM 667 CA LEU A 49 -1.742 -3.302 -1.835 1.00 24.25 C ATOM 668 C LEU A 49 -2.037 -2.599 -3.138 1.00 12.51 C ATOM 669 O LEU A 49 -1.186 -2.570 -4.038 1.00 33.23 O ATOM 670 CB LEU A 49 -1.125 -2.370 -0.740 1.00 53.11 C ATOM 671 CG LEU A 49 0.317 -1.832 -0.931 1.00 63.32 C ATOM 672 CD1 LEU A 49 0.398 -0.731 -1.981 1.00 3.01 C ATOM 673 CD2 LEU A 49 0.879 -1.345 0.395 1.00 3.42 C ATOM 0 H LEU A 49 -0.080 -4.251 -2.630 1.00 63.40 H new ATOM 0 HA LEU A 49 -2.691 -3.623 -1.405 1.00 24.25 H new ATOM 0 HB2 LEU A 49 -1.785 -1.509 -0.632 1.00 53.11 H new ATOM 0 HB3 LEU A 49 -1.151 -2.912 0.205 1.00 53.11 H new ATOM 0 HG LEU A 49 0.922 -2.662 -1.296 1.00 63.32 H new ATOM 0 HD11 LEU A 49 1.430 -0.392 -2.073 1.00 3.01 H new ATOM 0 HD12 LEU A 49 0.056 -1.118 -2.941 1.00 3.01 H new ATOM 0 HD13 LEU A 49 -0.234 0.105 -1.681 1.00 3.01 H new ATOM 0 HD21 LEU A 49 1.892 -0.970 0.245 1.00 3.42 H new ATOM 0 HD22 LEU A 49 0.250 -0.545 0.785 1.00 3.42 H new ATOM 0 HD23 LEU A 49 0.899 -2.170 1.107 1.00 3.42 H new ATOM 685 N VAL A 50 -3.229 -2.109 -3.277 1.00 64.30 N ATOM 686 CA VAL A 50 -3.618 -1.416 -4.479 1.00 12.31 C ATOM 687 C VAL A 50 -3.925 0.039 -4.161 1.00 53.11 C ATOM 688 O VAL A 50 -4.574 0.344 -3.141 1.00 54.05 O ATOM 689 CB VAL A 50 -4.826 -2.115 -5.203 1.00 5.34 C ATOM 690 CG1 VAL A 50 -6.075 -2.175 -4.325 1.00 63.05 C ATOM 691 CG2 VAL A 50 -5.133 -1.451 -6.545 1.00 52.40 C ATOM 0 H VAL A 50 -3.961 -2.174 -2.569 1.00 64.30 H new ATOM 0 HA VAL A 50 -2.781 -1.453 -5.176 1.00 12.31 H new ATOM 0 HB VAL A 50 -4.520 -3.143 -5.395 1.00 5.34 H new ATOM 0 HG11 VAL A 50 -6.880 -2.667 -4.871 1.00 63.05 H new ATOM 0 HG12 VAL A 50 -5.855 -2.738 -3.418 1.00 63.05 H new ATOM 0 HG13 VAL A 50 -6.382 -1.163 -4.059 1.00 63.05 H new ATOM 0 HG21 VAL A 50 -5.973 -1.959 -7.019 1.00 52.40 H new ATOM 0 HG22 VAL A 50 -5.387 -0.403 -6.383 1.00 52.40 H new ATOM 0 HG23 VAL A 50 -4.258 -1.516 -7.192 1.00 52.40 H new ATOM 701 N VAL A 51 -3.416 0.928 -4.973 1.00 63.34 N ATOM 702 CA VAL A 51 -3.655 2.332 -4.788 1.00 55.24 C ATOM 703 C VAL A 51 -4.955 2.687 -5.493 1.00 1.21 C ATOM 704 O VAL A 51 -5.075 2.528 -6.714 1.00 32.53 O ATOM 705 CB VAL A 51 -2.512 3.202 -5.377 1.00 22.22 C ATOM 706 CG1 VAL A 51 -2.646 4.655 -4.930 1.00 13.34 C ATOM 707 CG2 VAL A 51 -1.135 2.645 -5.027 1.00 2.23 C ATOM 0 H VAL A 51 -2.829 0.700 -5.775 1.00 63.34 H new ATOM 0 HA VAL A 51 -3.708 2.534 -3.718 1.00 55.24 H new ATOM 0 HB VAL A 51 -2.606 3.170 -6.462 1.00 22.22 H new ATOM 0 HG11 VAL A 51 -1.833 5.243 -5.356 1.00 13.34 H new ATOM 0 HG12 VAL A 51 -3.601 5.054 -5.272 1.00 13.34 H new ATOM 0 HG13 VAL A 51 -2.600 4.707 -3.842 1.00 13.34 H new ATOM 0 HG21 VAL A 51 -0.364 3.283 -5.458 1.00 2.23 H new ATOM 0 HG22 VAL A 51 -1.019 2.617 -3.944 1.00 2.23 H new ATOM 0 HG23 VAL A 51 -1.038 1.636 -5.429 1.00 2.23 H new ATOM 717 N LYS A 52 -5.911 3.150 -4.736 1.00 22.14 N ATOM 718 CA LYS A 52 -7.209 3.518 -5.261 1.00 24.44 C ATOM 719 C LYS A 52 -7.258 4.982 -5.629 1.00 21.45 C ATOM 720 O LYS A 52 -7.937 5.373 -6.576 1.00 63.13 O ATOM 721 CB LYS A 52 -8.317 3.208 -4.241 1.00 71.02 C ATOM 722 CG LYS A 52 -8.610 1.724 -4.035 1.00 11.31 C ATOM 723 CD LYS A 52 -9.190 1.066 -5.294 1.00 12.24 C ATOM 724 CE LYS A 52 -10.539 1.678 -5.693 1.00 61.30 C ATOM 725 NZ LYS A 52 -11.059 1.091 -6.941 1.00 71.03 N ATOM 0 H LYS A 52 -5.817 3.286 -3.729 1.00 22.14 H new ATOM 0 HA LYS A 52 -7.374 2.927 -6.162 1.00 24.44 H new ATOM 0 HB2 LYS A 52 -8.039 3.644 -3.282 1.00 71.02 H new ATOM 0 HB3 LYS A 52 -9.234 3.702 -4.562 1.00 71.02 H new ATOM 0 HG2 LYS A 52 -7.692 1.211 -3.749 1.00 11.31 H new ATOM 0 HG3 LYS A 52 -9.312 1.605 -3.209 1.00 11.31 H new ATOM 0 HD2 LYS A 52 -8.485 1.175 -6.118 1.00 12.24 H new ATOM 0 HD3 LYS A 52 -9.314 -0.003 -5.120 1.00 12.24 H new ATOM 0 HE2 LYS A 52 -11.260 1.523 -4.890 1.00 61.30 H new ATOM 0 HE3 LYS A 52 -10.427 2.755 -5.817 1.00 61.30 H new ATOM 0 HZ1 LYS A 52 -11.972 1.530 -7.177 1.00 71.03 H new ATOM 0 HZ2 LYS A 52 -10.383 1.261 -7.713 1.00 71.03 H new ATOM 0 HZ3 LYS A 52 -11.190 0.067 -6.815 1.00 71.03 H new ATOM 739 N ARG A 53 -6.529 5.790 -4.902 1.00 24.41 N ATOM 740 CA ARG A 53 -6.572 7.215 -5.127 1.00 51.51 C ATOM 741 C ARG A 53 -5.195 7.816 -4.925 1.00 25.45 C ATOM 742 O ARG A 53 -4.485 7.449 -3.973 1.00 55.22 O ATOM 743 CB ARG A 53 -7.589 7.874 -4.179 1.00 55.11 C ATOM 744 CG ARG A 53 -7.818 9.360 -4.428 1.00 41.04 C ATOM 745 CD ARG A 53 -8.471 9.614 -5.784 1.00 75.32 C ATOM 746 NE ARG A 53 -9.812 9.019 -5.881 1.00 4.30 N ATOM 747 CZ ARG A 53 -10.476 8.777 -7.030 1.00 41.13 C ATOM 748 NH1 ARG A 53 -9.884 8.949 -8.207 1.00 61.25 N ATOM 749 NH2 ARG A 53 -11.718 8.318 -6.994 1.00 52.03 N ATOM 0 H ARG A 53 -5.903 5.490 -4.155 1.00 24.41 H new ATOM 0 HA ARG A 53 -6.886 7.399 -6.154 1.00 51.51 H new ATOM 0 HB2 ARG A 53 -8.542 7.353 -4.270 1.00 55.11 H new ATOM 0 HB3 ARG A 53 -7.249 7.739 -3.152 1.00 55.11 H new ATOM 0 HG2 ARG A 53 -8.449 9.768 -3.639 1.00 41.04 H new ATOM 0 HG3 ARG A 53 -6.866 9.888 -4.379 1.00 41.04 H new ATOM 0 HD2 ARG A 53 -8.540 10.688 -5.955 1.00 75.32 H new ATOM 0 HD3 ARG A 53 -7.838 9.206 -6.571 1.00 75.32 H new ATOM 0 HE ARG A 53 -10.278 8.769 -5.009 1.00 4.30 H new ATOM 0 HH11 ARG A 53 -8.916 9.268 -8.249 1.00 61.25 H new ATOM 0 HH12 ARG A 53 -10.398 8.762 -9.068 1.00 61.25 H new ATOM 0 HH21 ARG A 53 -12.173 8.147 -6.097 1.00 52.03 H new ATOM 0 HH22 ARG A 53 -12.220 8.135 -7.863 1.00 52.03 H new ATOM 763 N GLY A 54 -4.824 8.704 -5.819 1.00 2.14 N ATOM 764 CA GLY A 54 -3.553 9.377 -5.751 1.00 63.34 C ATOM 765 C GLY A 54 -2.833 9.268 -7.076 1.00 0.41 C ATOM 766 O GLY A 54 -3.325 8.592 -7.967 1.00 14.03 O ATOM 0 H GLY A 54 -5.399 8.979 -6.615 1.00 2.14 H new ATOM 0 HA2 GLY A 54 -3.702 10.426 -5.495 1.00 63.34 H new ATOM 0 HA3 GLY A 54 -2.943 8.939 -4.960 1.00 63.34 H new ATOM 770 N PRO A 55 -1.673 9.921 -7.251 1.00 74.20 N ATOM 771 CA PRO A 55 -0.891 9.832 -8.496 1.00 44.45 C ATOM 772 C PRO A 55 -0.546 8.385 -8.880 1.00 62.13 C ATOM 773 O PRO A 55 -0.466 8.047 -10.068 1.00 51.42 O ATOM 774 CB PRO A 55 0.396 10.619 -8.188 1.00 20.54 C ATOM 775 CG PRO A 55 0.369 10.890 -6.721 1.00 54.53 C ATOM 776 CD PRO A 55 -1.073 10.870 -6.309 1.00 44.25 C ATOM 0 HA PRO A 55 -1.454 10.226 -9.342 1.00 44.45 H new ATOM 0 HB2 PRO A 55 1.280 10.044 -8.463 1.00 20.54 H new ATOM 0 HB3 PRO A 55 0.431 11.549 -8.756 1.00 20.54 H new ATOM 0 HG2 PRO A 55 0.938 10.136 -6.177 1.00 54.53 H new ATOM 0 HG3 PRO A 55 0.823 11.855 -6.497 1.00 54.53 H new ATOM 0 HD2 PRO A 55 -1.193 10.543 -5.276 1.00 44.25 H new ATOM 0 HD3 PRO A 55 -1.528 11.857 -6.386 1.00 44.25 H new ATOM 784 N ASN A 56 -0.363 7.531 -7.882 1.00 52.03 N ATOM 785 CA ASN A 56 -0.031 6.126 -8.127 1.00 2.13 C ATOM 786 C ASN A 56 -1.280 5.245 -8.236 1.00 72.35 C ATOM 787 O ASN A 56 -1.166 4.023 -8.249 1.00 73.11 O ATOM 788 CB ASN A 56 0.869 5.557 -7.011 1.00 51.10 C ATOM 789 CG ASN A 56 2.233 6.216 -6.888 1.00 22.30 C ATOM 790 OD1 ASN A 56 2.410 7.408 -7.157 1.00 3.31 O ATOM 791 ND2 ASN A 56 3.204 5.451 -6.487 1.00 61.43 N ATOM 0 H ASN A 56 -0.438 7.782 -6.896 1.00 52.03 H new ATOM 0 HA ASN A 56 0.501 6.108 -9.078 1.00 2.13 H new ATOM 0 HB2 ASN A 56 0.348 5.655 -6.059 1.00 51.10 H new ATOM 0 HB3 ASN A 56 1.012 4.491 -7.188 1.00 51.10 H new ATOM 0 HD21 ASN A 56 4.145 5.832 -6.387 1.00 61.43 H new ATOM 0 HD22 ASN A 56 3.025 4.470 -6.273 1.00 61.43 H new ATOM 798 N ALA A 57 -2.467 5.851 -8.316 1.00 42.20 N ATOM 799 CA ALA A 57 -3.721 5.083 -8.399 1.00 70.42 C ATOM 800 C ALA A 57 -3.728 4.160 -9.605 1.00 70.21 C ATOM 801 O ALA A 57 -3.291 4.549 -10.699 1.00 22.31 O ATOM 802 CB ALA A 57 -4.923 5.999 -8.438 1.00 53.41 C ATOM 0 H ALA A 57 -2.591 6.863 -8.325 1.00 42.20 H new ATOM 0 HA ALA A 57 -3.782 4.471 -7.499 1.00 70.42 H new ATOM 0 HB1 ALA A 57 -5.833 5.402 -8.499 1.00 53.41 H new ATOM 0 HB2 ALA A 57 -4.947 6.606 -7.533 1.00 53.41 H new ATOM 0 HB3 ALA A 57 -4.856 6.650 -9.310 1.00 53.41 H new ATOM 808 N GLY A 58 -4.176 2.944 -9.397 1.00 31.23 N ATOM 809 CA GLY A 58 -4.214 1.964 -10.455 1.00 32.44 C ATOM 810 C GLY A 58 -3.074 0.979 -10.339 1.00 4.15 C ATOM 811 O GLY A 58 -3.090 -0.100 -10.955 1.00 5.42 O ATOM 0 H GLY A 58 -4.521 2.609 -8.498 1.00 31.23 H new ATOM 0 HA2 GLY A 58 -5.163 1.429 -10.423 1.00 32.44 H new ATOM 0 HA3 GLY A 58 -4.164 2.467 -11.421 1.00 32.44 H new ATOM 815 N ALA A 59 -2.077 1.338 -9.565 1.00 34.32 N ATOM 816 CA ALA A 59 -0.942 0.485 -9.367 1.00 25.31 C ATOM 817 C ALA A 59 -1.165 -0.417 -8.176 1.00 54.20 C ATOM 818 O ALA A 59 -1.727 0.006 -7.151 1.00 10.23 O ATOM 819 CB ALA A 59 0.329 1.301 -9.199 1.00 21.24 C ATOM 0 H ALA A 59 -2.035 2.224 -9.061 1.00 34.32 H new ATOM 0 HA ALA A 59 -0.822 -0.138 -10.253 1.00 25.31 H new ATOM 0 HB1 ALA A 59 1.175 0.630 -9.050 1.00 21.24 H new ATOM 0 HB2 ALA A 59 0.496 1.903 -10.092 1.00 21.24 H new ATOM 0 HB3 ALA A 59 0.229 1.956 -8.334 1.00 21.24 H new ATOM 825 N ARG A 60 -0.769 -1.650 -8.320 1.00 44.51 N ATOM 826 CA ARG A 60 -0.853 -2.608 -7.258 1.00 33.52 C ATOM 827 C ARG A 60 0.532 -3.152 -7.005 1.00 24.22 C ATOM 828 O ARG A 60 1.261 -3.475 -7.947 1.00 24.51 O ATOM 829 CB ARG A 60 -1.856 -3.734 -7.589 1.00 12.32 C ATOM 830 CG ARG A 60 -1.619 -4.436 -8.924 1.00 50.13 C ATOM 831 CD ARG A 60 -2.604 -5.571 -9.136 1.00 31.43 C ATOM 832 NE ARG A 60 -2.433 -6.213 -10.449 1.00 73.15 N ATOM 833 CZ ARG A 60 -2.335 -7.540 -10.659 1.00 72.23 C ATOM 834 NH1 ARG A 60 -2.227 -8.381 -9.633 1.00 42.10 N ATOM 835 NH2 ARG A 60 -2.306 -8.011 -11.898 1.00 74.53 N ATOM 0 H ARG A 60 -0.376 -2.020 -9.185 1.00 44.51 H new ATOM 0 HA ARG A 60 -1.227 -2.125 -6.355 1.00 33.52 H new ATOM 0 HB2 ARG A 60 -1.820 -4.478 -6.793 1.00 12.32 H new ATOM 0 HB3 ARG A 60 -2.862 -3.315 -7.589 1.00 12.32 H new ATOM 0 HG2 ARG A 60 -1.711 -3.716 -9.737 1.00 50.13 H new ATOM 0 HG3 ARG A 60 -0.601 -4.825 -8.957 1.00 50.13 H new ATOM 0 HD2 ARG A 60 -2.475 -6.315 -8.350 1.00 31.43 H new ATOM 0 HD3 ARG A 60 -3.621 -5.189 -9.049 1.00 31.43 H new ATOM 0 HE ARG A 60 -2.385 -5.604 -11.266 1.00 73.15 H new ATOM 0 HH11 ARG A 60 -2.218 -8.022 -8.678 1.00 42.10 H new ATOM 0 HH12 ARG A 60 -2.153 -9.384 -9.802 1.00 42.10 H new ATOM 0 HH21 ARG A 60 -2.358 -7.369 -12.689 1.00 74.53 H new ATOM 0 HH22 ARG A 60 -2.232 -9.015 -12.060 1.00 74.53 H new ATOM 849 N PHE A 61 0.903 -3.237 -5.768 1.00 43.53 N ATOM 850 CA PHE A 61 2.231 -3.666 -5.413 1.00 34.55 C ATOM 851 C PHE A 61 2.170 -4.896 -4.556 1.00 72.11 C ATOM 852 O PHE A 61 1.565 -4.876 -3.490 1.00 34.34 O ATOM 853 CB PHE A 61 2.984 -2.552 -4.656 1.00 51.03 C ATOM 854 CG PHE A 61 3.163 -1.269 -5.427 1.00 71.34 C ATOM 855 CD1 PHE A 61 4.230 -1.110 -6.296 1.00 34.51 C ATOM 856 CD2 PHE A 61 2.265 -0.220 -5.277 1.00 21.53 C ATOM 857 CE1 PHE A 61 4.404 0.069 -6.997 1.00 74.32 C ATOM 858 CE2 PHE A 61 2.431 0.961 -5.975 1.00 61.30 C ATOM 859 CZ PHE A 61 3.501 1.106 -6.839 1.00 52.55 C ATOM 0 H PHE A 61 0.303 -3.014 -4.974 1.00 43.53 H new ATOM 0 HA PHE A 61 2.768 -3.892 -6.334 1.00 34.55 H new ATOM 0 HB2 PHE A 61 2.446 -2.332 -3.734 1.00 51.03 H new ATOM 0 HB3 PHE A 61 3.967 -2.927 -4.371 1.00 51.03 H new ATOM 0 HD1 PHE A 61 4.935 -1.917 -6.428 1.00 34.51 H new ATOM 0 HD2 PHE A 61 1.426 -0.329 -4.606 1.00 21.53 H new ATOM 0 HE1 PHE A 61 5.244 0.181 -7.667 1.00 74.32 H new ATOM 0 HE2 PHE A 61 1.726 1.769 -5.846 1.00 61.30 H new ATOM 0 HZ PHE A 61 3.632 2.026 -7.389 1.00 52.55 H new ATOM 869 N LEU A 62 2.743 -5.967 -5.040 1.00 11.11 N ATOM 870 CA LEU A 62 2.859 -7.188 -4.279 1.00 12.30 C ATOM 871 C LEU A 62 4.132 -7.121 -3.464 1.00 31.01 C ATOM 872 O LEU A 62 5.238 -7.112 -4.025 1.00 2.15 O ATOM 873 CB LEU A 62 2.885 -8.406 -5.221 1.00 33.35 C ATOM 874 CG LEU A 62 3.047 -9.790 -4.575 1.00 61.00 C ATOM 875 CD1 LEU A 62 1.899 -10.098 -3.631 1.00 55.25 C ATOM 876 CD2 LEU A 62 3.154 -10.860 -5.648 1.00 72.14 C ATOM 0 H LEU A 62 3.144 -6.019 -5.976 1.00 11.11 H new ATOM 0 HA LEU A 62 2.000 -7.298 -3.616 1.00 12.30 H new ATOM 0 HB2 LEU A 62 1.959 -8.408 -5.796 1.00 33.35 H new ATOM 0 HB3 LEU A 62 3.701 -8.267 -5.931 1.00 33.35 H new ATOM 0 HG LEU A 62 3.966 -9.783 -3.989 1.00 61.00 H new ATOM 0 HD11 LEU A 62 2.045 -11.085 -3.191 1.00 55.25 H new ATOM 0 HD12 LEU A 62 1.867 -9.349 -2.840 1.00 55.25 H new ATOM 0 HD13 LEU A 62 0.959 -10.082 -4.183 1.00 55.25 H new ATOM 0 HD21 LEU A 62 3.269 -11.837 -5.178 1.00 72.14 H new ATOM 0 HD22 LEU A 62 2.251 -10.855 -6.258 1.00 72.14 H new ATOM 0 HD23 LEU A 62 4.019 -10.657 -6.279 1.00 72.14 H new ATOM 888 N LEU A 63 3.992 -7.030 -2.171 1.00 73.31 N ATOM 889 CA LEU A 63 5.125 -6.944 -1.297 1.00 45.10 C ATOM 890 C LEU A 63 5.478 -8.318 -0.788 1.00 54.53 C ATOM 891 O LEU A 63 4.666 -8.993 -0.134 1.00 51.35 O ATOM 892 CB LEU A 63 4.909 -5.971 -0.111 1.00 40.53 C ATOM 893 CG LEU A 63 4.620 -4.486 -0.432 1.00 34.44 C ATOM 894 CD1 LEU A 63 5.567 -3.936 -1.489 1.00 51.30 C ATOM 895 CD2 LEU A 63 3.167 -4.254 -0.803 1.00 0.33 C ATOM 0 H LEU A 63 3.090 -7.013 -1.695 1.00 73.31 H new ATOM 0 HA LEU A 63 5.950 -6.537 -1.882 1.00 45.10 H new ATOM 0 HB2 LEU A 63 4.080 -6.351 0.486 1.00 40.53 H new ATOM 0 HB3 LEU A 63 5.798 -6.009 0.518 1.00 40.53 H new ATOM 0 HG LEU A 63 4.806 -3.927 0.485 1.00 34.44 H new ATOM 0 HD11 LEU A 63 5.328 -2.890 -1.683 1.00 51.30 H new ATOM 0 HD12 LEU A 63 6.594 -4.013 -1.133 1.00 51.30 H new ATOM 0 HD13 LEU A 63 5.458 -4.510 -2.409 1.00 51.30 H new ATOM 0 HD21 LEU A 63 3.011 -3.197 -1.020 1.00 0.33 H new ATOM 0 HD22 LEU A 63 2.917 -4.846 -1.684 1.00 0.33 H new ATOM 0 HD23 LEU A 63 2.527 -4.552 0.028 1.00 0.33 H new ATOM 907 N ASP A 64 6.656 -8.744 -1.137 1.00 62.21 N ATOM 908 CA ASP A 64 7.188 -10.026 -0.718 1.00 14.10 C ATOM 909 C ASP A 64 8.499 -9.795 0.030 1.00 34.35 C ATOM 910 O ASP A 64 9.258 -10.719 0.293 1.00 14.21 O ATOM 911 CB ASP A 64 7.427 -10.925 -1.950 1.00 72.21 C ATOM 912 CG ASP A 64 8.543 -10.427 -2.854 1.00 72.10 C ATOM 913 OD1 ASP A 64 8.383 -9.366 -3.488 1.00 30.41 O ATOM 914 OD2 ASP A 64 9.611 -11.082 -2.933 1.00 34.34 O ATOM 0 H ASP A 64 7.291 -8.209 -1.730 1.00 62.21 H new ATOM 0 HA ASP A 64 6.476 -10.525 -0.060 1.00 14.10 H new ATOM 0 HB2 ASP A 64 7.665 -11.934 -1.613 1.00 72.21 H new ATOM 0 HB3 ASP A 64 6.504 -10.991 -2.527 1.00 72.21 H new ATOM 919 N GLN A 65 8.727 -8.552 0.394 1.00 52.04 N ATOM 920 CA GLN A 65 9.951 -8.143 1.068 1.00 24.22 C ATOM 921 C GLN A 65 9.644 -7.816 2.533 1.00 34.32 C ATOM 922 O GLN A 65 8.505 -7.509 2.867 1.00 20.53 O ATOM 923 CB GLN A 65 10.541 -6.914 0.366 1.00 14.14 C ATOM 924 CG GLN A 65 9.609 -5.726 0.371 1.00 53.20 C ATOM 925 CD GLN A 65 10.130 -4.535 -0.392 1.00 53.11 C ATOM 926 OE1 GLN A 65 9.349 -3.772 -0.929 1.00 64.31 O ATOM 927 NE2 GLN A 65 11.422 -4.358 -0.445 1.00 60.42 N ATOM 0 H GLN A 65 8.069 -7.790 0.232 1.00 52.04 H new ATOM 0 HA GLN A 65 10.677 -8.955 1.029 1.00 24.22 H new ATOM 0 HB2 GLN A 65 11.475 -6.637 0.854 1.00 14.14 H new ATOM 0 HB3 GLN A 65 10.784 -7.173 -0.664 1.00 14.14 H new ATOM 0 HG2 GLN A 65 8.651 -6.027 -0.054 1.00 53.20 H new ATOM 0 HG3 GLN A 65 9.420 -5.429 1.403 1.00 53.20 H new ATOM 0 HE21 GLN A 65 12.047 -5.019 0.017 1.00 60.42 H new ATOM 0 HE22 GLN A 65 11.807 -3.559 -0.949 1.00 60.42 H new ATOM 936 N PRO A 66 10.643 -7.888 3.423 1.00 14.34 N ATOM 937 CA PRO A 66 10.442 -7.604 4.846 1.00 65.23 C ATOM 938 C PRO A 66 10.152 -6.123 5.169 1.00 42.01 C ATOM 939 O PRO A 66 9.611 -5.812 6.234 1.00 61.32 O ATOM 940 CB PRO A 66 11.754 -8.051 5.497 1.00 45.32 C ATOM 941 CG PRO A 66 12.760 -7.997 4.405 1.00 64.13 C ATOM 942 CD PRO A 66 12.029 -8.329 3.142 1.00 61.00 C ATOM 0 HA PRO A 66 9.558 -8.124 5.216 1.00 65.23 H new ATOM 0 HB2 PRO A 66 12.030 -7.394 6.321 1.00 45.32 H new ATOM 0 HB3 PRO A 66 11.669 -9.058 5.907 1.00 45.32 H new ATOM 0 HG2 PRO A 66 13.213 -7.008 4.343 1.00 64.13 H new ATOM 0 HG3 PRO A 66 13.567 -8.707 4.585 1.00 64.13 H new ATOM 0 HD2 PRO A 66 12.451 -7.806 2.284 1.00 61.00 H new ATOM 0 HD3 PRO A 66 12.074 -9.395 2.920 1.00 61.00 H new ATOM 950 N THR A 67 10.507 -5.206 4.286 1.00 13.42 N ATOM 951 CA THR A 67 10.294 -3.786 4.564 1.00 53.11 C ATOM 952 C THR A 67 10.143 -2.970 3.278 1.00 42.02 C ATOM 953 O THR A 67 10.984 -3.046 2.382 1.00 70.11 O ATOM 954 CB THR A 67 11.458 -3.198 5.421 1.00 1.42 C ATOM 955 OG1 THR A 67 11.567 -3.928 6.650 1.00 11.03 O ATOM 956 CG2 THR A 67 11.223 -1.725 5.746 1.00 75.14 C ATOM 0 H THR A 67 10.937 -5.408 3.384 1.00 13.42 H new ATOM 0 HA THR A 67 9.364 -3.715 5.128 1.00 53.11 H new ATOM 0 HB THR A 67 12.376 -3.286 4.840 1.00 1.42 H new ATOM 0 HG1 THR A 67 12.458 -3.792 7.034 1.00 11.03 H new ATOM 0 HG21 THR A 67 12.053 -1.347 6.344 1.00 75.14 H new ATOM 0 HG22 THR A 67 11.154 -1.155 4.820 1.00 75.14 H new ATOM 0 HG23 THR A 67 10.294 -1.620 6.307 1.00 75.14 H new ATOM 964 N THR A 68 9.078 -2.217 3.201 1.00 51.41 N ATOM 965 CA THR A 68 8.822 -1.334 2.104 1.00 20.31 C ATOM 966 C THR A 68 8.568 0.066 2.673 1.00 74.30 C ATOM 967 O THR A 68 7.580 0.278 3.358 1.00 43.30 O ATOM 968 CB THR A 68 7.543 -1.798 1.377 1.00 35.03 C ATOM 969 OG1 THR A 68 7.640 -3.194 1.095 1.00 2.32 O ATOM 970 CG2 THR A 68 7.344 -1.038 0.074 1.00 45.32 C ATOM 0 H THR A 68 8.351 -2.203 3.917 1.00 51.41 H new ATOM 0 HA THR A 68 9.666 -1.330 1.415 1.00 20.31 H new ATOM 0 HB THR A 68 6.690 -1.600 2.026 1.00 35.03 H new ATOM 0 HG1 THR A 68 8.153 -3.326 0.270 1.00 2.32 H new ATOM 0 HG21 THR A 68 6.435 -1.387 -0.416 1.00 45.32 H new ATOM 0 HG22 THR A 68 7.257 0.028 0.284 1.00 45.32 H new ATOM 0 HG23 THR A 68 8.198 -1.210 -0.581 1.00 45.32 H new ATOM 978 N THR A 69 9.444 0.998 2.417 1.00 50.24 N ATOM 979 CA THR A 69 9.240 2.346 2.899 1.00 23.23 C ATOM 980 C THR A 69 8.440 3.150 1.861 1.00 15.14 C ATOM 981 O THR A 69 8.649 2.980 0.652 1.00 31.41 O ATOM 982 CB THR A 69 10.599 3.021 3.237 1.00 25.45 C ATOM 983 OG1 THR A 69 11.301 2.212 4.210 1.00 73.40 O ATOM 984 CG2 THR A 69 10.405 4.422 3.806 1.00 62.43 C ATOM 0 H THR A 69 10.301 0.856 1.882 1.00 50.24 H new ATOM 0 HA THR A 69 8.662 2.317 3.823 1.00 23.23 H new ATOM 0 HB THR A 69 11.174 3.104 2.315 1.00 25.45 H new ATOM 0 HG1 THR A 69 11.038 2.485 5.114 1.00 73.40 H new ATOM 0 HG21 THR A 69 11.377 4.862 4.030 1.00 62.43 H new ATOM 0 HG22 THR A 69 9.886 5.043 3.076 1.00 62.43 H new ATOM 0 HG23 THR A 69 9.813 4.365 4.720 1.00 62.43 H new ATOM 992 N ALA A 70 7.503 3.960 2.321 1.00 30.32 N ATOM 993 CA ALA A 70 6.670 4.747 1.448 1.00 4.43 C ATOM 994 C ALA A 70 6.800 6.232 1.765 1.00 21.43 C ATOM 995 O ALA A 70 6.797 6.648 2.943 1.00 2.24 O ATOM 996 CB ALA A 70 5.220 4.304 1.570 1.00 60.32 C ATOM 0 H ALA A 70 7.303 4.086 3.313 1.00 30.32 H new ATOM 0 HA ALA A 70 7.002 4.590 0.422 1.00 4.43 H new ATOM 0 HB1 ALA A 70 4.599 4.905 0.906 1.00 60.32 H new ATOM 0 HB2 ALA A 70 5.136 3.253 1.293 1.00 60.32 H new ATOM 0 HB3 ALA A 70 4.885 4.436 2.599 1.00 60.32 H new ATOM 1002 N GLY A 71 6.919 7.004 0.734 1.00 60.24 N ATOM 1003 CA GLY A 71 7.048 8.422 0.837 1.00 44.20 C ATOM 1004 C GLY A 71 7.546 8.928 -0.471 1.00 15.43 C ATOM 1005 O GLY A 71 7.427 8.213 -1.485 1.00 61.23 O ATOM 0 H GLY A 71 6.929 6.659 -0.226 1.00 60.24 H new ATOM 0 HA2 GLY A 71 6.088 8.876 1.082 1.00 44.20 H new ATOM 0 HA3 GLY A 71 7.739 8.686 1.637 1.00 44.20 H new ATOM 1009 N ARG A 72 8.104 10.103 -0.500 1.00 43.31 N ATOM 1010 CA ARG A 72 8.646 10.593 -1.722 1.00 33.23 C ATOM 1011 C ARG A 72 10.135 10.748 -1.556 1.00 5.34 C ATOM 1012 O ARG A 72 10.580 11.576 -0.767 1.00 63.11 O ATOM 1013 CB ARG A 72 8.019 11.952 -2.080 1.00 71.32 C ATOM 1014 CG ARG A 72 8.552 12.543 -3.372 1.00 12.42 C ATOM 1015 CD ARG A 72 7.944 13.896 -3.684 1.00 44.31 C ATOM 1016 NE ARG A 72 8.443 14.420 -4.958 1.00 44.34 N ATOM 1017 CZ ARG A 72 7.837 15.361 -5.705 1.00 5.04 C ATOM 1018 NH1 ARG A 72 6.777 16.015 -5.244 1.00 23.21 N ATOM 1019 NH2 ARG A 72 8.317 15.667 -6.896 1.00 33.04 N ATOM 0 H ARG A 72 8.193 10.729 0.300 1.00 43.31 H new ATOM 0 HA ARG A 72 8.427 9.891 -2.527 1.00 33.23 H new ATOM 0 HB2 ARG A 72 6.938 11.834 -2.162 1.00 71.32 H new ATOM 0 HB3 ARG A 72 8.202 12.653 -1.266 1.00 71.32 H new ATOM 0 HG2 ARG A 72 9.635 12.642 -3.303 1.00 12.42 H new ATOM 0 HG3 ARG A 72 8.346 11.857 -4.194 1.00 12.42 H new ATOM 0 HD2 ARG A 72 6.858 13.809 -3.724 1.00 44.31 H new ATOM 0 HD3 ARG A 72 8.179 14.597 -2.883 1.00 44.31 H new ATOM 0 HE ARG A 72 9.323 14.040 -5.308 1.00 44.34 H new ATOM 0 HH11 ARG A 72 6.414 15.806 -4.314 1.00 23.21 H new ATOM 0 HH12 ARG A 72 6.326 16.726 -5.820 1.00 23.21 H new ATOM 0 HH21 ARG A 72 9.147 15.190 -7.249 1.00 33.04 H new ATOM 0 HH22 ARG A 72 7.858 16.380 -7.463 1.00 33.04 H new ATOM 1033 N HIS A 73 10.867 9.969 -2.353 1.00 22.41 N ATOM 1034 CA HIS A 73 12.335 9.931 -2.467 1.00 24.54 C ATOM 1035 C HIS A 73 12.716 8.527 -2.888 1.00 12.25 C ATOM 1036 O HIS A 73 11.974 7.586 -2.598 1.00 42.11 O ATOM 1037 CB HIS A 73 13.077 10.252 -1.143 1.00 61.41 C ATOM 1038 CG HIS A 73 13.876 11.514 -1.234 1.00 31.41 C ATOM 1039 ND1 HIS A 73 15.235 11.546 -1.411 1.00 45.24 N ATOM 1040 CD2 HIS A 73 13.472 12.798 -1.227 1.00 15.43 C ATOM 1041 CE1 HIS A 73 15.610 12.815 -1.518 1.00 45.21 C ATOM 1042 NE2 HIS A 73 14.572 13.626 -1.410 1.00 23.21 N ATOM 0 H HIS A 73 10.424 9.299 -2.982 1.00 22.41 H new ATOM 0 HA HIS A 73 12.629 10.696 -3.186 1.00 24.54 H new ATOM 0 HB2 HIS A 73 12.352 10.341 -0.334 1.00 61.41 H new ATOM 0 HB3 HIS A 73 13.738 9.423 -0.889 1.00 61.41 H new ATOM 0 HD1 HIS A 73 15.852 10.735 -1.453 1.00 45.24 H new ATOM 0 HD2 HIS A 73 12.453 13.132 -1.099 1.00 15.43 H new ATOM 0 HE1 HIS A 73 16.628 13.141 -1.673 1.00 45.21 H new ATOM 1050 N PRO A 74 13.860 8.337 -3.574 1.00 53.12 N ATOM 1051 CA PRO A 74 14.340 6.993 -3.956 1.00 34.51 C ATOM 1052 C PRO A 74 14.720 6.150 -2.724 1.00 1.31 C ATOM 1053 O PRO A 74 14.954 4.945 -2.821 1.00 15.15 O ATOM 1054 CB PRO A 74 15.569 7.274 -4.829 1.00 51.04 C ATOM 1055 CG PRO A 74 16.001 8.653 -4.461 1.00 75.10 C ATOM 1056 CD PRO A 74 14.754 9.398 -4.086 1.00 34.04 C ATOM 0 HA PRO A 74 13.574 6.415 -4.474 1.00 34.51 H new ATOM 0 HB2 PRO A 74 16.361 6.549 -4.640 1.00 51.04 H new ATOM 0 HB3 PRO A 74 15.323 7.208 -5.889 1.00 51.04 H new ATOM 0 HG2 PRO A 74 16.706 8.631 -3.630 1.00 75.10 H new ATOM 0 HG3 PRO A 74 16.508 9.138 -5.296 1.00 75.10 H new ATOM 0 HD2 PRO A 74 14.952 10.156 -3.329 1.00 34.04 H new ATOM 0 HD3 PRO A 74 14.319 9.910 -4.944 1.00 34.04 H new ATOM 1064 N GLU A 75 14.759 6.810 -1.566 1.00 53.30 N ATOM 1065 CA GLU A 75 15.019 6.175 -0.281 1.00 62.35 C ATOM 1066 C GLU A 75 13.804 5.373 0.166 1.00 2.41 C ATOM 1067 O GLU A 75 13.899 4.515 1.049 1.00 24.35 O ATOM 1068 CB GLU A 75 15.388 7.221 0.784 1.00 3.31 C ATOM 1069 CG GLU A 75 16.815 7.769 0.695 1.00 13.10 C ATOM 1070 CD GLU A 75 17.192 8.294 -0.666 1.00 42.54 C ATOM 1071 OE1 GLU A 75 16.675 9.340 -1.086 1.00 41.31 O ATOM 1072 OE2 GLU A 75 18.022 7.662 -1.342 1.00 23.13 O ATOM 0 H GLU A 75 14.608 7.816 -1.497 1.00 53.30 H new ATOM 0 HA GLU A 75 15.865 5.498 -0.400 1.00 62.35 H new ATOM 0 HB2 GLU A 75 14.691 8.055 0.708 1.00 3.31 H new ATOM 0 HB3 GLU A 75 15.247 6.777 1.770 1.00 3.31 H new ATOM 0 HG2 GLU A 75 16.931 8.570 1.426 1.00 13.10 H new ATOM 0 HG3 GLU A 75 17.513 6.980 0.974 1.00 13.10 H new ATOM 1079 N SER A 76 12.672 5.667 -0.431 1.00 54.22 N ATOM 1080 CA SER A 76 11.487 4.902 -0.215 1.00 44.11 C ATOM 1081 C SER A 76 11.471 3.793 -1.256 1.00 62.20 C ATOM 1082 O SER A 76 12.025 3.961 -2.345 1.00 50.04 O ATOM 1083 CB SER A 76 10.249 5.793 -0.341 1.00 52.32 C ATOM 1084 OG SER A 76 10.249 6.802 0.659 1.00 24.03 O ATOM 0 H SER A 76 12.557 6.446 -1.079 1.00 54.22 H new ATOM 0 HA SER A 76 11.475 4.477 0.788 1.00 44.11 H new ATOM 0 HB2 SER A 76 10.226 6.254 -1.329 1.00 52.32 H new ATOM 0 HB3 SER A 76 9.348 5.186 -0.251 1.00 52.32 H new ATOM 0 HG SER A 76 9.790 7.599 0.320 1.00 24.03 H new ATOM 1090 N ASP A 77 10.884 2.670 -0.933 1.00 11.42 N ATOM 1091 CA ASP A 77 10.865 1.550 -1.855 1.00 70.52 C ATOM 1092 C ASP A 77 9.818 1.816 -2.923 1.00 4.53 C ATOM 1093 O ASP A 77 10.077 1.673 -4.137 1.00 54.50 O ATOM 1094 CB ASP A 77 10.578 0.244 -1.126 1.00 74.43 C ATOM 1095 CG ASP A 77 10.836 -0.965 -1.997 1.00 21.43 C ATOM 1096 OD1 ASP A 77 10.005 -1.297 -2.854 1.00 72.05 O ATOM 1097 OD2 ASP A 77 11.909 -1.601 -1.844 1.00 32.13 O ATOM 0 H ASP A 77 10.413 2.501 -0.044 1.00 11.42 H new ATOM 0 HA ASP A 77 11.845 1.448 -2.321 1.00 70.52 H new ATOM 0 HB2 ASP A 77 11.199 0.185 -0.232 1.00 74.43 H new ATOM 0 HB3 ASP A 77 9.540 0.236 -0.794 1.00 74.43 H new ATOM 1102 N ILE A 78 8.657 2.251 -2.479 1.00 75.42 N ATOM 1103 CA ILE A 78 7.614 2.660 -3.376 1.00 44.44 C ATOM 1104 C ILE A 78 7.528 4.171 -3.339 1.00 41.32 C ATOM 1105 O ILE A 78 7.512 4.782 -2.261 1.00 24.31 O ATOM 1106 CB ILE A 78 6.233 1.995 -3.086 1.00 2.23 C ATOM 1107 CG1 ILE A 78 5.764 2.248 -1.641 1.00 20.25 C ATOM 1108 CG2 ILE A 78 6.297 0.498 -3.388 1.00 72.40 C ATOM 1109 CD1 ILE A 78 4.391 1.679 -1.329 1.00 4.03 C ATOM 0 H ILE A 78 8.418 2.328 -1.491 1.00 75.42 H new ATOM 0 HA ILE A 78 7.872 2.316 -4.378 1.00 44.44 H new ATOM 0 HB ILE A 78 5.495 2.456 -3.743 1.00 2.23 H new ATOM 0 HG12 ILE A 78 6.490 1.815 -0.953 1.00 20.25 H new ATOM 0 HG13 ILE A 78 5.751 3.322 -1.457 1.00 20.25 H new ATOM 0 HG21 ILE A 78 5.328 0.044 -3.182 1.00 72.40 H new ATOM 0 HG22 ILE A 78 6.552 0.349 -4.437 1.00 72.40 H new ATOM 0 HG23 ILE A 78 7.057 0.032 -2.760 1.00 72.40 H new ATOM 0 HD11 ILE A 78 4.133 1.899 -0.293 1.00 4.03 H new ATOM 0 HD12 ILE A 78 3.651 2.130 -1.991 1.00 4.03 H new ATOM 0 HD13 ILE A 78 4.402 0.599 -1.479 1.00 4.03 H new ATOM 1121 N PHE A 79 7.519 4.766 -4.488 1.00 74.41 N ATOM 1122 CA PHE A 79 7.579 6.193 -4.599 1.00 15.14 C ATOM 1123 C PHE A 79 6.177 6.765 -4.701 1.00 23.13 C ATOM 1124 O PHE A 79 5.505 6.604 -5.716 1.00 41.45 O ATOM 1125 CB PHE A 79 8.413 6.566 -5.838 1.00 33.34 C ATOM 1126 CG PHE A 79 8.749 8.031 -5.975 1.00 33.22 C ATOM 1127 CD1 PHE A 79 7.838 8.929 -6.509 1.00 65.43 C ATOM 1128 CD2 PHE A 79 9.991 8.500 -5.586 1.00 5.41 C ATOM 1129 CE1 PHE A 79 8.157 10.259 -6.647 1.00 2.51 C ATOM 1130 CE2 PHE A 79 10.313 9.833 -5.721 1.00 42.25 C ATOM 1131 CZ PHE A 79 9.394 10.713 -6.256 1.00 10.00 C ATOM 0 H PHE A 79 7.470 4.276 -5.381 1.00 74.41 H new ATOM 0 HA PHE A 79 8.052 6.614 -3.712 1.00 15.14 H new ATOM 0 HB2 PHE A 79 9.343 5.998 -5.813 1.00 33.34 H new ATOM 0 HB3 PHE A 79 7.870 6.250 -6.729 1.00 33.34 H new ATOM 0 HD1 PHE A 79 6.865 8.579 -6.821 1.00 65.43 H new ATOM 0 HD2 PHE A 79 10.716 7.814 -5.172 1.00 5.41 H new ATOM 0 HE1 PHE A 79 7.436 10.947 -7.063 1.00 2.51 H new ATOM 0 HE2 PHE A 79 11.284 10.189 -5.408 1.00 42.25 H new ATOM 0 HZ PHE A 79 9.647 11.757 -6.367 1.00 10.00 H new ATOM 1141 N LEU A 80 5.742 7.403 -3.657 1.00 12.31 N ATOM 1142 CA LEU A 80 4.456 8.057 -3.634 1.00 63.31 C ATOM 1143 C LEU A 80 4.707 9.527 -3.828 1.00 1.20 C ATOM 1144 O LEU A 80 5.392 10.157 -3.021 1.00 72.45 O ATOM 1145 CB LEU A 80 3.753 7.828 -2.287 1.00 12.23 C ATOM 1146 CG LEU A 80 3.454 6.373 -1.897 1.00 35.44 C ATOM 1147 CD1 LEU A 80 2.795 6.323 -0.531 1.00 72.04 C ATOM 1148 CD2 LEU A 80 2.562 5.703 -2.935 1.00 41.24 C ATOM 0 H LEU A 80 6.269 7.489 -2.788 1.00 12.31 H new ATOM 0 HA LEU A 80 3.813 7.655 -4.417 1.00 63.31 H new ATOM 0 HB2 LEU A 80 4.369 8.269 -1.504 1.00 12.23 H new ATOM 0 HB3 LEU A 80 2.811 8.376 -2.299 1.00 12.23 H new ATOM 0 HG LEU A 80 4.398 5.830 -1.857 1.00 35.44 H new ATOM 0 HD11 LEU A 80 2.588 5.287 -0.265 1.00 72.04 H new ATOM 0 HD12 LEU A 80 3.462 6.762 0.211 1.00 72.04 H new ATOM 0 HD13 LEU A 80 1.861 6.885 -0.557 1.00 72.04 H new ATOM 0 HD21 LEU A 80 2.365 4.674 -2.635 1.00 41.24 H new ATOM 0 HD22 LEU A 80 1.620 6.246 -3.010 1.00 41.24 H new ATOM 0 HD23 LEU A 80 3.062 5.710 -3.903 1.00 41.24 H new ATOM 1160 N ASP A 81 4.217 10.061 -4.907 1.00 60.44 N ATOM 1161 CA ASP A 81 4.408 11.468 -5.192 1.00 4.53 C ATOM 1162 C ASP A 81 3.559 12.313 -4.258 1.00 31.20 C ATOM 1163 O ASP A 81 2.337 12.226 -4.266 1.00 73.20 O ATOM 1164 CB ASP A 81 4.067 11.758 -6.650 1.00 63.40 C ATOM 1165 CG ASP A 81 4.162 13.219 -7.011 1.00 24.22 C ATOM 1166 OD1 ASP A 81 5.276 13.728 -7.194 1.00 25.02 O ATOM 1167 OD2 ASP A 81 3.110 13.870 -7.188 1.00 14.12 O ATOM 0 H ASP A 81 3.681 9.551 -5.609 1.00 60.44 H new ATOM 0 HA ASP A 81 5.454 11.726 -5.027 1.00 4.53 H new ATOM 0 HB2 ASP A 81 4.739 11.189 -7.292 1.00 63.40 H new ATOM 0 HB3 ASP A 81 3.056 11.406 -6.855 1.00 63.40 H new ATOM 1172 N ASP A 82 4.214 13.104 -3.455 1.00 35.32 N ATOM 1173 CA ASP A 82 3.557 13.964 -2.478 1.00 54.55 C ATOM 1174 C ASP A 82 3.644 15.413 -2.935 1.00 33.22 C ATOM 1175 O ASP A 82 4.411 15.727 -3.850 1.00 24.23 O ATOM 1176 CB ASP A 82 4.194 13.767 -1.067 1.00 65.11 C ATOM 1177 CG ASP A 82 3.671 14.742 -0.012 1.00 43.14 C ATOM 1178 OD1 ASP A 82 2.448 14.921 0.086 1.00 60.43 O ATOM 1179 OD2 ASP A 82 4.491 15.375 0.688 1.00 13.12 O ATOM 0 H ASP A 82 5.231 13.179 -3.451 1.00 35.32 H new ATOM 0 HA ASP A 82 2.504 13.693 -2.402 1.00 54.55 H new ATOM 0 HB2 ASP A 82 4.004 12.747 -0.732 1.00 65.11 H new ATOM 0 HB3 ASP A 82 5.275 13.879 -1.148 1.00 65.11 H new ATOM 1184 N VAL A 83 2.866 16.277 -2.324 1.00 32.52 N ATOM 1185 CA VAL A 83 2.850 17.698 -2.644 1.00 23.23 C ATOM 1186 C VAL A 83 4.151 18.334 -2.135 1.00 11.43 C ATOM 1187 O VAL A 83 4.675 19.306 -2.705 1.00 73.24 O ATOM 1188 CB VAL A 83 1.619 18.398 -1.982 1.00 33.31 C ATOM 1189 CG1 VAL A 83 1.539 19.877 -2.355 1.00 13.05 C ATOM 1190 CG2 VAL A 83 0.324 17.685 -2.363 1.00 44.43 C ATOM 0 H VAL A 83 2.217 16.016 -1.582 1.00 32.52 H new ATOM 0 HA VAL A 83 2.771 17.824 -3.724 1.00 23.23 H new ATOM 0 HB VAL A 83 1.752 18.335 -0.902 1.00 33.31 H new ATOM 0 HG11 VAL A 83 0.670 20.327 -1.875 1.00 13.05 H new ATOM 0 HG12 VAL A 83 2.443 20.386 -2.020 1.00 13.05 H new ATOM 0 HG13 VAL A 83 1.447 19.975 -3.437 1.00 13.05 H new ATOM 0 HG21 VAL A 83 -0.520 18.188 -1.892 1.00 44.43 H new ATOM 0 HG22 VAL A 83 0.201 17.707 -3.446 1.00 44.43 H new ATOM 0 HG23 VAL A 83 0.365 16.650 -2.024 1.00 44.43 H new ATOM 1200 N THR A 84 4.681 17.752 -1.099 1.00 53.44 N ATOM 1201 CA THR A 84 5.890 18.202 -0.496 1.00 54.33 C ATOM 1202 C THR A 84 6.946 17.133 -0.784 1.00 4.40 C ATOM 1203 O THR A 84 6.633 16.084 -1.378 1.00 54.12 O ATOM 1204 CB THR A 84 5.679 18.282 1.035 1.00 44.23 C ATOM 1205 OG1 THR A 84 4.328 18.709 1.302 1.00 21.44 O ATOM 1206 CG2 THR A 84 6.645 19.281 1.669 1.00 20.55 C ATOM 0 H THR A 84 4.272 16.935 -0.645 1.00 53.44 H new ATOM 0 HA THR A 84 6.189 19.178 -0.879 1.00 54.33 H new ATOM 0 HB THR A 84 5.864 17.296 1.462 1.00 44.23 H new ATOM 0 HG1 THR A 84 4.102 18.515 2.236 1.00 21.44 H new ATOM 0 HG21 THR A 84 6.476 19.318 2.745 1.00 20.55 H new ATOM 0 HG22 THR A 84 7.671 18.969 1.474 1.00 20.55 H new ATOM 0 HG23 THR A 84 6.479 20.270 1.241 1.00 20.55 H new ATOM 1214 N VAL A 85 8.175 17.378 -0.433 1.00 12.14 N ATOM 1215 CA VAL A 85 9.121 16.327 -0.497 1.00 41.12 C ATOM 1216 C VAL A 85 9.164 15.719 0.888 1.00 51.44 C ATOM 1217 O VAL A 85 9.803 16.242 1.782 1.00 34.04 O ATOM 1218 CB VAL A 85 10.535 16.816 -0.917 1.00 24.11 C ATOM 1219 CG1 VAL A 85 11.481 15.641 -1.070 1.00 63.34 C ATOM 1220 CG2 VAL A 85 10.473 17.606 -2.214 1.00 32.40 C ATOM 0 H VAL A 85 8.530 18.277 -0.108 1.00 12.14 H new ATOM 0 HA VAL A 85 8.824 15.605 -1.257 1.00 41.12 H new ATOM 0 HB VAL A 85 10.911 17.471 -0.131 1.00 24.11 H new ATOM 0 HG11 VAL A 85 12.466 16.003 -1.364 1.00 63.34 H new ATOM 0 HG12 VAL A 85 11.558 15.110 -0.121 1.00 63.34 H new ATOM 0 HG13 VAL A 85 11.100 14.964 -1.835 1.00 63.34 H new ATOM 0 HG21 VAL A 85 11.475 17.937 -2.487 1.00 32.40 H new ATOM 0 HG22 VAL A 85 10.072 16.974 -3.006 1.00 32.40 H new ATOM 0 HG23 VAL A 85 9.828 18.474 -2.081 1.00 32.40 H new ATOM 1230 N SER A 86 8.435 14.661 1.062 1.00 25.00 N ATOM 1231 CA SER A 86 8.363 13.986 2.319 1.00 44.41 C ATOM 1232 C SER A 86 9.174 12.707 2.230 1.00 64.12 C ATOM 1233 O SER A 86 8.752 11.753 1.587 1.00 75.42 O ATOM 1234 CB SER A 86 6.891 13.705 2.670 1.00 74.23 C ATOM 1235 OG SER A 86 6.135 14.926 2.715 1.00 52.23 O ATOM 0 H SER A 86 7.868 14.238 0.328 1.00 25.00 H new ATOM 0 HA SER A 86 8.779 14.605 3.114 1.00 44.41 H new ATOM 0 HB2 SER A 86 6.458 13.031 1.930 1.00 74.23 H new ATOM 0 HB3 SER A 86 6.832 13.200 3.634 1.00 74.23 H new ATOM 0 HG SER A 86 5.755 15.108 1.830 1.00 52.23 H new ATOM 1241 N ARG A 87 10.341 12.706 2.882 1.00 63.13 N ATOM 1242 CA ARG A 87 11.310 11.593 2.795 1.00 30.41 C ATOM 1243 C ARG A 87 10.725 10.231 3.190 1.00 74.50 C ATOM 1244 O ARG A 87 11.008 9.230 2.543 1.00 52.23 O ATOM 1245 CB ARG A 87 12.595 11.893 3.600 1.00 20.13 C ATOM 1246 CG ARG A 87 12.366 12.266 5.062 1.00 74.13 C ATOM 1247 CD ARG A 87 13.679 12.442 5.813 1.00 44.11 C ATOM 1248 NE ARG A 87 13.468 12.873 7.211 1.00 73.24 N ATOM 1249 CZ ARG A 87 14.254 12.526 8.259 1.00 70.32 C ATOM 1250 NH1 ARG A 87 15.316 11.742 8.079 1.00 14.11 N ATOM 1251 NH2 ARG A 87 13.977 12.983 9.472 1.00 54.31 N ATOM 0 H ARG A 87 10.646 13.471 3.484 1.00 63.13 H new ATOM 0 HA ARG A 87 11.569 11.518 1.739 1.00 30.41 H new ATOM 0 HB2 ARG A 87 13.243 11.018 3.561 1.00 20.13 H new ATOM 0 HB3 ARG A 87 13.130 12.708 3.112 1.00 20.13 H new ATOM 0 HG2 ARG A 87 11.790 13.190 5.115 1.00 74.13 H new ATOM 0 HG3 ARG A 87 11.771 11.491 5.546 1.00 74.13 H new ATOM 0 HD2 ARG A 87 14.230 11.502 5.804 1.00 44.11 H new ATOM 0 HD3 ARG A 87 14.295 13.178 5.297 1.00 44.11 H new ATOM 0 HE ARG A 87 12.669 13.478 7.402 1.00 73.24 H new ATOM 0 HH11 ARG A 87 15.543 11.398 7.146 1.00 14.11 H new ATOM 0 HH12 ARG A 87 15.902 11.486 8.874 1.00 14.11 H new ATOM 0 HH21 ARG A 87 13.173 13.595 9.615 1.00 54.31 H new ATOM 0 HH22 ARG A 87 14.567 12.723 10.262 1.00 54.31 H new ATOM 1265 N ARG A 88 9.935 10.192 4.246 1.00 52.22 N ATOM 1266 CA ARG A 88 9.276 8.970 4.670 1.00 73.13 C ATOM 1267 C ARG A 88 7.966 9.349 5.306 1.00 3.32 C ATOM 1268 O ARG A 88 7.938 10.259 6.142 1.00 5.34 O ATOM 1269 CB ARG A 88 10.078 8.186 5.733 1.00 23.43 C ATOM 1270 CG ARG A 88 11.490 7.734 5.384 1.00 65.22 C ATOM 1271 CD ARG A 88 12.024 6.821 6.489 1.00 42.21 C ATOM 1272 NE ARG A 88 13.435 6.454 6.314 1.00 43.45 N ATOM 1273 CZ ARG A 88 13.969 5.251 6.616 1.00 43.21 C ATOM 1274 NH1 ARG A 88 13.190 4.222 6.961 1.00 41.41 N ATOM 1275 NH2 ARG A 88 15.287 5.078 6.559 1.00 23.21 N ATOM 0 H ARG A 88 9.732 11.002 4.832 1.00 52.22 H new ATOM 0 HA ARG A 88 9.166 8.339 3.788 1.00 73.13 H new ATOM 0 HB2 ARG A 88 10.139 8.806 6.627 1.00 23.43 H new ATOM 0 HB3 ARG A 88 9.501 7.300 5.998 1.00 23.43 H new ATOM 0 HG2 ARG A 88 11.488 7.205 4.431 1.00 65.22 H new ATOM 0 HG3 ARG A 88 12.142 8.600 5.267 1.00 65.22 H new ATOM 0 HD2 ARG A 88 11.903 7.319 7.451 1.00 42.21 H new ATOM 0 HD3 ARG A 88 11.422 5.913 6.522 1.00 42.21 H new ATOM 0 HE ARG A 88 14.061 7.164 5.934 1.00 43.45 H new ATOM 0 HH11 ARG A 88 12.177 4.339 6.999 1.00 41.41 H new ATOM 0 HH12 ARG A 88 13.608 3.319 7.186 1.00 41.41 H new ATOM 0 HH21 ARG A 88 15.892 5.853 6.288 1.00 23.21 H new ATOM 0 HH22 ARG A 88 15.693 4.170 6.787 1.00 23.21 H new ATOM 1289 N HIS A 89 6.892 8.734 4.889 1.00 44.53 N ATOM 1290 CA HIS A 89 5.629 8.941 5.574 1.00 21.54 C ATOM 1291 C HIS A 89 5.399 7.751 6.494 1.00 54.12 C ATOM 1292 O HIS A 89 5.219 7.889 7.684 1.00 32.11 O ATOM 1293 CB HIS A 89 4.457 9.085 4.568 1.00 13.13 C ATOM 1294 CG HIS A 89 3.114 9.457 5.190 1.00 70.22 C ATOM 1295 ND1 HIS A 89 2.360 10.492 4.702 1.00 73.03 N ATOM 1296 CD2 HIS A 89 2.429 8.872 6.206 1.00 22.12 C ATOM 1297 CE1 HIS A 89 1.250 10.502 5.426 1.00 61.33 C ATOM 1298 NE2 HIS A 89 1.258 9.539 6.340 1.00 31.30 N ATOM 0 H HIS A 89 6.857 8.096 4.094 1.00 44.53 H new ATOM 0 HA HIS A 89 5.670 9.867 6.148 1.00 21.54 H new ATOM 0 HB2 HIS A 89 4.722 9.844 3.831 1.00 13.13 H new ATOM 0 HB3 HIS A 89 4.343 8.144 4.030 1.00 13.13 H new ATOM 0 HD1 HIS A 89 2.603 11.124 3.939 1.00 73.03 H new ATOM 0 HD2 HIS A 89 2.757 8.030 6.798 1.00 22.12 H new ATOM 0 HE1 HIS A 89 0.441 11.205 5.290 1.00 61.33 H new ATOM 1306 N ALA A 90 5.493 6.579 5.934 1.00 44.32 N ATOM 1307 CA ALA A 90 5.253 5.365 6.661 1.00 24.44 C ATOM 1308 C ALA A 90 5.959 4.250 5.953 1.00 13.31 C ATOM 1309 O ALA A 90 6.375 4.411 4.808 1.00 71.31 O ATOM 1310 CB ALA A 90 3.751 5.072 6.725 1.00 64.12 C ATOM 0 H ALA A 90 5.740 6.438 4.954 1.00 44.32 H new ATOM 0 HA ALA A 90 5.625 5.463 7.681 1.00 24.44 H new ATOM 0 HB1 ALA A 90 3.584 4.148 7.279 1.00 64.12 H new ATOM 0 HB2 ALA A 90 3.241 5.894 7.227 1.00 64.12 H new ATOM 0 HB3 ALA A 90 3.358 4.965 5.714 1.00 64.12 H new ATOM 1316 N GLU A 91 6.129 3.158 6.607 1.00 13.22 N ATOM 1317 CA GLU A 91 6.712 2.016 5.998 1.00 62.44 C ATOM 1318 C GLU A 91 5.984 0.771 6.405 1.00 74.23 C ATOM 1319 O GLU A 91 5.431 0.684 7.502 1.00 22.54 O ATOM 1320 CB GLU A 91 8.225 1.925 6.226 1.00 32.02 C ATOM 1321 CG GLU A 91 8.695 1.988 7.655 1.00 2.02 C ATOM 1322 CD GLU A 91 10.198 1.897 7.730 1.00 11.15 C ATOM 1323 OE1 GLU A 91 10.893 2.597 6.954 1.00 22.04 O ATOM 1324 OE2 GLU A 91 10.720 1.144 8.577 1.00 73.01 O ATOM 0 H GLU A 91 5.867 3.030 7.584 1.00 13.22 H new ATOM 0 HA GLU A 91 6.597 2.125 4.920 1.00 62.44 H new ATOM 0 HB2 GLU A 91 8.580 0.990 5.791 1.00 32.02 H new ATOM 0 HB3 GLU A 91 8.702 2.735 5.674 1.00 32.02 H new ATOM 0 HG2 GLU A 91 8.360 2.919 8.112 1.00 2.02 H new ATOM 0 HG3 GLU A 91 8.248 1.174 8.226 1.00 2.02 H new ATOM 1331 N PHE A 92 5.961 -0.160 5.522 1.00 71.44 N ATOM 1332 CA PHE A 92 5.266 -1.383 5.708 1.00 62.23 C ATOM 1333 C PHE A 92 6.291 -2.436 5.983 1.00 30.41 C ATOM 1334 O PHE A 92 7.312 -2.516 5.294 1.00 15.24 O ATOM 1335 CB PHE A 92 4.479 -1.737 4.437 1.00 14.45 C ATOM 1336 CG PHE A 92 3.574 -0.632 3.957 1.00 21.00 C ATOM 1337 CD1 PHE A 92 2.349 -0.418 4.554 1.00 3.42 C ATOM 1338 CD2 PHE A 92 3.956 0.196 2.908 1.00 22.40 C ATOM 1339 CE1 PHE A 92 1.517 0.596 4.118 1.00 64.20 C ATOM 1340 CE2 PHE A 92 3.128 1.210 2.471 1.00 43.01 C ATOM 1341 CZ PHE A 92 1.907 1.410 3.078 1.00 45.40 C ATOM 0 H PHE A 92 6.439 -0.091 4.624 1.00 71.44 H new ATOM 0 HA PHE A 92 4.559 -1.305 6.534 1.00 62.23 H new ATOM 0 HB2 PHE A 92 5.182 -1.989 3.643 1.00 14.45 H new ATOM 0 HB3 PHE A 92 3.880 -2.628 4.627 1.00 14.45 H new ATOM 0 HD1 PHE A 92 2.036 -1.050 5.372 1.00 3.42 H new ATOM 0 HD2 PHE A 92 4.912 0.044 2.429 1.00 22.40 H new ATOM 0 HE1 PHE A 92 0.560 0.750 4.594 1.00 64.20 H new ATOM 0 HE2 PHE A 92 3.437 1.846 1.654 1.00 43.01 H new ATOM 0 HZ PHE A 92 1.257 2.203 2.739 1.00 45.40 H new ATOM 1351 N ARG A 93 6.068 -3.195 6.985 1.00 14.31 N ATOM 1352 CA ARG A 93 6.983 -4.211 7.365 1.00 33.34 C ATOM 1353 C ARG A 93 6.309 -5.539 7.380 1.00 22.12 C ATOM 1354 O ARG A 93 5.230 -5.689 7.937 1.00 60.51 O ATOM 1355 CB ARG A 93 7.588 -3.923 8.732 1.00 55.14 C ATOM 1356 CG ARG A 93 8.528 -2.730 8.771 1.00 23.22 C ATOM 1357 CD ARG A 93 9.106 -2.549 10.163 1.00 60.41 C ATOM 1358 NE ARG A 93 9.633 -3.816 10.693 1.00 4.12 N ATOM 1359 CZ ARG A 93 10.786 -4.393 10.338 1.00 43.04 C ATOM 1360 NH1 ARG A 93 11.617 -3.786 9.509 1.00 43.12 N ATOM 1361 NH2 ARG A 93 11.100 -5.582 10.832 1.00 40.13 N ATOM 0 H ARG A 93 5.238 -3.132 7.574 1.00 14.31 H new ATOM 0 HA ARG A 93 7.787 -4.226 6.629 1.00 33.34 H new ATOM 0 HB2 ARG A 93 6.780 -3.755 9.444 1.00 55.14 H new ATOM 0 HB3 ARG A 93 8.130 -4.807 9.068 1.00 55.14 H new ATOM 0 HG2 ARG A 93 9.335 -2.873 8.052 1.00 23.22 H new ATOM 0 HG3 ARG A 93 7.992 -1.828 8.474 1.00 23.22 H new ATOM 0 HD2 ARG A 93 9.902 -1.805 10.134 1.00 60.41 H new ATOM 0 HD3 ARG A 93 8.336 -2.165 10.832 1.00 60.41 H new ATOM 0 HE ARG A 93 9.069 -4.297 11.393 1.00 4.12 H new ATOM 0 HH11 ARG A 93 11.382 -2.868 9.133 1.00 43.12 H new ATOM 0 HH12 ARG A 93 12.494 -4.236 9.245 1.00 43.12 H new ATOM 0 HH21 ARG A 93 10.464 -6.050 11.478 1.00 40.13 H new ATOM 0 HH22 ARG A 93 11.977 -6.029 10.566 1.00 40.13 H new ATOM 1375 N ILE A 94 6.923 -6.487 6.759 1.00 33.43 N ATOM 1376 CA ILE A 94 6.435 -7.822 6.766 1.00 24.43 C ATOM 1377 C ILE A 94 7.482 -8.629 7.473 1.00 14.25 C ATOM 1378 O ILE A 94 8.607 -8.753 6.989 1.00 3.41 O ATOM 1379 CB ILE A 94 6.238 -8.371 5.332 1.00 32.31 C ATOM 1380 CG1 ILE A 94 5.338 -7.420 4.521 1.00 1.22 C ATOM 1381 CG2 ILE A 94 5.641 -9.783 5.383 1.00 23.24 C ATOM 1382 CD1 ILE A 94 5.072 -7.866 3.098 1.00 22.11 C ATOM 0 H ILE A 94 7.784 -6.356 6.228 1.00 33.43 H new ATOM 0 HA ILE A 94 5.462 -7.871 7.255 1.00 24.43 H new ATOM 0 HB ILE A 94 7.207 -8.430 4.836 1.00 32.31 H new ATOM 0 HG12 ILE A 94 4.385 -7.313 5.039 1.00 1.22 H new ATOM 0 HG13 ILE A 94 5.801 -6.433 4.498 1.00 1.22 H new ATOM 0 HG21 ILE A 94 5.507 -10.158 4.368 1.00 23.24 H new ATOM 0 HG22 ILE A 94 6.315 -10.444 5.928 1.00 23.24 H new ATOM 0 HG23 ILE A 94 4.676 -9.752 5.889 1.00 23.24 H new ATOM 0 HD11 ILE A 94 4.430 -7.137 2.602 1.00 22.11 H new ATOM 0 HD12 ILE A 94 6.016 -7.944 2.559 1.00 22.11 H new ATOM 0 HD13 ILE A 94 4.578 -8.837 3.108 1.00 22.11 H new ATOM 1394 N ASN A 95 7.155 -9.111 8.620 1.00 61.41 N ATOM 1395 CA ASN A 95 8.108 -9.830 9.406 1.00 64.45 C ATOM 1396 C ASN A 95 7.442 -11.015 10.054 1.00 73.45 C ATOM 1397 O ASN A 95 6.397 -10.862 10.688 1.00 70.30 O ATOM 1398 CB ASN A 95 8.741 -8.888 10.446 1.00 52.35 C ATOM 1399 CG ASN A 95 9.899 -9.503 11.213 1.00 23.10 C ATOM 1400 OD1 ASN A 95 9.725 -10.073 12.282 1.00 64.21 O ATOM 1401 ND2 ASN A 95 11.093 -9.379 10.681 1.00 44.25 N ATOM 0 H ASN A 95 6.230 -9.022 9.041 1.00 61.41 H new ATOM 0 HA ASN A 95 8.908 -10.206 8.768 1.00 64.45 H new ATOM 0 HB2 ASN A 95 9.091 -7.988 9.940 1.00 52.35 H new ATOM 0 HB3 ASN A 95 7.973 -8.578 11.155 1.00 52.35 H new ATOM 0 HD21 ASN A 95 11.907 -9.763 11.160 1.00 44.25 H new ATOM 0 HD22 ASN A 95 11.206 -8.898 9.788 1.00 44.25 H new ATOM 1408 N GLU A 96 8.008 -12.195 9.837 1.00 60.22 N ATOM 1409 CA GLU A 96 7.534 -13.462 10.429 1.00 52.54 C ATOM 1410 C GLU A 96 6.054 -13.739 10.111 1.00 52.43 C ATOM 1411 O GLU A 96 5.309 -14.257 10.948 1.00 73.24 O ATOM 1412 CB GLU A 96 7.756 -13.468 11.952 1.00 42.22 C ATOM 1413 CG GLU A 96 9.197 -13.268 12.374 1.00 53.11 C ATOM 1414 CD GLU A 96 10.131 -14.253 11.735 1.00 42.33 C ATOM 1415 OE1 GLU A 96 10.165 -15.427 12.160 1.00 33.12 O ATOM 1416 OE2 GLU A 96 10.847 -13.867 10.786 1.00 61.24 O ATOM 0 H GLU A 96 8.824 -12.312 9.236 1.00 60.22 H new ATOM 0 HA GLU A 96 8.122 -14.260 9.977 1.00 52.54 H new ATOM 0 HB2 GLU A 96 7.147 -12.683 12.399 1.00 42.22 H new ATOM 0 HB3 GLU A 96 7.400 -14.416 12.355 1.00 42.22 H new ATOM 0 HG2 GLU A 96 9.510 -12.257 12.115 1.00 53.11 H new ATOM 0 HG3 GLU A 96 9.269 -13.356 13.458 1.00 53.11 H new ATOM 1423 N GLY A 97 5.646 -13.404 8.903 1.00 23.42 N ATOM 1424 CA GLY A 97 4.292 -13.687 8.462 1.00 10.53 C ATOM 1425 C GLY A 97 3.279 -12.637 8.871 1.00 23.30 C ATOM 1426 O GLY A 97 2.097 -12.779 8.591 1.00 30.14 O ATOM 0 H GLY A 97 6.230 -12.937 8.210 1.00 23.42 H new ATOM 0 HA2 GLY A 97 4.286 -13.779 7.376 1.00 10.53 H new ATOM 0 HA3 GLY A 97 3.983 -14.651 8.865 1.00 10.53 H new ATOM 1430 N GLU A 98 3.725 -11.618 9.566 1.00 2.24 N ATOM 1431 CA GLU A 98 2.861 -10.543 9.979 1.00 13.45 C ATOM 1432 C GLU A 98 3.138 -9.311 9.154 1.00 3.31 C ATOM 1433 O GLU A 98 4.302 -8.969 8.897 1.00 55.21 O ATOM 1434 CB GLU A 98 3.052 -10.253 11.456 1.00 54.25 C ATOM 1435 CG GLU A 98 2.813 -11.468 12.311 1.00 32.22 C ATOM 1436 CD GLU A 98 2.912 -11.188 13.775 1.00 45.44 C ATOM 1437 OE1 GLU A 98 1.913 -10.746 14.381 1.00 31.32 O ATOM 1438 OE2 GLU A 98 3.984 -11.444 14.360 1.00 32.43 O ATOM 0 H GLU A 98 4.696 -11.513 9.860 1.00 2.24 H new ATOM 0 HA GLU A 98 1.825 -10.841 9.820 1.00 13.45 H new ATOM 0 HB2 GLU A 98 4.065 -9.886 11.624 1.00 54.25 H new ATOM 0 HB3 GLU A 98 2.371 -9.458 11.759 1.00 54.25 H new ATOM 0 HG2 GLU A 98 1.824 -11.870 12.091 1.00 32.22 H new ATOM 0 HG3 GLU A 98 3.537 -12.239 12.046 1.00 32.22 H new ATOM 1445 N PHE A 99 2.085 -8.660 8.742 1.00 60.25 N ATOM 1446 CA PHE A 99 2.164 -7.479 7.912 1.00 54.55 C ATOM 1447 C PHE A 99 1.792 -6.262 8.775 1.00 71.01 C ATOM 1448 O PHE A 99 0.688 -6.204 9.317 1.00 22.41 O ATOM 1449 CB PHE A 99 1.155 -7.606 6.745 1.00 5.35 C ATOM 1450 CG PHE A 99 1.192 -8.923 5.989 1.00 21.43 C ATOM 1451 CD1 PHE A 99 2.090 -9.133 4.962 1.00 43.43 C ATOM 1452 CD2 PHE A 99 0.309 -9.945 6.309 1.00 42.31 C ATOM 1453 CE1 PHE A 99 2.115 -10.334 4.273 1.00 2.12 C ATOM 1454 CE2 PHE A 99 0.328 -11.145 5.627 1.00 1.04 C ATOM 1455 CZ PHE A 99 1.232 -11.340 4.607 1.00 63.22 C ATOM 0 H PHE A 99 1.131 -8.936 8.975 1.00 60.25 H new ATOM 0 HA PHE A 99 3.170 -7.365 7.507 1.00 54.55 H new ATOM 0 HB2 PHE A 99 0.149 -7.462 7.140 1.00 5.35 H new ATOM 0 HB3 PHE A 99 1.339 -6.796 6.039 1.00 5.35 H new ATOM 0 HD1 PHE A 99 2.783 -8.350 4.692 1.00 43.43 H new ATOM 0 HD2 PHE A 99 -0.405 -9.799 7.106 1.00 42.31 H new ATOM 0 HE1 PHE A 99 2.826 -10.483 3.474 1.00 2.12 H new ATOM 0 HE2 PHE A 99 -0.365 -11.929 5.893 1.00 1.04 H new ATOM 0 HZ PHE A 99 1.250 -12.277 4.070 1.00 63.22 H new ATOM 1465 N GLU A 100 2.687 -5.315 8.929 1.00 41.33 N ATOM 1466 CA GLU A 100 2.411 -4.155 9.765 1.00 1.55 C ATOM 1467 C GLU A 100 2.730 -2.836 9.054 1.00 52.43 C ATOM 1468 O GLU A 100 3.653 -2.759 8.240 1.00 62.30 O ATOM 1469 CB GLU A 100 3.181 -4.245 11.097 1.00 43.13 C ATOM 1470 CG GLU A 100 4.698 -4.247 10.940 1.00 12.13 C ATOM 1471 CD GLU A 100 5.434 -4.314 12.250 1.00 4.51 C ATOM 1472 OE1 GLU A 100 5.484 -3.307 12.972 1.00 42.54 O ATOM 1473 OE2 GLU A 100 5.989 -5.367 12.587 1.00 0.30 O ATOM 0 H GLU A 100 3.609 -5.318 8.492 1.00 41.33 H new ATOM 0 HA GLU A 100 1.341 -4.162 9.972 1.00 1.55 H new ATOM 0 HB2 GLU A 100 2.893 -3.405 11.728 1.00 43.13 H new ATOM 0 HB3 GLU A 100 2.879 -5.153 11.618 1.00 43.13 H new ATOM 0 HG2 GLU A 100 4.991 -5.097 10.323 1.00 12.13 H new ATOM 0 HG3 GLU A 100 5.002 -3.346 10.407 1.00 12.13 H new ATOM 1480 N VAL A 101 1.956 -1.824 9.359 1.00 51.14 N ATOM 1481 CA VAL A 101 2.182 -0.484 8.865 1.00 11.14 C ATOM 1482 C VAL A 101 2.767 0.300 10.008 1.00 24.15 C ATOM 1483 O VAL A 101 2.177 0.344 11.094 1.00 61.13 O ATOM 1484 CB VAL A 101 0.857 0.222 8.479 1.00 23.10 C ATOM 1485 CG1 VAL A 101 1.114 1.557 7.789 1.00 43.04 C ATOM 1486 CG2 VAL A 101 -0.025 -0.665 7.641 1.00 14.24 C ATOM 0 H VAL A 101 1.140 -1.907 9.965 1.00 51.14 H new ATOM 0 HA VAL A 101 2.824 -0.535 7.986 1.00 11.14 H new ATOM 0 HB VAL A 101 0.323 0.428 9.407 1.00 23.10 H new ATOM 0 HG11 VAL A 101 0.163 2.023 7.533 1.00 43.04 H new ATOM 0 HG12 VAL A 101 1.670 2.212 8.460 1.00 43.04 H new ATOM 0 HG13 VAL A 101 1.693 1.391 6.880 1.00 43.04 H new ATOM 0 HG21 VAL A 101 -0.943 -0.134 7.391 1.00 14.24 H new ATOM 0 HG22 VAL A 101 0.498 -0.936 6.724 1.00 14.24 H new ATOM 0 HG23 VAL A 101 -0.269 -1.568 8.200 1.00 14.24 H new ATOM 1496 N VAL A 102 3.904 0.878 9.803 1.00 13.31 N ATOM 1497 CA VAL A 102 4.521 1.682 10.815 1.00 51.31 C ATOM 1498 C VAL A 102 4.677 3.095 10.277 1.00 30.24 C ATOM 1499 O VAL A 102 5.304 3.302 9.236 1.00 4.32 O ATOM 1500 CB VAL A 102 5.920 1.127 11.190 1.00 42.03 C ATOM 1501 CG1 VAL A 102 6.554 1.924 12.317 1.00 2.12 C ATOM 1502 CG2 VAL A 102 5.845 -0.342 11.550 1.00 51.11 C ATOM 0 H VAL A 102 4.433 0.809 8.934 1.00 13.31 H new ATOM 0 HA VAL A 102 3.895 1.671 11.708 1.00 51.31 H new ATOM 0 HB VAL A 102 6.556 1.231 10.311 1.00 42.03 H new ATOM 0 HG11 VAL A 102 7.533 1.506 12.552 1.00 2.12 H new ATOM 0 HG12 VAL A 102 6.668 2.963 12.008 1.00 2.12 H new ATOM 0 HG13 VAL A 102 5.917 1.875 13.200 1.00 2.12 H new ATOM 0 HG21 VAL A 102 6.840 -0.705 11.808 1.00 51.11 H new ATOM 0 HG22 VAL A 102 5.178 -0.474 12.402 1.00 51.11 H new ATOM 0 HG23 VAL A 102 5.463 -0.906 10.699 1.00 51.11 H new ATOM 1512 N ASP A 103 4.115 4.027 10.963 1.00 23.31 N ATOM 1513 CA ASP A 103 4.196 5.431 10.612 1.00 73.23 C ATOM 1514 C ASP A 103 5.518 5.986 11.101 1.00 23.24 C ATOM 1515 O ASP A 103 5.925 5.726 12.246 1.00 32.24 O ATOM 1516 CB ASP A 103 3.042 6.165 11.284 1.00 25.42 C ATOM 1517 CG ASP A 103 2.912 7.617 10.935 1.00 32.33 C ATOM 1518 OD1 ASP A 103 3.799 8.180 10.316 1.00 54.40 O ATOM 1519 OD2 ASP A 103 1.878 8.212 11.300 1.00 44.14 O ATOM 0 H ASP A 103 3.570 3.847 11.806 1.00 23.31 H new ATOM 0 HA ASP A 103 4.132 5.560 9.532 1.00 73.23 H new ATOM 0 HB2 ASP A 103 2.112 5.661 11.022 1.00 25.42 H new ATOM 0 HB3 ASP A 103 3.158 6.078 12.364 1.00 25.42 H new ATOM 1524 N VAL A 104 6.180 6.735 10.258 1.00 45.02 N ATOM 1525 CA VAL A 104 7.465 7.326 10.579 1.00 4.11 C ATOM 1526 C VAL A 104 7.470 8.812 10.184 1.00 52.11 C ATOM 1527 O VAL A 104 8.512 9.487 10.240 1.00 44.30 O ATOM 1528 CB VAL A 104 8.652 6.574 9.877 1.00 54.44 C ATOM 1529 CG1 VAL A 104 8.798 5.151 10.400 1.00 33.23 C ATOM 1530 CG2 VAL A 104 8.464 6.544 8.368 1.00 42.51 C ATOM 0 H VAL A 104 5.845 6.957 9.321 1.00 45.02 H new ATOM 0 HA VAL A 104 7.613 7.233 11.655 1.00 4.11 H new ATOM 0 HB VAL A 104 9.562 7.126 10.111 1.00 54.44 H new ATOM 0 HG11 VAL A 104 9.629 4.660 9.893 1.00 33.23 H new ATOM 0 HG12 VAL A 104 8.991 5.176 11.472 1.00 33.23 H new ATOM 0 HG13 VAL A 104 7.879 4.597 10.210 1.00 33.23 H new ATOM 0 HG21 VAL A 104 9.300 6.018 7.908 1.00 42.51 H new ATOM 0 HG22 VAL A 104 7.534 6.029 8.127 1.00 42.51 H new ATOM 0 HG23 VAL A 104 8.423 7.564 7.986 1.00 42.51 H new ATOM 1540 N GLY A 105 6.308 9.305 9.830 1.00 11.20 N ATOM 1541 CA GLY A 105 6.131 10.656 9.374 1.00 23.44 C ATOM 1542 C GLY A 105 4.712 11.066 9.624 1.00 12.31 C ATOM 1543 O GLY A 105 3.992 11.508 8.713 1.00 71.31 O ATOM 0 H GLY A 105 5.443 8.764 9.853 1.00 11.20 H new ATOM 0 HA2 GLY A 105 6.815 11.324 9.897 1.00 23.44 H new ATOM 0 HA3 GLY A 105 6.364 10.730 8.312 1.00 23.44 H new ATOM 1547 N SER A 106 4.339 10.969 10.885 1.00 13.40 N ATOM 1548 CA SER A 106 2.982 11.140 11.404 1.00 1.33 C ATOM 1549 C SER A 106 2.451 12.573 11.322 1.00 74.40 C ATOM 1550 O SER A 106 1.528 12.956 12.051 1.00 25.14 O ATOM 1551 CB SER A 106 3.016 10.665 12.849 1.00 44.35 C ATOM 1552 OG SER A 106 4.167 11.193 13.519 1.00 62.25 O ATOM 0 H SER A 106 5.009 10.756 11.624 1.00 13.40 H new ATOM 0 HA SER A 106 2.295 10.562 10.787 1.00 1.33 H new ATOM 0 HB2 SER A 106 2.109 10.982 13.365 1.00 44.35 H new ATOM 0 HB3 SER A 106 3.036 9.576 12.880 1.00 44.35 H new ATOM 0 HG SER A 106 4.176 10.881 14.448 1.00 62.25 H new ATOM 1558 N LEU A 107 2.984 13.332 10.427 1.00 55.12 N ATOM 1559 CA LEU A 107 2.631 14.698 10.289 1.00 21.32 C ATOM 1560 C LEU A 107 1.769 14.930 9.060 1.00 15.40 C ATOM 1561 O LEU A 107 0.947 15.839 9.056 1.00 71.44 O ATOM 1562 CB LEU A 107 3.891 15.551 10.261 1.00 44.23 C ATOM 1563 CG LEU A 107 4.805 15.407 11.484 1.00 74.13 C ATOM 1564 CD1 LEU A 107 6.070 16.206 11.298 1.00 45.22 C ATOM 1565 CD2 LEU A 107 4.085 15.834 12.760 1.00 32.35 C ATOM 0 H LEU A 107 3.688 13.013 9.761 1.00 55.12 H new ATOM 0 HA LEU A 107 2.031 14.993 11.150 1.00 21.32 H new ATOM 0 HB2 LEU A 107 4.463 15.297 9.368 1.00 44.23 H new ATOM 0 HB3 LEU A 107 3.600 16.597 10.166 1.00 44.23 H new ATOM 0 HG LEU A 107 5.071 14.355 11.583 1.00 74.13 H new ATOM 0 HD11 LEU A 107 6.705 16.091 12.176 1.00 45.22 H new ATOM 0 HD12 LEU A 107 6.601 15.847 10.416 1.00 45.22 H new ATOM 0 HD13 LEU A 107 5.819 17.259 11.167 1.00 45.22 H new ATOM 0 HD21 LEU A 107 4.756 15.722 13.611 1.00 32.35 H new ATOM 0 HD22 LEU A 107 3.779 16.877 12.674 1.00 32.35 H new ATOM 0 HD23 LEU A 107 3.204 15.209 12.907 1.00 32.35 H new ATOM 1577 N ASN A 108 1.896 14.073 8.039 1.00 73.34 N ATOM 1578 CA ASN A 108 1.150 14.313 6.789 1.00 53.11 C ATOM 1579 C ASN A 108 -0.254 13.719 6.846 1.00 44.41 C ATOM 1580 O ASN A 108 -1.122 14.110 6.073 1.00 30.32 O ATOM 1581 CB ASN A 108 1.874 13.783 5.515 1.00 23.12 C ATOM 1582 CG ASN A 108 3.182 14.479 5.132 1.00 41.03 C ATOM 1583 OD1 ASN A 108 3.936 14.942 5.973 1.00 63.31 O ATOM 1584 ND2 ASN A 108 3.451 14.558 3.845 1.00 23.44 N ATOM 0 H ASN A 108 2.482 13.238 8.045 1.00 73.34 H new ATOM 0 HA ASN A 108 1.089 15.398 6.707 1.00 53.11 H new ATOM 0 HB2 ASN A 108 2.081 12.722 5.657 1.00 23.12 H new ATOM 0 HB3 ASN A 108 1.186 13.864 4.673 1.00 23.12 H new ATOM 0 HD21 ASN A 108 4.307 15.015 3.530 1.00 23.44 H new ATOM 0 HD22 ASN A 108 2.803 14.163 3.163 1.00 23.44 H new ATOM 1591 N GLY A 109 -0.483 12.787 7.757 1.00 22.24 N ATOM 1592 CA GLY A 109 -1.823 12.254 7.918 1.00 2.02 C ATOM 1593 C GLY A 109 -1.914 10.788 7.609 1.00 31.31 C ATOM 1594 O GLY A 109 -2.366 10.401 6.533 1.00 55.15 O ATOM 0 H GLY A 109 0.222 12.393 8.381 1.00 22.24 H new ATOM 0 HA2 GLY A 109 -2.155 12.425 8.942 1.00 2.02 H new ATOM 0 HA3 GLY A 109 -2.505 12.800 7.266 1.00 2.02 H new ATOM 1598 N THR A 110 -1.423 9.980 8.501 1.00 61.10 N ATOM 1599 CA THR A 110 -1.504 8.556 8.359 1.00 33.53 C ATOM 1600 C THR A 110 -2.828 8.040 8.957 1.00 43.33 C ATOM 1601 O THR A 110 -3.167 8.348 10.118 1.00 33.11 O ATOM 1602 CB THR A 110 -0.345 7.958 9.130 1.00 51.14 C ATOM 1603 OG1 THR A 110 0.772 8.863 8.999 1.00 75.51 O ATOM 1604 CG2 THR A 110 0.038 6.598 8.555 1.00 71.12 C ATOM 0 H THR A 110 -0.953 10.291 9.351 1.00 61.10 H new ATOM 0 HA THR A 110 -1.465 8.277 7.306 1.00 33.53 H new ATOM 0 HB THR A 110 -0.623 7.819 10.175 1.00 51.14 H new ATOM 0 HG1 THR A 110 0.785 9.237 8.093 1.00 75.51 H new ATOM 0 HG21 THR A 110 0.872 6.185 9.122 1.00 71.12 H new ATOM 0 HG22 THR A 110 -0.815 5.922 8.620 1.00 71.12 H new ATOM 0 HG23 THR A 110 0.331 6.714 7.511 1.00 71.12 H new ATOM 1612 N TYR A 111 -3.555 7.265 8.191 1.00 22.22 N ATOM 1613 CA TYR A 111 -4.791 6.667 8.641 1.00 21.41 C ATOM 1614 C TYR A 111 -4.813 5.216 8.208 1.00 20.43 C ATOM 1615 O TYR A 111 -4.443 4.906 7.087 1.00 32.03 O ATOM 1616 CB TYR A 111 -6.012 7.411 8.053 1.00 22.43 C ATOM 1617 CG TYR A 111 -6.078 8.890 8.402 1.00 72.25 C ATOM 1618 CD1 TYR A 111 -6.522 9.303 9.641 1.00 25.41 C ATOM 1619 CD2 TYR A 111 -5.677 9.867 7.495 1.00 51.22 C ATOM 1620 CE1 TYR A 111 -6.577 10.639 9.979 1.00 45.43 C ATOM 1621 CE2 TYR A 111 -5.724 11.212 7.827 1.00 31.14 C ATOM 1622 CZ TYR A 111 -6.175 11.588 9.076 1.00 4.42 C ATOM 1623 OH TYR A 111 -6.224 12.921 9.425 1.00 43.44 O ATOM 0 H TYR A 111 -3.305 7.029 7.231 1.00 22.22 H new ATOM 0 HA TYR A 111 -4.848 6.737 9.727 1.00 21.41 H new ATOM 0 HB2 TYR A 111 -5.997 7.307 6.968 1.00 22.43 H new ATOM 0 HB3 TYR A 111 -6.922 6.926 8.407 1.00 22.43 H new ATOM 0 HD1 TYR A 111 -6.834 8.563 10.363 1.00 25.41 H new ATOM 0 HD2 TYR A 111 -5.324 9.573 6.518 1.00 51.22 H new ATOM 0 HE1 TYR A 111 -6.936 10.937 10.953 1.00 45.43 H new ATOM 0 HE2 TYR A 111 -5.410 11.960 7.114 1.00 31.14 H new ATOM 0 HH TYR A 111 -5.368 13.347 9.210 1.00 43.44 H new ATOM 1633 N VAL A 112 -5.218 4.341 9.086 1.00 3.40 N ATOM 1634 CA VAL A 112 -5.301 2.914 8.797 1.00 32.24 C ATOM 1635 C VAL A 112 -6.658 2.439 9.278 1.00 24.34 C ATOM 1636 O VAL A 112 -7.075 2.821 10.378 1.00 23.52 O ATOM 1637 CB VAL A 112 -4.177 2.096 9.523 1.00 52.35 C ATOM 1638 CG1 VAL A 112 -4.272 0.616 9.190 1.00 70.32 C ATOM 1639 CG2 VAL A 112 -2.785 2.619 9.176 1.00 50.03 C ATOM 0 H VAL A 112 -5.505 4.588 10.033 1.00 3.40 H new ATOM 0 HA VAL A 112 -5.168 2.757 7.727 1.00 32.24 H new ATOM 0 HB VAL A 112 -4.333 2.225 10.594 1.00 52.35 H new ATOM 0 HG11 VAL A 112 -3.480 0.075 9.708 1.00 70.32 H new ATOM 0 HG12 VAL A 112 -5.241 0.233 9.509 1.00 70.32 H new ATOM 0 HG13 VAL A 112 -4.163 0.477 8.114 1.00 70.32 H new ATOM 0 HG21 VAL A 112 -2.033 2.027 9.698 1.00 50.03 H new ATOM 0 HG22 VAL A 112 -2.625 2.542 8.101 1.00 50.03 H new ATOM 0 HG23 VAL A 112 -2.702 3.662 9.481 1.00 50.03 H new ATOM 1649 N ASN A 113 -7.368 1.668 8.442 1.00 21.43 N ATOM 1650 CA ASN A 113 -8.715 1.144 8.736 1.00 73.05 C ATOM 1651 C ASN A 113 -9.647 2.329 9.055 1.00 42.52 C ATOM 1652 O ASN A 113 -10.548 2.245 9.896 1.00 74.13 O ATOM 1653 CB ASN A 113 -8.655 0.161 9.932 1.00 42.13 C ATOM 1654 CG ASN A 113 -9.775 -0.878 9.916 1.00 31.24 C ATOM 1655 OD1 ASN A 113 -10.864 -0.669 10.445 1.00 20.33 O ATOM 1656 ND2 ASN A 113 -9.486 -2.031 9.354 1.00 40.13 N ATOM 0 H ASN A 113 -7.019 1.385 7.526 1.00 21.43 H new ATOM 0 HA ASN A 113 -9.100 0.601 7.872 1.00 73.05 H new ATOM 0 HB2 ASN A 113 -7.693 -0.352 9.924 1.00 42.13 H new ATOM 0 HB3 ASN A 113 -8.707 0.727 10.862 1.00 42.13 H new ATOM 0 HD21 ASN A 113 -10.175 -2.783 9.349 1.00 40.13 H new ATOM 0 HD22 ASN A 113 -8.573 -2.174 8.923 1.00 40.13 H new ATOM 1663 N ARG A 114 -9.438 3.422 8.294 1.00 62.32 N ATOM 1664 CA ARG A 114 -10.177 4.690 8.426 1.00 34.34 C ATOM 1665 C ARG A 114 -9.978 5.420 9.755 1.00 61.32 C ATOM 1666 O ARG A 114 -10.730 6.340 10.058 1.00 42.13 O ATOM 1667 CB ARG A 114 -11.663 4.520 8.127 1.00 5.54 C ATOM 1668 CG ARG A 114 -11.980 4.377 6.662 1.00 30.54 C ATOM 1669 CD ARG A 114 -11.688 5.670 5.902 1.00 24.11 C ATOM 1670 NE ARG A 114 -12.124 5.578 4.514 1.00 63.12 N ATOM 1671 CZ ARG A 114 -12.561 6.599 3.767 1.00 25.22 C ATOM 1672 NH1 ARG A 114 -12.335 7.862 4.136 1.00 4.25 N ATOM 1673 NH2 ARG A 114 -13.162 6.359 2.617 1.00 12.14 N ATOM 0 H ARG A 114 -8.735 3.446 7.555 1.00 62.32 H new ATOM 0 HA ARG A 114 -9.731 5.333 7.667 1.00 34.34 H new ATOM 0 HB2 ARG A 114 -12.031 3.641 8.656 1.00 5.54 H new ATOM 0 HB3 ARG A 114 -12.204 5.380 8.523 1.00 5.54 H new ATOM 0 HG2 ARG A 114 -11.392 3.563 6.238 1.00 30.54 H new ATOM 0 HG3 ARG A 114 -13.030 4.110 6.539 1.00 30.54 H new ATOM 0 HD2 ARG A 114 -12.194 6.503 6.390 1.00 24.11 H new ATOM 0 HD3 ARG A 114 -10.619 5.881 5.937 1.00 24.11 H new ATOM 0 HE ARG A 114 -12.093 4.658 4.075 1.00 63.12 H new ATOM 0 HH11 ARG A 114 -11.824 8.058 4.997 1.00 4.25 H new ATOM 0 HH12 ARG A 114 -12.674 8.631 3.557 1.00 4.25 H new ATOM 0 HH21 ARG A 114 -13.292 5.398 2.300 1.00 12.14 H new ATOM 0 HH22 ARG A 114 -13.496 7.134 2.045 1.00 12.14 H new ATOM 1687 N GLU A 115 -8.984 5.054 10.523 1.00 61.33 N ATOM 1688 CA GLU A 115 -8.736 5.743 11.769 1.00 63.00 C ATOM 1689 C GLU A 115 -7.306 6.253 11.788 1.00 41.13 C ATOM 1690 O GLU A 115 -6.438 5.641 11.167 1.00 4.14 O ATOM 1691 CB GLU A 115 -8.958 4.810 12.958 1.00 61.12 C ATOM 1692 CG GLU A 115 -10.296 4.108 12.954 1.00 35.35 C ATOM 1693 CD GLU A 115 -10.601 3.412 14.246 1.00 31.24 C ATOM 1694 OE1 GLU A 115 -9.952 2.391 14.582 1.00 33.22 O ATOM 1695 OE2 GLU A 115 -11.531 3.856 14.952 1.00 2.41 O ATOM 0 H GLU A 115 -8.339 4.292 10.314 1.00 61.33 H new ATOM 0 HA GLU A 115 -9.431 6.579 11.848 1.00 63.00 H new ATOM 0 HB2 GLU A 115 -8.167 4.060 12.969 1.00 61.12 H new ATOM 0 HB3 GLU A 115 -8.865 5.385 13.879 1.00 61.12 H new ATOM 0 HG2 GLU A 115 -11.080 4.836 12.747 1.00 35.35 H new ATOM 0 HG3 GLU A 115 -10.315 3.380 12.143 1.00 35.35 H new ATOM 1702 N PRO A 116 -7.030 7.394 12.462 1.00 4.43 N ATOM 1703 CA PRO A 116 -5.660 7.895 12.604 1.00 10.02 C ATOM 1704 C PRO A 116 -4.838 6.849 13.334 1.00 74.35 C ATOM 1705 O PRO A 116 -5.194 6.421 14.443 1.00 31.43 O ATOM 1706 CB PRO A 116 -5.813 9.168 13.456 1.00 32.43 C ATOM 1707 CG PRO A 116 -7.182 9.085 14.052 1.00 10.10 C ATOM 1708 CD PRO A 116 -8.014 8.282 13.099 1.00 51.15 C ATOM 0 HA PRO A 116 -5.162 8.101 11.656 1.00 10.02 H new ATOM 0 HB2 PRO A 116 -5.049 9.216 14.232 1.00 32.43 H new ATOM 0 HB3 PRO A 116 -5.704 10.065 12.846 1.00 32.43 H new ATOM 0 HG2 PRO A 116 -7.150 8.611 15.033 1.00 10.10 H new ATOM 0 HG3 PRO A 116 -7.605 10.080 14.193 1.00 10.10 H new ATOM 0 HD2 PRO A 116 -8.789 7.718 13.618 1.00 51.15 H new ATOM 0 HD3 PRO A 116 -8.516 8.917 12.369 1.00 51.15 H new ATOM 1716 N ARG A 117 -3.771 6.415 12.736 1.00 42.25 N ATOM 1717 CA ARG A 117 -3.068 5.295 13.272 1.00 11.23 C ATOM 1718 C ARG A 117 -1.614 5.395 12.921 1.00 64.24 C ATOM 1719 O ARG A 117 -1.273 5.736 11.799 1.00 42.23 O ATOM 1720 CB ARG A 117 -3.684 4.036 12.666 1.00 63.52 C ATOM 1721 CG ARG A 117 -3.290 2.720 13.302 1.00 63.13 C ATOM 1722 CD ARG A 117 -3.692 2.642 14.772 1.00 75.11 C ATOM 1723 NE ARG A 117 -5.074 3.129 15.009 1.00 43.55 N ATOM 1724 CZ ARG A 117 -6.224 2.438 14.832 1.00 21.24 C ATOM 1725 NH1 ARG A 117 -6.212 1.195 14.381 1.00 10.00 N ATOM 1726 NH2 ARG A 117 -7.380 3.009 15.138 1.00 42.13 N ATOM 0 H ARG A 117 -3.373 6.815 11.886 1.00 42.25 H new ATOM 0 HA ARG A 117 -3.148 5.266 14.359 1.00 11.23 H new ATOM 0 HB2 ARG A 117 -4.769 4.128 12.716 1.00 63.52 H new ATOM 0 HB3 ARG A 117 -3.416 3.999 11.610 1.00 63.52 H new ATOM 0 HG2 ARG A 117 -3.758 1.901 12.756 1.00 63.13 H new ATOM 0 HG3 ARG A 117 -2.212 2.586 13.215 1.00 63.13 H new ATOM 0 HD2 ARG A 117 -3.610 1.610 15.114 1.00 75.11 H new ATOM 0 HD3 ARG A 117 -2.995 3.231 15.368 1.00 75.11 H new ATOM 0 HE ARG A 117 -5.167 4.089 15.341 1.00 43.55 H new ATOM 0 HH11 ARG A 117 -5.326 0.741 14.160 1.00 10.00 H new ATOM 0 HH12 ARG A 117 -7.089 0.690 14.254 1.00 10.00 H new ATOM 0 HH21 ARG A 117 -7.398 3.961 15.503 1.00 42.13 H new ATOM 0 HH22 ARG A 117 -8.252 2.496 15.008 1.00 42.13 H new ATOM 1740 N ASN A 118 -0.774 5.126 13.883 1.00 32.33 N ATOM 1741 CA ASN A 118 0.655 5.193 13.674 1.00 21.42 C ATOM 1742 C ASN A 118 1.217 3.808 13.367 1.00 41.24 C ATOM 1743 O ASN A 118 1.794 3.594 12.328 1.00 41.41 O ATOM 1744 CB ASN A 118 1.351 5.881 14.861 1.00 25.24 C ATOM 1745 CG ASN A 118 0.957 7.366 14.993 1.00 61.22 C ATOM 1746 OD1 ASN A 118 0.811 7.893 16.107 1.00 51.23 O ATOM 1747 ND2 ASN A 118 0.842 8.070 13.881 1.00 21.24 N ATOM 0 H ASN A 118 -1.052 4.856 14.827 1.00 32.33 H new ATOM 0 HA ASN A 118 0.860 5.812 12.801 1.00 21.42 H new ATOM 0 HB2 ASN A 118 1.096 5.357 15.782 1.00 25.24 H new ATOM 0 HB3 ASN A 118 2.431 5.804 14.740 1.00 25.24 H new ATOM 0 HD21 ASN A 118 0.629 9.066 13.928 1.00 21.24 H new ATOM 0 HD22 ASN A 118 0.966 7.617 12.976 1.00 21.24 H new ATOM 1754 N ALA A 119 1.025 2.860 14.237 1.00 34.42 N ATOM 1755 CA ALA A 119 1.456 1.522 13.924 1.00 21.24 C ATOM 1756 C ALA A 119 0.254 0.629 13.975 1.00 64.15 C ATOM 1757 O ALA A 119 -0.555 0.733 14.902 1.00 3.12 O ATOM 1758 CB ALA A 119 2.520 1.058 14.910 1.00 4.40 C ATOM 0 H ALA A 119 0.584 2.979 15.149 1.00 34.42 H new ATOM 0 HA ALA A 119 1.902 1.491 12.930 1.00 21.24 H new ATOM 0 HB1 ALA A 119 2.833 0.045 14.657 1.00 4.40 H new ATOM 0 HB2 ALA A 119 3.379 1.727 14.859 1.00 4.40 H new ATOM 0 HB3 ALA A 119 2.110 1.070 15.920 1.00 4.40 H new ATOM 1764 N GLN A 120 0.106 -0.211 12.988 1.00 0.52 N ATOM 1765 CA GLN A 120 -1.034 -1.110 12.927 1.00 13.32 C ATOM 1766 C GLN A 120 -0.719 -2.335 12.111 1.00 12.12 C ATOM 1767 O GLN A 120 -0.147 -2.220 11.045 1.00 1.01 O ATOM 1768 CB GLN A 120 -2.235 -0.370 12.330 1.00 3.34 C ATOM 1769 CG GLN A 120 -3.564 -1.138 12.271 1.00 32.33 C ATOM 1770 CD GLN A 120 -4.005 -1.698 13.613 1.00 65.10 C ATOM 1771 OE1 GLN A 120 -4.636 -1.007 14.404 1.00 51.32 O ATOM 1772 NE2 GLN A 120 -3.788 -2.969 13.822 1.00 52.41 N ATOM 0 H GLN A 120 0.758 -0.299 12.208 1.00 0.52 H new ATOM 0 HA GLN A 120 -1.273 -1.437 13.939 1.00 13.32 H new ATOM 0 HB2 GLN A 120 -2.394 0.540 12.908 1.00 3.34 H new ATOM 0 HB3 GLN A 120 -1.975 -0.063 11.317 1.00 3.34 H new ATOM 0 HG2 GLN A 120 -4.341 -0.474 11.891 1.00 32.33 H new ATOM 0 HG3 GLN A 120 -3.469 -1.958 11.559 1.00 32.33 H new ATOM 0 HE21 GLN A 120 -3.258 -3.515 13.142 1.00 52.41 H new ATOM 0 HE22 GLN A 120 -4.148 -3.416 14.665 1.00 52.41 H new ATOM 1781 N VAL A 121 -1.049 -3.489 12.620 1.00 14.51 N ATOM 1782 CA VAL A 121 -1.006 -4.693 11.817 1.00 3.33 C ATOM 1783 C VAL A 121 -2.076 -4.547 10.715 1.00 34.13 C ATOM 1784 O VAL A 121 -3.213 -4.155 11.000 1.00 63.20 O ATOM 1785 CB VAL A 121 -1.271 -5.961 12.677 1.00 75.34 C ATOM 1786 CG1 VAL A 121 -1.326 -7.208 11.815 1.00 74.21 C ATOM 1787 CG2 VAL A 121 -0.188 -6.115 13.737 1.00 45.14 C ATOM 0 H VAL A 121 -1.351 -3.628 13.584 1.00 14.51 H new ATOM 0 HA VAL A 121 -0.015 -4.816 11.381 1.00 3.33 H new ATOM 0 HB VAL A 121 -2.238 -5.838 13.164 1.00 75.34 H new ATOM 0 HG11 VAL A 121 -1.513 -8.078 12.445 1.00 74.21 H new ATOM 0 HG12 VAL A 121 -2.129 -7.110 11.084 1.00 74.21 H new ATOM 0 HG13 VAL A 121 -0.376 -7.333 11.295 1.00 74.21 H new ATOM 0 HG21 VAL A 121 -0.386 -7.007 14.332 1.00 45.14 H new ATOM 0 HG22 VAL A 121 0.784 -6.210 13.253 1.00 45.14 H new ATOM 0 HG23 VAL A 121 -0.186 -5.239 14.386 1.00 45.14 H new ATOM 1797 N MET A 122 -1.699 -4.800 9.492 1.00 25.21 N ATOM 1798 CA MET A 122 -2.583 -4.594 8.358 1.00 25.34 C ATOM 1799 C MET A 122 -3.217 -5.913 7.940 1.00 2.02 C ATOM 1800 O MET A 122 -2.534 -6.927 7.786 1.00 52.23 O ATOM 1801 CB MET A 122 -1.811 -3.903 7.205 1.00 24.02 C ATOM 1802 CG MET A 122 -0.597 -4.678 6.704 1.00 62.11 C ATOM 1803 SD MET A 122 0.659 -3.658 5.882 1.00 52.12 S ATOM 1804 CE MET A 122 -0.262 -2.932 4.546 1.00 70.45 C ATOM 0 H MET A 122 -0.775 -5.154 9.245 1.00 25.21 H new ATOM 0 HA MET A 122 -3.399 -3.928 8.639 1.00 25.34 H new ATOM 0 HB2 MET A 122 -2.494 -3.744 6.371 1.00 24.02 H new ATOM 0 HB3 MET A 122 -1.485 -2.919 7.542 1.00 24.02 H new ATOM 0 HG2 MET A 122 -0.135 -5.191 7.548 1.00 62.11 H new ATOM 0 HG3 MET A 122 -0.934 -5.447 6.009 1.00 62.11 H new ATOM 0 HE1 MET A 122 0.143 -3.277 3.595 1.00 70.45 H new ATOM 0 HE2 MET A 122 -1.309 -3.227 4.623 1.00 70.45 H new ATOM 0 HE3 MET A 122 -0.186 -1.846 4.600 1.00 70.45 H new ATOM 1814 N GLN A 123 -4.516 -5.899 7.789 1.00 20.42 N ATOM 1815 CA GLN A 123 -5.267 -7.059 7.489 1.00 35.23 C ATOM 1816 C GLN A 123 -5.877 -6.948 6.091 1.00 12.34 C ATOM 1817 O GLN A 123 -6.034 -5.860 5.570 1.00 45.41 O ATOM 1818 CB GLN A 123 -6.359 -7.146 8.521 1.00 32.44 C ATOM 1819 CG GLN A 123 -6.488 -8.483 9.157 1.00 24.13 C ATOM 1820 CD GLN A 123 -5.233 -8.898 9.907 1.00 0.52 C ATOM 1821 OE1 GLN A 123 -4.490 -8.066 10.413 1.00 32.44 O ATOM 1822 NE2 GLN A 123 -5.006 -10.169 10.017 1.00 2.44 N ATOM 0 H GLN A 123 -5.081 -5.054 7.876 1.00 20.42 H new ATOM 0 HA GLN A 123 -4.636 -7.947 7.506 1.00 35.23 H new ATOM 0 HB2 GLN A 123 -6.171 -6.403 9.296 1.00 32.44 H new ATOM 0 HB3 GLN A 123 -7.308 -6.885 8.053 1.00 32.44 H new ATOM 0 HG2 GLN A 123 -7.332 -8.473 9.847 1.00 24.13 H new ATOM 0 HG3 GLN A 123 -6.711 -9.226 8.391 1.00 24.13 H new ATOM 0 HE21 GLN A 123 -5.642 -10.840 9.585 1.00 2.44 H new ATOM 0 HE22 GLN A 123 -4.192 -10.499 10.535 1.00 2.44 H new ATOM 1831 N THR A 124 -6.179 -8.072 5.477 1.00 63.52 N ATOM 1832 CA THR A 124 -6.808 -8.093 4.169 1.00 13.11 C ATOM 1833 C THR A 124 -8.184 -7.401 4.224 1.00 41.54 C ATOM 1834 O THR A 124 -9.040 -7.781 5.014 1.00 12.44 O ATOM 1835 CB THR A 124 -6.966 -9.551 3.711 1.00 41.01 C ATOM 1836 OG1 THR A 124 -5.685 -10.176 3.764 1.00 51.20 O ATOM 1837 CG2 THR A 124 -7.520 -9.647 2.294 1.00 30.12 C ATOM 0 H THR A 124 -5.997 -8.996 5.868 1.00 63.52 H new ATOM 0 HA THR A 124 -6.182 -7.553 3.458 1.00 13.11 H new ATOM 0 HB THR A 124 -7.675 -10.049 4.372 1.00 41.01 H new ATOM 0 HG1 THR A 124 -5.113 -9.809 3.058 1.00 51.20 H new ATOM 0 HG21 THR A 124 -7.615 -10.695 2.011 1.00 30.12 H new ATOM 0 HG22 THR A 124 -8.499 -9.169 2.253 1.00 30.12 H new ATOM 0 HG23 THR A 124 -6.842 -9.145 1.604 1.00 30.12 H new ATOM 1845 N GLY A 125 -8.360 -6.394 3.393 1.00 61.33 N ATOM 1846 CA GLY A 125 -9.590 -5.638 3.363 1.00 10.33 C ATOM 1847 C GLY A 125 -9.466 -4.331 4.119 1.00 52.35 C ATOM 1848 O GLY A 125 -10.413 -3.532 4.155 1.00 54.32 O ATOM 0 H GLY A 125 -7.657 -6.080 2.724 1.00 61.33 H new ATOM 0 HA2 GLY A 125 -9.866 -5.435 2.328 1.00 10.33 H new ATOM 0 HA3 GLY A 125 -10.393 -6.234 3.796 1.00 10.33 H new ATOM 1852 N ASP A 126 -8.303 -4.110 4.707 1.00 63.30 N ATOM 1853 CA ASP A 126 -8.031 -2.885 5.454 1.00 62.20 C ATOM 1854 C ASP A 126 -7.704 -1.785 4.470 1.00 51.30 C ATOM 1855 O ASP A 126 -7.099 -2.048 3.403 1.00 23.34 O ATOM 1856 CB ASP A 126 -6.838 -3.083 6.402 1.00 61.25 C ATOM 1857 CG ASP A 126 -6.650 -1.958 7.402 1.00 4.42 C ATOM 1858 OD1 ASP A 126 -6.261 -0.852 7.018 1.00 33.44 O ATOM 1859 OD2 ASP A 126 -6.910 -2.194 8.600 1.00 64.11 O ATOM 0 H ASP A 126 -7.523 -4.767 4.683 1.00 63.30 H new ATOM 0 HA ASP A 126 -8.908 -2.624 6.047 1.00 62.20 H new ATOM 0 HB2 ASP A 126 -6.970 -4.019 6.945 1.00 61.25 H new ATOM 0 HB3 ASP A 126 -5.929 -3.184 5.809 1.00 61.25 H new ATOM 1864 N GLU A 127 -8.089 -0.587 4.792 1.00 41.23 N ATOM 1865 CA GLU A 127 -7.842 0.519 3.940 1.00 41.11 C ATOM 1866 C GLU A 127 -7.008 1.560 4.647 1.00 31.40 C ATOM 1867 O GLU A 127 -7.347 2.041 5.734 1.00 65.33 O ATOM 1868 CB GLU A 127 -9.146 1.079 3.392 1.00 33.21 C ATOM 1869 CG GLU A 127 -10.172 1.482 4.434 1.00 62.24 C ATOM 1870 CD GLU A 127 -11.465 1.905 3.800 1.00 52.42 C ATOM 1871 OE1 GLU A 127 -12.270 1.027 3.426 1.00 63.33 O ATOM 1872 OE2 GLU A 127 -11.703 3.112 3.650 1.00 1.41 O ATOM 0 H GLU A 127 -8.583 -0.357 5.654 1.00 41.23 H new ATOM 0 HA GLU A 127 -7.262 0.183 3.081 1.00 41.11 H new ATOM 0 HB2 GLU A 127 -8.917 1.949 2.777 1.00 33.21 H new ATOM 0 HB3 GLU A 127 -9.594 0.333 2.735 1.00 33.21 H new ATOM 0 HG2 GLU A 127 -10.353 0.646 5.109 1.00 62.24 H new ATOM 0 HG3 GLU A 127 -9.777 2.299 5.037 1.00 62.24 H new ATOM 1879 N ILE A 128 -5.951 1.914 4.017 1.00 65.22 N ATOM 1880 CA ILE A 128 -4.988 2.816 4.554 1.00 12.51 C ATOM 1881 C ILE A 128 -5.068 4.097 3.777 1.00 54.42 C ATOM 1882 O ILE A 128 -5.096 4.085 2.555 1.00 45.03 O ATOM 1883 CB ILE A 128 -3.568 2.211 4.427 1.00 11.01 C ATOM 1884 CG1 ILE A 128 -3.535 0.836 5.095 1.00 14.41 C ATOM 1885 CG2 ILE A 128 -2.521 3.135 5.053 1.00 1.14 C ATOM 1886 CD1 ILE A 128 -2.246 0.093 4.905 1.00 14.43 C ATOM 0 H ILE A 128 -5.719 1.576 3.083 1.00 65.22 H new ATOM 0 HA ILE A 128 -5.191 3.000 5.609 1.00 12.51 H new ATOM 0 HB ILE A 128 -3.327 2.103 3.369 1.00 11.01 H new ATOM 0 HG12 ILE A 128 -3.717 0.958 6.163 1.00 14.41 H new ATOM 0 HG13 ILE A 128 -4.352 0.232 4.699 1.00 14.41 H new ATOM 0 HG21 ILE A 128 -1.533 2.687 4.951 1.00 1.14 H new ATOM 0 HG22 ILE A 128 -2.537 4.099 4.545 1.00 1.14 H new ATOM 0 HG23 ILE A 128 -2.747 3.278 6.110 1.00 1.14 H new ATOM 0 HD11 ILE A 128 -2.304 -0.872 5.409 1.00 14.43 H new ATOM 0 HD12 ILE A 128 -2.070 -0.064 3.841 1.00 14.43 H new ATOM 0 HD13 ILE A 128 -1.426 0.674 5.327 1.00 14.43 H new ATOM 1898 N GLN A 129 -5.129 5.177 4.454 1.00 51.23 N ATOM 1899 CA GLN A 129 -5.224 6.431 3.812 1.00 25.42 C ATOM 1900 C GLN A 129 -4.026 7.263 4.235 1.00 50.33 C ATOM 1901 O GLN A 129 -3.859 7.591 5.401 1.00 71.42 O ATOM 1902 CB GLN A 129 -6.577 7.072 4.126 1.00 51.00 C ATOM 1903 CG GLN A 129 -6.926 8.272 3.275 1.00 73.25 C ATOM 1904 CD GLN A 129 -8.396 8.636 3.371 1.00 73.45 C ATOM 1905 OE1 GLN A 129 -9.051 8.431 4.399 1.00 50.20 O ATOM 1906 NE2 GLN A 129 -8.938 9.128 2.287 1.00 1.14 N ATOM 0 H GLN A 129 -5.115 5.219 5.473 1.00 51.23 H new ATOM 0 HA GLN A 129 -5.191 6.340 2.726 1.00 25.42 H new ATOM 0 HB2 GLN A 129 -7.356 6.320 4.004 1.00 51.00 H new ATOM 0 HB3 GLN A 129 -6.586 7.373 5.174 1.00 51.00 H new ATOM 0 HG2 GLN A 129 -6.322 9.124 3.586 1.00 73.25 H new ATOM 0 HG3 GLN A 129 -6.672 8.064 2.236 1.00 73.25 H new ATOM 0 HE21 GLN A 129 -8.366 9.284 1.457 1.00 1.14 H new ATOM 0 HE22 GLN A 129 -9.932 9.356 2.272 1.00 1.14 H new ATOM 1915 N ILE A 130 -3.168 7.519 3.292 1.00 43.44 N ATOM 1916 CA ILE A 130 -1.921 8.210 3.530 1.00 61.34 C ATOM 1917 C ILE A 130 -1.991 9.590 2.911 1.00 71.14 C ATOM 1918 O ILE A 130 -1.911 9.735 1.688 1.00 21.12 O ATOM 1919 CB ILE A 130 -0.715 7.392 2.937 1.00 14.13 C ATOM 1920 CG1 ILE A 130 -0.529 6.078 3.721 1.00 62.51 C ATOM 1921 CG2 ILE A 130 0.578 8.198 2.904 1.00 73.44 C ATOM 1922 CD1 ILE A 130 0.605 5.196 3.219 1.00 14.23 C ATOM 0 H ILE A 130 -3.311 7.252 2.318 1.00 43.44 H new ATOM 0 HA ILE A 130 -1.760 8.308 4.604 1.00 61.34 H new ATOM 0 HB ILE A 130 -0.958 7.157 1.901 1.00 14.13 H new ATOM 0 HG12 ILE A 130 -0.349 6.318 4.769 1.00 62.51 H new ATOM 0 HG13 ILE A 130 -1.459 5.511 3.679 1.00 62.51 H new ATOM 0 HG21 ILE A 130 1.378 7.586 2.486 1.00 73.44 H new ATOM 0 HG22 ILE A 130 0.438 9.085 2.286 1.00 73.44 H new ATOM 0 HG23 ILE A 130 0.844 8.500 3.917 1.00 73.44 H new ATOM 0 HD11 ILE A 130 0.662 4.294 3.829 1.00 14.23 H new ATOM 0 HD12 ILE A 130 0.420 4.921 2.181 1.00 14.23 H new ATOM 0 HD13 ILE A 130 1.547 5.740 3.287 1.00 14.23 H new ATOM 1934 N GLY A 131 -2.178 10.588 3.746 1.00 4.21 N ATOM 1935 CA GLY A 131 -2.315 11.944 3.277 1.00 75.42 C ATOM 1936 C GLY A 131 -3.643 12.117 2.581 1.00 5.34 C ATOM 1937 O GLY A 131 -4.633 12.469 3.197 1.00 50.44 O ATOM 0 H GLY A 131 -2.239 10.482 4.759 1.00 4.21 H new ATOM 0 HA2 GLY A 131 -2.241 12.637 4.115 1.00 75.42 H new ATOM 0 HA3 GLY A 131 -1.502 12.185 2.592 1.00 75.42 H new ATOM 1941 N LYS A 132 -3.652 11.858 1.288 1.00 40.11 N ATOM 1942 CA LYS A 132 -4.868 11.862 0.502 1.00 0.32 C ATOM 1943 C LYS A 132 -4.896 10.616 -0.405 1.00 74.41 C ATOM 1944 O LYS A 132 -5.792 10.457 -1.249 1.00 51.42 O ATOM 1945 CB LYS A 132 -5.009 13.150 -0.335 1.00 43.42 C ATOM 1946 CG LYS A 132 -5.008 14.444 0.482 1.00 14.25 C ATOM 1947 CD LYS A 132 -5.319 15.700 -0.356 1.00 1.40 C ATOM 1948 CE LYS A 132 -6.825 15.894 -0.675 1.00 32.53 C ATOM 1949 NZ LYS A 132 -7.408 14.859 -1.561 1.00 73.12 N ATOM 0 H LYS A 132 -2.812 11.638 0.752 1.00 40.11 H new ATOM 0 HA LYS A 132 -5.717 11.834 1.186 1.00 0.32 H new ATOM 0 HB2 LYS A 132 -4.192 13.190 -1.056 1.00 43.42 H new ATOM 0 HB3 LYS A 132 -5.936 13.097 -0.906 1.00 43.42 H new ATOM 0 HG2 LYS A 132 -5.743 14.360 1.282 1.00 14.25 H new ATOM 0 HG3 LYS A 132 -4.034 14.565 0.955 1.00 14.25 H new ATOM 0 HD2 LYS A 132 -4.956 16.578 0.178 1.00 1.40 H new ATOM 0 HD3 LYS A 132 -4.765 15.645 -1.293 1.00 1.40 H new ATOM 0 HE2 LYS A 132 -7.382 15.907 0.262 1.00 32.53 H new ATOM 0 HE3 LYS A 132 -6.961 16.870 -1.140 1.00 32.53 H new ATOM 0 HZ1 LYS A 132 -8.180 15.275 -2.120 1.00 73.12 H new ATOM 0 HZ2 LYS A 132 -6.673 14.497 -2.202 1.00 73.12 H new ATOM 0 HZ3 LYS A 132 -7.780 14.078 -0.984 1.00 73.12 H new ATOM 1963 N PHE A 133 -3.912 9.738 -0.215 1.00 12.34 N ATOM 1964 CA PHE A 133 -3.808 8.485 -0.960 1.00 40.31 C ATOM 1965 C PHE A 133 -4.655 7.447 -0.290 1.00 33.02 C ATOM 1966 O PHE A 133 -4.782 7.446 0.924 1.00 53.34 O ATOM 1967 CB PHE A 133 -2.373 7.929 -0.949 1.00 54.50 C ATOM 1968 CG PHE A 133 -1.346 8.660 -1.753 1.00 11.22 C ATOM 1969 CD1 PHE A 133 -0.748 9.815 -1.276 1.00 13.12 C ATOM 1970 CD2 PHE A 133 -0.939 8.155 -2.973 1.00 52.01 C ATOM 1971 CE1 PHE A 133 0.229 10.449 -2.003 1.00 64.34 C ATOM 1972 CE2 PHE A 133 0.032 8.786 -3.707 1.00 35.43 C ATOM 1973 CZ PHE A 133 0.618 9.935 -3.219 1.00 23.53 C ATOM 0 H PHE A 133 -3.162 9.877 0.462 1.00 12.34 H new ATOM 0 HA PHE A 133 -4.122 8.694 -1.983 1.00 40.31 H new ATOM 0 HB2 PHE A 133 -2.032 7.898 0.086 1.00 54.50 H new ATOM 0 HB3 PHE A 133 -2.408 6.899 -1.304 1.00 54.50 H new ATOM 0 HD1 PHE A 133 -1.053 10.221 -0.323 1.00 13.12 H new ATOM 0 HD2 PHE A 133 -1.392 7.251 -3.353 1.00 52.01 H new ATOM 0 HE1 PHE A 133 0.691 11.348 -1.622 1.00 64.34 H new ATOM 0 HE2 PHE A 133 0.336 8.385 -4.663 1.00 35.43 H new ATOM 0 HZ PHE A 133 1.385 10.433 -3.793 1.00 23.53 H new ATOM 1983 N ARG A 134 -5.202 6.556 -1.052 1.00 65.14 N ATOM 1984 CA ARG A 134 -5.946 5.473 -0.480 1.00 4.22 C ATOM 1985 C ARG A 134 -5.376 4.175 -0.980 1.00 73.32 C ATOM 1986 O ARG A 134 -5.336 3.933 -2.187 1.00 50.42 O ATOM 1987 CB ARG A 134 -7.431 5.548 -0.814 1.00 64.04 C ATOM 1988 CG ARG A 134 -8.254 4.483 -0.092 1.00 24.20 C ATOM 1989 CD ARG A 134 -9.704 4.503 -0.523 1.00 14.53 C ATOM 1990 NE ARG A 134 -10.325 5.815 -0.325 1.00 13.20 N ATOM 1991 CZ ARG A 134 -11.593 6.110 -0.632 1.00 43.24 C ATOM 1992 NH1 ARG A 134 -12.416 5.156 -1.094 1.00 14.14 N ATOM 1993 NH2 ARG A 134 -12.039 7.349 -0.463 1.00 12.24 N ATOM 0 H ARG A 134 -5.150 6.553 -2.071 1.00 65.14 H new ATOM 0 HA ARG A 134 -5.859 5.540 0.604 1.00 4.22 H new ATOM 0 HB2 ARG A 134 -7.809 6.535 -0.548 1.00 64.04 H new ATOM 0 HB3 ARG A 134 -7.563 5.435 -1.890 1.00 64.04 H new ATOM 0 HG2 ARG A 134 -7.829 3.499 -0.291 1.00 24.20 H new ATOM 0 HG3 ARG A 134 -8.193 4.645 0.984 1.00 24.20 H new ATOM 0 HD2 ARG A 134 -9.772 4.227 -1.575 1.00 14.53 H new ATOM 0 HD3 ARG A 134 -10.258 3.752 0.040 1.00 14.53 H new ATOM 0 HE ARG A 134 -9.750 6.556 0.075 1.00 13.20 H new ATOM 0 HH11 ARG A 134 -12.075 4.202 -1.212 1.00 14.14 H new ATOM 0 HH12 ARG A 134 -13.382 5.385 -1.327 1.00 14.14 H new ATOM 0 HH21 ARG A 134 -11.416 8.070 -0.101 1.00 12.24 H new ATOM 0 HH22 ARG A 134 -13.005 7.579 -0.696 1.00 12.24 H new ATOM 2007 N LEU A 135 -4.925 3.376 -0.072 1.00 14.51 N ATOM 2008 CA LEU A 135 -4.364 2.095 -0.360 1.00 11.52 C ATOM 2009 C LEU A 135 -5.274 1.064 0.234 1.00 4.11 C ATOM 2010 O LEU A 135 -5.774 1.245 1.338 1.00 64.11 O ATOM 2011 CB LEU A 135 -2.972 1.909 0.294 1.00 4.21 C ATOM 2012 CG LEU A 135 -1.833 2.879 -0.073 1.00 25.12 C ATOM 2013 CD1 LEU A 135 -1.646 2.992 -1.563 1.00 50.41 C ATOM 2014 CD2 LEU A 135 -1.982 4.246 0.588 1.00 33.50 C ATOM 0 H LEU A 135 -4.936 3.602 0.923 1.00 14.51 H new ATOM 0 HA LEU A 135 -4.256 2.001 -1.441 1.00 11.52 H new ATOM 0 HB2 LEU A 135 -3.108 1.957 1.374 1.00 4.21 H new ATOM 0 HB3 LEU A 135 -2.632 0.900 0.060 1.00 4.21 H new ATOM 0 HG LEU A 135 -0.921 2.442 0.334 1.00 25.12 H new ATOM 0 HD11 LEU A 135 -0.833 3.686 -1.776 1.00 50.41 H new ATOM 0 HD12 LEU A 135 -1.404 2.012 -1.975 1.00 50.41 H new ATOM 0 HD13 LEU A 135 -2.566 3.360 -2.018 1.00 50.41 H new ATOM 0 HD21 LEU A 135 -1.151 4.886 0.292 1.00 33.50 H new ATOM 0 HD22 LEU A 135 -2.921 4.702 0.273 1.00 33.50 H new ATOM 0 HD23 LEU A 135 -1.981 4.128 1.672 1.00 33.50 H new ATOM 2026 N VAL A 136 -5.508 0.025 -0.475 1.00 40.13 N ATOM 2027 CA VAL A 136 -6.296 -1.068 0.043 1.00 22.43 C ATOM 2028 C VAL A 136 -5.406 -2.285 0.096 1.00 53.21 C ATOM 2029 O VAL A 136 -4.752 -2.618 -0.901 1.00 72.15 O ATOM 2030 CB VAL A 136 -7.564 -1.362 -0.811 1.00 41.22 C ATOM 2031 CG1 VAL A 136 -8.369 -2.503 -0.201 1.00 40.35 C ATOM 2032 CG2 VAL A 136 -8.436 -0.119 -0.929 1.00 50.14 C ATOM 0 H VAL A 136 -5.169 -0.108 -1.428 1.00 40.13 H new ATOM 0 HA VAL A 136 -6.661 -0.797 1.034 1.00 22.43 H new ATOM 0 HB VAL A 136 -7.236 -1.655 -1.808 1.00 41.22 H new ATOM 0 HG11 VAL A 136 -9.251 -2.693 -0.812 1.00 40.35 H new ATOM 0 HG12 VAL A 136 -7.754 -3.402 -0.162 1.00 40.35 H new ATOM 0 HG13 VAL A 136 -8.679 -2.231 0.808 1.00 40.35 H new ATOM 0 HG21 VAL A 136 -9.316 -0.348 -1.530 1.00 50.14 H new ATOM 0 HG22 VAL A 136 -8.748 0.202 0.065 1.00 50.14 H new ATOM 0 HG23 VAL A 136 -7.868 0.680 -1.406 1.00 50.14 H new ATOM 2042 N PHE A 137 -5.341 -2.907 1.236 1.00 53.34 N ATOM 2043 CA PHE A 137 -4.469 -4.036 1.432 1.00 41.45 C ATOM 2044 C PHE A 137 -5.214 -5.346 1.219 1.00 64.12 C ATOM 2045 O PHE A 137 -6.267 -5.587 1.823 1.00 24.30 O ATOM 2046 CB PHE A 137 -3.862 -3.975 2.832 1.00 75.21 C ATOM 2047 CG PHE A 137 -2.917 -5.094 3.152 1.00 12.31 C ATOM 2048 CD1 PHE A 137 -1.688 -5.176 2.531 1.00 72.32 C ATOM 2049 CD2 PHE A 137 -3.248 -6.046 4.095 1.00 3.04 C ATOM 2050 CE1 PHE A 137 -0.811 -6.182 2.848 1.00 12.15 C ATOM 2051 CE2 PHE A 137 -2.378 -7.059 4.413 1.00 3.51 C ATOM 2052 CZ PHE A 137 -1.161 -7.126 3.794 1.00 63.12 C ATOM 0 H PHE A 137 -5.888 -2.650 2.057 1.00 53.34 H new ATOM 0 HA PHE A 137 -3.667 -3.994 0.695 1.00 41.45 H new ATOM 0 HB2 PHE A 137 -3.334 -3.028 2.944 1.00 75.21 H new ATOM 0 HB3 PHE A 137 -4.669 -3.978 3.564 1.00 75.21 H new ATOM 0 HD1 PHE A 137 -1.414 -4.441 1.788 1.00 72.32 H new ATOM 0 HD2 PHE A 137 -4.206 -5.993 4.590 1.00 3.04 H new ATOM 0 HE1 PHE A 137 0.151 -6.236 2.359 1.00 12.15 H new ATOM 0 HE2 PHE A 137 -2.654 -7.800 5.149 1.00 3.51 H new ATOM 0 HZ PHE A 137 -0.472 -7.919 4.045 1.00 63.12 H new ATOM 2062 N LEU A 138 -4.672 -6.179 0.368 1.00 14.10 N ATOM 2063 CA LEU A 138 -5.239 -7.472 0.073 1.00 75.40 C ATOM 2064 C LEU A 138 -4.172 -8.534 0.259 1.00 65.24 C ATOM 2065 O LEU A 138 -2.980 -8.230 0.269 1.00 61.12 O ATOM 2066 CB LEU A 138 -5.816 -7.580 -1.364 1.00 21.12 C ATOM 2067 CG LEU A 138 -7.039 -6.716 -1.757 1.00 20.21 C ATOM 2068 CD1 LEU A 138 -8.176 -6.832 -0.751 1.00 21.43 C ATOM 2069 CD2 LEU A 138 -6.658 -5.267 -2.024 1.00 43.34 C ATOM 0 H LEU A 138 -3.814 -5.977 -0.146 1.00 14.10 H new ATOM 0 HA LEU A 138 -6.072 -7.618 0.761 1.00 75.40 H new ATOM 0 HB2 LEU A 138 -5.011 -7.343 -2.059 1.00 21.12 H new ATOM 0 HB3 LEU A 138 -6.085 -8.623 -1.532 1.00 21.12 H new ATOM 0 HG LEU A 138 -7.413 -7.121 -2.698 1.00 20.21 H new ATOM 0 HD11 LEU A 138 -9.010 -6.208 -1.071 1.00 21.43 H new ATOM 0 HD12 LEU A 138 -8.502 -7.870 -0.689 1.00 21.43 H new ATOM 0 HD13 LEU A 138 -7.830 -6.501 0.228 1.00 21.43 H new ATOM 0 HD21 LEU A 138 -7.549 -4.701 -2.296 1.00 43.34 H new ATOM 0 HD22 LEU A 138 -6.214 -4.836 -1.127 1.00 43.34 H new ATOM 0 HD23 LEU A 138 -5.938 -5.225 -2.841 1.00 43.34 H new ATOM 2081 N ALA A 139 -4.583 -9.763 0.432 1.00 30.41 N ATOM 2082 CA ALA A 139 -3.636 -10.848 0.555 1.00 10.41 C ATOM 2083 C ALA A 139 -3.055 -11.164 -0.824 1.00 65.45 C ATOM 2084 O ALA A 139 -3.707 -10.917 -1.852 1.00 23.23 O ATOM 2085 CB ALA A 139 -4.312 -12.073 1.151 1.00 73.42 C ATOM 0 H ALA A 139 -5.563 -10.040 0.491 1.00 30.41 H new ATOM 0 HA ALA A 139 -2.827 -10.554 1.224 1.00 10.41 H new ATOM 0 HB1 ALA A 139 -3.587 -12.882 1.238 1.00 73.42 H new ATOM 0 HB2 ALA A 139 -4.703 -11.828 2.139 1.00 73.42 H new ATOM 0 HB3 ALA A 139 -5.131 -12.387 0.504 1.00 73.42 H new ATOM 2091 N GLY A 140 -1.830 -11.664 -0.848 1.00 63.05 N ATOM 2092 CA GLY A 140 -1.167 -11.960 -2.098 1.00 42.51 C ATOM 2093 C GLY A 140 -1.803 -13.128 -2.822 1.00 24.24 C ATOM 2094 O GLY A 140 -2.430 -13.983 -2.177 1.00 10.34 O ATOM 0 H GLY A 140 -1.279 -11.872 -0.015 1.00 63.05 H new ATOM 0 HA2 GLY A 140 -1.195 -11.079 -2.739 1.00 42.51 H new ATOM 0 HA3 GLY A 140 -0.117 -12.182 -1.906 1.00 42.51 H new ATOM 2098 N PRO A 141 -1.659 -13.207 -4.150 1.00 1.12 N ATOM 2099 CA PRO A 141 -2.264 -14.266 -4.938 1.00 65.03 C ATOM 2100 C PRO A 141 -1.578 -15.601 -4.698 1.00 1.21 C ATOM 2101 O PRO A 141 -0.354 -15.665 -4.547 1.00 53.23 O ATOM 2102 CB PRO A 141 -2.054 -13.822 -6.399 1.00 41.42 C ATOM 2103 CG PRO A 141 -1.523 -12.429 -6.329 1.00 75.15 C ATOM 2104 CD PRO A 141 -0.873 -12.296 -4.991 1.00 54.32 C ATOM 0 HA PRO A 141 -3.313 -14.411 -4.680 1.00 65.03 H new ATOM 0 HB2 PRO A 141 -1.354 -14.482 -6.911 1.00 41.42 H new ATOM 0 HB3 PRO A 141 -2.990 -13.856 -6.956 1.00 41.42 H new ATOM 0 HG2 PRO A 141 -0.806 -12.245 -7.130 1.00 75.15 H new ATOM 0 HG3 PRO A 141 -2.325 -11.701 -6.446 1.00 75.15 H new ATOM 0 HD2 PRO A 141 0.178 -12.582 -5.023 1.00 54.32 H new ATOM 0 HD3 PRO A 141 -0.913 -11.271 -4.623 1.00 54.32 H new ATOM 2112 N ALA A 142 -2.350 -16.652 -4.681 1.00 74.11 N ATOM 2113 CA ALA A 142 -1.833 -17.980 -4.495 1.00 54.53 C ATOM 2114 C ALA A 142 -1.843 -18.653 -5.841 1.00 23.13 C ATOM 2115 O ALA A 142 -2.643 -19.557 -6.125 1.00 20.13 O ATOM 2116 CB ALA A 142 -2.641 -18.762 -3.465 1.00 33.51 C ATOM 0 H ALA A 142 -3.363 -16.611 -4.797 1.00 74.11 H new ATOM 0 HA ALA A 142 -0.818 -17.939 -4.100 1.00 54.53 H new ATOM 0 HB1 ALA A 142 -2.219 -19.761 -3.353 1.00 33.51 H new ATOM 0 HB2 ALA A 142 -2.607 -18.244 -2.507 1.00 33.51 H new ATOM 0 HB3 ALA A 142 -3.676 -18.841 -3.798 1.00 33.51 H new ATOM 2122 N GLU A 143 -1.042 -18.115 -6.692 1.00 65.54 N ATOM 2123 CA GLU A 143 -0.936 -18.546 -8.047 1.00 24.03 C ATOM 2124 C GLU A 143 0.484 -18.992 -8.298 1.00 2.11 C ATOM 2125 O GLU A 143 0.726 -20.204 -8.396 1.00 37.84 O ATOM 2126 CB GLU A 143 -1.320 -17.393 -8.969 1.00 62.23 C ATOM 2127 CG GLU A 143 -1.353 -17.729 -10.445 1.00 34.23 C ATOM 2128 CD GLU A 143 -1.744 -16.542 -11.273 1.00 40.44 C ATOM 2129 OE1 GLU A 143 -2.950 -16.268 -11.412 1.00 23.20 O ATOM 2130 OE2 GLU A 143 -0.853 -15.838 -11.789 1.00 3.51 O ATOM 2131 OXT GLU A 143 1.387 -18.131 -8.327 1.00 37.84 O ATOM 0 H GLU A 143 -0.422 -17.339 -6.460 1.00 65.54 H new ATOM 0 HA GLU A 143 -1.609 -19.381 -8.244 1.00 24.03 H new ATOM 0 HB2 GLU A 143 -2.303 -17.026 -8.675 1.00 62.23 H new ATOM 0 HB3 GLU A 143 -0.615 -16.576 -8.815 1.00 62.23 H new ATOM 0 HG2 GLU A 143 -0.372 -18.085 -10.760 1.00 34.23 H new ATOM 0 HG3 GLU A 143 -2.058 -18.542 -10.618 1.00 34.23 H new