USER MOD reduce.3.24.130724 H: found=0, std=0, add=976, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 829 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 476 ASN : amide:sc= -9.57! C(o=-17!,f=-22!) USER MOD Set 1.2: A 480 GLN : amide:sc= -7.13! C(o=-17!,f=-22!) USER MOD Set 2.1: A 443 GLN : amide:sc= -5.18! K(o=-5.5!,f=-1.7) USER MOD Set 2.2: A 475 SER OG : rot 170:sc= -0.308 USER MOD Set 3.1: A 462 CYS SG : rot -95:sc= -2.5! USER MOD Set 3.2: A 503 THR OG1 : rot -71:sc= 0.807 USER MOD Set 4.1: A 458 SER OG : rot -139:sc= 2.35 USER MOD Set 4.2: A 494 SER OG : rot -73:sc= 0.409 USER MOD Set 4.3: A 498 GLN : amide:sc= 0.984 K(o=3.7,f=-1.4) USER MOD Single : A 395 TYR OH : rot 180:sc= 0 USER MOD Single : A 396 ASN : amide:sc= -13.7! C(o=-14!,f=-12!) USER MOD Single : A 401 HIS : no HD1:sc= -10.6! C(o=-11!,f=-12!) USER MOD Single : A 407 HIS : no HD1:sc= -2.6! X(o=-2.6!,f=-2.7) USER MOD Single : A 415 LYS NZ :NH3+ -144:sc= -2.97! (180deg=-6.14!) USER MOD Single : A 426 THR OG1 : rot 180:sc= 0 USER MOD Single : A 448 HIS : no HD1:sc= -6.12! C(o=-6.1!,f=-3.7!) USER MOD Single : A 449 SER OG : rot -82:sc= -0.0197 USER MOD Single : A 457 THR OG1 : rot 180:sc= 0 USER MOD Single : A 459 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 465 SER OG : rot -55:sc= -3.63! USER MOD Single : A 467 HIS : no HE2:sc= -0.989! C(o=-0.99!,f=-3.8!) USER MOD Single : A 468 GLN : amide:sc= -0.0301 X(o=-0.03,f=-0.03) USER MOD Single : A 470 ASN : amide:sc= -0.687 K(o=-0.69,f=-0.005) USER MOD Single : A 471 GLN : amide:sc= -1.37 K(o=-1.4,f=-0.14) USER MOD Single : A 473 MET CE :methyl -153:sc= -10.7! (180deg=-13.4!) USER MOD Single : A 474 MET CE :methyl -125:sc= -2.97 (180deg=-4.15!) USER MOD Single : A 478 THR OG1 : rot -5:sc= 0.793 USER MOD Single : A 482 SER OG : rot 62:sc= 0.137 USER MOD Single : A 485 CYS SG : rot -115:sc= 0.527 USER MOD Single : A 495 SER OG : rot 180:sc= 0 USER MOD Single : A 500 SER OG : rot -133:sc= 0.148 USER MOD Single : A 501 SER OG : rot 180:sc= 0 USER MOD Single : A 505 SER OG : rot 180:sc= 0 USER MOD Single : A 508 SER OG : rot 47:sc= -1.88 USER MOD Single : A 516 HIS : no HD1:sc= -2.2 X(o=-2.2,f=-2.3!) USER MOD Single : A 517 SER OG : rot 160:sc= -1.04 USER MOD Single : A 518 GLN : amide:sc= -1.84 K(o=-1.8,f=-2.6!) USER MOD Single : A 523 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 526 ASN : amide:sc= -2.62! C(o=-2.6!,f=-4.5!) USER MOD Single : A 527 THR OG1 : rot -63:sc= -0.151 USER MOD Single : A 529 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 531 HIS : no HD1:sc= -14! C(o=-14!,f=-14!) USER MOD ----------------------------------------------------------------- ATOM 125 N TYR A 395 4.280 8.889 4.132 1.00 25.25 N ATOM 126 CA TYR A 395 3.758 7.607 3.689 1.00 2.52 C ATOM 127 C TYR A 395 4.402 7.180 2.369 1.00 2.20 C ATOM 128 O TYR A 395 4.538 7.987 1.450 1.00 2.33 O ATOM 129 CB TYR A 395 2.259 7.815 3.468 1.00 45.24 C ATOM 130 CG TYR A 395 1.466 8.040 4.757 1.00 2.33 C ATOM 131 CD1 TYR A 395 2.103 7.982 5.980 1.00 23.31 C ATOM 132 CD2 TYR A 395 0.112 8.301 4.697 1.00 13.34 C ATOM 133 CE1 TYR A 395 1.356 8.193 7.193 1.00 31.31 C ATOM 134 CE2 TYR A 395 -0.635 8.514 5.910 1.00 3.34 C ATOM 135 CZ TYR A 395 0.025 8.449 7.098 1.00 15.13 C ATOM 136 OH TYR A 395 -0.682 8.649 8.243 1.00 30.31 O ATOM 0 HA TYR A 395 3.968 6.832 4.426 1.00 2.52 H new ATOM 0 HB2 TYR A 395 2.114 8.672 2.810 1.00 45.24 H new ATOM 0 HB3 TYR A 395 1.854 6.945 2.951 1.00 45.24 H new ATOM 0 HD1 TYR A 395 3.163 7.778 6.027 1.00 23.31 H new ATOM 0 HD2 TYR A 395 -0.387 8.346 3.740 1.00 13.34 H new ATOM 0 HE1 TYR A 395 1.843 8.149 8.156 1.00 31.31 H new ATOM 0 HE2 TYR A 395 -1.695 8.721 5.877 1.00 3.34 H new ATOM 0 HH TYR A 395 -1.621 8.822 8.022 1.00 30.31 H new ATOM 145 N ASN A 396 4.782 5.910 2.315 1.00 52.24 N ATOM 146 CA ASN A 396 5.407 5.367 1.122 1.00 41.41 C ATOM 147 C ASN A 396 4.478 4.326 0.494 1.00 23.50 C ATOM 148 O ASN A 396 4.706 3.884 -0.631 1.00 54.10 O ATOM 149 CB ASN A 396 6.731 4.678 1.460 1.00 2.33 C ATOM 150 CG ASN A 396 7.158 3.730 0.337 1.00 53.03 C ATOM 151 OD1 ASN A 396 7.233 2.524 0.502 1.00 13.35 O ATOM 152 ND2 ASN A 396 7.434 4.342 -0.811 1.00 65.54 N ATOM 0 H ASN A 396 4.668 5.243 3.078 1.00 52.24 H new ATOM 0 HA ASN A 396 5.595 6.191 0.434 1.00 41.41 H new ATOM 0 HB2 ASN A 396 7.505 5.428 1.621 1.00 2.33 H new ATOM 0 HB3 ASN A 396 6.628 4.121 2.391 1.00 2.33 H new ATOM 0 HD21 ASN A 396 7.729 3.797 -1.621 1.00 65.54 H new ATOM 0 HD22 ASN A 396 7.351 5.356 -0.881 1.00 65.54 H new ATOM 158 N PHE A 397 3.452 3.963 1.249 1.00 13.13 N ATOM 159 CA PHE A 397 2.488 2.982 0.780 1.00 12.00 C ATOM 160 C PHE A 397 1.335 2.828 1.774 1.00 23.03 C ATOM 161 O PHE A 397 1.530 2.958 2.982 1.00 4.04 O ATOM 162 CB PHE A 397 3.229 1.647 0.665 1.00 41.12 C ATOM 163 CG PHE A 397 3.832 1.155 1.982 1.00 63.34 C ATOM 164 CD1 PHE A 397 4.884 1.816 2.536 1.00 40.40 C ATOM 165 CD2 PHE A 397 3.317 0.058 2.598 1.00 13.54 C ATOM 166 CE1 PHE A 397 5.445 1.359 3.759 1.00 14.40 C ATOM 167 CE2 PHE A 397 3.878 -0.399 3.819 1.00 4.45 C ATOM 168 CZ PHE A 397 4.930 0.261 4.375 1.00 41.21 C ATOM 0 H PHE A 397 3.267 4.330 2.182 1.00 13.13 H new ATOM 0 HA PHE A 397 2.069 3.299 -0.175 1.00 12.00 H new ATOM 0 HB2 PHE A 397 2.539 0.892 0.288 1.00 41.12 H new ATOM 0 HB3 PHE A 397 4.025 1.748 -0.072 1.00 41.12 H new ATOM 0 HD1 PHE A 397 5.293 2.688 2.047 1.00 40.40 H new ATOM 0 HD2 PHE A 397 2.481 -0.466 2.158 1.00 13.54 H new ATOM 0 HE1 PHE A 397 6.280 1.883 4.199 1.00 14.40 H new ATOM 0 HE2 PHE A 397 3.470 -1.271 4.307 1.00 4.45 H new ATOM 0 HZ PHE A 397 5.356 -0.087 5.305 1.00 41.21 H new ATOM 177 N VAL A 398 0.159 2.553 1.229 1.00 41.11 N ATOM 178 CA VAL A 398 -1.026 2.380 2.053 1.00 64.44 C ATOM 179 C VAL A 398 -1.486 0.922 1.977 1.00 74.23 C ATOM 180 O VAL A 398 -1.993 0.482 0.947 1.00 4.33 O ATOM 181 CB VAL A 398 -2.109 3.372 1.626 1.00 71.12 C ATOM 182 CG1 VAL A 398 -3.505 2.827 1.934 1.00 41.03 C ATOM 183 CG2 VAL A 398 -1.895 4.736 2.288 1.00 61.41 C ATOM 0 H VAL A 398 0.001 2.446 0.227 1.00 41.11 H new ATOM 0 HA VAL A 398 -0.800 2.596 3.097 1.00 64.44 H new ATOM 0 HB VAL A 398 -2.033 3.507 0.547 1.00 71.12 H new ATOM 0 HG11 VAL A 398 -4.256 3.552 1.620 1.00 41.03 H new ATOM 0 HG12 VAL A 398 -3.657 1.891 1.396 1.00 41.03 H new ATOM 0 HG13 VAL A 398 -3.598 2.649 3.005 1.00 41.03 H new ATOM 0 HG21 VAL A 398 -2.678 5.423 1.968 1.00 61.41 H new ATOM 0 HG22 VAL A 398 -1.931 4.624 3.372 1.00 61.41 H new ATOM 0 HG23 VAL A 398 -0.923 5.133 1.997 1.00 61.41 H new ATOM 193 N ILE A 399 -1.292 0.216 3.080 1.00 5.34 N ATOM 194 CA ILE A 399 -1.682 -1.182 3.151 1.00 62.53 C ATOM 195 C ILE A 399 -3.205 -1.278 3.246 1.00 22.14 C ATOM 196 O ILE A 399 -3.765 -1.252 4.342 1.00 72.41 O ATOM 197 CB ILE A 399 -0.947 -1.884 4.295 1.00 11.44 C ATOM 198 CG1 ILE A 399 0.569 -1.765 4.130 1.00 52.12 C ATOM 199 CG2 ILE A 399 -1.397 -3.341 4.421 1.00 5.55 C ATOM 200 CD1 ILE A 399 1.303 -2.533 5.231 1.00 22.22 C ATOM 0 H ILE A 399 -0.870 0.585 3.932 1.00 5.34 H new ATOM 0 HA ILE A 399 -1.387 -1.708 2.243 1.00 62.53 H new ATOM 0 HB ILE A 399 -1.208 -1.383 5.227 1.00 11.44 H new ATOM 0 HG12 ILE A 399 0.863 -2.151 3.154 1.00 52.12 H new ATOM 0 HG13 ILE A 399 0.860 -0.715 4.158 1.00 52.12 H new ATOM 0 HG21 ILE A 399 -0.860 -3.818 5.241 1.00 5.55 H new ATOM 0 HG22 ILE A 399 -2.468 -3.375 4.620 1.00 5.55 H new ATOM 0 HG23 ILE A 399 -1.184 -3.869 3.492 1.00 5.55 H new ATOM 0 HD11 ILE A 399 2.379 -2.432 5.090 1.00 22.22 H new ATOM 0 HD12 ILE A 399 1.025 -2.128 6.204 1.00 22.22 H new ATOM 0 HD13 ILE A 399 1.029 -3.587 5.184 1.00 22.22 H new ATOM 211 N LEU A 400 -3.833 -1.390 2.085 1.00 73.44 N ATOM 212 CA LEU A 400 -5.282 -1.489 2.025 1.00 33.32 C ATOM 213 C LEU A 400 -5.708 -2.901 2.438 1.00 71.24 C ATOM 214 O LEU A 400 -5.653 -3.830 1.635 1.00 34.41 O ATOM 215 CB LEU A 400 -5.789 -1.074 0.643 1.00 54.53 C ATOM 216 CG LEU A 400 -7.113 -1.700 0.198 1.00 50.34 C ATOM 217 CD1 LEU A 400 -8.080 -1.830 1.377 1.00 25.23 C ATOM 218 CD2 LEU A 400 -7.729 -0.916 -0.962 1.00 70.32 C ATOM 0 H LEU A 400 -3.366 -1.414 1.179 1.00 73.44 H new ATOM 0 HA LEU A 400 -5.742 -0.796 2.730 1.00 33.32 H new ATOM 0 HB2 LEU A 400 -5.900 0.010 0.629 1.00 54.53 H new ATOM 0 HB3 LEU A 400 -5.025 -1.326 -0.093 1.00 54.53 H new ATOM 0 HG LEU A 400 -6.909 -2.707 -0.166 1.00 50.34 H new ATOM 0 HD11 LEU A 400 -9.013 -2.277 1.035 1.00 25.23 H new ATOM 0 HD12 LEU A 400 -7.635 -2.463 2.145 1.00 25.23 H new ATOM 0 HD13 LEU A 400 -8.282 -0.843 1.792 1.00 25.23 H new ATOM 0 HD21 LEU A 400 -8.669 -1.382 -1.258 1.00 70.32 H new ATOM 0 HD22 LEU A 400 -7.917 0.111 -0.648 1.00 70.32 H new ATOM 0 HD23 LEU A 400 -7.041 -0.917 -1.808 1.00 70.32 H new ATOM 229 N HIS A 401 -6.124 -3.014 3.691 1.00 22.11 N ATOM 230 CA HIS A 401 -6.559 -4.295 4.220 1.00 30.31 C ATOM 231 C HIS A 401 -7.893 -4.122 4.950 1.00 64.03 C ATOM 232 O HIS A 401 -8.540 -3.082 4.832 1.00 75.50 O ATOM 233 CB HIS A 401 -5.475 -4.915 5.105 1.00 50.12 C ATOM 234 CG HIS A 401 -5.303 -4.227 6.438 1.00 54.24 C ATOM 235 ND1 HIS A 401 -5.956 -4.640 7.586 1.00 13.30 N ATOM 236 CD2 HIS A 401 -4.545 -3.150 6.793 1.00 45.20 C ATOM 237 CE1 HIS A 401 -5.600 -3.841 8.581 1.00 14.22 C ATOM 238 NE2 HIS A 401 -4.726 -2.918 8.088 1.00 1.10 N ATOM 0 H HIS A 401 -6.169 -2.240 4.354 1.00 22.11 H new ATOM 0 HA HIS A 401 -6.720 -4.995 3.400 1.00 30.31 H new ATOM 0 HB2 HIS A 401 -5.717 -5.964 5.277 1.00 50.12 H new ATOM 0 HB3 HIS A 401 -4.526 -4.891 4.570 1.00 50.12 H new ATOM 0 HD2 HIS A 401 -3.906 -2.582 6.133 1.00 45.20 H new ATOM 0 HE1 HIS A 401 -5.942 -3.909 9.603 1.00 14.22 H new ATOM 0 HE2 HIS A 401 -4.284 -2.172 8.625 1.00 1.10 H new ATOM 246 N ALA A 402 -8.264 -5.156 5.690 1.00 13.43 N ATOM 247 CA ALA A 402 -9.510 -5.131 6.440 1.00 73.04 C ATOM 248 C ALA A 402 -9.275 -4.447 7.788 1.00 30.31 C ATOM 249 O ALA A 402 -8.242 -3.809 7.993 1.00 1.24 O ATOM 250 CB ALA A 402 -10.041 -6.558 6.594 1.00 62.35 C ATOM 0 H ALA A 402 -7.725 -6.016 5.787 1.00 13.43 H new ATOM 0 HA ALA A 402 -10.268 -4.557 5.907 1.00 73.04 H new ATOM 0 HB1 ALA A 402 -10.975 -6.540 7.156 1.00 62.35 H new ATOM 0 HB2 ALA A 402 -10.219 -6.988 5.608 1.00 62.35 H new ATOM 0 HB3 ALA A 402 -9.308 -7.163 7.127 1.00 62.35 H new ATOM 256 N ARG A 403 -10.247 -4.605 8.673 1.00 43.12 N ATOM 257 CA ARG A 403 -10.160 -4.010 9.996 1.00 2.24 C ATOM 258 C ARG A 403 -9.708 -5.055 11.018 1.00 33.51 C ATOM 259 O ARG A 403 -9.400 -4.718 12.160 1.00 62.40 O ATOM 260 CB ARG A 403 -11.507 -3.432 10.431 1.00 40.40 C ATOM 261 CG ARG A 403 -11.318 -2.302 11.444 1.00 54.43 C ATOM 262 CD ARG A 403 -11.710 -2.755 12.852 1.00 73.31 C ATOM 263 NE ARG A 403 -12.193 -1.600 13.641 1.00 34.13 N ATOM 264 CZ ARG A 403 -12.153 -1.533 14.988 1.00 61.21 C ATOM 265 NH1 ARG A 403 -11.650 -2.556 15.709 1.00 4.12 N ATOM 266 NH2 ARG A 403 -12.613 -0.451 15.589 1.00 43.40 N ATOM 0 H ARG A 403 -11.100 -5.137 8.500 1.00 43.12 H new ATOM 0 HA ARG A 403 -9.430 -3.202 9.948 1.00 2.24 H new ATOM 0 HB2 ARG A 403 -12.044 -3.058 9.560 1.00 40.40 H new ATOM 0 HB3 ARG A 403 -12.120 -4.219 10.870 1.00 40.40 H new ATOM 0 HG2 ARG A 403 -10.278 -1.975 11.440 1.00 54.43 H new ATOM 0 HG3 ARG A 403 -11.923 -1.443 11.153 1.00 54.43 H new ATOM 0 HD2 ARG A 403 -12.488 -3.517 12.794 1.00 73.31 H new ATOM 0 HD3 ARG A 403 -10.853 -3.211 13.348 1.00 73.31 H new ATOM 0 HE ARG A 403 -12.581 -0.804 13.134 1.00 34.13 H new ATOM 0 HH11 ARG A 403 -11.296 -3.388 15.236 1.00 4.12 H new ATOM 0 HH12 ARG A 403 -11.623 -2.498 16.727 1.00 4.12 H new ATOM 0 HH21 ARG A 403 -12.991 0.318 15.036 1.00 43.40 H new ATOM 0 HH22 ARG A 403 -12.590 -0.384 16.607 1.00 43.40 H new ATOM 276 N ALA A 404 -9.682 -6.302 10.570 1.00 63.22 N ATOM 277 CA ALA A 404 -9.272 -7.398 11.432 1.00 72.34 C ATOM 278 C ALA A 404 -7.887 -7.887 11.002 1.00 4.12 C ATOM 279 O ALA A 404 -7.470 -8.984 11.372 1.00 25.23 O ATOM 280 CB ALA A 404 -10.324 -8.507 11.382 1.00 60.31 C ATOM 0 H ALA A 404 -9.938 -6.578 9.622 1.00 63.22 H new ATOM 0 HA ALA A 404 -9.198 -7.066 12.468 1.00 72.34 H new ATOM 0 HB1 ALA A 404 -10.017 -9.329 12.028 1.00 60.31 H new ATOM 0 HB2 ALA A 404 -11.282 -8.115 11.724 1.00 60.31 H new ATOM 0 HB3 ALA A 404 -10.424 -8.868 10.358 1.00 60.31 H new ATOM 286 N ASP A 405 -7.212 -7.050 10.229 1.00 34.52 N ATOM 287 CA ASP A 405 -5.883 -7.385 9.745 1.00 40.11 C ATOM 288 C ASP A 405 -4.919 -6.247 10.089 1.00 32.10 C ATOM 289 O ASP A 405 -3.941 -6.022 9.378 1.00 1.43 O ATOM 290 CB ASP A 405 -5.878 -7.564 8.225 1.00 41.10 C ATOM 291 CG ASP A 405 -5.433 -8.944 7.739 1.00 32.53 C ATOM 292 OD1 ASP A 405 -4.269 -9.143 7.359 1.00 55.33 O ATOM 293 OD2 ASP A 405 -6.349 -9.854 7.761 1.00 42.03 O ATOM 0 H ASP A 405 -7.560 -6.140 9.926 1.00 34.52 H new ATOM 0 HA ASP A 405 -5.577 -8.318 10.219 1.00 40.11 H new ATOM 0 HB2 ASP A 405 -6.882 -7.369 7.848 1.00 41.10 H new ATOM 0 HB3 ASP A 405 -5.221 -6.812 7.788 1.00 41.10 H new ATOM 298 N GLU A 406 -5.229 -5.561 11.179 1.00 21.41 N ATOM 299 CA GLU A 406 -4.402 -4.452 11.626 1.00 15.14 C ATOM 300 C GLU A 406 -2.999 -4.947 11.982 1.00 43.32 C ATOM 301 O GLU A 406 -2.062 -4.777 11.203 1.00 25.23 O ATOM 302 CB GLU A 406 -5.046 -3.731 12.812 1.00 52.11 C ATOM 303 CG GLU A 406 -4.047 -2.795 13.492 1.00 52.44 C ATOM 304 CD GLU A 406 -4.678 -2.106 14.704 1.00 42.12 C ATOM 305 OE1 GLU A 406 -5.192 -0.985 14.583 1.00 63.55 O ATOM 306 OE2 GLU A 406 -4.624 -2.781 15.803 1.00 30.00 O ATOM 0 H GLU A 406 -6.041 -5.751 11.766 1.00 21.41 H new ATOM 0 HA GLU A 406 -4.317 -3.735 10.810 1.00 15.14 H new ATOM 0 HB2 GLU A 406 -5.910 -3.161 12.470 1.00 52.11 H new ATOM 0 HB3 GLU A 406 -5.412 -4.463 13.532 1.00 52.11 H new ATOM 0 HG2 GLU A 406 -3.170 -3.360 13.807 1.00 52.44 H new ATOM 0 HG3 GLU A 406 -3.704 -2.044 12.780 1.00 52.44 H new ATOM 312 N HIS A 407 -2.899 -5.548 13.158 1.00 53.22 N ATOM 313 CA HIS A 407 -1.625 -6.068 13.627 1.00 33.11 C ATOM 314 C HIS A 407 -0.834 -6.630 12.444 1.00 2.03 C ATOM 315 O HIS A 407 0.362 -6.374 12.314 1.00 0.11 O ATOM 316 CB HIS A 407 -1.835 -7.095 14.742 1.00 51.42 C ATOM 317 CG HIS A 407 -2.479 -8.381 14.279 1.00 73.41 C ATOM 318 ND1 HIS A 407 -3.762 -8.433 13.763 1.00 73.33 N ATOM 319 CD2 HIS A 407 -2.003 -9.659 14.260 1.00 44.13 C ATOM 320 CE1 HIS A 407 -4.035 -9.691 13.451 1.00 2.33 C ATOM 321 NE2 HIS A 407 -2.944 -10.449 13.761 1.00 22.13 N ATOM 0 H HIS A 407 -3.679 -5.687 13.801 1.00 53.22 H new ATOM 0 HA HIS A 407 -1.036 -5.261 14.062 1.00 33.11 H new ATOM 0 HB2 HIS A 407 -0.871 -7.326 15.196 1.00 51.42 H new ATOM 0 HB3 HIS A 407 -2.455 -6.650 15.520 1.00 51.42 H new ATOM 0 HD2 HIS A 407 -1.026 -9.974 14.595 1.00 44.13 H new ATOM 0 HE1 HIS A 407 -4.959 -10.053 13.026 1.00 2.33 H new ATOM 0 HE2 HIS A 407 -2.865 -11.458 13.630 1.00 22.13 H new ATOM 328 N ILE A 408 -1.534 -7.386 11.611 1.00 34.42 N ATOM 329 CA ILE A 408 -0.912 -7.986 10.443 1.00 41.50 C ATOM 330 C ILE A 408 -0.209 -6.898 9.629 1.00 51.05 C ATOM 331 O ILE A 408 1.000 -6.966 9.409 1.00 0.33 O ATOM 332 CB ILE A 408 -1.941 -8.787 9.640 1.00 24.13 C ATOM 333 CG1 ILE A 408 -2.430 -10.000 10.434 1.00 42.52 C ATOM 334 CG2 ILE A 408 -1.380 -9.184 8.274 1.00 61.51 C ATOM 335 CD1 ILE A 408 -3.472 -10.790 9.639 1.00 3.04 C ATOM 0 H ILE A 408 -2.526 -7.597 11.722 1.00 34.42 H new ATOM 0 HA ILE A 408 -0.148 -8.703 10.744 1.00 41.50 H new ATOM 0 HB ILE A 408 -2.807 -8.150 9.459 1.00 24.13 H new ATOM 0 HG12 ILE A 408 -1.586 -10.645 10.676 1.00 42.52 H new ATOM 0 HG13 ILE A 408 -2.861 -9.671 11.379 1.00 42.52 H new ATOM 0 HG21 ILE A 408 -2.130 -9.752 7.724 1.00 61.51 H new ATOM 0 HG22 ILE A 408 -1.120 -8.287 7.713 1.00 61.51 H new ATOM 0 HG23 ILE A 408 -0.489 -9.797 8.411 1.00 61.51 H new ATOM 0 HD11 ILE A 408 -3.804 -11.647 10.225 1.00 3.04 H new ATOM 0 HD12 ILE A 408 -4.325 -10.148 9.420 1.00 3.04 H new ATOM 0 HD13 ILE A 408 -3.030 -11.138 8.705 1.00 3.04 H new ATOM 346 N ALA A 409 -0.995 -5.920 9.203 1.00 5.14 N ATOM 347 CA ALA A 409 -0.463 -4.820 8.419 1.00 23.40 C ATOM 348 C ALA A 409 0.679 -4.156 9.190 1.00 63.45 C ATOM 349 O ALA A 409 1.761 -3.943 8.643 1.00 50.25 O ATOM 350 CB ALA A 409 -1.589 -3.839 8.085 1.00 70.12 C ATOM 0 H ALA A 409 -1.997 -5.867 9.387 1.00 5.14 H new ATOM 0 HA ALA A 409 -0.056 -5.183 7.475 1.00 23.40 H new ATOM 0 HB1 ALA A 409 -1.189 -3.013 7.496 1.00 70.12 H new ATOM 0 HB2 ALA A 409 -2.361 -4.353 7.512 1.00 70.12 H new ATOM 0 HB3 ALA A 409 -2.020 -3.451 9.008 1.00 70.12 H new ATOM 356 N LEU A 410 0.402 -3.847 10.447 1.00 1.10 N ATOM 357 CA LEU A 410 1.393 -3.210 11.299 1.00 24.14 C ATOM 358 C LEU A 410 2.597 -4.141 11.454 1.00 71.31 C ATOM 359 O LEU A 410 3.660 -3.715 11.904 1.00 24.53 O ATOM 360 CB LEU A 410 0.766 -2.790 12.630 1.00 13.23 C ATOM 361 CG LEU A 410 -0.082 -1.517 12.599 1.00 74.34 C ATOM 362 CD1 LEU A 410 -1.334 -1.713 11.740 1.00 54.24 C ATOM 363 CD2 LEU A 410 -0.426 -1.052 14.016 1.00 15.33 C ATOM 0 H LEU A 410 -0.495 -4.026 10.898 1.00 1.10 H new ATOM 0 HA LEU A 410 1.756 -2.290 10.840 1.00 24.14 H new ATOM 0 HB2 LEU A 410 0.143 -3.609 12.990 1.00 13.23 H new ATOM 0 HB3 LEU A 410 1.565 -2.653 13.358 1.00 13.23 H new ATOM 0 HG LEU A 410 0.507 -0.726 12.135 1.00 74.34 H new ATOM 0 HD11 LEU A 410 -1.919 -0.793 11.735 1.00 54.24 H new ATOM 0 HD12 LEU A 410 -1.040 -1.962 10.720 1.00 54.24 H new ATOM 0 HD13 LEU A 410 -1.935 -2.523 12.153 1.00 54.24 H new ATOM 0 HD21 LEU A 410 -1.029 -0.146 13.965 1.00 15.33 H new ATOM 0 HD22 LEU A 410 -0.987 -1.833 14.529 1.00 15.33 H new ATOM 0 HD23 LEU A 410 0.493 -0.846 14.564 1.00 15.33 H new ATOM 374 N ARG A 411 2.391 -5.393 11.073 1.00 34.34 N ATOM 375 CA ARG A 411 3.447 -6.387 11.163 1.00 62.31 C ATOM 376 C ARG A 411 4.389 -6.272 9.963 1.00 50.11 C ATOM 377 O ARG A 411 5.516 -6.763 10.003 1.00 21.41 O ATOM 378 CB ARG A 411 2.869 -7.803 11.215 1.00 54.24 C ATOM 379 CG ARG A 411 3.833 -8.763 11.914 1.00 74.15 C ATOM 380 CD ARG A 411 3.208 -10.151 12.067 1.00 32.32 C ATOM 381 NE ARG A 411 3.460 -10.956 10.850 1.00 60.32 N ATOM 382 CZ ARG A 411 4.657 -11.489 10.530 1.00 42.11 C ATOM 383 NH1 ARG A 411 5.726 -11.307 11.334 1.00 60.50 N ATOM 384 NH2 ARG A 411 4.768 -12.191 9.417 1.00 63.10 N ATOM 0 H ARG A 411 1.508 -5.742 10.701 1.00 34.34 H new ATOM 0 HA ARG A 411 4.001 -6.199 12.083 1.00 62.31 H new ATOM 0 HB2 ARG A 411 1.915 -7.791 11.743 1.00 54.24 H new ATOM 0 HB3 ARG A 411 2.669 -8.155 10.203 1.00 54.24 H new ATOM 0 HG2 ARG A 411 4.757 -8.837 11.341 1.00 74.15 H new ATOM 0 HG3 ARG A 411 4.097 -8.369 12.895 1.00 74.15 H new ATOM 0 HD2 ARG A 411 3.627 -10.654 12.939 1.00 32.32 H new ATOM 0 HD3 ARG A 411 2.135 -10.059 12.237 1.00 32.32 H new ATOM 0 HE ARG A 411 2.679 -11.118 10.214 1.00 60.32 H new ATOM 0 HH11 ARG A 411 5.632 -10.763 12.192 1.00 60.50 H new ATOM 0 HH12 ARG A 411 6.627 -11.714 11.084 1.00 60.50 H new ATOM 0 HH21 ARG A 411 3.956 -12.323 8.814 1.00 63.10 H new ATOM 0 HH22 ARG A 411 5.666 -12.601 9.160 1.00 63.10 H new ATOM 394 N VAL A 412 3.892 -5.620 8.921 1.00 3.33 N ATOM 395 CA VAL A 412 4.674 -5.435 7.712 1.00 30.43 C ATOM 396 C VAL A 412 5.370 -4.073 7.762 1.00 74.24 C ATOM 397 O VAL A 412 6.584 -3.985 7.592 1.00 24.05 O ATOM 398 CB VAL A 412 3.782 -5.606 6.480 1.00 72.34 C ATOM 399 CG1 VAL A 412 4.406 -4.935 5.254 1.00 11.52 C ATOM 400 CG2 VAL A 412 3.498 -7.085 6.211 1.00 34.44 C ATOM 0 H VAL A 412 2.957 -5.214 8.890 1.00 3.33 H new ATOM 0 HA VAL A 412 5.452 -6.195 7.641 1.00 30.43 H new ATOM 0 HB VAL A 412 2.831 -5.114 6.683 1.00 72.34 H new ATOM 0 HG11 VAL A 412 3.752 -5.071 4.392 1.00 11.52 H new ATOM 0 HG12 VAL A 412 4.534 -3.870 5.448 1.00 11.52 H new ATOM 0 HG13 VAL A 412 5.377 -5.385 5.048 1.00 11.52 H new ATOM 0 HG21 VAL A 412 2.862 -7.179 5.331 1.00 34.44 H new ATOM 0 HG22 VAL A 412 4.437 -7.610 6.038 1.00 34.44 H new ATOM 0 HG23 VAL A 412 2.992 -7.521 7.072 1.00 34.44 H new ATOM 410 N ARG A 413 4.568 -3.045 7.997 1.00 75.25 N ATOM 411 CA ARG A 413 5.091 -1.691 8.071 1.00 72.42 C ATOM 412 C ARG A 413 6.480 -1.692 8.715 1.00 14.13 C ATOM 413 O ARG A 413 7.362 -0.944 8.297 1.00 53.55 O ATOM 414 CB ARG A 413 4.162 -0.785 8.884 1.00 21.44 C ATOM 415 CG ARG A 413 2.703 -0.983 8.467 1.00 71.54 C ATOM 416 CD ARG A 413 1.858 0.239 8.834 1.00 64.21 C ATOM 417 NE ARG A 413 2.309 0.794 10.130 1.00 53.22 N ATOM 418 CZ ARG A 413 1.506 1.459 10.989 1.00 60.40 C ATOM 419 NH1 ARG A 413 0.203 1.656 10.696 1.00 21.40 N ATOM 420 NH2 ARG A 413 2.015 1.913 12.119 1.00 1.22 N ATOM 0 H ARG A 413 3.561 -3.122 8.139 1.00 75.25 H new ATOM 0 HA ARG A 413 5.158 -1.306 7.053 1.00 72.42 H new ATOM 0 HB2 ARG A 413 4.273 -1.003 9.946 1.00 21.44 H new ATOM 0 HB3 ARG A 413 4.447 0.257 8.741 1.00 21.44 H new ATOM 0 HG2 ARG A 413 2.649 -1.158 7.393 1.00 71.54 H new ATOM 0 HG3 ARG A 413 2.298 -1.870 8.955 1.00 71.54 H new ATOM 0 HD2 ARG A 413 1.942 0.997 8.055 1.00 64.21 H new ATOM 0 HD3 ARG A 413 0.806 -0.041 8.895 1.00 64.21 H new ATOM 0 HE ARG A 413 3.287 0.666 10.391 1.00 53.22 H new ATOM 0 HH11 ARG A 413 -0.182 1.302 9.820 1.00 21.40 H new ATOM 0 HH12 ARG A 413 -0.396 2.159 11.350 1.00 21.40 H new ATOM 0 HH21 ARG A 413 3.001 1.760 12.332 1.00 1.22 H new ATOM 0 HH22 ARG A 413 1.423 2.417 12.779 1.00 1.22 H new ATOM 430 N GLU A 414 6.631 -2.543 9.719 1.00 11.43 N ATOM 431 CA GLU A 414 7.896 -2.652 10.423 1.00 33.44 C ATOM 432 C GLU A 414 8.910 -3.428 9.577 1.00 40.31 C ATOM 433 O GLU A 414 9.929 -2.879 9.166 1.00 20.22 O ATOM 434 CB GLU A 414 7.708 -3.310 11.792 1.00 21.41 C ATOM 435 CG GLU A 414 6.737 -2.504 12.657 1.00 34.33 C ATOM 436 CD GLU A 414 6.228 -3.340 13.833 1.00 14.11 C ATOM 437 OE1 GLU A 414 6.520 -4.543 13.910 1.00 0.24 O ATOM 438 OE2 GLU A 414 5.507 -2.697 14.688 1.00 10.00 O ATOM 0 H GLU A 414 5.897 -3.164 10.061 1.00 11.43 H new ATOM 0 HA GLU A 414 8.284 -1.647 10.590 1.00 33.44 H new ATOM 0 HB2 GLU A 414 7.331 -4.324 11.663 1.00 21.41 H new ATOM 0 HB3 GLU A 414 8.671 -3.390 12.297 1.00 21.41 H new ATOM 0 HG2 GLU A 414 7.234 -1.609 13.031 1.00 34.33 H new ATOM 0 HG3 GLU A 414 5.894 -2.171 12.051 1.00 34.33 H new ATOM 444 N LYS A 415 8.591 -4.692 9.343 1.00 0.54 N ATOM 445 CA LYS A 415 9.460 -5.549 8.554 1.00 21.45 C ATOM 446 C LYS A 415 10.034 -4.746 7.384 1.00 22.34 C ATOM 447 O LYS A 415 11.250 -4.691 7.202 1.00 22.14 O ATOM 448 CB LYS A 415 8.717 -6.816 8.124 1.00 31.23 C ATOM 449 CG LYS A 415 9.584 -8.059 8.337 1.00 51.01 C ATOM 450 CD LYS A 415 10.945 -7.901 7.656 1.00 15.52 C ATOM 451 CE LYS A 415 10.788 -7.800 6.137 1.00 34.43 C ATOM 452 NZ LYS A 415 9.695 -8.681 5.669 1.00 51.44 N ATOM 0 H LYS A 415 7.743 -5.144 9.686 1.00 0.54 H new ATOM 0 HA LYS A 415 10.304 -5.890 9.153 1.00 21.45 H new ATOM 0 HB2 LYS A 415 7.793 -6.911 8.694 1.00 31.23 H new ATOM 0 HB3 LYS A 415 8.437 -6.739 7.073 1.00 31.23 H new ATOM 0 HG2 LYS A 415 9.725 -8.230 9.404 1.00 51.01 H new ATOM 0 HG3 LYS A 415 9.073 -8.936 7.938 1.00 51.01 H new ATOM 0 HD2 LYS A 415 11.444 -7.009 8.034 1.00 15.52 H new ATOM 0 HD3 LYS A 415 11.581 -8.751 7.904 1.00 15.52 H new ATOM 0 HE2 LYS A 415 10.577 -6.768 5.855 1.00 34.43 H new ATOM 0 HE3 LYS A 415 11.722 -8.079 5.650 1.00 34.43 H new ATOM 0 HZ1 LYS A 415 9.947 -9.086 4.745 1.00 51.44 H new ATOM 0 HZ2 LYS A 415 9.550 -9.448 6.356 1.00 51.44 H new ATOM 0 HZ3 LYS A 415 8.819 -8.128 5.577 1.00 51.44 H new ATOM 461 N LEU A 416 9.133 -4.145 6.622 1.00 41.04 N ATOM 462 CA LEU A 416 9.536 -3.348 5.475 1.00 2.21 C ATOM 463 C LEU A 416 10.786 -2.542 5.834 1.00 75.11 C ATOM 464 O LEU A 416 11.799 -2.617 5.139 1.00 14.44 O ATOM 465 CB LEU A 416 8.369 -2.488 4.984 1.00 44.52 C ATOM 466 CG LEU A 416 7.169 -3.247 4.416 1.00 74.13 C ATOM 467 CD1 LEU A 416 6.034 -2.287 4.054 1.00 70.21 C ATOM 468 CD2 LEU A 416 7.585 -4.117 3.228 1.00 13.40 C ATOM 0 H LEU A 416 8.126 -4.193 6.776 1.00 41.04 H new ATOM 0 HA LEU A 416 9.802 -3.992 4.637 1.00 2.21 H new ATOM 0 HB2 LEU A 416 8.024 -1.871 5.814 1.00 44.52 H new ATOM 0 HB3 LEU A 416 8.741 -1.810 4.216 1.00 44.52 H new ATOM 0 HG LEU A 416 6.790 -3.916 5.189 1.00 74.13 H new ATOM 0 HD11 LEU A 416 5.193 -2.853 3.652 1.00 70.21 H new ATOM 0 HD12 LEU A 416 5.715 -1.747 4.946 1.00 70.21 H new ATOM 0 HD13 LEU A 416 6.384 -1.576 3.305 1.00 70.21 H new ATOM 0 HD21 LEU A 416 6.714 -4.646 2.842 1.00 13.40 H new ATOM 0 HD22 LEU A 416 8.003 -3.486 2.444 1.00 13.40 H new ATOM 0 HD23 LEU A 416 8.335 -4.839 3.551 1.00 13.40 H new ATOM 479 N GLU A 417 10.675 -1.788 6.918 1.00 12.43 N ATOM 480 CA GLU A 417 11.784 -0.968 7.376 1.00 40.23 C ATOM 481 C GLU A 417 13.111 -1.695 7.147 1.00 22.42 C ATOM 482 O GLU A 417 14.071 -1.102 6.659 1.00 54.35 O ATOM 483 CB GLU A 417 11.613 -0.590 8.849 1.00 63.43 C ATOM 484 CG GLU A 417 10.317 0.192 9.068 1.00 14.33 C ATOM 485 CD GLU A 417 10.462 1.184 10.223 1.00 73.43 C ATOM 486 OE1 GLU A 417 11.228 2.154 10.114 1.00 75.45 O ATOM 487 OE2 GLU A 417 9.746 0.921 11.263 1.00 21.14 O ATOM 0 H GLU A 417 9.834 -1.728 7.492 1.00 12.43 H new ATOM 0 HA GLU A 417 11.793 -0.045 6.796 1.00 40.23 H new ATOM 0 HB2 GLU A 417 11.605 -1.492 9.461 1.00 63.43 H new ATOM 0 HB3 GLU A 417 12.463 0.009 9.175 1.00 63.43 H new ATOM 0 HG2 GLU A 417 10.053 0.727 8.156 1.00 14.33 H new ATOM 0 HG3 GLU A 417 9.502 -0.500 9.279 1.00 14.33 H new ATOM 493 N ALA A 418 13.122 -2.970 7.509 1.00 52.35 N ATOM 494 CA ALA A 418 14.315 -3.782 7.349 1.00 12.23 C ATOM 495 C ALA A 418 14.819 -3.663 5.910 1.00 40.33 C ATOM 496 O ALA A 418 15.991 -3.369 5.680 1.00 62.14 O ATOM 497 CB ALA A 418 14.004 -5.229 7.738 1.00 0.55 C ATOM 0 H ALA A 418 12.323 -3.460 7.912 1.00 52.35 H new ATOM 0 HA ALA A 418 15.109 -3.430 8.007 1.00 12.23 H new ATOM 0 HB1 ALA A 418 14.900 -5.839 7.618 1.00 0.55 H new ATOM 0 HB2 ALA A 418 13.678 -5.264 8.777 1.00 0.55 H new ATOM 0 HB3 ALA A 418 13.213 -5.616 7.096 1.00 0.55 H new ATOM 503 N LEU A 419 13.909 -3.896 4.976 1.00 43.41 N ATOM 504 CA LEU A 419 14.246 -3.818 3.565 1.00 73.54 C ATOM 505 C LEU A 419 14.596 -2.370 3.209 1.00 33.35 C ATOM 506 O LEU A 419 15.592 -2.117 2.531 1.00 3.35 O ATOM 507 CB LEU A 419 13.122 -4.406 2.712 1.00 35.41 C ATOM 508 CG LEU A 419 12.768 -5.869 2.983 1.00 65.40 C ATOM 509 CD1 LEU A 419 11.253 -6.080 2.974 1.00 61.43 C ATOM 510 CD2 LEU A 419 13.483 -6.798 1.998 1.00 51.34 C ATOM 0 H LEU A 419 12.937 -4.139 5.169 1.00 43.41 H new ATOM 0 HA LEU A 419 15.127 -4.423 3.349 1.00 73.54 H new ATOM 0 HB2 LEU A 419 12.226 -3.803 2.861 1.00 35.41 H new ATOM 0 HB3 LEU A 419 13.401 -4.309 1.663 1.00 35.41 H new ATOM 0 HG LEU A 419 13.121 -6.125 3.982 1.00 65.40 H new ATOM 0 HD11 LEU A 419 11.031 -7.129 3.169 1.00 61.43 H new ATOM 0 HD12 LEU A 419 10.795 -5.462 3.746 1.00 61.43 H new ATOM 0 HD13 LEU A 419 10.852 -5.799 2.000 1.00 61.43 H new ATOM 0 HD21 LEU A 419 13.214 -7.832 2.213 1.00 51.34 H new ATOM 0 HD22 LEU A 419 13.183 -6.549 0.980 1.00 51.34 H new ATOM 0 HD23 LEU A 419 14.561 -6.675 2.099 1.00 51.34 H new ATOM 521 N GLY A 420 13.758 -1.459 3.680 1.00 23.34 N ATOM 522 CA GLY A 420 13.966 -0.046 3.418 1.00 44.14 C ATOM 523 C GLY A 420 12.696 0.757 3.706 1.00 74.01 C ATOM 524 O GLY A 420 12.652 1.542 4.652 1.00 32.01 O ATOM 0 H GLY A 420 12.934 -1.672 4.242 1.00 23.34 H new ATOM 0 HA2 GLY A 420 14.784 0.326 4.036 1.00 44.14 H new ATOM 0 HA3 GLY A 420 14.262 0.095 2.379 1.00 44.14 H new ATOM 528 N VAL A 421 11.692 0.535 2.869 1.00 63.14 N ATOM 529 CA VAL A 421 10.424 1.228 3.022 1.00 75.31 C ATOM 530 C VAL A 421 10.083 1.338 4.508 1.00 12.32 C ATOM 531 O VAL A 421 10.254 0.380 5.260 1.00 42.32 O ATOM 532 CB VAL A 421 9.338 0.518 2.210 1.00 73.02 C ATOM 533 CG1 VAL A 421 9.588 -0.990 2.162 1.00 11.24 C ATOM 534 CG2 VAL A 421 7.947 0.827 2.766 1.00 11.11 C ATOM 0 H VAL A 421 11.731 -0.115 2.084 1.00 63.14 H new ATOM 0 HA VAL A 421 10.494 2.242 2.629 1.00 75.31 H new ATOM 0 HB VAL A 421 9.381 0.897 1.189 1.00 73.02 H new ATOM 0 HG11 VAL A 421 8.802 -1.471 1.579 1.00 11.24 H new ATOM 0 HG12 VAL A 421 10.555 -1.184 1.697 1.00 11.24 H new ATOM 0 HG13 VAL A 421 9.585 -1.392 3.175 1.00 11.24 H new ATOM 0 HG21 VAL A 421 7.194 0.310 2.171 1.00 11.11 H new ATOM 0 HG22 VAL A 421 7.886 0.490 3.801 1.00 11.11 H new ATOM 0 HG23 VAL A 421 7.768 1.901 2.723 1.00 11.11 H new ATOM 544 N PRO A 422 9.591 2.545 4.898 1.00 25.42 N ATOM 545 CA PRO A 422 9.223 2.792 6.282 1.00 32.44 C ATOM 546 C PRO A 422 7.903 2.103 6.629 1.00 44.31 C ATOM 547 O PRO A 422 7.461 1.202 5.918 1.00 53.53 O ATOM 548 CB PRO A 422 9.156 4.305 6.407 1.00 44.33 C ATOM 549 CG PRO A 422 9.031 4.835 4.988 1.00 44.30 C ATOM 550 CD PRO A 422 9.373 3.702 4.034 1.00 63.04 C ATOM 0 HA PRO A 422 9.943 2.380 6.989 1.00 32.44 H new ATOM 0 HB2 PRO A 422 8.303 4.609 7.014 1.00 44.33 H new ATOM 0 HB3 PRO A 422 10.050 4.697 6.893 1.00 44.33 H new ATOM 0 HG2 PRO A 422 8.019 5.197 4.804 1.00 44.30 H new ATOM 0 HG3 PRO A 422 9.704 5.679 4.835 1.00 44.30 H new ATOM 0 HD2 PRO A 422 8.563 3.521 3.327 1.00 63.04 H new ATOM 0 HD3 PRO A 422 10.263 3.932 3.448 1.00 63.04 H new ATOM 555 N ASP A 423 7.308 2.554 7.725 1.00 71.11 N ATOM 556 CA ASP A 423 6.045 1.992 8.175 1.00 23.13 C ATOM 557 C ASP A 423 4.991 2.175 7.082 1.00 61.44 C ATOM 558 O ASP A 423 4.229 1.256 6.789 1.00 22.03 O ATOM 559 CB ASP A 423 5.546 2.700 9.437 1.00 72.44 C ATOM 560 CG ASP A 423 5.734 4.219 9.442 1.00 0.23 C ATOM 561 OD1 ASP A 423 6.201 4.809 8.458 1.00 34.14 O ATOM 562 OD2 ASP A 423 5.372 4.808 10.531 1.00 64.13 O ATOM 0 H ASP A 423 7.677 3.301 8.314 1.00 71.11 H new ATOM 0 HA ASP A 423 6.205 0.936 8.393 1.00 23.13 H new ATOM 0 HB2 ASP A 423 4.486 2.479 9.564 1.00 72.44 H new ATOM 0 HB3 ASP A 423 6.065 2.282 10.300 1.00 72.44 H new ATOM 567 N GLY A 424 4.981 3.370 6.508 1.00 23.43 N ATOM 568 CA GLY A 424 4.033 3.686 5.454 1.00 4.35 C ATOM 569 C GLY A 424 2.663 4.041 6.036 1.00 63.24 C ATOM 570 O GLY A 424 2.439 5.175 6.459 1.00 72.33 O ATOM 0 H GLY A 424 5.615 4.131 6.754 1.00 23.43 H new ATOM 0 HA2 GLY A 424 4.408 4.521 4.862 1.00 4.35 H new ATOM 0 HA3 GLY A 424 3.936 2.835 4.780 1.00 4.35 H new ATOM 574 N ALA A 425 1.783 3.051 6.040 1.00 63.15 N ATOM 575 CA ALA A 425 0.442 3.245 6.564 1.00 44.32 C ATOM 576 C ALA A 425 -0.458 2.103 6.088 1.00 21.31 C ATOM 577 O ALA A 425 0.010 1.173 5.434 1.00 15.23 O ATOM 578 CB ALA A 425 -0.082 4.618 6.133 1.00 4.25 C ATOM 0 H ALA A 425 1.972 2.112 5.689 1.00 63.15 H new ATOM 0 HA ALA A 425 0.450 3.226 7.654 1.00 44.32 H new ATOM 0 HB1 ALA A 425 -1.088 4.763 6.526 1.00 4.25 H new ATOM 0 HB2 ALA A 425 0.575 5.396 6.521 1.00 4.25 H new ATOM 0 HB3 ALA A 425 -0.106 4.673 5.045 1.00 4.25 H new ATOM 584 N THR A 426 -1.732 2.211 6.435 1.00 54.13 N ATOM 585 CA THR A 426 -2.700 1.198 6.052 1.00 2.51 C ATOM 586 C THR A 426 -4.092 1.818 5.910 1.00 34.44 C ATOM 587 O THR A 426 -4.420 2.782 6.601 1.00 34.45 O ATOM 588 CB THR A 426 -2.640 0.070 7.084 1.00 61.21 C ATOM 589 OG1 THR A 426 -3.391 0.570 8.188 1.00 12.12 O ATOM 590 CG2 THR A 426 -1.233 -0.128 7.652 1.00 32.21 C ATOM 0 H THR A 426 -2.116 2.985 6.977 1.00 54.13 H new ATOM 0 HA THR A 426 -2.464 0.776 5.075 1.00 2.51 H new ATOM 0 HB THR A 426 -2.983 -0.859 6.628 1.00 61.21 H new ATOM 0 HG1 THR A 426 -3.405 -0.099 8.904 1.00 12.12 H new ATOM 0 HG21 THR A 426 -1.245 -0.940 8.379 1.00 32.21 H new ATOM 0 HG22 THR A 426 -0.546 -0.376 6.843 1.00 32.21 H new ATOM 0 HG23 THR A 426 -0.905 0.790 8.139 1.00 32.21 H new ATOM 598 N PHE A 427 -4.873 1.240 5.010 1.00 34.34 N ATOM 599 CA PHE A 427 -6.221 1.724 4.768 1.00 0.33 C ATOM 600 C PHE A 427 -7.252 0.617 5.009 1.00 72.45 C ATOM 601 O PHE A 427 -6.953 -0.563 4.833 1.00 10.33 O ATOM 602 CB PHE A 427 -6.286 2.154 3.302 1.00 15.55 C ATOM 603 CG PHE A 427 -7.673 2.620 2.850 1.00 72.54 C ATOM 604 CD1 PHE A 427 -8.686 1.722 2.731 1.00 2.12 C ATOM 605 CD2 PHE A 427 -7.890 3.932 2.569 1.00 74.25 C ATOM 606 CE1 PHE A 427 -9.972 2.156 2.312 1.00 14.34 C ATOM 607 CE2 PHE A 427 -9.175 4.365 2.151 1.00 60.12 C ATOM 608 CZ PHE A 427 -10.191 3.469 2.031 1.00 25.44 C ATOM 0 H PHE A 427 -4.598 0.441 4.439 1.00 34.34 H new ATOM 0 HA PHE A 427 -6.447 2.549 5.444 1.00 0.33 H new ATOM 0 HB2 PHE A 427 -5.572 2.961 3.139 1.00 15.55 H new ATOM 0 HB3 PHE A 427 -5.972 1.319 2.675 1.00 15.55 H new ATOM 0 HD1 PHE A 427 -8.514 0.680 2.955 1.00 2.12 H new ATOM 0 HD2 PHE A 427 -7.084 4.645 2.664 1.00 74.25 H new ATOM 0 HE1 PHE A 427 -10.777 1.443 2.216 1.00 14.34 H new ATOM 0 HE2 PHE A 427 -9.346 5.408 1.928 1.00 60.12 H new ATOM 0 HZ PHE A 427 -11.169 3.799 1.713 1.00 25.44 H new ATOM 823 N GLN A 443 -6.637 8.324 -3.731 1.00 41.21 N ATOM 824 CA GLN A 443 -5.515 8.685 -4.582 1.00 31.24 C ATOM 825 C GLN A 443 -4.395 9.312 -3.747 1.00 11.04 C ATOM 826 O GLN A 443 -3.246 9.358 -4.182 1.00 10.13 O ATOM 827 CB GLN A 443 -5.959 9.629 -5.702 1.00 63.35 C ATOM 828 CG GLN A 443 -7.023 8.973 -6.583 1.00 1.13 C ATOM 829 CD GLN A 443 -7.724 10.013 -7.460 1.00 22.25 C ATOM 830 OE1 GLN A 443 -8.703 10.631 -7.073 1.00 21.40 O ATOM 831 NE2 GLN A 443 -7.171 10.170 -8.659 1.00 2.32 N ATOM 0 HA GLN A 443 -5.130 7.778 -5.047 1.00 31.24 H new ATOM 0 HB2 GLN A 443 -6.355 10.549 -5.271 1.00 63.35 H new ATOM 0 HB3 GLN A 443 -5.099 9.907 -6.311 1.00 63.35 H new ATOM 0 HG2 GLN A 443 -6.561 8.213 -7.213 1.00 1.13 H new ATOM 0 HG3 GLN A 443 -7.757 8.466 -5.957 1.00 1.13 H new ATOM 0 HE21 GLN A 443 -6.352 9.620 -8.919 1.00 2.32 H new ATOM 0 HE22 GLN A 443 -7.566 10.840 -9.319 1.00 2.32 H new ATOM 838 N ASP A 444 -4.772 9.777 -2.565 1.00 13.25 N ATOM 839 CA ASP A 444 -3.814 10.397 -1.666 1.00 75.14 C ATOM 840 C ASP A 444 -2.622 9.458 -1.470 1.00 11.10 C ATOM 841 O ASP A 444 -1.489 9.912 -1.321 1.00 35.53 O ATOM 842 CB ASP A 444 -4.438 10.664 -0.296 1.00 43.12 C ATOM 843 CG ASP A 444 -4.533 9.442 0.620 1.00 12.43 C ATOM 844 OD1 ASP A 444 -4.804 8.322 0.163 1.00 31.34 O ATOM 845 OD2 ASP A 444 -4.314 9.679 1.869 1.00 32.44 O ATOM 0 H ASP A 444 -5.727 9.737 -2.209 1.00 13.25 H new ATOM 0 HA ASP A 444 -3.499 11.342 -2.108 1.00 75.14 H new ATOM 0 HB2 ASP A 444 -3.854 11.433 0.209 1.00 43.12 H new ATOM 0 HB3 ASP A 444 -5.440 11.069 -0.442 1.00 43.12 H new ATOM 850 N ALA A 445 -2.920 8.168 -1.473 1.00 12.24 N ATOM 851 CA ALA A 445 -1.888 7.159 -1.296 1.00 74.33 C ATOM 852 C ALA A 445 -1.192 6.910 -2.635 1.00 10.25 C ATOM 853 O ALA A 445 -0.015 6.556 -2.670 1.00 21.00 O ATOM 854 CB ALA A 445 -2.510 5.889 -0.715 1.00 72.23 C ATOM 0 H ALA A 445 -3.862 7.797 -1.595 1.00 12.24 H new ATOM 0 HA ALA A 445 -1.131 7.502 -0.590 1.00 74.33 H new ATOM 0 HB1 ALA A 445 -1.736 5.133 -0.582 1.00 72.23 H new ATOM 0 HB2 ALA A 445 -2.965 6.115 0.249 1.00 72.23 H new ATOM 0 HB3 ALA A 445 -3.272 5.512 -1.397 1.00 72.23 H new ATOM 860 N ILE A 446 -1.949 7.102 -3.705 1.00 54.44 N ATOM 861 CA ILE A 446 -1.420 6.902 -5.044 1.00 33.03 C ATOM 862 C ILE A 446 -0.552 8.100 -5.429 1.00 72.42 C ATOM 863 O ILE A 446 0.284 8.003 -6.327 1.00 62.42 O ATOM 864 CB ILE A 446 -2.554 6.622 -6.031 1.00 31.52 C ATOM 865 CG1 ILE A 446 -3.062 5.185 -5.890 1.00 43.03 C ATOM 866 CG2 ILE A 446 -2.123 6.938 -7.465 1.00 33.54 C ATOM 867 CD1 ILE A 446 -4.276 4.942 -6.788 1.00 13.12 C ATOM 0 H ILE A 446 -2.926 7.394 -3.672 1.00 54.44 H new ATOM 0 HA ILE A 446 -0.778 6.021 -5.073 1.00 33.03 H new ATOM 0 HB ILE A 446 -3.386 7.283 -5.791 1.00 31.52 H new ATOM 0 HG12 ILE A 446 -2.267 4.487 -6.151 1.00 43.03 H new ATOM 0 HG13 ILE A 446 -3.329 4.990 -4.851 1.00 43.03 H new ATOM 0 HG21 ILE A 446 -2.948 6.730 -8.147 1.00 33.54 H new ATOM 0 HG22 ILE A 446 -1.847 7.990 -7.539 1.00 33.54 H new ATOM 0 HG23 ILE A 446 -1.266 6.319 -7.732 1.00 33.54 H new ATOM 0 HD11 ILE A 446 -4.617 3.914 -6.669 1.00 13.12 H new ATOM 0 HD12 ILE A 446 -5.078 5.625 -6.508 1.00 13.12 H new ATOM 0 HD13 ILE A 446 -3.999 5.114 -7.828 1.00 13.12 H new ATOM 878 N ASP A 447 -0.778 9.204 -4.731 1.00 14.44 N ATOM 879 CA ASP A 447 -0.027 10.420 -4.988 1.00 73.41 C ATOM 880 C ASP A 447 1.023 10.608 -3.891 1.00 74.24 C ATOM 881 O ASP A 447 2.223 10.576 -4.164 1.00 50.34 O ATOM 882 CB ASP A 447 -0.943 11.646 -4.981 1.00 33.23 C ATOM 883 CG ASP A 447 -0.239 12.981 -5.233 1.00 32.55 C ATOM 884 OD1 ASP A 447 0.680 13.074 -6.061 1.00 23.04 O ATOM 885 OD2 ASP A 447 -0.675 13.969 -4.527 1.00 0.34 O ATOM 0 H ASP A 447 -1.472 9.281 -3.987 1.00 14.44 H new ATOM 0 HA ASP A 447 0.441 10.326 -5.968 1.00 73.41 H new ATOM 0 HB2 ASP A 447 -1.713 11.510 -5.740 1.00 33.23 H new ATOM 0 HB3 ASP A 447 -1.450 11.696 -4.018 1.00 33.23 H new ATOM 890 N HIS A 448 0.534 10.800 -2.676 1.00 22.03 N ATOM 891 CA HIS A 448 1.415 10.993 -1.536 1.00 10.24 C ATOM 892 C HIS A 448 2.377 9.808 -1.424 1.00 1.41 C ATOM 893 O HIS A 448 3.592 9.978 -1.520 1.00 12.44 O ATOM 894 CB HIS A 448 0.608 11.223 -0.257 1.00 11.33 C ATOM 895 CG HIS A 448 -0.556 12.170 -0.429 1.00 44.50 C ATOM 896 ND1 HIS A 448 -1.432 12.474 0.598 1.00 4.33 N ATOM 897 CD2 HIS A 448 -0.978 12.876 -1.517 1.00 41.14 C ATOM 898 CE1 HIS A 448 -2.337 13.325 0.137 1.00 40.44 C ATOM 899 NE2 HIS A 448 -2.053 13.574 -1.174 1.00 3.34 N ATOM 0 H HIS A 448 -0.461 10.826 -2.455 1.00 22.03 H new ATOM 0 HA HIS A 448 2.014 11.891 -1.684 1.00 10.24 H new ATOM 0 HB2 HIS A 448 0.234 10.264 0.102 1.00 11.33 H new ATOM 0 HB3 HIS A 448 1.272 11.615 0.514 1.00 11.33 H new ATOM 0 HD2 HIS A 448 -0.515 12.868 -2.493 1.00 41.14 H new ATOM 0 HE1 HIS A 448 -3.156 13.747 0.700 1.00 40.44 H new ATOM 0 HE2 HIS A 448 -2.580 14.194 -1.789 1.00 3.34 H new ATOM 906 N SER A 449 1.797 8.634 -1.225 1.00 3.34 N ATOM 907 CA SER A 449 2.587 7.420 -1.099 1.00 12.42 C ATOM 908 C SER A 449 3.187 7.044 -2.456 1.00 5.53 C ATOM 909 O SER A 449 2.729 7.519 -3.494 1.00 22.14 O ATOM 910 CB SER A 449 1.741 6.267 -0.554 1.00 33.51 C ATOM 911 OG SER A 449 1.778 5.127 -1.410 1.00 43.23 O ATOM 0 H SER A 449 0.789 8.497 -1.148 1.00 3.34 H new ATOM 0 HA SER A 449 3.394 7.608 -0.391 1.00 12.42 H new ATOM 0 HB2 SER A 449 2.102 5.989 0.436 1.00 33.51 H new ATOM 0 HB3 SER A 449 0.709 6.598 -0.436 1.00 33.51 H new ATOM 0 HG SER A 449 1.136 5.246 -2.141 1.00 43.23 H new ATOM 916 N ALA A 450 4.201 6.195 -2.402 1.00 33.21 N ATOM 917 CA ALA A 450 4.869 5.749 -3.613 1.00 74.40 C ATOM 918 C ALA A 450 3.997 4.708 -4.318 1.00 54.14 C ATOM 919 O ALA A 450 3.394 4.996 -5.351 1.00 73.11 O ATOM 920 CB ALA A 450 6.256 5.205 -3.263 1.00 22.03 C ATOM 0 H ALA A 450 4.577 5.803 -1.539 1.00 33.21 H new ATOM 0 HA ALA A 450 5.010 6.583 -4.301 1.00 74.40 H new ATOM 0 HB1 ALA A 450 6.756 4.871 -4.172 1.00 22.03 H new ATOM 0 HB2 ALA A 450 6.847 5.991 -2.792 1.00 22.03 H new ATOM 0 HB3 ALA A 450 6.155 4.365 -2.575 1.00 22.03 H new ATOM 926 N PHE A 451 3.957 3.521 -3.733 1.00 21.11 N ATOM 927 CA PHE A 451 3.170 2.436 -4.291 1.00 53.11 C ATOM 928 C PHE A 451 2.143 1.926 -3.278 1.00 51.50 C ATOM 929 O PHE A 451 2.461 1.741 -2.105 1.00 60.52 O ATOM 930 CB PHE A 451 4.141 1.303 -4.628 1.00 14.42 C ATOM 931 CG PHE A 451 5.420 1.769 -5.328 1.00 45.42 C ATOM 932 CD1 PHE A 451 6.426 2.328 -4.602 1.00 31.12 C ATOM 933 CD2 PHE A 451 5.551 1.624 -6.673 1.00 41.24 C ATOM 934 CE1 PHE A 451 7.613 2.760 -5.251 1.00 24.42 C ATOM 935 CE2 PHE A 451 6.738 2.056 -7.321 1.00 74.14 C ATOM 936 CZ PHE A 451 7.745 2.615 -6.597 1.00 0.40 C ATOM 0 H PHE A 451 4.458 3.286 -2.876 1.00 21.11 H new ATOM 0 HA PHE A 451 2.631 2.784 -5.172 1.00 53.11 H new ATOM 0 HB2 PHE A 451 4.411 0.783 -3.709 1.00 14.42 H new ATOM 0 HB3 PHE A 451 3.633 0.580 -5.266 1.00 14.42 H new ATOM 0 HD1 PHE A 451 6.322 2.443 -3.533 1.00 31.12 H new ATOM 0 HD2 PHE A 451 4.752 1.180 -7.249 1.00 41.24 H new ATOM 0 HE1 PHE A 451 8.412 3.204 -4.675 1.00 24.42 H new ATOM 0 HE2 PHE A 451 6.842 1.941 -8.390 1.00 74.14 H new ATOM 0 HZ PHE A 451 8.648 2.943 -7.090 1.00 0.40 H new ATOM 945 N ILE A 452 0.930 1.713 -3.767 1.00 74.50 N ATOM 946 CA ILE A 452 -0.146 1.227 -2.920 1.00 43.55 C ATOM 947 C ILE A 452 0.030 -0.274 -2.689 1.00 33.33 C ATOM 948 O ILE A 452 0.324 -1.020 -3.623 1.00 61.54 O ATOM 949 CB ILE A 452 -1.505 1.604 -3.511 1.00 33.11 C ATOM 950 CG1 ILE A 452 -1.526 3.069 -3.952 1.00 4.12 C ATOM 951 CG2 ILE A 452 -2.637 1.284 -2.532 1.00 20.23 C ATOM 952 CD1 ILE A 452 -1.569 4.004 -2.742 1.00 44.15 C ATOM 0 H ILE A 452 0.668 1.868 -4.741 1.00 74.50 H new ATOM 0 HA ILE A 452 -0.106 1.706 -1.942 1.00 43.55 H new ATOM 0 HB ILE A 452 -1.668 0.998 -4.402 1.00 33.11 H new ATOM 0 HG12 ILE A 452 -0.642 3.285 -4.552 1.00 4.12 H new ATOM 0 HG13 ILE A 452 -2.394 3.249 -4.587 1.00 4.12 H new ATOM 0 HG21 ILE A 452 -3.592 1.562 -2.977 1.00 20.23 H new ATOM 0 HG22 ILE A 452 -2.636 0.217 -2.311 1.00 20.23 H new ATOM 0 HG23 ILE A 452 -2.490 1.845 -1.609 1.00 20.23 H new ATOM 0 HD11 ILE A 452 -1.583 5.039 -3.083 1.00 44.15 H new ATOM 0 HD12 ILE A 452 -2.467 3.802 -2.158 1.00 44.15 H new ATOM 0 HD13 ILE A 452 -0.688 3.838 -2.122 1.00 44.15 H new ATOM 963 N ILE A 453 -0.157 -0.676 -1.440 1.00 73.42 N ATOM 964 CA ILE A 453 -0.022 -2.076 -1.076 1.00 41.31 C ATOM 965 C ILE A 453 -1.397 -2.636 -0.705 1.00 34.34 C ATOM 966 O ILE A 453 -2.060 -2.121 0.194 1.00 15.42 O ATOM 967 CB ILE A 453 1.027 -2.244 0.025 1.00 61.02 C ATOM 968 CG1 ILE A 453 2.436 -2.327 -0.566 1.00 13.31 C ATOM 969 CG2 ILE A 453 0.704 -3.450 0.910 1.00 73.24 C ATOM 970 CD1 ILE A 453 3.486 -1.890 0.455 1.00 25.13 C ATOM 0 H ILE A 453 -0.401 -0.056 -0.668 1.00 73.42 H new ATOM 0 HA ILE A 453 0.342 -2.657 -1.923 1.00 41.31 H new ATOM 0 HB ILE A 453 0.998 -1.360 0.662 1.00 61.02 H new ATOM 0 HG12 ILE A 453 2.640 -3.348 -0.888 1.00 13.31 H new ATOM 0 HG13 ILE A 453 2.500 -1.695 -1.452 1.00 13.31 H new ATOM 0 HG21 ILE A 453 1.465 -3.547 1.684 1.00 73.24 H new ATOM 0 HG22 ILE A 453 -0.272 -3.309 1.375 1.00 73.24 H new ATOM 0 HG23 ILE A 453 0.688 -4.354 0.301 1.00 73.24 H new ATOM 0 HD11 ILE A 453 4.478 -1.959 0.009 1.00 25.13 H new ATOM 0 HD12 ILE A 453 3.294 -0.860 0.756 1.00 25.13 H new ATOM 0 HD13 ILE A 453 3.436 -2.539 1.329 1.00 25.13 H new ATOM 981 N LEU A 454 -1.784 -3.684 -1.417 1.00 53.20 N ATOM 982 CA LEU A 454 -3.067 -4.320 -1.176 1.00 2.23 C ATOM 983 C LEU A 454 -2.848 -5.637 -0.428 1.00 73.43 C ATOM 984 O LEU A 454 -2.309 -6.590 -0.988 1.00 45.23 O ATOM 985 CB LEU A 454 -3.842 -4.480 -2.486 1.00 63.25 C ATOM 986 CG LEU A 454 -3.656 -3.363 -3.516 1.00 22.41 C ATOM 987 CD1 LEU A 454 -4.597 -3.553 -4.706 1.00 73.14 C ATOM 988 CD2 LEU A 454 -3.821 -1.987 -2.867 1.00 15.32 C ATOM 0 H LEU A 454 -1.231 -4.109 -2.161 1.00 53.20 H new ATOM 0 HA LEU A 454 -3.688 -3.690 -0.539 1.00 2.23 H new ATOM 0 HB2 LEU A 454 -3.549 -5.424 -2.946 1.00 63.25 H new ATOM 0 HB3 LEU A 454 -4.903 -4.557 -2.250 1.00 63.25 H new ATOM 0 HG LEU A 454 -2.637 -3.417 -3.900 1.00 22.41 H new ATOM 0 HD11 LEU A 454 -4.445 -2.746 -5.423 1.00 73.14 H new ATOM 0 HD12 LEU A 454 -4.388 -4.509 -5.186 1.00 73.14 H new ATOM 0 HD13 LEU A 454 -5.630 -3.539 -4.359 1.00 73.14 H new ATOM 0 HD21 LEU A 454 -3.684 -1.211 -3.620 1.00 15.32 H new ATOM 0 HD22 LEU A 454 -4.820 -1.904 -2.438 1.00 15.32 H new ATOM 0 HD23 LEU A 454 -3.077 -1.864 -2.080 1.00 15.32 H new ATOM 999 N LEU A 455 -3.274 -5.645 0.827 1.00 14.23 N ATOM 1000 CA LEU A 455 -3.130 -6.828 1.658 1.00 32.12 C ATOM 1001 C LEU A 455 -4.158 -7.876 1.227 1.00 10.12 C ATOM 1002 O LEU A 455 -5.216 -8.003 1.841 1.00 70.12 O ATOM 1003 CB LEU A 455 -3.214 -6.456 3.138 1.00 3.24 C ATOM 1004 CG LEU A 455 -2.370 -7.303 4.093 1.00 3.21 C ATOM 1005 CD1 LEU A 455 -0.947 -7.476 3.558 1.00 62.50 C ATOM 1006 CD2 LEU A 455 -2.384 -6.718 5.506 1.00 15.14 C ATOM 0 H LEU A 455 -3.719 -4.851 1.288 1.00 14.23 H new ATOM 0 HA LEU A 455 -2.144 -7.273 1.521 1.00 32.12 H new ATOM 0 HB2 LEU A 455 -2.914 -5.414 3.248 1.00 3.24 H new ATOM 0 HB3 LEU A 455 -4.256 -6.522 3.450 1.00 3.24 H new ATOM 0 HG LEU A 455 -2.816 -8.296 4.153 1.00 3.21 H new ATOM 0 HD11 LEU A 455 -0.367 -8.082 4.255 1.00 62.50 H new ATOM 0 HD12 LEU A 455 -0.981 -7.972 2.588 1.00 62.50 H new ATOM 0 HD13 LEU A 455 -0.478 -6.498 3.450 1.00 62.50 H new ATOM 0 HD21 LEU A 455 -1.776 -7.340 6.163 1.00 15.14 H new ATOM 0 HD22 LEU A 455 -1.978 -5.707 5.485 1.00 15.14 H new ATOM 0 HD23 LEU A 455 -3.408 -6.690 5.878 1.00 15.14 H new ATOM 1017 N LEU A 456 -3.810 -8.603 0.176 1.00 15.43 N ATOM 1018 CA LEU A 456 -4.689 -9.637 -0.345 1.00 71.42 C ATOM 1019 C LEU A 456 -4.766 -10.788 0.660 1.00 1.10 C ATOM 1020 O LEU A 456 -3.992 -11.740 0.579 1.00 21.15 O ATOM 1021 CB LEU A 456 -4.241 -10.069 -1.742 1.00 32.02 C ATOM 1022 CG LEU A 456 -3.878 -8.941 -2.710 1.00 71.21 C ATOM 1023 CD1 LEU A 456 -3.900 -9.433 -4.158 1.00 53.33 C ATOM 1024 CD2 LEU A 456 -4.785 -7.728 -2.502 1.00 43.52 C ATOM 0 H LEU A 456 -2.931 -8.497 -0.330 1.00 15.43 H new ATOM 0 HA LEU A 456 -5.701 -9.251 -0.467 1.00 71.42 H new ATOM 0 HB2 LEU A 456 -3.376 -10.724 -1.638 1.00 32.02 H new ATOM 0 HB3 LEU A 456 -5.038 -10.663 -2.190 1.00 32.02 H new ATOM 0 HG LEU A 456 -2.859 -8.621 -2.495 1.00 71.21 H new ATOM 0 HD11 LEU A 456 -3.638 -8.612 -4.825 1.00 53.33 H new ATOM 0 HD12 LEU A 456 -3.179 -10.242 -4.278 1.00 53.33 H new ATOM 0 HD13 LEU A 456 -4.898 -9.796 -4.404 1.00 53.33 H new ATOM 0 HD21 LEU A 456 -4.506 -6.941 -3.202 1.00 43.52 H new ATOM 0 HD22 LEU A 456 -5.822 -8.016 -2.674 1.00 43.52 H new ATOM 0 HD23 LEU A 456 -4.674 -7.362 -1.481 1.00 43.52 H new ATOM 1035 N THR A 457 -5.707 -10.661 1.585 1.00 34.42 N ATOM 1036 CA THR A 457 -5.894 -11.679 2.604 1.00 65.22 C ATOM 1037 C THR A 457 -7.346 -12.162 2.616 1.00 73.41 C ATOM 1038 O THR A 457 -8.240 -11.463 2.139 1.00 41.43 O ATOM 1039 CB THR A 457 -5.438 -11.097 3.944 1.00 12.32 C ATOM 1040 OG1 THR A 457 -6.451 -10.151 4.275 1.00 22.34 O ATOM 1041 CG2 THR A 457 -4.169 -10.252 3.813 1.00 75.30 C ATOM 0 H THR A 457 -6.347 -9.869 1.650 1.00 34.42 H new ATOM 0 HA THR A 457 -5.291 -12.563 2.394 1.00 65.22 H new ATOM 0 HB THR A 457 -5.264 -11.908 4.651 1.00 12.32 H new ATOM 0 HG1 THR A 457 -6.235 -9.727 5.132 1.00 22.34 H new ATOM 0 HG21 THR A 457 -3.888 -9.863 4.792 1.00 75.30 H new ATOM 0 HG22 THR A 457 -3.360 -10.869 3.422 1.00 75.30 H new ATOM 0 HG23 THR A 457 -4.354 -9.421 3.132 1.00 75.30 H new ATOM 1049 N SER A 458 -7.537 -13.352 3.165 1.00 62.24 N ATOM 1050 CA SER A 458 -8.865 -13.937 3.244 1.00 73.51 C ATOM 1051 C SER A 458 -9.774 -13.054 4.102 1.00 3.32 C ATOM 1052 O SER A 458 -10.992 -13.225 4.100 1.00 4.33 O ATOM 1053 CB SER A 458 -8.810 -15.354 3.813 1.00 25.33 C ATOM 1054 OG SER A 458 -7.784 -15.498 4.792 1.00 64.32 O ATOM 0 H SER A 458 -6.794 -13.928 3.560 1.00 62.24 H new ATOM 0 HA SER A 458 -9.274 -13.997 2.235 1.00 73.51 H new ATOM 0 HB2 SER A 458 -9.773 -15.603 4.258 1.00 25.33 H new ATOM 0 HB3 SER A 458 -8.640 -16.063 3.003 1.00 25.33 H new ATOM 0 HG SER A 458 -7.334 -16.360 4.670 1.00 64.32 H new ATOM 1059 N ASN A 459 -9.147 -12.129 4.815 1.00 34.23 N ATOM 1060 CA ASN A 459 -9.883 -11.221 5.675 1.00 64.03 C ATOM 1061 C ASN A 459 -10.107 -9.898 4.941 1.00 60.24 C ATOM 1062 O ASN A 459 -10.488 -8.901 5.553 1.00 64.34 O ATOM 1063 CB ASN A 459 -9.105 -10.925 6.958 1.00 70.44 C ATOM 1064 CG ASN A 459 -9.280 -12.050 7.980 1.00 34.24 C ATOM 1065 OD1 ASN A 459 -8.564 -13.038 7.981 1.00 3.22 O ATOM 1066 ND2 ASN A 459 -10.269 -11.847 8.844 1.00 3.10 N ATOM 0 H ASN A 459 -8.137 -11.990 4.814 1.00 34.23 H new ATOM 0 HA ASN A 459 -10.832 -11.693 5.930 1.00 64.03 H new ATOM 0 HB2 ASN A 459 -8.047 -10.802 6.725 1.00 70.44 H new ATOM 0 HB3 ASN A 459 -9.449 -9.984 7.386 1.00 70.44 H new ATOM 0 HD21 ASN A 459 -10.467 -12.541 9.565 1.00 3.10 H new ATOM 0 HD22 ASN A 459 -10.830 -10.997 8.787 1.00 3.10 H new ATOM 1072 N PHE A 460 -9.860 -9.931 3.639 1.00 21.11 N ATOM 1073 CA PHE A 460 -10.030 -8.747 2.815 1.00 22.45 C ATOM 1074 C PHE A 460 -10.412 -9.125 1.383 1.00 0.42 C ATOM 1075 O PHE A 460 -10.275 -10.281 0.985 1.00 33.11 O ATOM 1076 CB PHE A 460 -8.682 -8.020 2.794 1.00 1.45 C ATOM 1077 CG PHE A 460 -8.630 -6.835 1.828 1.00 12.12 C ATOM 1078 CD1 PHE A 460 -9.482 -5.787 1.990 1.00 10.30 C ATOM 1079 CD2 PHE A 460 -7.732 -6.829 0.807 1.00 25.44 C ATOM 1080 CE1 PHE A 460 -9.432 -4.687 1.094 1.00 25.24 C ATOM 1081 CE2 PHE A 460 -7.683 -5.730 -0.089 1.00 51.12 C ATOM 1082 CZ PHE A 460 -8.534 -4.682 0.073 1.00 50.34 C ATOM 0 H PHE A 460 -9.543 -10.759 3.135 1.00 21.11 H new ATOM 0 HA PHE A 460 -10.825 -8.122 3.222 1.00 22.45 H new ATOM 0 HB2 PHE A 460 -8.456 -7.666 3.800 1.00 1.45 H new ATOM 0 HB3 PHE A 460 -7.901 -8.731 2.523 1.00 1.45 H new ATOM 0 HD1 PHE A 460 -10.196 -5.792 2.800 1.00 10.30 H new ATOM 0 HD2 PHE A 460 -7.056 -7.661 0.678 1.00 25.44 H new ATOM 0 HE1 PHE A 460 -10.107 -3.854 1.223 1.00 25.24 H new ATOM 0 HE2 PHE A 460 -6.970 -5.726 -0.900 1.00 51.12 H new ATOM 0 HZ PHE A 460 -8.497 -3.846 -0.609 1.00 50.34 H new ATOM 1091 N ASP A 461 -10.887 -8.130 0.649 1.00 15.44 N ATOM 1092 CA ASP A 461 -11.292 -8.345 -0.731 1.00 32.31 C ATOM 1093 C ASP A 461 -10.367 -7.554 -1.658 1.00 33.22 C ATOM 1094 O ASP A 461 -10.163 -6.357 -1.463 1.00 40.34 O ATOM 1095 CB ASP A 461 -12.724 -7.860 -0.966 1.00 24.11 C ATOM 1096 CG ASP A 461 -13.483 -8.597 -2.070 1.00 12.34 C ATOM 1097 OD1 ASP A 461 -14.575 -8.181 -2.483 1.00 55.24 O ATOM 1098 OD2 ASP A 461 -12.900 -9.658 -2.517 1.00 51.40 O ATOM 0 H ASP A 461 -11.001 -7.173 0.983 1.00 15.44 H new ATOM 0 HA ASP A 461 -11.235 -9.414 -0.937 1.00 32.31 H new ATOM 0 HB2 ASP A 461 -13.282 -7.958 -0.035 1.00 24.11 H new ATOM 0 HB3 ASP A 461 -12.696 -6.798 -1.211 1.00 24.11 H new ATOM 1103 N CYS A 462 -9.833 -8.255 -2.647 1.00 3.24 N ATOM 1104 CA CYS A 462 -8.933 -7.634 -3.604 1.00 13.54 C ATOM 1105 C CYS A 462 -9.779 -6.939 -4.675 1.00 25.34 C ATOM 1106 O CYS A 462 -9.463 -5.827 -5.093 1.00 54.42 O ATOM 1107 CB CYS A 462 -7.965 -8.650 -4.213 1.00 10.14 C ATOM 1108 SG CYS A 462 -8.898 -10.045 -4.942 1.00 12.05 S ATOM 0 H CYS A 462 -10.006 -9.247 -2.807 1.00 3.24 H new ATOM 0 HA CYS A 462 -8.310 -6.897 -3.097 1.00 13.54 H new ATOM 0 HB2 CYS A 462 -7.355 -8.170 -4.979 1.00 10.14 H new ATOM 0 HB3 CYS A 462 -7.283 -9.019 -3.447 1.00 10.14 H new ATOM 0 HG CYS A 462 -8.975 -11.014 -4.078 1.00 12.05 H new ATOM 1113 N ARG A 463 -10.835 -7.625 -5.086 1.00 53.45 N ATOM 1114 CA ARG A 463 -11.728 -7.088 -6.100 1.00 62.20 C ATOM 1115 C ARG A 463 -11.932 -5.588 -5.883 1.00 54.34 C ATOM 1116 O ARG A 463 -12.161 -4.845 -6.839 1.00 22.52 O ATOM 1117 CB ARG A 463 -13.085 -7.792 -6.066 1.00 50.04 C ATOM 1118 CG ARG A 463 -13.072 -9.051 -6.936 1.00 20.22 C ATOM 1119 CD ARG A 463 -13.258 -8.700 -8.414 1.00 63.31 C ATOM 1120 NE ARG A 463 -13.649 -9.906 -9.175 1.00 4.23 N ATOM 1121 CZ ARG A 463 -13.638 -9.987 -10.522 1.00 13.44 C ATOM 1122 NH1 ARG A 463 -13.254 -8.931 -11.269 1.00 12.34 N ATOM 1123 NH2 ARG A 463 -14.009 -11.116 -11.099 1.00 22.44 N ATOM 0 H ARG A 463 -11.093 -8.548 -4.736 1.00 53.45 H new ATOM 0 HA ARG A 463 -11.268 -7.259 -7.074 1.00 62.20 H new ATOM 0 HB2 ARG A 463 -13.335 -8.058 -5.039 1.00 50.04 H new ATOM 0 HB3 ARG A 463 -13.861 -7.111 -6.417 1.00 50.04 H new ATOM 0 HG2 ARG A 463 -12.129 -9.581 -6.801 1.00 20.22 H new ATOM 0 HG3 ARG A 463 -13.866 -9.726 -6.616 1.00 20.22 H new ATOM 0 HD2 ARG A 463 -14.022 -7.930 -8.520 1.00 63.31 H new ATOM 0 HD3 ARG A 463 -12.333 -8.289 -8.818 1.00 63.31 H new ATOM 0 HE ARG A 463 -13.946 -10.728 -8.649 1.00 4.23 H new ATOM 0 HH11 ARG A 463 -12.969 -8.063 -10.816 1.00 12.34 H new ATOM 0 HH12 ARG A 463 -13.249 -9.001 -12.287 1.00 12.34 H new ATOM 0 HH21 ARG A 463 -14.298 -11.910 -10.527 1.00 22.44 H new ATOM 0 HH22 ARG A 463 -14.006 -11.194 -12.116 1.00 22.44 H new ATOM 1133 N LEU A 464 -11.847 -5.186 -4.624 1.00 63.45 N ATOM 1134 CA LEU A 464 -12.021 -3.786 -4.271 1.00 35.45 C ATOM 1135 C LEU A 464 -10.675 -3.067 -4.381 1.00 41.51 C ATOM 1136 O LEU A 464 -10.546 -2.090 -5.118 1.00 12.23 O ATOM 1137 CB LEU A 464 -12.676 -3.659 -2.895 1.00 52.11 C ATOM 1138 CG LEU A 464 -13.048 -2.240 -2.460 1.00 43.34 C ATOM 1139 CD1 LEU A 464 -11.910 -1.595 -1.665 1.00 3.55 C ATOM 1140 CD2 LEU A 464 -13.463 -1.387 -3.661 1.00 42.12 C ATOM 0 H LEU A 464 -11.660 -5.805 -3.835 1.00 63.45 H new ATOM 0 HA LEU A 464 -12.702 -3.298 -4.968 1.00 35.45 H new ATOM 0 HB2 LEU A 464 -13.579 -4.269 -2.886 1.00 52.11 H new ATOM 0 HB3 LEU A 464 -11.999 -4.080 -2.152 1.00 52.11 H new ATOM 0 HG LEU A 464 -13.911 -2.302 -1.797 1.00 43.34 H new ATOM 0 HD11 LEU A 464 -12.200 -0.587 -1.368 1.00 3.55 H new ATOM 0 HD12 LEU A 464 -11.704 -2.191 -0.776 1.00 3.55 H new ATOM 0 HD13 LEU A 464 -11.015 -1.547 -2.285 1.00 3.55 H new ATOM 0 HD21 LEU A 464 -13.722 -0.384 -3.323 1.00 42.12 H new ATOM 0 HD22 LEU A 464 -12.636 -1.329 -4.369 1.00 42.12 H new ATOM 0 HD23 LEU A 464 -14.327 -1.840 -4.148 1.00 42.12 H new ATOM 1151 N SER A 465 -9.705 -3.575 -3.635 1.00 35.02 N ATOM 1152 CA SER A 465 -8.374 -2.993 -3.639 1.00 25.15 C ATOM 1153 C SER A 465 -8.000 -2.550 -5.054 1.00 14.25 C ATOM 1154 O SER A 465 -7.327 -1.536 -5.235 1.00 21.05 O ATOM 1155 CB SER A 465 -7.339 -3.984 -3.102 1.00 71.22 C ATOM 1156 OG SER A 465 -6.819 -4.823 -4.130 1.00 22.23 O ATOM 0 H SER A 465 -9.815 -4.384 -3.023 1.00 35.02 H new ATOM 0 HA SER A 465 -8.379 -2.123 -2.983 1.00 25.15 H new ATOM 0 HB2 SER A 465 -6.522 -3.436 -2.633 1.00 71.22 H new ATOM 0 HB3 SER A 465 -7.795 -4.600 -2.327 1.00 71.22 H new ATOM 0 HG SER A 465 -7.558 -5.270 -4.592 1.00 22.23 H new ATOM 1161 N LEU A 466 -8.454 -3.333 -6.024 1.00 42.13 N ATOM 1162 CA LEU A 466 -8.176 -3.033 -7.418 1.00 23.34 C ATOM 1163 C LEU A 466 -9.085 -1.894 -7.882 1.00 24.35 C ATOM 1164 O LEU A 466 -8.605 -0.843 -8.303 1.00 43.41 O ATOM 1165 CB LEU A 466 -8.289 -4.299 -8.270 1.00 41.50 C ATOM 1166 CG LEU A 466 -7.519 -4.290 -9.591 1.00 22.21 C ATOM 1167 CD1 LEU A 466 -6.978 -5.683 -9.919 1.00 61.25 C ATOM 1168 CD2 LEU A 466 -8.378 -3.727 -10.726 1.00 64.52 C ATOM 0 H LEU A 466 -9.012 -4.173 -5.871 1.00 42.13 H new ATOM 0 HA LEU A 466 -7.149 -2.688 -7.537 1.00 23.34 H new ATOM 0 HB2 LEU A 466 -7.942 -5.145 -7.676 1.00 41.50 H new ATOM 0 HB3 LEU A 466 -9.343 -4.473 -8.488 1.00 41.50 H new ATOM 0 HG LEU A 466 -6.660 -3.628 -9.480 1.00 22.21 H new ATOM 0 HD11 LEU A 466 -6.435 -5.649 -10.863 1.00 61.25 H new ATOM 0 HD12 LEU A 466 -6.306 -6.009 -9.125 1.00 61.25 H new ATOM 0 HD13 LEU A 466 -7.808 -6.385 -10.003 1.00 61.25 H new ATOM 0 HD21 LEU A 466 -7.805 -3.733 -11.653 1.00 64.52 H new ATOM 0 HD22 LEU A 466 -9.270 -4.342 -10.847 1.00 64.52 H new ATOM 0 HD23 LEU A 466 -8.672 -2.705 -10.487 1.00 64.52 H new ATOM 1179 N HIS A 467 -10.383 -2.143 -7.791 1.00 42.12 N ATOM 1180 CA HIS A 467 -11.365 -1.151 -8.196 1.00 42.21 C ATOM 1181 C HIS A 467 -10.976 0.217 -7.632 1.00 54.11 C ATOM 1182 O HIS A 467 -11.305 1.249 -8.215 1.00 5.41 O ATOM 1183 CB HIS A 467 -12.775 -1.582 -7.787 1.00 44.34 C ATOM 1184 CG HIS A 467 -13.829 -0.524 -8.005 1.00 13.33 C ATOM 1185 ND1 HIS A 467 -13.646 0.551 -8.858 1.00 63.23 N ATOM 1186 CD2 HIS A 467 -15.079 -0.388 -7.475 1.00 74.03 C ATOM 1187 CE1 HIS A 467 -14.742 1.295 -8.834 1.00 42.43 C ATOM 1188 NE2 HIS A 467 -15.629 0.712 -7.976 1.00 51.22 N ATOM 0 H HIS A 467 -10.778 -3.017 -7.443 1.00 42.12 H new ATOM 0 HA HIS A 467 -11.375 -1.068 -9.283 1.00 42.21 H new ATOM 0 HB2 HIS A 467 -13.049 -2.474 -8.350 1.00 44.34 H new ATOM 0 HB3 HIS A 467 -12.767 -1.860 -6.733 1.00 44.34 H new ATOM 0 HD1 HIS A 467 -12.810 0.738 -9.411 1.00 63.23 H new ATOM 0 HD2 HIS A 467 -15.542 -1.061 -6.768 1.00 74.03 H new ATOM 0 HE1 HIS A 467 -14.905 2.203 -9.395 1.00 42.43 H new ATOM 1195 N GLN A 468 -10.282 0.181 -6.503 1.00 34.12 N ATOM 1196 CA GLN A 468 -9.844 1.404 -5.855 1.00 43.50 C ATOM 1197 C GLN A 468 -8.640 1.994 -6.589 1.00 72.40 C ATOM 1198 O GLN A 468 -8.771 2.977 -7.316 1.00 44.23 O ATOM 1199 CB GLN A 468 -9.521 1.156 -4.379 1.00 14.42 C ATOM 1200 CG GLN A 468 -10.730 0.574 -3.643 1.00 32.22 C ATOM 1201 CD GLN A 468 -11.504 1.670 -2.907 1.00 71.51 C ATOM 1202 OE1 GLN A 468 -12.437 2.261 -3.426 1.00 25.43 O ATOM 1203 NE2 GLN A 468 -11.067 1.907 -1.675 1.00 31.14 N ATOM 0 H GLN A 468 -10.013 -0.677 -6.021 1.00 34.12 H new ATOM 0 HA GLN A 468 -10.659 2.127 -5.899 1.00 43.50 H new ATOM 0 HB2 GLN A 468 -8.677 0.471 -4.298 1.00 14.42 H new ATOM 0 HB3 GLN A 468 -9.219 2.091 -3.907 1.00 14.42 H new ATOM 0 HG2 GLN A 468 -11.388 0.075 -4.355 1.00 32.22 H new ATOM 0 HG3 GLN A 468 -10.398 -0.182 -2.931 1.00 32.22 H new ATOM 0 HE21 GLN A 468 -10.281 1.375 -1.302 1.00 31.14 H new ATOM 0 HE22 GLN A 468 -11.518 2.621 -1.102 1.00 31.14 H new ATOM 1210 N VAL A 469 -7.492 1.368 -6.374 1.00 21.21 N ATOM 1211 CA VAL A 469 -6.263 1.817 -7.006 1.00 40.25 C ATOM 1212 C VAL A 469 -6.559 2.229 -8.450 1.00 2.30 C ATOM 1213 O VAL A 469 -5.895 3.106 -8.998 1.00 65.41 O ATOM 1214 CB VAL A 469 -5.192 0.731 -6.902 1.00 60.33 C ATOM 1215 CG1 VAL A 469 -5.519 -0.451 -7.817 1.00 35.24 C ATOM 1216 CG2 VAL A 469 -3.805 1.298 -7.211 1.00 71.13 C ATOM 0 H VAL A 469 -7.387 0.553 -5.770 1.00 21.21 H new ATOM 0 HA VAL A 469 -5.868 2.693 -6.492 1.00 40.25 H new ATOM 0 HB VAL A 469 -5.183 0.366 -5.875 1.00 60.33 H new ATOM 0 HG11 VAL A 469 -4.741 -1.209 -7.724 1.00 35.24 H new ATOM 0 HG12 VAL A 469 -6.479 -0.879 -7.529 1.00 35.24 H new ATOM 0 HG13 VAL A 469 -5.569 -0.108 -8.850 1.00 35.24 H new ATOM 0 HG21 VAL A 469 -3.061 0.505 -7.130 1.00 71.13 H new ATOM 0 HG22 VAL A 469 -3.795 1.703 -8.223 1.00 71.13 H new ATOM 0 HG23 VAL A 469 -3.569 2.090 -6.501 1.00 71.13 H new ATOM 1226 N ASN A 470 -7.558 1.575 -9.024 1.00 70.02 N ATOM 1227 CA ASN A 470 -7.950 1.861 -10.395 1.00 51.52 C ATOM 1228 C ASN A 470 -8.705 3.192 -10.437 1.00 63.21 C ATOM 1229 O ASN A 470 -8.194 4.183 -10.958 1.00 12.24 O ATOM 1230 CB ASN A 470 -8.879 0.775 -10.940 1.00 42.23 C ATOM 1231 CG ASN A 470 -8.102 -0.235 -11.787 1.00 14.14 C ATOM 1232 OD1 ASN A 470 -8.411 -0.484 -12.940 1.00 71.31 O ATOM 1233 ND2 ASN A 470 -7.080 -0.800 -11.153 1.00 5.34 N ATOM 0 H ASN A 470 -8.108 0.848 -8.566 1.00 70.02 H new ATOM 0 HA ASN A 470 -7.046 1.901 -11.003 1.00 51.52 H new ATOM 0 HB2 ASN A 470 -9.369 0.261 -10.113 1.00 42.23 H new ATOM 0 HB3 ASN A 470 -9.665 1.232 -11.542 1.00 42.23 H new ATOM 0 HD21 ASN A 470 -6.499 -1.488 -11.633 1.00 5.34 H new ATOM 0 HD22 ASN A 470 -6.876 -0.546 -10.186 1.00 5.34 H new ATOM 1239 N GLN A 471 -9.907 3.173 -9.880 1.00 72.34 N ATOM 1240 CA GLN A 471 -10.737 4.366 -9.847 1.00 74.42 C ATOM 1241 C GLN A 471 -9.902 5.581 -9.437 1.00 61.31 C ATOM 1242 O GLN A 471 -10.232 6.712 -9.789 1.00 73.22 O ATOM 1243 CB GLN A 471 -11.929 4.177 -8.909 1.00 41.03 C ATOM 1244 CG GLN A 471 -11.507 4.333 -7.446 1.00 14.01 C ATOM 1245 CD GLN A 471 -12.153 5.570 -6.818 1.00 44.01 C ATOM 1246 OE1 GLN A 471 -12.573 5.569 -5.672 1.00 62.31 O ATOM 1247 NE2 GLN A 471 -12.209 6.623 -7.629 1.00 11.21 N ATOM 0 H GLN A 471 -10.326 2.350 -9.448 1.00 72.34 H new ATOM 0 HA GLN A 471 -11.130 4.541 -10.849 1.00 74.42 H new ATOM 0 HB2 GLN A 471 -12.703 4.906 -9.148 1.00 41.03 H new ATOM 0 HB3 GLN A 471 -12.364 3.189 -9.062 1.00 41.03 H new ATOM 0 HG2 GLN A 471 -11.794 3.444 -6.884 1.00 14.01 H new ATOM 0 HG3 GLN A 471 -10.422 4.414 -7.383 1.00 14.01 H new ATOM 0 HE21 GLN A 471 -11.839 6.557 -8.577 1.00 11.21 H new ATOM 0 HE22 GLN A 471 -12.622 7.497 -7.303 1.00 11.21 H new ATOM 1254 N ALA A 472 -8.838 5.306 -8.697 1.00 73.44 N ATOM 1255 CA ALA A 472 -7.953 6.363 -8.235 1.00 71.44 C ATOM 1256 C ALA A 472 -6.887 6.630 -9.298 1.00 21.55 C ATOM 1257 O ALA A 472 -6.539 7.780 -9.560 1.00 45.44 O ATOM 1258 CB ALA A 472 -7.347 5.969 -6.887 1.00 4.52 C ATOM 0 H ALA A 472 -8.568 4.366 -8.406 1.00 73.44 H new ATOM 0 HA ALA A 472 -8.507 7.289 -8.084 1.00 71.44 H new ATOM 0 HB1 ALA A 472 -6.684 6.761 -6.541 1.00 4.52 H new ATOM 0 HB2 ALA A 472 -8.145 5.820 -6.159 1.00 4.52 H new ATOM 0 HB3 ALA A 472 -6.780 5.045 -6.999 1.00 4.52 H new ATOM 1264 N MET A 473 -6.395 5.548 -9.883 1.00 5.14 N ATOM 1265 CA MET A 473 -5.373 5.650 -10.912 1.00 5.41 C ATOM 1266 C MET A 473 -5.892 6.427 -12.123 1.00 11.05 C ATOM 1267 O MET A 473 -5.345 7.471 -12.476 1.00 32.42 O ATOM 1268 CB MET A 473 -4.946 4.246 -11.349 1.00 72.02 C ATOM 1269 CG MET A 473 -3.782 3.737 -10.497 1.00 62.33 C ATOM 1270 SD MET A 473 -3.681 1.959 -10.603 1.00 13.21 S ATOM 1271 CE MET A 473 -2.048 1.701 -9.932 1.00 45.02 C ATOM 0 H MET A 473 -6.685 4.595 -9.664 1.00 5.14 H new ATOM 0 HA MET A 473 -4.519 6.186 -10.499 1.00 5.41 H new ATOM 0 HB2 MET A 473 -5.790 3.562 -11.263 1.00 72.02 H new ATOM 0 HB3 MET A 473 -4.653 4.261 -12.399 1.00 72.02 H new ATOM 0 HG2 MET A 473 -2.848 4.184 -10.838 1.00 62.33 H new ATOM 0 HG3 MET A 473 -3.920 4.041 -9.459 1.00 62.33 H new ATOM 0 HE1 MET A 473 -1.628 0.781 -10.339 1.00 45.02 H new ATOM 0 HE2 MET A 473 -1.408 2.542 -10.200 1.00 45.02 H new ATOM 0 HE3 MET A 473 -2.109 1.622 -8.847 1.00 45.02 H new ATOM 1279 N MET A 474 -6.941 5.889 -12.727 1.00 11.14 N ATOM 1280 CA MET A 474 -7.540 6.518 -13.891 1.00 74.14 C ATOM 1281 C MET A 474 -8.069 7.912 -13.548 1.00 34.12 C ATOM 1282 O MET A 474 -8.396 8.692 -14.443 1.00 41.24 O ATOM 1283 CB MET A 474 -8.686 5.648 -14.411 1.00 64.11 C ATOM 1284 CG MET A 474 -9.861 5.651 -13.431 1.00 33.13 C ATOM 1285 SD MET A 474 -10.935 7.036 -13.770 1.00 50.43 S ATOM 1286 CE MET A 474 -11.842 7.109 -12.235 1.00 10.25 C ATOM 0 H MET A 474 -7.392 5.023 -12.431 1.00 11.14 H new ATOM 0 HA MET A 474 -6.774 6.620 -14.660 1.00 74.14 H new ATOM 0 HB2 MET A 474 -9.016 6.017 -15.382 1.00 64.11 H new ATOM 0 HB3 MET A 474 -8.334 4.627 -14.560 1.00 64.11 H new ATOM 0 HG2 MET A 474 -10.419 4.718 -13.516 1.00 33.13 H new ATOM 0 HG3 MET A 474 -9.491 5.709 -12.407 1.00 33.13 H new ATOM 0 HE1 MET A 474 -12.911 7.059 -12.441 1.00 10.25 H new ATOM 0 HE2 MET A 474 -11.555 6.269 -11.602 1.00 10.25 H new ATOM 0 HE3 MET A 474 -11.615 8.044 -11.722 1.00 10.25 H new ATOM 1294 N SER A 475 -8.140 8.181 -12.254 1.00 54.34 N ATOM 1295 CA SER A 475 -8.626 9.467 -11.782 1.00 73.40 C ATOM 1296 C SER A 475 -7.478 10.479 -11.747 1.00 61.03 C ATOM 1297 O SER A 475 -7.704 11.683 -11.854 1.00 1.15 O ATOM 1298 CB SER A 475 -9.266 9.340 -10.398 1.00 61.44 C ATOM 1299 OG SER A 475 -9.492 10.612 -9.796 1.00 52.03 O ATOM 0 H SER A 475 -7.869 7.531 -11.516 1.00 54.34 H new ATOM 0 HA SER A 475 -9.391 9.819 -12.474 1.00 73.40 H new ATOM 0 HB2 SER A 475 -10.212 8.806 -10.484 1.00 61.44 H new ATOM 0 HB3 SER A 475 -8.621 8.743 -9.753 1.00 61.44 H new ATOM 0 HG SER A 475 -10.042 10.501 -8.993 1.00 52.03 H new ATOM 1304 N ASN A 476 -6.271 9.953 -11.595 1.00 10.32 N ATOM 1305 CA ASN A 476 -5.089 10.793 -11.544 1.00 72.44 C ATOM 1306 C ASN A 476 -3.938 10.094 -12.272 1.00 11.20 C ATOM 1307 O ASN A 476 -3.163 9.363 -11.657 1.00 51.55 O ATOM 1308 CB ASN A 476 -4.652 11.043 -10.099 1.00 21.21 C ATOM 1309 CG ASN A 476 -3.425 11.957 -10.047 1.00 42.21 C ATOM 1310 OD1 ASN A 476 -3.164 12.739 -10.944 1.00 51.13 O ATOM 1311 ND2 ASN A 476 -2.691 11.813 -8.948 1.00 0.33 N ATOM 0 H ASN A 476 -6.088 8.954 -11.506 1.00 10.32 H new ATOM 0 HA ASN A 476 -5.332 11.744 -12.017 1.00 72.44 H new ATOM 0 HB2 ASN A 476 -5.471 11.496 -9.541 1.00 21.21 H new ATOM 0 HB3 ASN A 476 -4.423 10.093 -9.615 1.00 21.21 H new ATOM 0 HD21 ASN A 476 -1.851 12.377 -8.818 1.00 0.33 H new ATOM 0 HD22 ASN A 476 -2.967 11.138 -8.235 1.00 0.33 H new ATOM 1317 N LEU A 477 -3.864 10.344 -13.571 1.00 44.24 N ATOM 1318 CA LEU A 477 -2.821 9.747 -14.388 1.00 20.41 C ATOM 1319 C LEU A 477 -1.841 10.836 -14.832 1.00 24.12 C ATOM 1320 O LEU A 477 -0.698 10.542 -15.178 1.00 43.32 O ATOM 1321 CB LEU A 477 -3.434 8.962 -15.549 1.00 33.03 C ATOM 1322 CG LEU A 477 -4.570 8.003 -15.185 1.00 33.50 C ATOM 1323 CD1 LEU A 477 -5.468 7.734 -16.394 1.00 64.14 C ATOM 1324 CD2 LEU A 477 -4.022 6.709 -14.578 1.00 62.32 C ATOM 0 H LEU A 477 -4.508 10.951 -14.078 1.00 44.24 H new ATOM 0 HA LEU A 477 -2.251 9.021 -13.808 1.00 20.41 H new ATOM 0 HB2 LEU A 477 -3.808 9.673 -16.285 1.00 33.03 H new ATOM 0 HB3 LEU A 477 -2.642 8.389 -16.032 1.00 33.03 H new ATOM 0 HG LEU A 477 -5.189 8.479 -14.424 1.00 33.50 H new ATOM 0 HD11 LEU A 477 -6.267 7.050 -16.109 1.00 64.14 H new ATOM 0 HD12 LEU A 477 -5.900 8.672 -16.742 1.00 64.14 H new ATOM 0 HD13 LEU A 477 -4.877 7.288 -17.194 1.00 64.14 H new ATOM 0 HD21 LEU A 477 -4.850 6.045 -14.328 1.00 62.32 H new ATOM 0 HD22 LEU A 477 -3.368 6.218 -15.298 1.00 62.32 H new ATOM 0 HD23 LEU A 477 -3.458 6.941 -13.675 1.00 62.32 H new ATOM 1335 N THR A 478 -2.324 12.069 -14.805 1.00 2.13 N ATOM 1336 CA THR A 478 -1.506 13.201 -15.200 1.00 52.33 C ATOM 1337 C THR A 478 -0.470 13.514 -14.118 1.00 13.22 C ATOM 1338 O THR A 478 0.345 14.422 -14.278 1.00 23.42 O ATOM 1339 CB THR A 478 -2.438 14.376 -15.507 1.00 25.53 C ATOM 1340 OG1 THR A 478 -1.555 15.464 -15.760 1.00 60.33 O ATOM 1341 CG2 THR A 478 -3.239 14.821 -14.281 1.00 51.54 C ATOM 0 H THR A 478 -3.272 12.308 -14.515 1.00 2.13 H new ATOM 0 HA THR A 478 -0.933 12.979 -16.100 1.00 52.33 H new ATOM 0 HB THR A 478 -3.123 14.097 -16.307 1.00 25.53 H new ATOM 0 HG1 THR A 478 -0.632 15.183 -15.588 1.00 60.33 H new ATOM 0 HG21 THR A 478 -3.884 15.657 -14.552 1.00 51.54 H new ATOM 0 HG22 THR A 478 -3.850 13.991 -13.925 1.00 51.54 H new ATOM 0 HG23 THR A 478 -2.554 15.132 -13.492 1.00 51.54 H new ATOM 1349 N ARG A 479 -0.538 12.747 -13.040 1.00 32.32 N ATOM 1350 CA ARG A 479 0.384 12.930 -11.931 1.00 70.53 C ATOM 1351 C ARG A 479 1.442 11.825 -11.932 1.00 10.42 C ATOM 1352 O ARG A 479 2.621 12.089 -12.158 1.00 15.10 O ATOM 1353 CB ARG A 479 -0.357 12.918 -10.593 1.00 24.33 C ATOM 1354 CG ARG A 479 -1.061 14.253 -10.344 1.00 60.33 C ATOM 1355 CD ARG A 479 -0.121 15.250 -9.663 1.00 24.21 C ATOM 1356 NE ARG A 479 -0.556 16.634 -9.952 1.00 61.52 N ATOM 1357 CZ ARG A 479 -0.191 17.329 -11.050 1.00 71.00 C ATOM 1358 NH1 ARG A 479 0.621 16.773 -11.974 1.00 34.31 N ATOM 1359 NH2 ARG A 479 -0.639 18.561 -11.207 1.00 3.33 N ATOM 0 H ARG A 479 -1.217 11.997 -12.910 1.00 32.32 H new ATOM 0 HA ARG A 479 0.867 13.899 -12.057 1.00 70.53 H new ATOM 0 HB2 ARG A 479 -1.089 12.110 -10.586 1.00 24.33 H new ATOM 0 HB3 ARG A 479 0.347 12.718 -9.785 1.00 24.33 H new ATOM 0 HG2 ARG A 479 -1.411 14.666 -11.290 1.00 60.33 H new ATOM 0 HG3 ARG A 479 -1.941 14.093 -9.721 1.00 60.33 H new ATOM 0 HD2 ARG A 479 -0.115 15.079 -8.586 1.00 24.21 H new ATOM 0 HD3 ARG A 479 0.899 15.100 -10.016 1.00 24.21 H new ATOM 0 HE ARG A 479 -1.171 17.092 -9.279 1.00 61.52 H new ATOM 0 HH11 ARG A 479 0.963 15.821 -11.845 1.00 34.31 H new ATOM 0 HH12 ARG A 479 0.892 17.305 -12.801 1.00 34.31 H new ATOM 0 HH21 ARG A 479 -1.252 18.974 -10.504 1.00 3.33 H new ATOM 0 HH22 ARG A 479 -0.372 19.099 -12.031 1.00 3.33 H new ATOM 1369 N GLN A 480 0.981 10.609 -11.675 1.00 63.32 N ATOM 1370 CA GLN A 480 1.873 9.463 -11.643 1.00 23.42 C ATOM 1371 C GLN A 480 1.582 8.531 -12.821 1.00 43.12 C ATOM 1372 O GLN A 480 2.493 7.903 -13.360 1.00 0.02 O ATOM 1373 CB GLN A 480 1.761 8.718 -10.312 1.00 4.31 C ATOM 1374 CG GLN A 480 0.319 8.274 -10.053 1.00 25.21 C ATOM 1375 CD GLN A 480 -0.498 9.407 -9.427 1.00 55.00 C ATOM 1376 OE1 GLN A 480 -1.546 9.795 -9.917 1.00 23.01 O ATOM 1377 NE2 GLN A 480 0.038 9.915 -8.322 1.00 22.54 N ATOM 0 H GLN A 480 0.002 10.393 -11.487 1.00 63.32 H new ATOM 0 HA GLN A 480 2.898 9.822 -11.734 1.00 23.42 H new ATOM 0 HB2 GLN A 480 2.417 7.848 -10.322 1.00 4.31 H new ATOM 0 HB3 GLN A 480 2.098 9.363 -9.500 1.00 4.31 H new ATOM 0 HG2 GLN A 480 -0.143 7.962 -10.989 1.00 25.21 H new ATOM 0 HG3 GLN A 480 0.314 7.408 -9.391 1.00 25.21 H new ATOM 0 HE21 GLN A 480 0.918 9.544 -7.965 1.00 22.54 H new ATOM 0 HE22 GLN A 480 -0.431 10.676 -7.831 1.00 22.54 H new ATOM 1384 N GLY A 481 0.310 8.469 -13.184 1.00 4.13 N ATOM 1385 CA GLY A 481 -0.112 7.623 -14.288 1.00 62.32 C ATOM 1386 C GLY A 481 0.654 6.299 -14.289 1.00 1.23 C ATOM 1387 O GLY A 481 0.989 5.771 -15.348 1.00 41.13 O ATOM 0 H GLY A 481 -0.442 8.990 -12.734 1.00 4.13 H new ATOM 0 HA2 GLY A 481 -1.182 7.428 -14.213 1.00 62.32 H new ATOM 0 HA3 GLY A 481 0.052 8.143 -15.232 1.00 62.32 H new ATOM 1391 N SER A 482 0.907 5.798 -13.088 1.00 74.35 N ATOM 1392 CA SER A 482 1.627 4.545 -12.936 1.00 51.22 C ATOM 1393 C SER A 482 0.692 3.468 -12.383 1.00 10.21 C ATOM 1394 O SER A 482 0.480 3.386 -11.174 1.00 32.42 O ATOM 1395 CB SER A 482 2.842 4.714 -12.022 1.00 42.54 C ATOM 1396 OG SER A 482 3.969 5.232 -12.723 1.00 31.33 O ATOM 0 H SER A 482 0.626 6.237 -12.211 1.00 74.35 H new ATOM 0 HA SER A 482 1.986 4.236 -13.918 1.00 51.22 H new ATOM 0 HB2 SER A 482 2.587 5.383 -11.200 1.00 42.54 H new ATOM 0 HB3 SER A 482 3.101 3.751 -11.581 1.00 42.54 H new ATOM 0 HG SER A 482 3.757 6.123 -13.071 1.00 31.33 H new ATOM 1401 N PRO A 483 0.143 2.648 -13.319 1.00 44.44 N ATOM 1402 CA PRO A 483 -0.765 1.579 -12.937 1.00 2.11 C ATOM 1403 C PRO A 483 -0.003 0.411 -12.310 1.00 44.22 C ATOM 1404 O PRO A 483 -0.603 -0.593 -11.926 1.00 41.24 O ATOM 1405 CB PRO A 483 -1.486 1.198 -14.219 1.00 32.32 C ATOM 1406 CG PRO A 483 -0.632 1.740 -15.354 1.00 74.51 C ATOM 1407 CD PRO A 483 0.370 2.715 -14.759 1.00 73.04 C ATOM 0 HA PRO A 483 -1.478 1.886 -12.172 1.00 2.11 H new ATOM 0 HB2 PRO A 483 -1.599 0.117 -14.297 1.00 32.32 H new ATOM 0 HB3 PRO A 483 -2.488 1.626 -14.245 1.00 32.32 H new ATOM 0 HG2 PRO A 483 -0.116 0.927 -15.865 1.00 74.51 H new ATOM 0 HG3 PRO A 483 -1.255 2.239 -16.096 1.00 74.51 H new ATOM 0 HD2 PRO A 483 1.393 2.435 -15.012 1.00 73.04 H new ATOM 0 HD3 PRO A 483 0.213 3.725 -15.138 1.00 73.04 H new ATOM 1412 N ASP A 484 1.308 0.579 -12.225 1.00 22.32 N ATOM 1413 CA ASP A 484 2.159 -0.451 -11.651 1.00 41.51 C ATOM 1414 C ASP A 484 2.490 -0.082 -10.203 1.00 32.23 C ATOM 1415 O ASP A 484 3.465 -0.579 -9.640 1.00 1.51 O ATOM 1416 CB ASP A 484 3.475 -0.571 -12.420 1.00 52.13 C ATOM 1417 CG ASP A 484 3.358 -1.207 -13.807 1.00 10.30 C ATOM 1418 OD1 ASP A 484 2.286 -1.187 -14.431 1.00 44.33 O ATOM 1419 OD2 ASP A 484 4.440 -1.748 -14.251 1.00 13.04 O ATOM 0 H ASP A 484 1.802 1.412 -12.544 1.00 22.32 H new ATOM 0 HA ASP A 484 1.624 -1.399 -11.704 1.00 41.51 H new ATOM 0 HB2 ASP A 484 3.907 0.424 -12.528 1.00 52.13 H new ATOM 0 HB3 ASP A 484 4.174 -1.159 -11.825 1.00 52.13 H new ATOM 1424 N CYS A 485 1.660 0.784 -9.641 1.00 11.04 N ATOM 1425 CA CYS A 485 1.853 1.225 -8.269 1.00 14.40 C ATOM 1426 C CYS A 485 1.015 0.328 -7.355 1.00 14.24 C ATOM 1427 O CYS A 485 0.692 0.709 -6.232 1.00 64.24 O ATOM 1428 CB CYS A 485 1.502 2.702 -8.096 1.00 41.24 C ATOM 1429 SG CYS A 485 2.992 3.733 -8.348 1.00 52.21 S ATOM 0 H CYS A 485 0.852 1.193 -10.110 1.00 11.04 H new ATOM 0 HA CYS A 485 2.905 1.136 -7.999 1.00 14.40 H new ATOM 0 HB2 CYS A 485 0.728 2.986 -8.809 1.00 41.24 H new ATOM 0 HB3 CYS A 485 1.095 2.873 -7.099 1.00 41.24 H new ATOM 0 HG CYS A 485 3.303 4.326 -7.234 1.00 52.21 H new ATOM 1434 N VAL A 486 0.685 -0.847 -7.873 1.00 64.52 N ATOM 1435 CA VAL A 486 -0.108 -1.801 -7.117 1.00 50.15 C ATOM 1436 C VAL A 486 0.803 -2.912 -6.588 1.00 10.40 C ATOM 1437 O VAL A 486 1.493 -3.571 -7.363 1.00 65.42 O ATOM 1438 CB VAL A 486 -1.256 -2.329 -7.982 1.00 65.15 C ATOM 1439 CG1 VAL A 486 -2.299 -3.051 -7.126 1.00 53.41 C ATOM 1440 CG2 VAL A 486 -1.896 -1.200 -8.791 1.00 63.23 C ATOM 0 H VAL A 486 0.952 -1.159 -8.806 1.00 64.52 H new ATOM 0 HA VAL A 486 -0.565 -1.318 -6.253 1.00 50.15 H new ATOM 0 HB VAL A 486 -0.842 -3.051 -8.685 1.00 65.15 H new ATOM 0 HG11 VAL A 486 -3.104 -3.416 -7.764 1.00 53.41 H new ATOM 0 HG12 VAL A 486 -1.831 -3.892 -6.615 1.00 53.41 H new ATOM 0 HG13 VAL A 486 -2.706 -2.359 -6.389 1.00 53.41 H new ATOM 0 HG21 VAL A 486 -2.708 -1.602 -9.397 1.00 63.23 H new ATOM 0 HG22 VAL A 486 -2.289 -0.444 -8.112 1.00 63.23 H new ATOM 0 HG23 VAL A 486 -1.147 -0.749 -9.442 1.00 63.23 H new ATOM 1450 N ILE A 487 0.772 -3.084 -5.275 1.00 51.15 N ATOM 1451 CA ILE A 487 1.586 -4.103 -4.635 1.00 34.42 C ATOM 1452 C ILE A 487 0.689 -5.007 -3.788 1.00 24.22 C ATOM 1453 O ILE A 487 0.401 -4.696 -2.634 1.00 5.23 O ATOM 1454 CB ILE A 487 2.730 -3.459 -3.849 1.00 50.22 C ATOM 1455 CG1 ILE A 487 3.345 -2.297 -4.629 1.00 52.44 C ATOM 1456 CG2 ILE A 487 3.777 -4.502 -3.452 1.00 55.14 C ATOM 1457 CD1 ILE A 487 4.162 -2.804 -5.819 1.00 21.12 C ATOM 0 H ILE A 487 0.196 -2.535 -4.637 1.00 51.15 H new ATOM 0 HA ILE A 487 2.062 -4.737 -5.383 1.00 34.42 H new ATOM 0 HB ILE A 487 2.321 -3.046 -2.927 1.00 50.22 H new ATOM 0 HG12 ILE A 487 2.555 -1.634 -4.982 1.00 52.44 H new ATOM 0 HG13 ILE A 487 3.984 -1.710 -3.969 1.00 52.44 H new ATOM 0 HG21 ILE A 487 4.579 -4.018 -2.895 1.00 55.14 H new ATOM 0 HG22 ILE A 487 3.312 -5.266 -2.829 1.00 55.14 H new ATOM 0 HG23 ILE A 487 4.187 -4.966 -4.349 1.00 55.14 H new ATOM 0 HD11 ILE A 487 4.588 -1.956 -6.356 1.00 21.12 H new ATOM 0 HD12 ILE A 487 4.966 -3.447 -5.461 1.00 21.12 H new ATOM 0 HD13 ILE A 487 3.515 -3.370 -6.489 1.00 21.12 H new ATOM 1468 N PRO A 488 0.263 -6.139 -4.410 1.00 42.20 N ATOM 1469 CA PRO A 488 -0.595 -7.091 -3.725 1.00 1.25 C ATOM 1470 C PRO A 488 0.199 -7.910 -2.704 1.00 22.24 C ATOM 1471 O PRO A 488 0.787 -8.934 -3.048 1.00 2.12 O ATOM 1472 CB PRO A 488 -1.197 -7.944 -4.830 1.00 71.10 C ATOM 1473 CG PRO A 488 -0.305 -7.744 -6.044 1.00 11.35 C ATOM 1474 CD PRO A 488 0.585 -6.541 -5.775 1.00 33.21 C ATOM 0 HA PRO A 488 -1.378 -6.607 -3.142 1.00 1.25 H new ATOM 0 HB2 PRO A 488 -1.230 -8.994 -4.539 1.00 71.10 H new ATOM 0 HB3 PRO A 488 -2.222 -7.640 -5.044 1.00 71.10 H new ATOM 0 HG2 PRO A 488 0.299 -8.633 -6.225 1.00 11.35 H new ATOM 0 HG3 PRO A 488 -0.907 -7.581 -6.938 1.00 11.35 H new ATOM 0 HD2 PRO A 488 1.639 -6.799 -5.873 1.00 33.21 H new ATOM 0 HD3 PRO A 488 0.386 -5.736 -6.482 1.00 33.21 H new ATOM 1479 N PHE A 489 0.190 -7.427 -1.470 1.00 55.03 N ATOM 1480 CA PHE A 489 0.901 -8.100 -0.398 1.00 32.45 C ATOM 1481 C PHE A 489 0.118 -9.316 0.101 1.00 32.14 C ATOM 1482 O PHE A 489 -1.109 -9.344 0.021 1.00 71.20 O ATOM 1483 CB PHE A 489 1.042 -7.094 0.746 1.00 5.24 C ATOM 1484 CG PHE A 489 2.244 -7.353 1.657 1.00 70.24 C ATOM 1485 CD1 PHE A 489 2.114 -8.161 2.743 1.00 64.34 C ATOM 1486 CD2 PHE A 489 3.444 -6.773 1.379 1.00 44.43 C ATOM 1487 CE1 PHE A 489 3.231 -8.399 3.587 1.00 25.14 C ATOM 1488 CE2 PHE A 489 4.560 -7.011 2.225 1.00 34.44 C ATOM 1489 CZ PHE A 489 4.429 -7.819 3.310 1.00 20.54 C ATOM 0 H PHE A 489 -0.299 -6.577 -1.189 1.00 55.03 H new ATOM 0 HA PHE A 489 1.870 -8.448 -0.756 1.00 32.45 H new ATOM 0 HB2 PHE A 489 1.126 -6.092 0.326 1.00 5.24 H new ATOM 0 HB3 PHE A 489 0.133 -7.113 1.347 1.00 5.24 H new ATOM 0 HD1 PHE A 489 1.162 -8.621 2.963 1.00 64.34 H new ATOM 0 HD2 PHE A 489 3.547 -6.132 0.516 1.00 44.43 H new ATOM 0 HE1 PHE A 489 3.129 -9.041 4.449 1.00 25.14 H new ATOM 0 HE2 PHE A 489 5.512 -6.550 2.006 1.00 34.44 H new ATOM 0 HZ PHE A 489 5.278 -8.001 3.953 1.00 20.54 H new ATOM 1498 N LEU A 490 0.858 -10.292 0.604 1.00 61.40 N ATOM 1499 CA LEU A 490 0.249 -11.508 1.117 1.00 14.33 C ATOM 1500 C LEU A 490 0.954 -11.922 2.409 1.00 30.31 C ATOM 1501 O LEU A 490 2.088 -12.398 2.376 1.00 22.22 O ATOM 1502 CB LEU A 490 0.242 -12.597 0.042 1.00 21.54 C ATOM 1503 CG LEU A 490 -0.389 -13.932 0.444 1.00 43.34 C ATOM 1504 CD1 LEU A 490 0.619 -14.818 1.178 1.00 72.33 C ATOM 1505 CD2 LEU A 490 -1.662 -13.710 1.266 1.00 23.42 C ATOM 0 H LEU A 490 1.876 -10.266 0.668 1.00 61.40 H new ATOM 0 HA LEU A 490 -0.797 -11.334 1.368 1.00 14.33 H new ATOM 0 HB2 LEU A 490 -0.288 -12.215 -0.830 1.00 21.54 H new ATOM 0 HB3 LEU A 490 1.271 -12.782 -0.266 1.00 21.54 H new ATOM 0 HG LEU A 490 -0.678 -14.460 -0.465 1.00 43.34 H new ATOM 0 HD11 LEU A 490 0.144 -15.760 1.452 1.00 72.33 H new ATOM 0 HD12 LEU A 490 1.470 -15.017 0.527 1.00 72.33 H new ATOM 0 HD13 LEU A 490 0.962 -14.309 2.079 1.00 72.33 H new ATOM 0 HD21 LEU A 490 -2.091 -14.674 1.539 1.00 23.42 H new ATOM 0 HD22 LEU A 490 -1.419 -13.152 2.170 1.00 23.42 H new ATOM 0 HD23 LEU A 490 -2.383 -13.146 0.675 1.00 23.42 H new ATOM 1516 N PRO A 491 0.237 -11.721 3.547 1.00 35.53 N ATOM 1517 CA PRO A 491 0.783 -12.069 4.848 1.00 52.21 C ATOM 1518 C PRO A 491 0.764 -13.584 5.063 1.00 74.15 C ATOM 1519 O PRO A 491 0.171 -14.319 4.276 1.00 73.51 O ATOM 1520 CB PRO A 491 -0.078 -11.316 5.849 1.00 74.02 C ATOM 1521 CG PRO A 491 -1.354 -10.948 5.108 1.00 71.30 C ATOM 1522 CD PRO A 491 -1.108 -11.159 3.624 1.00 11.11 C ATOM 0 HA PRO A 491 1.831 -11.789 4.954 1.00 52.21 H new ATOM 0 HB2 PRO A 491 -0.296 -11.935 6.719 1.00 74.02 H new ATOM 0 HB3 PRO A 491 0.434 -10.425 6.212 1.00 74.02 H new ATOM 0 HG2 PRO A 491 -2.185 -11.566 5.449 1.00 71.30 H new ATOM 0 HG3 PRO A 491 -1.625 -9.911 5.306 1.00 71.30 H new ATOM 0 HD2 PRO A 491 -1.845 -11.836 3.193 1.00 11.11 H new ATOM 0 HD3 PRO A 491 -1.177 -10.221 3.074 1.00 11.11 H new ATOM 1527 N LEU A 492 1.420 -14.005 6.134 1.00 61.25 N ATOM 1528 CA LEU A 492 1.486 -15.418 6.464 1.00 33.41 C ATOM 1529 C LEU A 492 0.156 -15.857 7.077 1.00 23.33 C ATOM 1530 O LEU A 492 -0.185 -17.039 7.049 1.00 23.11 O ATOM 1531 CB LEU A 492 2.699 -15.705 7.352 1.00 32.22 C ATOM 1532 CG LEU A 492 4.065 -15.362 6.754 1.00 62.20 C ATOM 1533 CD1 LEU A 492 4.175 -13.864 6.463 1.00 73.20 C ATOM 1534 CD2 LEU A 492 5.197 -15.856 7.656 1.00 72.12 C ATOM 0 H LEU A 492 1.911 -13.392 6.785 1.00 61.25 H new ATOM 0 HA LEU A 492 1.633 -16.013 5.563 1.00 33.41 H new ATOM 0 HB2 LEU A 492 2.582 -15.150 8.283 1.00 32.22 H new ATOM 0 HB3 LEU A 492 2.693 -16.764 7.610 1.00 32.22 H new ATOM 0 HG LEU A 492 4.162 -15.883 5.801 1.00 62.20 H new ATOM 0 HD11 LEU A 492 5.155 -13.647 6.039 1.00 73.20 H new ATOM 0 HD12 LEU A 492 3.400 -13.573 5.754 1.00 73.20 H new ATOM 0 HD13 LEU A 492 4.048 -13.303 7.389 1.00 73.20 H new ATOM 0 HD21 LEU A 492 6.157 -15.600 7.208 1.00 72.12 H new ATOM 0 HD22 LEU A 492 5.115 -15.383 8.635 1.00 72.12 H new ATOM 0 HD23 LEU A 492 5.127 -16.938 7.769 1.00 72.12 H new ATOM 1545 N GLU A 493 -0.560 -14.882 7.618 1.00 3.11 N ATOM 1546 CA GLU A 493 -1.846 -15.153 8.238 1.00 24.32 C ATOM 1547 C GLU A 493 -2.858 -15.607 7.185 1.00 5.13 C ATOM 1548 O GLU A 493 -3.705 -16.457 7.458 1.00 30.54 O ATOM 1549 CB GLU A 493 -2.358 -13.927 8.998 1.00 32.45 C ATOM 1550 CG GLU A 493 -1.874 -13.940 10.449 1.00 12.40 C ATOM 1551 CD GLU A 493 -2.854 -14.700 11.346 1.00 70.21 C ATOM 1552 OE1 GLU A 493 -3.999 -14.951 10.941 1.00 1.21 O ATOM 1553 OE2 GLU A 493 -2.387 -15.034 12.502 1.00 2.21 O ATOM 0 H GLU A 493 -0.274 -13.903 7.640 1.00 3.11 H new ATOM 0 HA GLU A 493 -1.716 -15.959 8.960 1.00 24.32 H new ATOM 0 HB2 GLU A 493 -2.013 -13.018 8.504 1.00 32.45 H new ATOM 0 HB3 GLU A 493 -3.448 -13.909 8.974 1.00 32.45 H new ATOM 0 HG2 GLU A 493 -0.890 -14.405 10.504 1.00 12.40 H new ATOM 0 HG3 GLU A 493 -1.764 -12.917 10.809 1.00 12.40 H new ATOM 1559 N SER A 494 -2.738 -15.021 6.003 1.00 70.30 N ATOM 1560 CA SER A 494 -3.631 -15.355 4.907 1.00 10.13 C ATOM 1561 C SER A 494 -2.825 -15.864 3.711 1.00 14.33 C ATOM 1562 O SER A 494 -1.596 -15.851 3.736 1.00 75.31 O ATOM 1563 CB SER A 494 -4.480 -14.148 4.501 1.00 42.14 C ATOM 1564 OG SER A 494 -5.584 -13.950 5.381 1.00 70.51 O ATOM 0 H SER A 494 -2.035 -14.316 5.780 1.00 70.30 H new ATOM 0 HA SER A 494 -4.305 -16.143 5.243 1.00 10.13 H new ATOM 0 HB2 SER A 494 -3.858 -13.253 4.494 1.00 42.14 H new ATOM 0 HB3 SER A 494 -4.848 -14.289 3.485 1.00 42.14 H new ATOM 0 HG SER A 494 -6.263 -14.636 5.213 1.00 70.51 H new ATOM 1569 N SER A 495 -3.551 -16.300 2.691 1.00 40.24 N ATOM 1570 CA SER A 495 -2.919 -16.813 1.487 1.00 64.02 C ATOM 1571 C SER A 495 -3.689 -16.343 0.251 1.00 3.43 C ATOM 1572 O SER A 495 -4.825 -15.881 0.361 1.00 31.30 O ATOM 1573 CB SER A 495 -2.839 -18.340 1.516 1.00 73.30 C ATOM 1574 OG SER A 495 -1.570 -18.801 1.975 1.00 43.21 O ATOM 0 H SER A 495 -4.571 -16.308 2.674 1.00 40.24 H new ATOM 0 HA SER A 495 -1.902 -16.424 1.441 1.00 64.02 H new ATOM 0 HB2 SER A 495 -3.623 -18.732 2.164 1.00 73.30 H new ATOM 0 HB3 SER A 495 -3.027 -18.732 0.516 1.00 73.30 H new ATOM 0 HG SER A 495 -1.560 -19.781 1.980 1.00 43.21 H new ATOM 1579 N PRO A 496 -3.024 -16.483 -0.926 1.00 11.23 N ATOM 1580 CA PRO A 496 -3.635 -16.079 -2.182 1.00 21.33 C ATOM 1581 C PRO A 496 -4.700 -17.086 -2.623 1.00 75.41 C ATOM 1582 O PRO A 496 -5.706 -16.709 -3.221 1.00 71.53 O ATOM 1583 CB PRO A 496 -2.478 -15.968 -3.164 1.00 5.50 C ATOM 1584 CG PRO A 496 -1.335 -16.758 -2.550 1.00 61.51 C ATOM 1585 CD PRO A 496 -1.680 -17.027 -1.095 1.00 70.04 C ATOM 0 HA PRO A 496 -4.168 -15.131 -2.105 1.00 21.33 H new ATOM 0 HB2 PRO A 496 -2.753 -16.371 -4.139 1.00 5.50 H new ATOM 0 HB3 PRO A 496 -2.195 -14.927 -3.318 1.00 5.50 H new ATOM 0 HG2 PRO A 496 -1.188 -17.695 -3.087 1.00 61.51 H new ATOM 0 HG3 PRO A 496 -0.402 -16.199 -2.624 1.00 61.51 H new ATOM 0 HD2 PRO A 496 -1.654 -18.094 -0.873 1.00 70.04 H new ATOM 0 HD3 PRO A 496 -0.970 -16.544 -0.424 1.00 70.04 H new ATOM 1590 N ALA A 497 -4.439 -18.347 -2.311 1.00 15.42 N ATOM 1591 CA ALA A 497 -5.363 -19.411 -2.669 1.00 45.11 C ATOM 1592 C ALA A 497 -6.708 -19.165 -1.981 1.00 5.43 C ATOM 1593 O ALA A 497 -7.749 -19.593 -2.476 1.00 73.10 O ATOM 1594 CB ALA A 497 -4.754 -20.764 -2.293 1.00 71.14 C ATOM 0 H ALA A 497 -3.603 -18.656 -1.815 1.00 15.42 H new ATOM 0 HA ALA A 497 -5.540 -19.421 -3.745 1.00 45.11 H new ATOM 0 HB1 ALA A 497 -5.447 -21.562 -2.561 1.00 71.14 H new ATOM 0 HB2 ALA A 497 -3.815 -20.902 -2.830 1.00 71.14 H new ATOM 0 HB3 ALA A 497 -4.566 -20.793 -1.220 1.00 71.14 H new ATOM 1600 N GLN A 498 -6.641 -18.478 -0.850 1.00 11.30 N ATOM 1601 CA GLN A 498 -7.841 -18.171 -0.090 1.00 44.05 C ATOM 1602 C GLN A 498 -8.702 -17.156 -0.843 1.00 73.43 C ATOM 1603 O GLN A 498 -9.865 -16.948 -0.503 1.00 43.22 O ATOM 1604 CB GLN A 498 -7.486 -17.659 1.308 1.00 53.42 C ATOM 1605 CG GLN A 498 -6.238 -18.359 1.848 1.00 52.12 C ATOM 1606 CD GLN A 498 -6.286 -18.462 3.375 1.00 1.30 C ATOM 1607 OE1 GLN A 498 -6.144 -17.487 4.093 1.00 64.10 O ATOM 1608 NE2 GLN A 498 -6.492 -19.695 3.827 1.00 10.15 N ATOM 0 H GLN A 498 -5.775 -18.126 -0.442 1.00 11.30 H new ATOM 0 HA GLN A 498 -8.418 -19.088 0.029 1.00 44.05 H new ATOM 0 HB2 GLN A 498 -7.317 -16.583 1.273 1.00 53.42 H new ATOM 0 HB3 GLN A 498 -8.324 -17.828 1.985 1.00 53.42 H new ATOM 0 HG2 GLN A 498 -6.159 -19.356 1.415 1.00 52.12 H new ATOM 0 HG3 GLN A 498 -5.348 -17.808 1.545 1.00 52.12 H new ATOM 0 HE21 GLN A 498 -6.603 -20.467 3.170 1.00 10.15 H new ATOM 0 HE22 GLN A 498 -6.539 -19.869 4.831 1.00 10.15 H new ATOM 1615 N LEU A 499 -8.097 -16.550 -1.855 1.00 33.42 N ATOM 1616 CA LEU A 499 -8.794 -15.561 -2.660 1.00 21.24 C ATOM 1617 C LEU A 499 -9.499 -16.263 -3.823 1.00 51.44 C ATOM 1618 O LEU A 499 -9.231 -17.429 -4.103 1.00 22.53 O ATOM 1619 CB LEU A 499 -7.834 -14.455 -3.100 1.00 22.52 C ATOM 1620 CG LEU A 499 -6.787 -14.025 -2.070 1.00 32.34 C ATOM 1621 CD1 LEU A 499 -5.890 -12.919 -2.628 1.00 43.32 C ATOM 1622 CD2 LEU A 499 -7.450 -13.618 -0.752 1.00 34.20 C ATOM 0 H LEU A 499 -7.132 -16.725 -2.136 1.00 33.42 H new ATOM 0 HA LEU A 499 -9.565 -15.065 -2.071 1.00 21.24 H new ATOM 0 HB2 LEU A 499 -7.315 -14.788 -3.999 1.00 22.52 H new ATOM 0 HB3 LEU A 499 -8.422 -13.580 -3.378 1.00 22.52 H new ATOM 0 HG LEU A 499 -6.146 -14.880 -1.857 1.00 32.34 H new ATOM 0 HD11 LEU A 499 -5.155 -12.632 -1.876 1.00 43.32 H new ATOM 0 HD12 LEU A 499 -5.376 -13.282 -3.518 1.00 43.32 H new ATOM 0 HD13 LEU A 499 -6.499 -12.053 -2.889 1.00 43.32 H new ATOM 0 HD21 LEU A 499 -6.684 -13.317 -0.037 1.00 34.20 H new ATOM 0 HD22 LEU A 499 -8.129 -12.784 -0.929 1.00 34.20 H new ATOM 0 HD23 LEU A 499 -8.009 -14.463 -0.350 1.00 34.20 H new ATOM 1633 N SER A 500 -10.387 -15.521 -4.469 1.00 70.55 N ATOM 1634 CA SER A 500 -11.131 -16.056 -5.595 1.00 52.14 C ATOM 1635 C SER A 500 -10.179 -16.379 -6.747 1.00 34.42 C ATOM 1636 O SER A 500 -9.048 -15.896 -6.777 1.00 20.11 O ATOM 1637 CB SER A 500 -12.211 -15.075 -6.058 1.00 33.53 C ATOM 1638 OG SER A 500 -13.297 -15.740 -6.700 1.00 62.13 O ATOM 0 H SER A 500 -10.607 -14.553 -4.233 1.00 70.55 H new ATOM 0 HA SER A 500 -11.625 -16.973 -5.273 1.00 52.14 H new ATOM 0 HB2 SER A 500 -12.585 -14.516 -5.200 1.00 33.53 H new ATOM 0 HB3 SER A 500 -11.773 -14.351 -6.744 1.00 33.53 H new ATOM 0 HG SER A 500 -13.525 -15.269 -7.529 1.00 62.13 H new ATOM 1643 N SER A 501 -10.670 -17.194 -7.670 1.00 4.51 N ATOM 1644 CA SER A 501 -9.876 -17.587 -8.820 1.00 34.25 C ATOM 1645 C SER A 501 -9.676 -16.389 -9.751 1.00 21.30 C ATOM 1646 O SER A 501 -8.901 -16.463 -10.705 1.00 4.43 O ATOM 1647 CB SER A 501 -10.537 -18.742 -9.578 1.00 44.00 C ATOM 1648 OG SER A 501 -10.474 -19.964 -8.847 1.00 22.44 O ATOM 0 H SER A 501 -11.609 -17.593 -7.644 1.00 4.51 H new ATOM 0 HA SER A 501 -8.905 -17.930 -8.464 1.00 34.25 H new ATOM 0 HB2 SER A 501 -11.579 -18.494 -9.781 1.00 44.00 H new ATOM 0 HB3 SER A 501 -10.046 -18.871 -10.543 1.00 44.00 H new ATOM 0 HG SER A 501 -10.907 -20.676 -9.362 1.00 22.44 H new ATOM 1653 N ASP A 502 -10.386 -15.315 -9.441 1.00 33.33 N ATOM 1654 CA ASP A 502 -10.295 -14.103 -10.239 1.00 41.13 C ATOM 1655 C ASP A 502 -9.099 -13.274 -9.764 1.00 14.42 C ATOM 1656 O ASP A 502 -8.413 -12.650 -10.571 1.00 71.23 O ATOM 1657 CB ASP A 502 -11.554 -13.248 -10.086 1.00 12.32 C ATOM 1658 CG ASP A 502 -12.874 -14.017 -10.182 1.00 44.23 C ATOM 1659 OD1 ASP A 502 -13.714 -13.959 -9.273 1.00 2.21 O ATOM 1660 OD2 ASP A 502 -13.025 -14.707 -11.261 1.00 73.23 O ATOM 0 H ASP A 502 -11.026 -15.258 -8.649 1.00 33.33 H new ATOM 0 HA ASP A 502 -10.181 -14.394 -11.283 1.00 41.13 H new ATOM 0 HB2 ASP A 502 -11.516 -12.741 -9.122 1.00 12.32 H new ATOM 0 HB3 ASP A 502 -11.545 -12.474 -10.854 1.00 12.32 H new ATOM 1665 N THR A 503 -8.888 -13.294 -8.457 1.00 44.01 N ATOM 1666 CA THR A 503 -7.788 -12.553 -7.865 1.00 1.11 C ATOM 1667 C THR A 503 -6.528 -12.691 -8.722 1.00 14.52 C ATOM 1668 O THR A 503 -5.827 -11.711 -8.964 1.00 24.32 O ATOM 1669 CB THR A 503 -7.603 -13.047 -6.428 1.00 21.33 C ATOM 1670 OG1 THR A 503 -8.844 -12.748 -5.795 1.00 72.41 O ATOM 1671 CG2 THR A 503 -6.578 -12.217 -5.651 1.00 24.22 C ATOM 0 H THR A 503 -9.461 -13.812 -7.791 1.00 44.01 H new ATOM 0 HA THR A 503 -8.004 -11.485 -7.832 1.00 1.11 H new ATOM 0 HB THR A 503 -7.290 -14.091 -6.441 1.00 21.33 H new ATOM 0 HG1 THR A 503 -8.926 -11.778 -5.678 1.00 72.41 H new ATOM 0 HG21 THR A 503 -6.485 -12.609 -4.638 1.00 24.22 H new ATOM 0 HG22 THR A 503 -5.611 -12.271 -6.152 1.00 24.22 H new ATOM 0 HG23 THR A 503 -6.907 -11.179 -5.609 1.00 24.22 H new ATOM 1679 N ALA A 504 -6.281 -13.919 -9.159 1.00 63.21 N ATOM 1680 CA ALA A 504 -5.119 -14.198 -9.984 1.00 41.13 C ATOM 1681 C ALA A 504 -5.137 -13.283 -11.209 1.00 33.22 C ATOM 1682 O ALA A 504 -4.111 -12.712 -11.578 1.00 12.34 O ATOM 1683 CB ALA A 504 -5.106 -15.680 -10.361 1.00 20.04 C ATOM 0 H ALA A 504 -6.866 -14.730 -8.957 1.00 63.21 H new ATOM 0 HA ALA A 504 -4.200 -13.994 -9.435 1.00 41.13 H new ATOM 0 HB1 ALA A 504 -4.234 -15.890 -10.980 1.00 20.04 H new ATOM 0 HB2 ALA A 504 -5.063 -16.285 -9.456 1.00 20.04 H new ATOM 0 HB3 ALA A 504 -6.012 -15.922 -10.916 1.00 20.04 H new ATOM 1689 N SER A 505 -6.314 -13.175 -11.809 1.00 62.44 N ATOM 1690 CA SER A 505 -6.479 -12.339 -12.986 1.00 15.32 C ATOM 1691 C SER A 505 -6.511 -10.864 -12.582 1.00 45.14 C ATOM 1692 O SER A 505 -6.315 -9.983 -13.417 1.00 34.20 O ATOM 1693 CB SER A 505 -7.754 -12.708 -13.748 1.00 75.21 C ATOM 1694 OG SER A 505 -7.526 -13.747 -14.698 1.00 64.31 O ATOM 0 H SER A 505 -7.162 -13.652 -11.502 1.00 62.44 H new ATOM 0 HA SER A 505 -5.629 -12.509 -13.647 1.00 15.32 H new ATOM 0 HB2 SER A 505 -8.520 -13.025 -13.041 1.00 75.21 H new ATOM 0 HB3 SER A 505 -8.138 -11.826 -14.260 1.00 75.21 H new ATOM 0 HG SER A 505 -8.363 -13.955 -15.162 1.00 64.31 H new ATOM 1699 N LEU A 506 -6.759 -10.641 -11.300 1.00 43.52 N ATOM 1700 CA LEU A 506 -6.819 -9.288 -10.773 1.00 51.34 C ATOM 1701 C LEU A 506 -5.397 -8.752 -10.593 1.00 34.24 C ATOM 1702 O LEU A 506 -5.140 -7.572 -10.830 1.00 1.43 O ATOM 1703 CB LEU A 506 -7.658 -9.247 -9.495 1.00 21.01 C ATOM 1704 CG LEU A 506 -9.122 -9.665 -9.640 1.00 43.30 C ATOM 1705 CD1 LEU A 506 -9.773 -9.870 -8.269 1.00 64.32 C ATOM 1706 CD2 LEU A 506 -9.897 -8.660 -10.495 1.00 0.10 C ATOM 0 H LEU A 506 -6.921 -11.375 -10.610 1.00 43.52 H new ATOM 0 HA LEU A 506 -7.323 -8.627 -11.478 1.00 51.34 H new ATOM 0 HB2 LEU A 506 -7.188 -9.894 -8.755 1.00 21.01 H new ATOM 0 HB3 LEU A 506 -7.628 -8.233 -9.097 1.00 21.01 H new ATOM 0 HG LEU A 506 -9.153 -10.623 -10.159 1.00 43.30 H new ATOM 0 HD11 LEU A 506 -10.814 -10.167 -8.401 1.00 64.32 H new ATOM 0 HD12 LEU A 506 -9.239 -10.650 -7.726 1.00 64.32 H new ATOM 0 HD13 LEU A 506 -9.730 -8.939 -7.703 1.00 64.32 H new ATOM 0 HD21 LEU A 506 -10.935 -8.981 -10.582 1.00 0.10 H new ATOM 0 HD22 LEU A 506 -9.859 -7.677 -10.025 1.00 0.10 H new ATOM 0 HD23 LEU A 506 -9.449 -8.605 -11.487 1.00 0.10 H new ATOM 1717 N LEU A 507 -4.510 -9.644 -10.178 1.00 44.45 N ATOM 1718 CA LEU A 507 -3.121 -9.275 -9.962 1.00 12.22 C ATOM 1719 C LEU A 507 -2.254 -9.924 -11.041 1.00 34.22 C ATOM 1720 O LEU A 507 -1.034 -10.000 -10.901 1.00 75.34 O ATOM 1721 CB LEU A 507 -2.689 -9.621 -8.536 1.00 43.43 C ATOM 1722 CG LEU A 507 -2.324 -11.085 -8.283 1.00 44.23 C ATOM 1723 CD1 LEU A 507 -0.827 -11.319 -8.487 1.00 2.55 C ATOM 1724 CD2 LEU A 507 -2.791 -11.533 -6.895 1.00 63.12 C ATOM 0 H LEU A 507 -4.726 -10.622 -9.985 1.00 44.45 H new ATOM 0 HA LEU A 507 -2.994 -8.196 -10.055 1.00 12.22 H new ATOM 0 HB2 LEU A 507 -1.829 -9.003 -8.278 1.00 43.43 H new ATOM 0 HB3 LEU A 507 -3.495 -9.345 -7.856 1.00 43.43 H new ATOM 0 HG LEU A 507 -2.848 -11.700 -9.014 1.00 44.23 H new ATOM 0 HD11 LEU A 507 -0.594 -12.367 -8.301 1.00 2.55 H new ATOM 0 HD12 LEU A 507 -0.555 -11.063 -9.511 1.00 2.55 H new ATOM 0 HD13 LEU A 507 -0.263 -10.694 -7.795 1.00 2.55 H new ATOM 0 HD21 LEU A 507 -2.520 -12.577 -6.739 1.00 63.12 H new ATOM 0 HD22 LEU A 507 -2.313 -10.917 -6.134 1.00 63.12 H new ATOM 0 HD23 LEU A 507 -3.873 -11.425 -6.823 1.00 63.12 H new ATOM 1735 N SER A 508 -2.917 -10.378 -12.096 1.00 62.34 N ATOM 1736 CA SER A 508 -2.222 -11.017 -13.200 1.00 25.14 C ATOM 1737 C SER A 508 -1.295 -10.013 -13.888 1.00 42.12 C ATOM 1738 O SER A 508 -1.755 -9.143 -14.626 1.00 54.15 O ATOM 1739 CB SER A 508 -3.212 -11.604 -14.209 1.00 65.52 C ATOM 1740 OG SER A 508 -4.288 -10.711 -14.481 1.00 41.34 O ATOM 0 H SER A 508 -3.929 -10.315 -12.209 1.00 62.34 H new ATOM 0 HA SER A 508 -1.625 -11.836 -12.799 1.00 25.14 H new ATOM 0 HB2 SER A 508 -2.689 -11.836 -15.137 1.00 65.52 H new ATOM 0 HB3 SER A 508 -3.609 -12.543 -13.824 1.00 65.52 H new ATOM 0 HG SER A 508 -3.934 -9.812 -14.646 1.00 41.34 H new ATOM 1745 N GLY A 509 -0.006 -10.167 -13.622 1.00 70.41 N ATOM 1746 CA GLY A 509 0.989 -9.284 -14.206 1.00 42.05 C ATOM 1747 C GLY A 509 1.676 -8.442 -13.129 1.00 10.50 C ATOM 1748 O GLY A 509 2.841 -8.075 -13.271 1.00 43.24 O ATOM 0 H GLY A 509 0.372 -10.890 -13.010 1.00 70.41 H new ATOM 0 HA2 GLY A 509 1.733 -9.873 -14.742 1.00 42.05 H new ATOM 0 HA3 GLY A 509 0.515 -8.629 -14.937 1.00 42.05 H new ATOM 1752 N LEU A 510 0.923 -8.159 -12.075 1.00 22.42 N ATOM 1753 CA LEU A 510 1.445 -7.368 -10.973 1.00 73.22 C ATOM 1754 C LEU A 510 2.607 -8.116 -10.319 1.00 73.42 C ATOM 1755 O LEU A 510 3.045 -9.150 -10.819 1.00 33.44 O ATOM 1756 CB LEU A 510 0.323 -7.002 -9.999 1.00 71.41 C ATOM 1757 CG LEU A 510 -0.870 -6.257 -10.600 1.00 52.45 C ATOM 1758 CD1 LEU A 510 -1.504 -5.316 -9.572 1.00 33.01 C ATOM 1759 CD2 LEU A 510 -0.470 -5.520 -11.881 1.00 64.25 C ATOM 0 H LEU A 510 -0.044 -8.463 -11.961 1.00 22.42 H new ATOM 0 HA LEU A 510 1.841 -6.421 -11.338 1.00 73.22 H new ATOM 0 HB2 LEU A 510 -0.042 -7.918 -9.536 1.00 71.41 H new ATOM 0 HB3 LEU A 510 0.745 -6.389 -9.203 1.00 71.41 H new ATOM 0 HG LEU A 510 -1.627 -6.992 -10.875 1.00 52.45 H new ATOM 0 HD11 LEU A 510 -2.350 -4.799 -10.025 1.00 33.01 H new ATOM 0 HD12 LEU A 510 -1.849 -5.893 -8.714 1.00 33.01 H new ATOM 0 HD13 LEU A 510 -0.765 -4.585 -9.244 1.00 33.01 H new ATOM 0 HD21 LEU A 510 -1.337 -4.999 -12.287 1.00 64.25 H new ATOM 0 HD22 LEU A 510 0.314 -4.798 -11.655 1.00 64.25 H new ATOM 0 HD23 LEU A 510 -0.102 -6.238 -12.614 1.00 64.25 H new ATOM 1770 N VAL A 511 3.076 -7.563 -9.209 1.00 31.21 N ATOM 1771 CA VAL A 511 4.180 -8.164 -8.482 1.00 4.01 C ATOM 1772 C VAL A 511 3.688 -8.628 -7.109 1.00 53.23 C ATOM 1773 O VAL A 511 3.783 -7.891 -6.130 1.00 63.32 O ATOM 1774 CB VAL A 511 5.348 -7.181 -8.396 1.00 73.53 C ATOM 1775 CG1 VAL A 511 6.363 -7.624 -7.340 1.00 31.02 C ATOM 1776 CG2 VAL A 511 6.019 -7.006 -9.761 1.00 41.52 C ATOM 0 H VAL A 511 2.711 -6.705 -8.796 1.00 31.21 H new ATOM 0 HA VAL A 511 4.551 -9.043 -9.010 1.00 4.01 H new ATOM 0 HB VAL A 511 4.949 -6.214 -8.091 1.00 73.53 H new ATOM 0 HG11 VAL A 511 7.183 -6.907 -7.300 1.00 31.02 H new ATOM 0 HG12 VAL A 511 5.876 -7.673 -6.366 1.00 31.02 H new ATOM 0 HG13 VAL A 511 6.754 -8.608 -7.601 1.00 31.02 H new ATOM 0 HG21 VAL A 511 6.846 -6.302 -9.672 1.00 41.52 H new ATOM 0 HG22 VAL A 511 6.397 -7.968 -10.107 1.00 41.52 H new ATOM 0 HG23 VAL A 511 5.292 -6.623 -10.477 1.00 41.52 H new ATOM 1786 N ARG A 512 3.171 -9.847 -7.082 1.00 4.20 N ATOM 1787 CA ARG A 512 2.663 -10.419 -5.846 1.00 64.40 C ATOM 1788 C ARG A 512 3.718 -10.317 -4.743 1.00 42.41 C ATOM 1789 O ARG A 512 4.736 -11.007 -4.787 1.00 64.00 O ATOM 1790 CB ARG A 512 2.273 -11.886 -6.037 1.00 43.50 C ATOM 1791 CG ARG A 512 1.073 -12.252 -5.160 1.00 74.32 C ATOM 1792 CD ARG A 512 1.509 -12.525 -3.720 1.00 3.21 C ATOM 1793 NE ARG A 512 2.495 -13.629 -3.690 1.00 53.42 N ATOM 1794 CZ ARG A 512 2.193 -14.920 -3.947 1.00 42.11 C ATOM 1795 NH1 ARG A 512 0.929 -15.280 -4.256 1.00 61.44 N ATOM 1796 NH2 ARG A 512 3.153 -15.825 -3.892 1.00 74.33 N ATOM 0 H ARG A 512 3.093 -10.455 -7.897 1.00 4.20 H new ATOM 0 HA ARG A 512 1.776 -9.855 -5.559 1.00 64.40 H new ATOM 0 HB2 ARG A 512 2.032 -12.069 -7.084 1.00 43.50 H new ATOM 0 HB3 ARG A 512 3.119 -12.527 -5.788 1.00 43.50 H new ATOM 0 HG2 ARG A 512 0.346 -11.440 -5.176 1.00 74.32 H new ATOM 0 HG3 ARG A 512 0.576 -13.133 -5.566 1.00 74.32 H new ATOM 0 HD2 ARG A 512 1.945 -11.625 -3.287 1.00 3.21 H new ATOM 0 HD3 ARG A 512 0.642 -12.784 -3.112 1.00 3.21 H new ATOM 0 HE ARG A 512 3.462 -13.400 -3.461 1.00 53.42 H new ATOM 0 HH11 ARG A 512 0.193 -14.575 -4.297 1.00 61.44 H new ATOM 0 HH12 ARG A 512 0.710 -16.257 -4.449 1.00 61.44 H new ATOM 0 HH21 ARG A 512 4.105 -15.545 -3.658 1.00 74.33 H new ATOM 0 HH22 ARG A 512 2.942 -16.804 -4.083 1.00 74.33 H new ATOM 1806 N LEU A 513 3.438 -9.454 -3.777 1.00 73.55 N ATOM 1807 CA LEU A 513 4.350 -9.253 -2.665 1.00 42.14 C ATOM 1808 C LEU A 513 4.000 -10.234 -1.542 1.00 73.32 C ATOM 1809 O LEU A 513 2.837 -10.368 -1.172 1.00 3.33 O ATOM 1810 CB LEU A 513 4.346 -7.788 -2.224 1.00 55.04 C ATOM 1811 CG LEU A 513 5.666 -7.250 -1.670 1.00 52.01 C ATOM 1812 CD1 LEU A 513 6.743 -7.217 -2.757 1.00 53.12 C ATOM 1813 CD2 LEU A 513 5.469 -5.881 -1.017 1.00 22.51 C ATOM 0 H LEU A 513 2.592 -8.886 -3.742 1.00 73.55 H new ATOM 0 HA LEU A 513 5.375 -9.466 -2.970 1.00 42.14 H new ATOM 0 HB2 LEU A 513 4.056 -7.174 -3.076 1.00 55.04 H new ATOM 0 HB3 LEU A 513 3.577 -7.661 -1.462 1.00 55.04 H new ATOM 0 HG LEU A 513 6.013 -7.930 -0.892 1.00 52.01 H new ATOM 0 HD11 LEU A 513 7.672 -6.831 -2.337 1.00 53.12 H new ATOM 0 HD12 LEU A 513 6.908 -8.225 -3.136 1.00 53.12 H new ATOM 0 HD13 LEU A 513 6.417 -6.571 -3.573 1.00 53.12 H new ATOM 0 HD21 LEU A 513 6.423 -5.521 -0.631 1.00 22.51 H new ATOM 0 HD22 LEU A 513 5.088 -5.177 -1.756 1.00 22.51 H new ATOM 0 HD23 LEU A 513 4.756 -5.968 -0.197 1.00 22.51 H new ATOM 1824 N ASP A 514 5.032 -10.891 -1.033 1.00 24.32 N ATOM 1825 CA ASP A 514 4.849 -11.855 0.039 1.00 3.32 C ATOM 1826 C ASP A 514 5.673 -11.423 1.254 1.00 31.33 C ATOM 1827 O ASP A 514 6.521 -10.537 1.149 1.00 43.53 O ATOM 1828 CB ASP A 514 5.322 -13.246 -0.384 1.00 24.42 C ATOM 1829 CG ASP A 514 4.255 -14.120 -1.045 1.00 73.11 C ATOM 1830 OD1 ASP A 514 4.511 -14.784 -2.061 1.00 61.33 O ATOM 1831 OD2 ASP A 514 3.101 -14.102 -0.469 1.00 53.14 O ATOM 0 H ASP A 514 5.997 -10.775 -1.343 1.00 24.32 H new ATOM 0 HA ASP A 514 3.787 -11.894 0.279 1.00 3.32 H new ATOM 0 HB2 ASP A 514 6.157 -13.134 -1.075 1.00 24.42 H new ATOM 0 HB3 ASP A 514 5.703 -13.766 0.495 1.00 24.42 H new ATOM 1836 N GLU A 515 5.398 -12.070 2.377 1.00 34.44 N ATOM 1837 CA GLU A 515 6.104 -11.764 3.609 1.00 73.11 C ATOM 1838 C GLU A 515 6.818 -13.012 4.135 1.00 24.22 C ATOM 1839 O GLU A 515 7.373 -12.997 5.232 1.00 73.12 O ATOM 1840 CB GLU A 515 5.151 -11.194 4.660 1.00 14.42 C ATOM 1841 CG GLU A 515 5.894 -10.876 5.958 1.00 44.50 C ATOM 1842 CD GLU A 515 7.243 -10.211 5.671 1.00 3.55 C ATOM 1843 OE1 GLU A 515 8.292 -10.745 6.059 1.00 55.34 O ATOM 1844 OE2 GLU A 515 7.173 -9.100 5.018 1.00 22.41 O ATOM 0 H GLU A 515 4.696 -12.805 2.459 1.00 34.44 H new ATOM 0 HA GLU A 515 6.854 -11.002 3.396 1.00 73.11 H new ATOM 0 HB2 GLU A 515 4.679 -10.290 4.276 1.00 14.42 H new ATOM 0 HB3 GLU A 515 4.353 -11.910 4.859 1.00 14.42 H new ATOM 0 HG2 GLU A 515 5.285 -10.218 6.578 1.00 44.50 H new ATOM 0 HG3 GLU A 515 6.050 -11.793 6.525 1.00 44.50 H new ATOM 1850 N HIS A 516 6.781 -14.060 3.326 1.00 45.00 N ATOM 1851 CA HIS A 516 7.418 -15.313 3.697 1.00 42.43 C ATOM 1852 C HIS A 516 8.239 -15.839 2.518 1.00 1.00 C ATOM 1853 O HIS A 516 8.709 -16.977 2.542 1.00 43.02 O ATOM 1854 CB HIS A 516 6.382 -16.323 4.196 1.00 62.40 C ATOM 1855 CG HIS A 516 5.168 -16.446 3.306 1.00 52.44 C ATOM 1856 ND1 HIS A 516 3.983 -17.023 3.731 1.00 22.21 N ATOM 1857 CD2 HIS A 516 4.965 -16.060 2.013 1.00 62.45 C ATOM 1858 CE1 HIS A 516 3.116 -16.982 2.730 1.00 64.13 C ATOM 1859 NE2 HIS A 516 3.727 -16.384 1.667 1.00 74.41 N ATOM 0 H HIS A 516 6.321 -14.068 2.416 1.00 45.00 H new ATOM 0 HA HIS A 516 8.104 -15.145 4.527 1.00 42.43 H new ATOM 0 HB2 HIS A 516 6.856 -17.301 4.285 1.00 62.40 H new ATOM 0 HB3 HIS A 516 6.059 -16.033 5.196 1.00 62.40 H new ATOM 0 HD2 HIS A 516 5.691 -15.573 1.379 1.00 62.45 H new ATOM 0 HE1 HIS A 516 2.103 -17.356 2.752 1.00 64.13 H new ATOM 0 HE2 HIS A 516 3.301 -16.214 0.756 1.00 74.41 H new ATOM 1866 N SER A 517 8.387 -14.988 1.514 1.00 73.30 N ATOM 1867 CA SER A 517 9.145 -15.353 0.328 1.00 40.30 C ATOM 1868 C SER A 517 10.622 -15.008 0.523 1.00 3.33 C ATOM 1869 O SER A 517 10.968 -14.221 1.403 1.00 3.02 O ATOM 1870 CB SER A 517 8.594 -14.648 -0.914 1.00 23.04 C ATOM 1871 OG SER A 517 9.269 -15.055 -2.101 1.00 22.43 O ATOM 0 H SER A 517 7.995 -14.046 1.497 1.00 73.30 H new ATOM 0 HA SER A 517 9.048 -16.428 0.177 1.00 40.30 H new ATOM 0 HB2 SER A 517 7.530 -14.862 -1.010 1.00 23.04 H new ATOM 0 HB3 SER A 517 8.692 -13.569 -0.792 1.00 23.04 H new ATOM 0 HG SER A 517 8.711 -14.852 -2.881 1.00 22.43 H new ATOM 1876 N GLN A 518 11.453 -15.613 -0.312 1.00 4.52 N ATOM 1877 CA GLN A 518 12.886 -15.381 -0.242 1.00 55.55 C ATOM 1878 C GLN A 518 13.314 -14.385 -1.323 1.00 65.53 C ATOM 1879 O GLN A 518 14.463 -13.948 -1.347 1.00 72.32 O ATOM 1880 CB GLN A 518 13.661 -16.693 -0.366 1.00 12.32 C ATOM 1881 CG GLN A 518 13.527 -17.277 -1.775 1.00 32.24 C ATOM 1882 CD GLN A 518 12.281 -18.156 -1.889 1.00 44.30 C ATOM 1883 OE1 GLN A 518 11.836 -18.772 -0.933 1.00 11.33 O ATOM 1884 NE2 GLN A 518 11.745 -18.181 -3.106 1.00 64.42 N ATOM 0 H GLN A 518 11.162 -16.264 -1.041 1.00 4.52 H new ATOM 0 HA GLN A 518 13.119 -14.952 0.733 1.00 55.55 H new ATOM 0 HB2 GLN A 518 14.713 -16.521 -0.138 1.00 12.32 H new ATOM 0 HB3 GLN A 518 13.289 -17.410 0.366 1.00 12.32 H new ATOM 0 HG2 GLN A 518 13.474 -16.468 -2.504 1.00 32.24 H new ATOM 0 HG3 GLN A 518 14.414 -17.864 -2.015 1.00 32.24 H new ATOM 0 HE21 GLN A 518 12.169 -17.642 -3.861 1.00 64.42 H new ATOM 0 HE22 GLN A 518 10.910 -18.740 -3.284 1.00 64.42 H new ATOM 1891 N ILE A 519 12.367 -14.058 -2.190 1.00 71.33 N ATOM 1892 CA ILE A 519 12.633 -13.122 -3.270 1.00 32.34 C ATOM 1893 C ILE A 519 11.906 -11.807 -2.990 1.00 31.00 C ATOM 1894 O ILE A 519 12.332 -10.748 -3.447 1.00 24.51 O ATOM 1895 CB ILE A 519 12.276 -13.749 -4.621 1.00 61.04 C ATOM 1896 CG1 ILE A 519 11.575 -12.733 -5.526 1.00 20.23 C ATOM 1897 CG2 ILE A 519 11.445 -15.019 -4.432 1.00 34.31 C ATOM 1898 CD1 ILE A 519 12.552 -11.658 -6.002 1.00 43.33 C ATOM 0 H ILE A 519 11.415 -14.424 -2.167 1.00 71.33 H new ATOM 0 HA ILE A 519 13.697 -12.892 -3.323 1.00 32.34 H new ATOM 0 HB ILE A 519 13.200 -14.041 -5.120 1.00 61.04 H new ATOM 0 HG12 ILE A 519 11.143 -13.244 -6.387 1.00 20.23 H new ATOM 0 HG13 ILE A 519 10.751 -12.267 -4.986 1.00 20.23 H new ATOM 0 HG21 ILE A 519 11.205 -15.445 -5.406 1.00 34.31 H new ATOM 0 HG22 ILE A 519 12.015 -15.743 -3.850 1.00 34.31 H new ATOM 0 HG23 ILE A 519 10.523 -14.775 -3.905 1.00 34.31 H new ATOM 0 HD11 ILE A 519 12.029 -10.949 -6.643 1.00 43.33 H new ATOM 0 HD12 ILE A 519 12.963 -11.133 -5.140 1.00 43.33 H new ATOM 0 HD13 ILE A 519 13.362 -12.125 -6.563 1.00 43.33 H new ATOM 1909 N PHE A 520 10.818 -11.917 -2.241 1.00 22.22 N ATOM 1910 CA PHE A 520 10.027 -10.748 -1.894 1.00 53.34 C ATOM 1911 C PHE A 520 10.925 -9.551 -1.582 1.00 70.42 C ATOM 1912 O PHE A 520 10.581 -8.412 -1.896 1.00 44.32 O ATOM 1913 CB PHE A 520 9.223 -11.108 -0.644 1.00 52.22 C ATOM 1914 CG PHE A 520 8.858 -9.905 0.230 1.00 75.22 C ATOM 1915 CD1 PHE A 520 8.241 -8.825 -0.322 1.00 33.15 C ATOM 1916 CD2 PHE A 520 9.153 -9.915 1.556 1.00 64.30 C ATOM 1917 CE1 PHE A 520 7.905 -7.710 0.488 1.00 55.14 C ATOM 1918 CE2 PHE A 520 8.816 -8.799 2.367 1.00 22.00 C ATOM 1919 CZ PHE A 520 8.199 -7.720 1.815 1.00 44.13 C ATOM 0 H PHE A 520 10.466 -12.797 -1.865 1.00 22.22 H new ATOM 0 HA PHE A 520 9.381 -10.474 -2.728 1.00 53.34 H new ATOM 0 HB2 PHE A 520 8.307 -11.615 -0.947 1.00 52.22 H new ATOM 0 HB3 PHE A 520 9.797 -11.817 -0.047 1.00 52.22 H new ATOM 0 HD1 PHE A 520 8.007 -8.817 -1.376 1.00 33.15 H new ATOM 0 HD2 PHE A 520 9.644 -10.772 1.993 1.00 64.30 H new ATOM 0 HE1 PHE A 520 7.415 -6.853 0.050 1.00 55.14 H new ATOM 0 HE2 PHE A 520 9.050 -8.807 3.421 1.00 22.00 H new ATOM 0 HZ PHE A 520 7.943 -6.871 2.431 1.00 44.13 H new ATOM 1928 N ALA A 521 12.061 -9.847 -0.966 1.00 10.24 N ATOM 1929 CA ALA A 521 13.012 -8.809 -0.608 1.00 31.15 C ATOM 1930 C ALA A 521 13.387 -8.012 -1.859 1.00 53.32 C ATOM 1931 O ALA A 521 13.384 -6.782 -1.839 1.00 10.15 O ATOM 1932 CB ALA A 521 14.231 -9.444 0.067 1.00 12.02 C ATOM 0 H ALA A 521 12.344 -10.792 -0.706 1.00 10.24 H new ATOM 0 HA ALA A 521 12.570 -8.113 0.105 1.00 31.15 H new ATOM 0 HB1 ALA A 521 14.945 -8.665 0.336 1.00 12.02 H new ATOM 0 HB2 ALA A 521 13.915 -9.972 0.966 1.00 12.02 H new ATOM 0 HB3 ALA A 521 14.702 -10.147 -0.620 1.00 12.02 H new ATOM 1938 N ARG A 522 13.700 -8.745 -2.917 1.00 24.24 N ATOM 1939 CA ARG A 522 14.075 -8.123 -4.174 1.00 71.44 C ATOM 1940 C ARG A 522 12.846 -7.523 -4.859 1.00 53.24 C ATOM 1941 O ARG A 522 12.971 -6.660 -5.726 1.00 20.51 O ATOM 1942 CB ARG A 522 14.732 -9.134 -5.116 1.00 64.31 C ATOM 1943 CG ARG A 522 16.118 -9.536 -4.607 1.00 33.51 C ATOM 1944 CD ARG A 522 16.010 -10.550 -3.467 1.00 22.21 C ATOM 1945 NE ARG A 522 17.348 -11.098 -3.149 1.00 62.33 N ATOM 1946 CZ ARG A 522 18.233 -10.501 -2.322 1.00 21.41 C ATOM 1947 NH1 ARG A 522 17.929 -9.330 -1.723 1.00 71.12 N ATOM 1948 NH2 ARG A 522 19.401 -11.078 -2.109 1.00 33.43 N ATOM 0 H ARG A 522 13.701 -9.765 -2.929 1.00 24.24 H new ATOM 0 HA ARG A 522 14.792 -7.333 -3.950 1.00 71.44 H new ATOM 0 HB2 ARG A 522 14.102 -10.019 -5.203 1.00 64.31 H new ATOM 0 HB3 ARG A 522 14.817 -8.704 -6.114 1.00 64.31 H new ATOM 0 HG2 ARG A 522 16.700 -9.963 -5.424 1.00 33.51 H new ATOM 0 HG3 ARG A 522 16.653 -8.651 -4.262 1.00 33.51 H new ATOM 0 HD2 ARG A 522 15.584 -10.073 -2.584 1.00 22.21 H new ATOM 0 HD3 ARG A 522 15.335 -11.358 -3.750 1.00 22.21 H new ATOM 0 HE ARG A 522 17.618 -11.981 -3.581 1.00 62.33 H new ATOM 0 HH11 ARG A 522 17.025 -8.889 -1.894 1.00 71.12 H new ATOM 0 HH12 ARG A 522 18.603 -8.886 -1.100 1.00 71.12 H new ATOM 0 HH21 ARG A 522 19.624 -11.962 -2.566 1.00 33.43 H new ATOM 0 HH22 ARG A 522 20.080 -10.640 -1.487 1.00 33.43 H new ATOM 1958 N LYS A 523 11.682 -8.005 -4.443 1.00 62.45 N ATOM 1959 CA LYS A 523 10.431 -7.527 -5.005 1.00 54.24 C ATOM 1960 C LYS A 523 10.115 -6.142 -4.435 1.00 23.53 C ATOM 1961 O LYS A 523 9.700 -5.246 -5.167 1.00 20.34 O ATOM 1962 CB LYS A 523 9.318 -8.553 -4.781 1.00 45.41 C ATOM 1963 CG LYS A 523 9.745 -9.940 -5.263 1.00 22.21 C ATOM 1964 CD LYS A 523 10.227 -9.891 -6.714 1.00 3.15 C ATOM 1965 CE LYS A 523 9.152 -9.304 -7.630 1.00 11.43 C ATOM 1966 NZ LYS A 523 9.210 -9.933 -8.968 1.00 12.10 N ATOM 0 H LYS A 523 11.581 -8.721 -3.724 1.00 62.45 H new ATOM 0 HA LYS A 523 10.517 -7.414 -6.086 1.00 54.24 H new ATOM 0 HB2 LYS A 523 9.065 -8.594 -3.722 1.00 45.41 H new ATOM 0 HB3 LYS A 523 8.419 -8.241 -5.312 1.00 45.41 H new ATOM 0 HG2 LYS A 523 10.541 -10.322 -4.624 1.00 22.21 H new ATOM 0 HG3 LYS A 523 8.908 -10.633 -5.177 1.00 22.21 H new ATOM 0 HD2 LYS A 523 11.134 -9.289 -6.780 1.00 3.15 H new ATOM 0 HD3 LYS A 523 10.486 -10.895 -7.049 1.00 3.15 H new ATOM 0 HE2 LYS A 523 8.167 -9.460 -7.191 1.00 11.43 H new ATOM 0 HE3 LYS A 523 9.293 -8.227 -7.722 1.00 11.43 H new ATOM 0 HZ1 LYS A 523 8.473 -9.523 -9.577 1.00 12.10 H new ATOM 0 HZ2 LYS A 523 10.144 -9.762 -9.392 1.00 12.10 H new ATOM 0 HZ3 LYS A 523 9.053 -10.957 -8.877 1.00 12.10 H new ATOM 1975 N VAL A 524 10.327 -6.012 -3.133 1.00 14.24 N ATOM 1976 CA VAL A 524 10.071 -4.752 -2.457 1.00 72.23 C ATOM 1977 C VAL A 524 11.193 -3.764 -2.784 1.00 21.04 C ATOM 1978 O VAL A 524 10.942 -2.576 -2.978 1.00 25.11 O ATOM 1979 CB VAL A 524 9.903 -4.988 -0.955 1.00 33.44 C ATOM 1980 CG1 VAL A 524 11.258 -4.980 -0.244 1.00 1.02 C ATOM 1981 CG2 VAL A 524 8.955 -3.958 -0.339 1.00 33.33 C ATOM 0 H VAL A 524 10.673 -6.758 -2.529 1.00 14.24 H new ATOM 0 HA VAL A 524 9.138 -4.313 -2.810 1.00 72.23 H new ATOM 0 HB VAL A 524 9.459 -5.974 -0.819 1.00 33.44 H new ATOM 0 HG11 VAL A 524 11.110 -5.150 0.822 1.00 1.02 H new ATOM 0 HG12 VAL A 524 11.888 -5.769 -0.653 1.00 1.02 H new ATOM 0 HG13 VAL A 524 11.742 -4.015 -0.394 1.00 1.02 H new ATOM 0 HG21 VAL A 524 8.854 -4.150 0.729 1.00 33.33 H new ATOM 0 HG22 VAL A 524 9.357 -2.956 -0.492 1.00 33.33 H new ATOM 0 HG23 VAL A 524 7.977 -4.033 -0.815 1.00 33.33 H new ATOM 1991 N ALA A 525 12.407 -4.293 -2.838 1.00 3.45 N ATOM 1992 CA ALA A 525 13.569 -3.474 -3.138 1.00 51.33 C ATOM 1993 C ALA A 525 13.579 -3.141 -4.631 1.00 72.31 C ATOM 1994 O ALA A 525 14.446 -2.406 -5.101 1.00 52.42 O ATOM 1995 CB ALA A 525 14.837 -4.204 -2.694 1.00 71.44 C ATOM 0 H ALA A 525 12.611 -5.280 -2.679 1.00 3.45 H new ATOM 0 HA ALA A 525 13.528 -2.533 -2.590 1.00 51.33 H new ATOM 0 HB1 ALA A 525 15.708 -3.589 -2.919 1.00 71.44 H new ATOM 0 HB2 ALA A 525 14.792 -4.391 -1.621 1.00 71.44 H new ATOM 0 HB3 ALA A 525 14.915 -5.153 -3.225 1.00 71.44 H new ATOM 2001 N ASN A 526 12.606 -3.699 -5.336 1.00 50.44 N ATOM 2002 CA ASN A 526 12.492 -3.470 -6.767 1.00 50.04 C ATOM 2003 C ASN A 526 11.430 -2.399 -7.025 1.00 21.24 C ATOM 2004 O ASN A 526 11.626 -1.515 -7.857 1.00 14.40 O ATOM 2005 CB ASN A 526 12.064 -4.746 -7.496 1.00 20.53 C ATOM 2006 CG ASN A 526 13.277 -5.481 -8.073 1.00 0.21 C ATOM 2007 OD1 ASN A 526 14.346 -4.922 -8.251 1.00 32.40 O ATOM 2008 ND2 ASN A 526 13.050 -6.761 -8.353 1.00 70.23 N ATOM 0 H ASN A 526 11.889 -4.309 -4.943 1.00 50.44 H new ATOM 0 HA ASN A 526 13.467 -3.153 -7.137 1.00 50.04 H new ATOM 0 HB2 ASN A 526 11.531 -5.401 -6.807 1.00 20.53 H new ATOM 0 HB3 ASN A 526 11.370 -4.495 -8.299 1.00 20.53 H new ATOM 0 HD21 ASN A 526 13.796 -7.338 -8.742 1.00 70.23 H new ATOM 0 HD22 ASN A 526 12.130 -7.166 -8.179 1.00 70.23 H new ATOM 2014 N THR A 527 10.329 -2.515 -6.297 1.00 71.44 N ATOM 2015 CA THR A 527 9.236 -1.567 -6.437 1.00 22.23 C ATOM 2016 C THR A 527 9.455 -0.363 -5.519 1.00 13.42 C ATOM 2017 O THR A 527 9.391 0.781 -5.967 1.00 42.53 O ATOM 2018 CB THR A 527 7.928 -2.312 -6.162 1.00 25.13 C ATOM 2019 OG1 THR A 527 6.930 -1.493 -6.764 1.00 74.12 O ATOM 2020 CG2 THR A 527 7.559 -2.319 -4.678 1.00 23.33 C ATOM 0 H THR A 527 10.170 -3.251 -5.609 1.00 71.44 H new ATOM 0 HA THR A 527 9.190 -1.161 -7.447 1.00 22.23 H new ATOM 0 HB THR A 527 8.013 -3.338 -6.519 1.00 25.13 H new ATOM 0 HG1 THR A 527 6.904 -0.624 -6.312 1.00 74.12 H new ATOM 0 HG21 THR A 527 6.623 -2.860 -4.538 1.00 23.33 H new ATOM 0 HG22 THR A 527 8.350 -2.808 -4.109 1.00 23.33 H new ATOM 0 HG23 THR A 527 7.441 -1.294 -4.328 1.00 23.33 H new ATOM 2028 N PHE A 528 9.708 -0.662 -4.253 1.00 74.24 N ATOM 2029 CA PHE A 528 9.935 0.383 -3.270 1.00 22.40 C ATOM 2030 C PHE A 528 11.428 0.695 -3.136 1.00 11.44 C ATOM 2031 O PHE A 528 12.019 0.475 -2.081 1.00 42.01 O ATOM 2032 CB PHE A 528 9.415 -0.143 -1.931 1.00 14.43 C ATOM 2033 CG PHE A 528 7.889 -0.223 -1.844 1.00 33.40 C ATOM 2034 CD1 PHE A 528 7.147 0.915 -1.850 1.00 42.04 C ATOM 2035 CD2 PHE A 528 7.276 -1.435 -1.762 1.00 75.24 C ATOM 2036 CE1 PHE A 528 5.731 0.841 -1.770 1.00 2.44 C ATOM 2037 CE2 PHE A 528 5.860 -1.509 -1.682 1.00 14.23 C ATOM 2038 CZ PHE A 528 5.118 -0.370 -1.688 1.00 61.30 C ATOM 0 H PHE A 528 9.761 -1.612 -3.886 1.00 74.24 H new ATOM 0 HA PHE A 528 9.426 1.297 -3.574 1.00 22.40 H new ATOM 0 HB2 PHE A 528 9.831 -1.135 -1.756 1.00 14.43 H new ATOM 0 HB3 PHE A 528 9.781 0.502 -1.132 1.00 14.43 H new ATOM 0 HD1 PHE A 528 7.634 1.877 -1.916 1.00 42.04 H new ATOM 0 HD2 PHE A 528 7.866 -2.340 -1.758 1.00 75.24 H new ATOM 0 HE1 PHE A 528 5.141 1.746 -1.774 1.00 2.44 H new ATOM 0 HE2 PHE A 528 5.373 -2.470 -1.616 1.00 14.23 H new ATOM 0 HZ PHE A 528 4.041 -0.427 -1.628 1.00 61.30 H new ATOM 2047 N LYS A 529 11.992 1.201 -4.222 1.00 73.34 N ATOM 2048 CA LYS A 529 13.404 1.546 -4.240 1.00 4.20 C ATOM 2049 C LYS A 529 13.633 2.786 -3.375 1.00 52.41 C ATOM 2050 O LYS A 529 12.710 3.567 -3.146 1.00 1.04 O ATOM 2051 CB LYS A 529 13.900 1.699 -5.679 1.00 12.21 C ATOM 2052 CG LYS A 529 14.354 0.355 -6.248 1.00 21.43 C ATOM 2053 CD LYS A 529 14.215 0.329 -7.773 1.00 60.23 C ATOM 2054 CE LYS A 529 14.887 -0.913 -8.364 1.00 41.31 C ATOM 2055 NZ LYS A 529 15.286 -0.668 -9.767 1.00 14.30 N ATOM 0 H LYS A 529 11.498 1.381 -5.096 1.00 73.34 H new ATOM 0 HA LYS A 529 13.998 0.741 -3.807 1.00 4.20 H new ATOM 0 HB2 LYS A 529 13.104 2.111 -6.300 1.00 12.21 H new ATOM 0 HB3 LYS A 529 14.727 2.409 -5.709 1.00 12.21 H new ATOM 0 HG2 LYS A 529 15.392 0.171 -5.971 1.00 21.43 H new ATOM 0 HG3 LYS A 529 13.760 -0.448 -5.811 1.00 21.43 H new ATOM 0 HD2 LYS A 529 13.160 0.340 -8.046 1.00 60.23 H new ATOM 0 HD3 LYS A 529 14.664 1.227 -8.198 1.00 60.23 H new ATOM 0 HE2 LYS A 529 15.763 -1.176 -7.771 1.00 41.31 H new ATOM 0 HE3 LYS A 529 14.203 -1.761 -8.317 1.00 41.31 H new ATOM 0 HZ1 LYS A 529 15.740 -1.520 -10.153 1.00 14.30 H new ATOM 0 HZ2 LYS A 529 14.444 -0.439 -10.332 1.00 14.30 H new ATOM 0 HZ3 LYS A 529 15.955 0.127 -9.804 1.00 14.30 H new ATOM 2064 N PRO A 530 14.902 2.935 -2.906 1.00 53.52 N ATOM 2065 CA PRO A 530 15.262 4.068 -2.071 1.00 23.24 C ATOM 2066 C PRO A 530 15.384 5.346 -2.903 1.00 12.20 C ATOM 2067 O PRO A 530 14.925 6.408 -2.486 1.00 54.33 O ATOM 2068 CB PRO A 530 16.570 3.666 -1.406 1.00 12.12 C ATOM 2069 CG PRO A 530 17.128 2.525 -2.242 1.00 72.44 C ATOM 2070 CD PRO A 530 16.020 2.031 -3.158 1.00 42.23 C ATOM 0 HA PRO A 530 14.503 4.297 -1.323 1.00 23.24 H new ATOM 0 HB2 PRO A 530 17.266 4.504 -1.375 1.00 12.12 H new ATOM 0 HB3 PRO A 530 16.404 3.351 -0.376 1.00 12.12 H new ATOM 0 HG2 PRO A 530 17.984 2.863 -2.826 1.00 72.44 H new ATOM 0 HG3 PRO A 530 17.480 1.718 -1.599 1.00 72.44 H new ATOM 0 HD2 PRO A 530 16.327 2.062 -4.203 1.00 42.23 H new ATOM 0 HD3 PRO A 530 15.752 0.998 -2.935 1.00 42.23 H new ATOM 2075 N HIS A 531 16.004 5.201 -4.066 1.00 52.34 N ATOM 2076 CA HIS A 531 16.191 6.330 -4.961 1.00 2.31 C ATOM 2077 C HIS A 531 14.828 6.873 -5.394 1.00 13.14 C ATOM 2078 O HIS A 531 14.740 7.963 -5.956 1.00 72.45 O ATOM 2079 CB HIS A 531 17.080 5.944 -6.144 1.00 12.33 C ATOM 2080 CG HIS A 531 16.722 4.620 -6.774 1.00 3.25 C ATOM 2081 ND1 HIS A 531 16.040 4.521 -7.975 1.00 31.22 N ATOM 2082 CD2 HIS A 531 16.959 3.342 -6.359 1.00 11.11 C ATOM 2083 CE1 HIS A 531 15.879 3.236 -8.260 1.00 5.35 C ATOM 2084 NE2 HIS A 531 16.448 2.508 -7.256 1.00 40.40 N ATOM 0 H HIS A 531 16.383 4.318 -4.409 1.00 52.34 H new ATOM 0 HA HIS A 531 16.712 7.132 -4.437 1.00 2.31 H new ATOM 0 HB2 HIS A 531 17.017 6.724 -6.902 1.00 12.33 H new ATOM 0 HB3 HIS A 531 18.117 5.907 -5.809 1.00 12.33 H new ATOM 0 HD2 HIS A 531 17.475 3.057 -5.454 1.00 11.11 H new ATOM 0 HE1 HIS A 531 15.385 2.836 -9.133 1.00 5.35 H new ATOM 0 HE2 HIS A 531 16.476 1.490 -7.203 1.00 40.40 H new ATOM 2091 N ARG A 532 13.799 6.086 -5.117 1.00 30.22 N ATOM 2092 CA ARG A 532 12.443 6.474 -5.471 1.00 21.02 C ATOM 2093 C ARG A 532 11.700 6.989 -4.237 1.00 52.41 C ATOM 2094 O ARG A 532 10.760 7.774 -4.359 1.00 50.33 O ATOM 2095 CB ARG A 532 11.672 5.296 -6.068 1.00 75.30 C ATOM 2096 CG ARG A 532 12.595 4.402 -6.901 1.00 41.31 C ATOM 2097 CD ARG A 532 13.143 5.158 -8.113 1.00 64.21 C ATOM 2098 NE ARG A 532 13.534 4.202 -9.172 1.00 3.33 N ATOM 2099 CZ ARG A 532 14.105 4.559 -10.342 1.00 50.33 C ATOM 2100 NH1 ARG A 532 14.357 5.857 -10.612 1.00 13.54 N ATOM 2101 NH2 ARG A 532 14.414 3.620 -11.216 1.00 11.11 N ATOM 0 H ARG A 532 13.876 5.182 -4.652 1.00 30.22 H new ATOM 0 HA ARG A 532 12.508 7.266 -6.217 1.00 21.02 H new ATOM 0 HB2 ARG A 532 11.218 4.711 -5.268 1.00 75.30 H new ATOM 0 HB3 ARG A 532 10.859 5.667 -6.692 1.00 75.30 H new ATOM 0 HG2 ARG A 532 13.421 4.050 -6.283 1.00 41.31 H new ATOM 0 HG3 ARG A 532 12.049 3.520 -7.235 1.00 41.31 H new ATOM 0 HD2 ARG A 532 12.389 5.847 -8.494 1.00 64.21 H new ATOM 0 HD3 ARG A 532 14.003 5.759 -7.818 1.00 64.21 H new ATOM 0 HE ARG A 532 13.361 3.210 -9.008 1.00 3.33 H new ATOM 0 HH11 ARG A 532 14.116 6.576 -9.930 1.00 13.54 H new ATOM 0 HH12 ARG A 532 14.789 6.119 -11.498 1.00 13.54 H new ATOM 0 HH21 ARG A 532 14.221 2.641 -11.003 1.00 11.11 H new ATOM 0 HH22 ARG A 532 14.846 3.873 -12.105 1.00 11.11 H new ATOM 2111 N LEU A 533 12.146 6.526 -3.079 1.00 33.02 N ATOM 2112 CA LEU A 533 11.534 6.930 -1.825 1.00 34.32 C ATOM 2113 C LEU A 533 11.957 8.363 -1.495 1.00 61.14 C ATOM 2114 O LEU A 533 11.113 9.217 -1.226 1.00 12.13 O ATOM 2115 CB LEU A 533 11.859 5.923 -0.720 1.00 32.32 C ATOM 2116 CG LEU A 533 10.875 4.762 -0.560 1.00 32.24 C ATOM 2117 CD1 LEU A 533 9.859 5.054 0.546 1.00 45.11 C ATOM 2118 CD2 LEU A 533 10.196 4.431 -1.891 1.00 5.30 C ATOM 0 H LEU A 533 12.925 5.874 -2.983 1.00 33.02 H new ATOM 0 HA LEU A 533 10.448 6.930 -1.914 1.00 34.32 H new ATOM 0 HB2 LEU A 533 12.849 5.510 -0.912 1.00 32.32 H new ATOM 0 HB3 LEU A 533 11.915 6.459 0.228 1.00 32.32 H new ATOM 0 HG LEU A 533 11.435 3.878 -0.257 1.00 32.24 H new ATOM 0 HD11 LEU A 533 9.171 4.214 0.639 1.00 45.11 H new ATOM 0 HD12 LEU A 533 10.382 5.202 1.491 1.00 45.11 H new ATOM 0 HD13 LEU A 533 9.299 5.955 0.297 1.00 45.11 H new ATOM 0 HD21 LEU A 533 9.502 3.603 -1.749 1.00 5.30 H new ATOM 0 HD22 LEU A 533 9.650 5.304 -2.248 1.00 5.30 H new ATOM 0 HD23 LEU A 533 10.951 4.150 -2.625 1.00 5.30 H new