USER MOD reduce.3.24.130724 H: found=0, std=0, add=976, rem=0, adj=27 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 474 MET CE :methyl 140:sc= -1.53 (180deg=-3.06!) USER MOD Set 1.2: A 475 SER OG : rot 94:sc= 0.964 USER MOD Set 2.1: A 473 MET CE :methyl -146:sc= -10.8! (180deg=-14.1!) USER MOD Set 2.2: A 485 CYS SG : rot -106:sc= -3.23! USER MOD Set 3.1: A 458 SER OG : rot -124:sc= 0.589 USER MOD Set 3.2: A 459 ASN : amide:sc= 0 K(o=-1.5,f=-2.5) USER MOD Set 3.3: A 494 SER OG : rot 60:sc= -1.91! USER MOD Set 3.4: A 498 GLN : amide:sc= -0.19 K(o=-1.5,f=-4.2) USER MOD Set 4.1: A 401 HIS : no HD1:sc= -8.89! C(o=-8.9!,f=-11!) USER MOD Set 4.2: A 426 THR OG1 : rot 180:sc= 0 USER MOD Single : A 395 TYR OH : rot 180:sc= 0 USER MOD Single : A 396 ASN : amide:sc= -4.66! C(o=-4.7!,f=-10!) USER MOD Single : A 407 HIS : no HD1:sc= -2.03! X(o=-2!,f=-1.6) USER MOD Single : A 415 LYS NZ :NH3+ 176:sc= 1.33 (180deg=1.24) USER MOD Single : A 443 GLN :FLIP amide:sc= 0 F(o=-0.78,f=0) USER MOD Single : A 448 HIS : no HD1:sc= -7.62! C(o=-7.6!,f=-9.1!) USER MOD Single : A 449 SER OG : rot -46:sc= 0.815 USER MOD Single : A 457 THR OG1 : rot -139:sc= -0.252 USER MOD Single : A 462 CYS SG : rot 110:sc= -5.98! USER MOD Single : A 465 SER OG : rot 34:sc= 0.444 USER MOD Single : A 467 HIS : no HD1:sc= -1.41 K(o=-1.4,f=-1.9) USER MOD Single : A 468 GLN : amide:sc= -0.135 X(o=-0.14,f=-0.079) USER MOD Single : A 470 ASN :FLIP amide:sc= -2.74! C(o=-6.3!,f=-2.7!) USER MOD Single : A 471 GLN : amide:sc= -0.43 X(o=-0.43,f=-0.15) USER MOD Single : A 476 ASN : amide:sc= -7.58! C(o=-7.6!,f=-17!) USER MOD Single : A 478 THR OG1 : rot -44:sc= 0.0383 USER MOD Single : A 480 GLN :FLIP amide:sc= -1.64! C(o=-7.4!,f=-1.6!) USER MOD Single : A 482 SER OG : rot 180:sc= 0 USER MOD Single : A 495 SER OG : rot 180:sc= 0 USER MOD Single : A 500 SER OG : rot 180:sc= 0 USER MOD Single : A 501 SER OG : rot -7:sc= 0.259! USER MOD Single : A 503 THR OG1 : rot 101:sc= 0.278 USER MOD Single : A 505 SER OG : rot 180:sc= 0 USER MOD Single : A 508 SER OG : rot 180:sc= 0 USER MOD Single : A 516 HIS : no HD1:sc= -3.25! C(o=-3.3!,f=-6.5!) USER MOD Single : A 517 SER OG : rot 180:sc= -1.13 USER MOD Single : A 518 GLN : amide:sc= -0.0163 X(o=-0.016,f=0) USER MOD Single : A 523 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 526 ASN : amide:sc= -3.19! C(o=-3.2!,f=-4.8!) USER MOD Single : A 527 THR OG1 : rot -130:sc= 0 USER MOD Single : A 529 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 531 HIS : no HE2:sc= -2.91 K(o=-2.9,f=-3.6!) USER MOD ----------------------------------------------------------------- ATOM 125 N TYR A 395 4.025 8.705 4.910 1.00 3.20 N ATOM 126 CA TYR A 395 3.757 7.357 4.440 1.00 74.43 C ATOM 127 C TYR A 395 4.395 7.119 3.069 1.00 4.15 C ATOM 128 O TYR A 395 4.471 8.032 2.248 1.00 25.53 O ATOM 129 CB TYR A 395 2.237 7.250 4.308 1.00 71.23 C ATOM 130 CG TYR A 395 1.473 7.673 5.563 1.00 45.12 C ATOM 131 CD1 TYR A 395 2.102 7.659 6.792 1.00 11.44 C ATOM 132 CD2 TYR A 395 0.154 8.069 5.467 1.00 21.02 C ATOM 133 CE1 TYR A 395 1.381 8.057 7.973 1.00 44.10 C ATOM 134 CE2 TYR A 395 -0.566 8.466 6.650 1.00 74.32 C ATOM 135 CZ TYR A 395 0.084 8.441 7.845 1.00 12.42 C ATOM 136 OH TYR A 395 -0.596 8.817 8.960 1.00 50.04 O ATOM 0 HA TYR A 395 4.168 6.620 5.130 1.00 74.43 H new ATOM 0 HB2 TYR A 395 1.911 7.867 3.471 1.00 71.23 H new ATOM 0 HB3 TYR A 395 1.975 6.220 4.065 1.00 71.23 H new ATOM 0 HD1 TYR A 395 3.134 7.350 6.867 1.00 11.44 H new ATOM 0 HD2 TYR A 395 -0.338 8.081 4.506 1.00 21.02 H new ATOM 0 HE1 TYR A 395 1.861 8.050 8.940 1.00 44.10 H new ATOM 0 HE2 TYR A 395 -1.599 8.777 6.590 1.00 74.32 H new ATOM 0 HH TYR A 395 -1.512 9.067 8.716 1.00 50.04 H new ATOM 145 N ASN A 396 4.837 5.886 2.863 1.00 51.41 N ATOM 146 CA ASN A 396 5.465 5.517 1.606 1.00 4.11 C ATOM 147 C ASN A 396 4.553 4.547 0.852 1.00 30.12 C ATOM 148 O ASN A 396 4.749 4.303 -0.338 1.00 51.12 O ATOM 149 CB ASN A 396 6.804 4.819 1.844 1.00 21.34 C ATOM 150 CG ASN A 396 7.948 5.832 1.909 1.00 21.30 C ATOM 151 OD1 ASN A 396 8.947 5.727 1.216 1.00 14.33 O ATOM 152 ND2 ASN A 396 7.749 6.818 2.779 1.00 23.01 N ATOM 0 H ASN A 396 4.772 5.131 3.546 1.00 51.41 H new ATOM 0 HA ASN A 396 5.631 6.428 1.031 1.00 4.11 H new ATOM 0 HB2 ASN A 396 6.762 4.253 2.774 1.00 21.34 H new ATOM 0 HB3 ASN A 396 6.992 4.104 1.043 1.00 21.34 H new ATOM 0 HD21 ASN A 396 8.455 7.545 2.897 1.00 23.01 H new ATOM 0 HD22 ASN A 396 6.890 6.848 3.329 1.00 23.01 H new ATOM 158 N PHE A 397 3.576 4.019 1.574 1.00 62.15 N ATOM 159 CA PHE A 397 2.634 3.080 0.989 1.00 72.23 C ATOM 160 C PHE A 397 1.414 2.892 1.892 1.00 52.52 C ATOM 161 O PHE A 397 1.526 2.968 3.115 1.00 1.03 O ATOM 162 CB PHE A 397 3.363 1.744 0.850 1.00 23.34 C ATOM 163 CG PHE A 397 3.983 1.234 2.152 1.00 21.42 C ATOM 164 CD1 PHE A 397 5.030 1.898 2.712 1.00 30.33 C ATOM 165 CD2 PHE A 397 3.488 0.118 2.750 1.00 61.11 C ATOM 166 CE1 PHE A 397 5.606 1.425 3.920 1.00 43.42 C ATOM 167 CE2 PHE A 397 4.064 -0.354 3.960 1.00 35.44 C ATOM 168 CZ PHE A 397 5.111 0.310 4.519 1.00 24.34 C ATOM 0 H PHE A 397 3.416 4.224 2.560 1.00 62.15 H new ATOM 0 HA PHE A 397 2.285 3.454 0.027 1.00 72.23 H new ATOM 0 HB2 PHE A 397 2.663 0.997 0.476 1.00 23.34 H new ATOM 0 HB3 PHE A 397 4.149 1.847 0.102 1.00 23.34 H new ATOM 0 HD1 PHE A 397 5.423 2.785 2.237 1.00 30.33 H new ATOM 0 HD2 PHE A 397 2.657 -0.410 2.305 1.00 61.11 H new ATOM 0 HE1 PHE A 397 6.438 1.952 4.363 1.00 43.42 H new ATOM 0 HE2 PHE A 397 3.670 -1.240 4.436 1.00 35.44 H new ATOM 0 HZ PHE A 397 5.549 -0.049 5.439 1.00 24.34 H new ATOM 177 N VAL A 398 0.278 2.650 1.256 1.00 72.21 N ATOM 178 CA VAL A 398 -0.961 2.449 1.987 1.00 65.24 C ATOM 179 C VAL A 398 -1.336 0.965 1.950 1.00 41.25 C ATOM 180 O VAL A 398 -1.631 0.422 0.887 1.00 55.02 O ATOM 181 CB VAL A 398 -2.056 3.357 1.421 1.00 22.51 C ATOM 182 CG1 VAL A 398 -2.769 2.688 0.246 1.00 15.31 C ATOM 183 CG2 VAL A 398 -3.051 3.760 2.511 1.00 15.25 C ATOM 0 H VAL A 398 0.189 2.589 0.242 1.00 72.21 H new ATOM 0 HA VAL A 398 -0.836 2.726 3.034 1.00 65.24 H new ATOM 0 HB VAL A 398 -1.581 4.265 1.050 1.00 22.51 H new ATOM 0 HG11 VAL A 398 -3.542 3.354 -0.137 1.00 15.31 H new ATOM 0 HG12 VAL A 398 -2.048 2.476 -0.544 1.00 15.31 H new ATOM 0 HG13 VAL A 398 -3.226 1.756 0.580 1.00 15.31 H new ATOM 0 HG21 VAL A 398 -3.818 4.405 2.083 1.00 15.25 H new ATOM 0 HG22 VAL A 398 -3.518 2.867 2.926 1.00 15.25 H new ATOM 0 HG23 VAL A 398 -2.527 4.296 3.302 1.00 15.25 H new ATOM 193 N ILE A 399 -1.314 0.353 3.124 1.00 23.00 N ATOM 194 CA ILE A 399 -1.647 -1.057 3.240 1.00 11.22 C ATOM 195 C ILE A 399 -3.152 -1.203 3.473 1.00 54.55 C ATOM 196 O ILE A 399 -3.634 -1.004 4.586 1.00 63.34 O ATOM 197 CB ILE A 399 -0.791 -1.724 4.317 1.00 33.31 C ATOM 198 CG1 ILE A 399 0.697 -1.462 4.076 1.00 2.10 C ATOM 199 CG2 ILE A 399 -1.100 -3.219 4.416 1.00 13.21 C ATOM 200 CD1 ILE A 399 1.554 -2.136 5.149 1.00 12.44 C ATOM 0 H ILE A 399 -1.071 0.807 4.004 1.00 23.00 H new ATOM 0 HA ILE A 399 -1.415 -1.580 2.313 1.00 11.22 H new ATOM 0 HB ILE A 399 -1.045 -1.278 5.279 1.00 33.31 H new ATOM 0 HG12 ILE A 399 0.981 -1.835 3.092 1.00 2.10 H new ATOM 0 HG13 ILE A 399 0.885 -0.388 4.077 1.00 2.10 H new ATOM 0 HG21 ILE A 399 -0.477 -3.669 5.189 1.00 13.21 H new ATOM 0 HG22 ILE A 399 -2.151 -3.357 4.670 1.00 13.21 H new ATOM 0 HG23 ILE A 399 -0.892 -3.698 3.459 1.00 13.21 H new ATOM 0 HD11 ILE A 399 2.607 -1.934 4.954 1.00 12.44 H new ATOM 0 HD12 ILE A 399 1.285 -1.743 6.129 1.00 12.44 H new ATOM 0 HD13 ILE A 399 1.382 -3.212 5.129 1.00 12.44 H new ATOM 211 N LEU A 400 -3.854 -1.547 2.403 1.00 42.04 N ATOM 212 CA LEU A 400 -5.295 -1.721 2.477 1.00 22.15 C ATOM 213 C LEU A 400 -5.608 -3.095 3.073 1.00 22.23 C ATOM 214 O LEU A 400 -5.174 -4.119 2.546 1.00 54.53 O ATOM 215 CB LEU A 400 -5.934 -1.486 1.107 1.00 61.14 C ATOM 216 CG LEU A 400 -6.592 -0.120 0.900 1.00 74.30 C ATOM 217 CD1 LEU A 400 -7.692 0.121 1.934 1.00 42.40 C ATOM 218 CD2 LEU A 400 -5.547 0.999 0.903 1.00 24.33 C ATOM 0 H LEU A 400 -3.452 -1.710 1.480 1.00 42.04 H new ATOM 0 HA LEU A 400 -5.735 -0.977 3.141 1.00 22.15 H new ATOM 0 HB2 LEU A 400 -5.168 -1.618 0.343 1.00 61.14 H new ATOM 0 HB3 LEU A 400 -6.685 -2.258 0.941 1.00 61.14 H new ATOM 0 HG LEU A 400 -7.066 -0.115 -0.081 1.00 74.30 H new ATOM 0 HD11 LEU A 400 -8.143 1.099 1.764 1.00 42.40 H new ATOM 0 HD12 LEU A 400 -8.455 -0.652 1.840 1.00 42.40 H new ATOM 0 HD13 LEU A 400 -7.263 0.088 2.936 1.00 42.40 H new ATOM 0 HD21 LEU A 400 -6.041 1.959 0.754 1.00 24.33 H new ATOM 0 HD22 LEU A 400 -5.023 1.005 1.859 1.00 24.33 H new ATOM 0 HD23 LEU A 400 -4.831 0.831 0.098 1.00 24.33 H new ATOM 229 N HIS A 401 -6.359 -3.074 4.165 1.00 21.43 N ATOM 230 CA HIS A 401 -6.734 -4.304 4.838 1.00 5.42 C ATOM 231 C HIS A 401 -7.997 -4.070 5.670 1.00 74.31 C ATOM 232 O HIS A 401 -8.379 -2.927 5.916 1.00 41.13 O ATOM 233 CB HIS A 401 -5.570 -4.847 5.671 1.00 11.05 C ATOM 234 CG HIS A 401 -5.383 -4.148 6.995 1.00 42.33 C ATOM 235 ND1 HIS A 401 -6.082 -4.503 8.136 1.00 52.53 N ATOM 236 CD2 HIS A 401 -4.570 -3.111 7.350 1.00 30.11 C ATOM 237 CE1 HIS A 401 -5.701 -3.709 9.125 1.00 60.51 C ATOM 238 NE2 HIS A 401 -4.763 -2.847 8.636 1.00 42.01 N ATOM 0 H HIS A 401 -6.717 -2.224 4.600 1.00 21.43 H new ATOM 0 HA HIS A 401 -6.964 -5.070 4.097 1.00 5.42 H new ATOM 0 HB2 HIS A 401 -5.732 -5.910 5.853 1.00 11.05 H new ATOM 0 HB3 HIS A 401 -4.651 -4.759 5.092 1.00 11.05 H new ATOM 0 HD2 HIS A 401 -3.885 -2.593 6.695 1.00 30.11 H new ATOM 0 HE1 HIS A 401 -6.068 -3.739 10.140 1.00 60.51 H new ATOM 0 HE2 HIS A 401 -4.288 -2.120 9.171 1.00 42.01 H new ATOM 246 N ALA A 402 -8.611 -5.170 6.080 1.00 35.12 N ATOM 247 CA ALA A 402 -9.824 -5.098 6.878 1.00 32.22 C ATOM 248 C ALA A 402 -9.499 -4.474 8.235 1.00 63.14 C ATOM 249 O ALA A 402 -8.460 -3.833 8.394 1.00 64.15 O ATOM 250 CB ALA A 402 -10.431 -6.496 7.009 1.00 1.12 C ATOM 0 H ALA A 402 -8.291 -6.117 5.875 1.00 35.12 H new ATOM 0 HA ALA A 402 -10.566 -4.464 6.393 1.00 32.22 H new ATOM 0 HB1 ALA A 402 -11.341 -6.443 7.607 1.00 1.12 H new ATOM 0 HB2 ALA A 402 -10.670 -6.883 6.019 1.00 1.12 H new ATOM 0 HB3 ALA A 402 -9.715 -7.159 7.495 1.00 1.12 H new ATOM 256 N ARG A 403 -10.405 -4.682 9.178 1.00 42.23 N ATOM 257 CA ARG A 403 -10.227 -4.146 10.518 1.00 21.04 C ATOM 258 C ARG A 403 -9.687 -5.229 11.455 1.00 15.22 C ATOM 259 O ARG A 403 -9.269 -4.934 12.573 1.00 25.33 O ATOM 260 CB ARG A 403 -11.547 -3.610 11.076 1.00 24.24 C ATOM 261 CG ARG A 403 -11.298 -2.512 12.113 1.00 74.51 C ATOM 262 CD ARG A 403 -11.608 -3.013 13.526 1.00 52.12 C ATOM 263 NE ARG A 403 -12.025 -1.880 14.383 1.00 34.41 N ATOM 264 CZ ARG A 403 -12.551 -2.019 15.618 1.00 22.23 C ATOM 265 NH1 ARG A 403 -12.729 -3.248 16.153 1.00 75.15 N ATOM 266 NH2 ARG A 403 -12.889 -0.939 16.296 1.00 42.21 N ATOM 0 H ARG A 403 -11.265 -5.214 9.042 1.00 42.23 H new ATOM 0 HA ARG A 403 -9.512 -3.325 10.455 1.00 21.04 H new ATOM 0 HB2 ARG A 403 -12.156 -3.216 10.263 1.00 24.24 H new ATOM 0 HB3 ARG A 403 -12.111 -4.424 11.531 1.00 24.24 H new ATOM 0 HG2 ARG A 403 -10.260 -2.184 12.059 1.00 74.51 H new ATOM 0 HG3 ARG A 403 -11.918 -1.645 11.886 1.00 74.51 H new ATOM 0 HD2 ARG A 403 -12.398 -3.763 13.490 1.00 52.12 H new ATOM 0 HD3 ARG A 403 -10.728 -3.497 13.951 1.00 52.12 H new ATOM 0 HE ARG A 403 -11.907 -0.935 14.017 1.00 34.41 H new ATOM 0 HH11 ARG A 403 -12.465 -4.078 15.623 1.00 75.15 H new ATOM 0 HH12 ARG A 403 -13.127 -3.345 17.087 1.00 75.15 H new ATOM 0 HH21 ARG A 403 -12.752 -0.015 15.886 1.00 42.21 H new ATOM 0 HH22 ARG A 403 -13.288 -1.028 17.231 1.00 42.21 H new ATOM 276 N ALA A 404 -9.714 -6.460 10.964 1.00 74.32 N ATOM 277 CA ALA A 404 -9.233 -7.588 11.742 1.00 45.34 C ATOM 278 C ALA A 404 -7.888 -8.053 11.180 1.00 0.13 C ATOM 279 O ALA A 404 -7.442 -9.162 11.470 1.00 65.53 O ATOM 280 CB ALA A 404 -10.284 -8.699 11.736 1.00 40.23 C ATOM 0 H ALA A 404 -10.062 -6.700 10.036 1.00 74.32 H new ATOM 0 HA ALA A 404 -9.073 -7.298 12.780 1.00 45.34 H new ATOM 0 HB1 ALA A 404 -9.922 -9.545 12.320 1.00 40.23 H new ATOM 0 HB2 ALA A 404 -11.210 -8.326 12.173 1.00 40.23 H new ATOM 0 HB3 ALA A 404 -10.470 -9.019 10.711 1.00 40.23 H new ATOM 286 N ASP A 405 -7.281 -7.184 10.385 1.00 42.23 N ATOM 287 CA ASP A 405 -5.997 -7.493 9.779 1.00 1.21 C ATOM 288 C ASP A 405 -4.987 -6.406 10.154 1.00 41.13 C ATOM 289 O ASP A 405 -4.028 -6.167 9.423 1.00 52.10 O ATOM 290 CB ASP A 405 -6.104 -7.534 8.253 1.00 1.11 C ATOM 291 CG ASP A 405 -5.938 -8.921 7.630 1.00 45.22 C ATOM 292 OD1 ASP A 405 -6.478 -9.916 8.135 1.00 44.32 O ATOM 293 OD2 ASP A 405 -5.207 -8.957 6.568 1.00 61.50 O ATOM 0 H ASP A 405 -7.655 -6.265 10.146 1.00 42.23 H new ATOM 0 HA ASP A 405 -5.677 -8.469 10.144 1.00 1.21 H new ATOM 0 HB2 ASP A 405 -7.076 -7.135 7.961 1.00 1.11 H new ATOM 0 HB3 ASP A 405 -5.348 -6.871 7.833 1.00 1.11 H new ATOM 298 N GLU A 406 -5.238 -5.778 11.293 1.00 44.05 N ATOM 299 CA GLU A 406 -4.362 -4.722 11.774 1.00 32.22 C ATOM 300 C GLU A 406 -2.995 -5.296 12.148 1.00 21.54 C ATOM 301 O GLU A 406 -2.028 -5.145 11.402 1.00 44.25 O ATOM 302 CB GLU A 406 -4.990 -3.986 12.958 1.00 73.05 C ATOM 303 CG GLU A 406 -3.951 -3.127 13.683 1.00 23.11 C ATOM 304 CD GLU A 406 -4.583 -2.383 14.862 1.00 70.03 C ATOM 305 OE1 GLU A 406 -5.414 -1.486 14.655 1.00 24.43 O ATOM 306 OE2 GLU A 406 -4.181 -2.766 16.027 1.00 41.35 O ATOM 0 H GLU A 406 -6.035 -5.980 11.897 1.00 44.05 H new ATOM 0 HA GLU A 406 -4.223 -3.998 10.971 1.00 32.22 H new ATOM 0 HB2 GLU A 406 -5.807 -3.356 12.607 1.00 73.05 H new ATOM 0 HB3 GLU A 406 -5.420 -4.707 13.653 1.00 73.05 H new ATOM 0 HG2 GLU A 406 -3.137 -3.758 14.040 1.00 23.11 H new ATOM 0 HG3 GLU A 406 -3.516 -2.410 12.986 1.00 23.11 H new ATOM 312 N HIS A 407 -2.956 -5.945 13.303 1.00 55.45 N ATOM 313 CA HIS A 407 -1.722 -6.542 13.786 1.00 32.22 C ATOM 314 C HIS A 407 -0.952 -7.148 12.610 1.00 71.13 C ATOM 315 O HIS A 407 0.278 -7.179 12.621 1.00 11.24 O ATOM 316 CB HIS A 407 -2.008 -7.559 14.893 1.00 13.32 C ATOM 317 CG HIS A 407 -2.675 -8.824 14.408 1.00 32.14 C ATOM 318 ND1 HIS A 407 -3.819 -8.818 13.627 1.00 5.41 N ATOM 319 CD2 HIS A 407 -2.347 -10.135 14.599 1.00 61.32 C ATOM 320 CE1 HIS A 407 -4.155 -10.073 13.368 1.00 5.12 C ATOM 321 NE2 HIS A 407 -3.241 -10.888 13.970 1.00 42.34 N ATOM 0 H HIS A 407 -3.760 -6.070 13.919 1.00 55.45 H new ATOM 0 HA HIS A 407 -1.091 -5.773 14.232 1.00 32.22 H new ATOM 0 HB2 HIS A 407 -1.070 -7.820 15.383 1.00 13.32 H new ATOM 0 HB3 HIS A 407 -2.642 -7.092 15.646 1.00 13.32 H new ATOM 0 HD2 HIS A 407 -1.503 -10.498 15.166 1.00 61.32 H new ATOM 0 HE1 HIS A 407 -5.004 -10.395 12.783 1.00 5.12 H new ATOM 0 HE2 HIS A 407 -3.244 -11.908 13.941 1.00 42.34 H new ATOM 328 N ILE A 408 -1.706 -7.611 11.625 1.00 15.52 N ATOM 329 CA ILE A 408 -1.109 -8.212 10.445 1.00 20.14 C ATOM 330 C ILE A 408 -0.281 -7.160 9.704 1.00 0.23 C ATOM 331 O ILE A 408 0.914 -7.346 9.487 1.00 63.32 O ATOM 332 CB ILE A 408 -2.184 -8.872 9.577 1.00 61.23 C ATOM 333 CG1 ILE A 408 -2.694 -10.163 10.223 1.00 1.21 C ATOM 334 CG2 ILE A 408 -1.673 -9.106 8.154 1.00 4.32 C ATOM 335 CD1 ILE A 408 -3.690 -10.877 9.308 1.00 74.31 C ATOM 0 H ILE A 408 -2.726 -7.582 11.620 1.00 15.52 H new ATOM 0 HA ILE A 408 -0.426 -9.012 10.730 1.00 20.14 H new ATOM 0 HB ILE A 408 -3.032 -8.190 9.506 1.00 61.23 H new ATOM 0 HG12 ILE A 408 -1.854 -10.823 10.437 1.00 1.21 H new ATOM 0 HG13 ILE A 408 -3.170 -9.933 11.176 1.00 1.21 H new ATOM 0 HG21 ILE A 408 -2.456 -9.576 7.559 1.00 4.32 H new ATOM 0 HG22 ILE A 408 -1.399 -8.152 7.704 1.00 4.32 H new ATOM 0 HG23 ILE A 408 -0.800 -9.758 8.184 1.00 4.32 H new ATOM 0 HD11 ILE A 408 -4.037 -11.791 9.790 1.00 74.31 H new ATOM 0 HD12 ILE A 408 -4.541 -10.223 9.115 1.00 74.31 H new ATOM 0 HD13 ILE A 408 -3.203 -11.127 8.365 1.00 74.31 H new ATOM 346 N ALA A 409 -0.953 -6.078 9.337 1.00 72.02 N ATOM 347 CA ALA A 409 -0.294 -4.996 8.625 1.00 60.31 C ATOM 348 C ALA A 409 0.784 -4.382 9.521 1.00 2.44 C ATOM 349 O ALA A 409 1.930 -4.225 9.101 1.00 41.54 O ATOM 350 CB ALA A 409 -1.337 -3.968 8.182 1.00 63.52 C ATOM 0 H ALA A 409 -1.945 -5.928 9.519 1.00 72.02 H new ATOM 0 HA ALA A 409 0.198 -5.371 7.728 1.00 60.31 H new ATOM 0 HB1 ALA A 409 -0.844 -3.156 7.648 1.00 63.52 H new ATOM 0 HB2 ALA A 409 -2.063 -4.446 7.525 1.00 63.52 H new ATOM 0 HB3 ALA A 409 -1.849 -3.568 9.058 1.00 63.52 H new ATOM 356 N LEU A 410 0.379 -4.054 10.740 1.00 11.41 N ATOM 357 CA LEU A 410 1.297 -3.464 11.699 1.00 53.41 C ATOM 358 C LEU A 410 2.575 -4.302 11.760 1.00 64.44 C ATOM 359 O LEU A 410 3.637 -3.796 12.119 1.00 43.01 O ATOM 360 CB LEU A 410 0.612 -3.286 13.056 1.00 52.11 C ATOM 361 CG LEU A 410 -0.675 -2.458 13.054 1.00 45.03 C ATOM 362 CD1 LEU A 410 -0.812 -1.656 14.350 1.00 52.44 C ATOM 363 CD2 LEU A 410 -0.749 -1.563 11.815 1.00 52.43 C ATOM 0 H LEU A 410 -0.572 -4.186 11.085 1.00 11.41 H new ATOM 0 HA LEU A 410 1.588 -2.463 11.381 1.00 53.41 H new ATOM 0 HB2 LEU A 410 0.385 -4.273 13.458 1.00 52.11 H new ATOM 0 HB3 LEU A 410 1.320 -2.818 13.740 1.00 52.11 H new ATOM 0 HG LEU A 410 -1.522 -3.142 13.008 1.00 45.03 H new ATOM 0 HD11 LEU A 410 -1.735 -1.076 14.323 1.00 52.44 H new ATOM 0 HD12 LEU A 410 -0.837 -2.339 15.199 1.00 52.44 H new ATOM 0 HD13 LEU A 410 0.038 -0.981 14.452 1.00 52.44 H new ATOM 0 HD21 LEU A 410 -1.673 -0.985 11.838 1.00 52.43 H new ATOM 0 HD22 LEU A 410 0.103 -0.884 11.805 1.00 52.43 H new ATOM 0 HD23 LEU A 410 -0.730 -2.182 10.918 1.00 52.43 H new ATOM 374 N ARG A 411 2.430 -5.570 11.404 1.00 55.32 N ATOM 375 CA ARG A 411 3.560 -6.484 11.414 1.00 41.54 C ATOM 376 C ARG A 411 4.405 -6.296 10.152 1.00 4.33 C ATOM 377 O ARG A 411 5.624 -6.457 10.187 1.00 44.13 O ATOM 378 CB ARG A 411 3.091 -7.937 11.495 1.00 22.14 C ATOM 379 CG ARG A 411 4.240 -8.861 11.909 1.00 13.13 C ATOM 380 CD ARG A 411 4.186 -10.180 11.136 1.00 2.30 C ATOM 381 NE ARG A 411 3.159 -11.070 11.724 1.00 31.50 N ATOM 382 CZ ARG A 411 3.243 -11.610 12.958 1.00 62.20 C ATOM 383 NH1 ARG A 411 4.308 -11.354 13.747 1.00 30.54 N ATOM 384 NH2 ARG A 411 2.267 -12.391 13.381 1.00 4.55 N ATOM 0 H ARG A 411 1.547 -5.986 11.107 1.00 55.32 H new ATOM 0 HA ARG A 411 4.162 -6.259 12.295 1.00 41.54 H new ATOM 0 HB2 ARG A 411 2.275 -8.020 12.213 1.00 22.14 H new ATOM 0 HB3 ARG A 411 2.697 -8.251 10.528 1.00 22.14 H new ATOM 0 HG2 ARG A 411 5.194 -8.366 11.726 1.00 13.13 H new ATOM 0 HG3 ARG A 411 4.185 -9.060 12.979 1.00 13.13 H new ATOM 0 HD2 ARG A 411 3.956 -9.988 10.088 1.00 2.30 H new ATOM 0 HD3 ARG A 411 5.161 -10.667 11.164 1.00 2.30 H new ATOM 0 HE ARG A 411 2.337 -11.289 11.161 1.00 31.50 H new ATOM 0 HH11 ARG A 411 5.057 -10.748 13.412 1.00 30.54 H new ATOM 0 HH12 ARG A 411 4.364 -11.766 14.678 1.00 30.54 H new ATOM 0 HH21 ARG A 411 1.466 -12.578 12.778 1.00 4.55 H new ATOM 0 HH22 ARG A 411 2.314 -12.808 14.311 1.00 4.55 H new ATOM 394 N VAL A 412 3.724 -5.959 9.068 1.00 31.32 N ATOM 395 CA VAL A 412 4.397 -5.749 7.797 1.00 10.42 C ATOM 396 C VAL A 412 5.146 -4.417 7.837 1.00 62.55 C ATOM 397 O VAL A 412 6.349 -4.369 7.576 1.00 4.41 O ATOM 398 CB VAL A 412 3.387 -5.831 6.650 1.00 10.44 C ATOM 399 CG1 VAL A 412 3.863 -5.023 5.441 1.00 44.34 C ATOM 400 CG2 VAL A 412 3.116 -7.286 6.262 1.00 0.41 C ATOM 0 H VAL A 412 2.713 -5.826 9.043 1.00 31.32 H new ATOM 0 HA VAL A 412 5.134 -6.533 7.621 1.00 10.42 H new ATOM 0 HB VAL A 412 2.450 -5.395 6.997 1.00 10.44 H new ATOM 0 HG11 VAL A 412 3.127 -5.098 4.640 1.00 44.34 H new ATOM 0 HG12 VAL A 412 3.983 -3.978 5.726 1.00 44.34 H new ATOM 0 HG13 VAL A 412 4.818 -5.416 5.094 1.00 44.34 H new ATOM 0 HG21 VAL A 412 2.395 -7.316 5.445 1.00 0.41 H new ATOM 0 HG22 VAL A 412 4.046 -7.757 5.943 1.00 0.41 H new ATOM 0 HG23 VAL A 412 2.714 -7.823 7.121 1.00 0.41 H new ATOM 410 N ARG A 413 4.408 -3.366 8.164 1.00 25.20 N ATOM 411 CA ARG A 413 4.990 -2.037 8.242 1.00 5.22 C ATOM 412 C ARG A 413 6.413 -2.111 8.801 1.00 34.24 C ATOM 413 O ARG A 413 7.339 -1.541 8.224 1.00 44.21 O ATOM 414 CB ARG A 413 4.149 -1.119 9.131 1.00 5.35 C ATOM 415 CG ARG A 413 2.659 -1.268 8.818 1.00 42.32 C ATOM 416 CD ARG A 413 1.906 0.033 9.103 1.00 54.52 C ATOM 417 NE ARG A 413 2.422 0.656 10.343 1.00 61.02 N ATOM 418 CZ ARG A 413 1.696 1.465 11.143 1.00 60.01 C ATOM 419 NH1 ARG A 413 0.412 1.756 10.840 1.00 21.31 N ATOM 420 NH2 ARG A 413 2.259 1.967 12.226 1.00 4.42 N ATOM 0 H ARG A 413 3.412 -3.408 8.378 1.00 25.20 H new ATOM 0 HA ARG A 413 5.013 -1.627 7.233 1.00 5.22 H new ATOM 0 HB2 ARG A 413 4.330 -1.357 10.179 1.00 5.35 H new ATOM 0 HB3 ARG A 413 4.454 -0.083 8.982 1.00 5.35 H new ATOM 0 HG2 ARG A 413 2.530 -1.546 7.772 1.00 42.32 H new ATOM 0 HG3 ARG A 413 2.237 -2.075 9.417 1.00 42.32 H new ATOM 0 HD2 ARG A 413 2.022 0.721 8.265 1.00 54.52 H new ATOM 0 HD3 ARG A 413 0.840 -0.169 9.204 1.00 54.52 H new ATOM 0 HE ARG A 413 3.387 0.462 10.610 1.00 61.02 H new ATOM 0 HH11 ARG A 413 -0.016 1.363 10.001 1.00 21.31 H new ATOM 0 HH12 ARG A 413 -0.130 2.368 11.450 1.00 21.31 H new ATOM 0 HH21 ARG A 413 3.229 1.742 12.448 1.00 4.42 H new ATOM 0 HH22 ARG A 413 1.724 2.580 12.841 1.00 4.42 H new ATOM 430 N GLU A 414 6.542 -2.819 9.912 1.00 44.30 N ATOM 431 CA GLU A 414 7.836 -2.975 10.554 1.00 31.30 C ATOM 432 C GLU A 414 8.774 -3.794 9.665 1.00 52.00 C ATOM 433 O GLU A 414 9.841 -3.319 9.277 1.00 53.32 O ATOM 434 CB GLU A 414 7.691 -3.619 11.935 1.00 54.44 C ATOM 435 CG GLU A 414 6.950 -2.687 12.897 1.00 23.23 C ATOM 436 CD GLU A 414 6.625 -3.402 14.210 1.00 24.30 C ATOM 437 OE1 GLU A 414 7.025 -4.561 14.401 1.00 10.32 O ATOM 438 OE2 GLU A 414 5.931 -2.712 15.050 1.00 31.33 O ATOM 0 H GLU A 414 5.772 -3.292 10.385 1.00 44.30 H new ATOM 0 HA GLU A 414 8.270 -1.985 10.695 1.00 31.30 H new ATOM 0 HB2 GLU A 414 7.150 -4.561 11.846 1.00 54.44 H new ATOM 0 HB3 GLU A 414 8.677 -3.854 12.337 1.00 54.44 H new ATOM 0 HG2 GLU A 414 7.560 -1.807 13.099 1.00 23.23 H new ATOM 0 HG3 GLU A 414 6.029 -2.336 12.432 1.00 23.23 H new ATOM 444 N LYS A 415 8.343 -5.011 9.366 1.00 31.14 N ATOM 445 CA LYS A 415 9.131 -5.900 8.530 1.00 72.35 C ATOM 446 C LYS A 415 9.789 -5.091 7.412 1.00 75.14 C ATOM 447 O LYS A 415 10.995 -5.196 7.191 1.00 70.45 O ATOM 448 CB LYS A 415 8.272 -7.061 8.025 1.00 61.32 C ATOM 449 CG LYS A 415 9.018 -8.391 8.154 1.00 33.12 C ATOM 450 CD LYS A 415 10.388 -8.319 7.476 1.00 35.20 C ATOM 451 CE LYS A 415 10.243 -8.230 5.956 1.00 73.12 C ATOM 452 NZ LYS A 415 10.414 -9.565 5.339 1.00 65.34 N ATOM 0 H LYS A 415 7.458 -5.402 9.688 1.00 31.14 H new ATOM 0 HA LYS A 415 9.934 -6.356 9.109 1.00 72.35 H new ATOM 0 HB2 LYS A 415 7.343 -7.105 8.593 1.00 61.32 H new ATOM 0 HB3 LYS A 415 8.001 -6.891 6.983 1.00 61.32 H new ATOM 0 HG2 LYS A 415 9.142 -8.642 9.207 1.00 33.12 H new ATOM 0 HG3 LYS A 415 8.427 -9.189 7.704 1.00 33.12 H new ATOM 0 HD2 LYS A 415 10.935 -7.451 7.844 1.00 35.20 H new ATOM 0 HD3 LYS A 415 10.974 -9.200 7.738 1.00 35.20 H new ATOM 0 HE2 LYS A 415 9.262 -7.828 5.701 1.00 73.12 H new ATOM 0 HE3 LYS A 415 10.984 -7.540 5.554 1.00 73.12 H new ATOM 0 HZ1 LYS A 415 10.246 -9.498 4.315 1.00 65.34 H new ATOM 0 HZ2 LYS A 415 11.382 -9.905 5.509 1.00 65.34 H new ATOM 0 HZ3 LYS A 415 9.735 -10.231 5.759 1.00 65.34 H new ATOM 461 N LEU A 416 8.970 -4.301 6.735 1.00 54.34 N ATOM 462 CA LEU A 416 9.457 -3.473 5.644 1.00 14.21 C ATOM 463 C LEU A 416 10.703 -2.712 6.104 1.00 10.24 C ATOM 464 O LEU A 416 11.765 -2.830 5.496 1.00 22.01 O ATOM 465 CB LEU A 416 8.341 -2.566 5.120 1.00 74.22 C ATOM 466 CG LEU A 416 7.135 -3.275 4.501 1.00 5.35 C ATOM 467 CD1 LEU A 416 6.049 -2.270 4.111 1.00 74.42 C ATOM 468 CD2 LEU A 416 7.559 -4.149 3.320 1.00 13.13 C ATOM 0 H LEU A 416 7.971 -4.216 6.921 1.00 54.34 H new ATOM 0 HA LEU A 416 9.755 -4.093 4.799 1.00 14.21 H new ATOM 0 HB2 LEU A 416 7.989 -1.944 5.943 1.00 74.22 H new ATOM 0 HB3 LEU A 416 8.766 -1.895 4.373 1.00 74.22 H new ATOM 0 HG LEU A 416 6.705 -3.937 5.253 1.00 5.35 H new ATOM 0 HD11 LEU A 416 5.203 -2.800 3.673 1.00 74.42 H new ATOM 0 HD12 LEU A 416 5.719 -1.729 4.998 1.00 74.42 H new ATOM 0 HD13 LEU A 416 6.451 -1.564 3.384 1.00 74.42 H new ATOM 0 HD21 LEU A 416 6.683 -4.641 2.899 1.00 13.13 H new ATOM 0 HD22 LEU A 416 8.028 -3.527 2.557 1.00 13.13 H new ATOM 0 HD23 LEU A 416 8.269 -4.902 3.661 1.00 13.13 H new ATOM 479 N GLU A 417 10.530 -1.951 7.174 1.00 63.32 N ATOM 480 CA GLU A 417 11.627 -1.172 7.722 1.00 53.12 C ATOM 481 C GLU A 417 12.933 -1.965 7.644 1.00 1.23 C ATOM 482 O GLU A 417 14.011 -1.385 7.523 1.00 43.21 O ATOM 483 CB GLU A 417 11.331 -0.745 9.161 1.00 55.20 C ATOM 484 CG GLU A 417 10.115 0.184 9.219 1.00 15.00 C ATOM 485 CD GLU A 417 9.440 0.118 10.590 1.00 32.01 C ATOM 486 OE1 GLU A 417 8.231 0.372 10.699 1.00 33.01 O ATOM 487 OE2 GLU A 417 10.217 -0.211 11.565 1.00 22.20 O ATOM 0 H GLU A 417 9.647 -1.857 7.676 1.00 63.32 H new ATOM 0 HA GLU A 417 11.738 -0.267 7.124 1.00 53.12 H new ATOM 0 HB2 GLU A 417 11.149 -1.627 9.776 1.00 55.20 H new ATOM 0 HB3 GLU A 417 12.200 -0.238 9.580 1.00 55.20 H new ATOM 0 HG2 GLU A 417 10.425 1.208 9.011 1.00 15.00 H new ATOM 0 HG3 GLU A 417 9.401 -0.096 8.444 1.00 15.00 H new ATOM 493 N ALA A 418 12.793 -3.282 7.718 1.00 40.14 N ATOM 494 CA ALA A 418 13.950 -4.160 7.657 1.00 24.04 C ATOM 495 C ALA A 418 14.589 -4.061 6.271 1.00 14.52 C ATOM 496 O ALA A 418 15.781 -3.784 6.151 1.00 51.30 O ATOM 497 CB ALA A 418 13.522 -5.589 8.000 1.00 45.01 C ATOM 0 H ALA A 418 11.898 -3.761 7.819 1.00 40.14 H new ATOM 0 HA ALA A 418 14.700 -3.858 8.387 1.00 24.04 H new ATOM 0 HB1 ALA A 418 14.388 -6.249 7.955 1.00 45.01 H new ATOM 0 HB2 ALA A 418 13.101 -5.611 9.005 1.00 45.01 H new ATOM 0 HB3 ALA A 418 12.772 -5.926 7.285 1.00 45.01 H new ATOM 503 N LEU A 419 13.766 -4.292 5.257 1.00 14.33 N ATOM 504 CA LEU A 419 14.236 -4.231 3.883 1.00 24.53 C ATOM 505 C LEU A 419 14.638 -2.794 3.549 1.00 43.12 C ATOM 506 O LEU A 419 15.693 -2.560 2.963 1.00 62.22 O ATOM 507 CB LEU A 419 13.189 -4.814 2.933 1.00 31.54 C ATOM 508 CG LEU A 419 12.614 -6.178 3.323 1.00 60.31 C ATOM 509 CD1 LEU A 419 11.127 -6.267 2.971 1.00 31.34 C ATOM 510 CD2 LEU A 419 13.422 -7.314 2.692 1.00 53.20 C ATOM 0 H LEU A 419 12.778 -4.521 5.360 1.00 14.33 H new ATOM 0 HA LEU A 419 15.126 -4.848 3.757 1.00 24.53 H new ATOM 0 HB2 LEU A 419 12.366 -4.104 2.852 1.00 31.54 H new ATOM 0 HB3 LEU A 419 13.634 -4.900 1.942 1.00 31.54 H new ATOM 0 HG LEU A 419 12.696 -6.287 4.404 1.00 60.31 H new ATOM 0 HD11 LEU A 419 10.743 -7.246 3.258 1.00 31.34 H new ATOM 0 HD12 LEU A 419 10.579 -5.491 3.506 1.00 31.34 H new ATOM 0 HD13 LEU A 419 10.998 -6.128 1.898 1.00 31.34 H new ATOM 0 HD21 LEU A 419 12.993 -8.272 2.985 1.00 53.20 H new ATOM 0 HD22 LEU A 419 13.394 -7.221 1.606 1.00 53.20 H new ATOM 0 HD23 LEU A 419 14.455 -7.260 3.035 1.00 53.20 H new ATOM 521 N GLY A 420 13.773 -1.866 3.936 1.00 32.22 N ATOM 522 CA GLY A 420 14.025 -0.458 3.685 1.00 12.32 C ATOM 523 C GLY A 420 12.782 0.383 3.989 1.00 3.33 C ATOM 524 O GLY A 420 12.751 1.115 4.978 1.00 70.22 O ATOM 0 H GLY A 420 12.898 -2.063 4.421 1.00 32.22 H new ATOM 0 HA2 GLY A 420 14.858 -0.118 4.300 1.00 12.32 H new ATOM 0 HA3 GLY A 420 14.319 -0.317 2.645 1.00 12.32 H new ATOM 528 N VAL A 421 11.790 0.250 3.121 1.00 51.12 N ATOM 529 CA VAL A 421 10.550 0.990 3.285 1.00 1.43 C ATOM 530 C VAL A 421 10.175 1.026 4.768 1.00 50.24 C ATOM 531 O VAL A 421 10.290 0.021 5.467 1.00 22.10 O ATOM 532 CB VAL A 421 9.456 0.376 2.408 1.00 33.20 C ATOM 533 CG1 VAL A 421 9.634 -1.138 2.287 1.00 21.43 C ATOM 534 CG2 VAL A 421 8.065 0.723 2.943 1.00 71.04 C ATOM 0 H VAL A 421 11.819 -0.358 2.303 1.00 51.12 H new ATOM 0 HA VAL A 421 10.674 2.022 2.955 1.00 1.43 H new ATOM 0 HB VAL A 421 9.548 0.805 1.410 1.00 33.20 H new ATOM 0 HG11 VAL A 421 8.843 -1.548 1.659 1.00 21.43 H new ATOM 0 HG12 VAL A 421 10.603 -1.356 1.839 1.00 21.43 H new ATOM 0 HG13 VAL A 421 9.582 -1.591 3.277 1.00 21.43 H new ATOM 0 HG21 VAL A 421 7.306 0.275 2.302 1.00 71.04 H new ATOM 0 HG22 VAL A 421 7.958 0.336 3.957 1.00 71.04 H new ATOM 0 HG23 VAL A 421 7.938 1.806 2.952 1.00 71.04 H new ATOM 544 N PRO A 422 9.723 2.228 5.217 1.00 15.13 N ATOM 545 CA PRO A 422 9.330 2.410 6.604 1.00 1.24 C ATOM 546 C PRO A 422 7.975 1.757 6.881 1.00 31.15 C ATOM 547 O PRO A 422 7.471 0.992 6.059 1.00 50.30 O ATOM 548 CB PRO A 422 9.319 3.915 6.816 1.00 73.42 C ATOM 549 CG PRO A 422 9.252 4.530 5.428 1.00 54.51 C ATOM 550 CD PRO A 422 9.573 3.441 4.418 1.00 71.10 C ATOM 0 HA PRO A 422 10.015 1.928 7.301 1.00 1.24 H new ATOM 0 HB2 PRO A 422 8.463 4.218 7.419 1.00 73.42 H new ATOM 0 HB3 PRO A 422 10.214 4.242 7.345 1.00 73.42 H new ATOM 0 HG2 PRO A 422 8.261 4.943 5.241 1.00 54.51 H new ATOM 0 HG3 PRO A 422 9.962 5.353 5.341 1.00 54.51 H new ATOM 0 HD2 PRO A 422 8.775 3.335 3.683 1.00 71.10 H new ATOM 0 HD3 PRO A 422 10.486 3.668 3.867 1.00 71.10 H new ATOM 555 N ASP A 423 7.423 2.083 8.040 1.00 13.15 N ATOM 556 CA ASP A 423 6.135 1.538 8.435 1.00 54.02 C ATOM 557 C ASP A 423 5.102 1.840 7.347 1.00 24.22 C ATOM 558 O ASP A 423 4.330 0.963 6.958 1.00 42.55 O ATOM 559 CB ASP A 423 5.646 2.170 9.739 1.00 11.20 C ATOM 560 CG ASP A 423 5.956 3.661 9.891 1.00 53.24 C ATOM 561 OD1 ASP A 423 5.388 4.506 9.182 1.00 52.23 O ATOM 562 OD2 ASP A 423 6.831 3.947 10.793 1.00 12.13 O ATOM 0 H ASP A 423 7.844 2.718 8.719 1.00 13.15 H new ATOM 0 HA ASP A 423 6.253 0.464 8.577 1.00 54.02 H new ATOM 0 HB2 ASP A 423 4.568 2.029 9.811 1.00 11.20 H new ATOM 0 HB3 ASP A 423 6.094 1.634 10.576 1.00 11.20 H new ATOM 567 N GLY A 424 5.122 3.081 6.885 1.00 43.11 N ATOM 568 CA GLY A 424 4.197 3.509 5.849 1.00 10.32 C ATOM 569 C GLY A 424 2.846 3.901 6.449 1.00 52.33 C ATOM 570 O GLY A 424 2.662 5.036 6.886 1.00 12.13 O ATOM 0 H GLY A 424 5.764 3.804 7.209 1.00 43.11 H new ATOM 0 HA2 GLY A 424 4.618 4.356 5.308 1.00 10.32 H new ATOM 0 HA3 GLY A 424 4.058 2.706 5.126 1.00 10.32 H new ATOM 574 N ALA A 425 1.934 2.940 6.450 1.00 61.35 N ATOM 575 CA ALA A 425 0.604 3.170 6.990 1.00 35.22 C ATOM 576 C ALA A 425 -0.347 2.093 6.465 1.00 3.30 C ATOM 577 O ALA A 425 0.070 1.187 5.747 1.00 71.52 O ATOM 578 CB ALA A 425 0.142 4.582 6.623 1.00 61.42 C ATOM 0 H ALA A 425 2.090 2.000 6.085 1.00 61.35 H new ATOM 0 HA ALA A 425 0.614 3.101 8.078 1.00 35.22 H new ATOM 0 HB1 ALA A 425 -0.855 4.755 7.028 1.00 61.42 H new ATOM 0 HB2 ALA A 425 0.835 5.312 7.041 1.00 61.42 H new ATOM 0 HB3 ALA A 425 0.117 4.686 5.538 1.00 61.42 H new ATOM 584 N THR A 426 -1.609 2.226 6.847 1.00 31.21 N ATOM 585 CA THR A 426 -2.623 1.275 6.426 1.00 11.43 C ATOM 586 C THR A 426 -3.995 1.949 6.369 1.00 22.00 C ATOM 587 O THR A 426 -4.311 2.793 7.206 1.00 52.01 O ATOM 588 CB THR A 426 -2.572 0.077 7.376 1.00 54.14 C ATOM 589 OG1 THR A 426 -3.268 0.525 8.535 1.00 54.54 O ATOM 590 CG2 THR A 426 -1.157 -0.211 7.880 1.00 34.35 C ATOM 0 H THR A 426 -1.952 2.979 7.444 1.00 31.21 H new ATOM 0 HA THR A 426 -2.432 0.914 5.416 1.00 11.43 H new ATOM 0 HB THR A 426 -2.963 -0.805 6.869 1.00 54.14 H new ATOM 0 HG1 THR A 426 -3.285 -0.191 9.204 1.00 54.54 H new ATOM 0 HG21 THR A 426 -1.177 -1.070 8.550 1.00 34.35 H new ATOM 0 HG22 THR A 426 -0.506 -0.427 7.033 1.00 34.35 H new ATOM 0 HG23 THR A 426 -0.778 0.659 8.417 1.00 34.35 H new ATOM 598 N PHE A 427 -4.774 1.551 5.374 1.00 10.42 N ATOM 599 CA PHE A 427 -6.106 2.106 5.197 1.00 21.20 C ATOM 600 C PHE A 427 -7.177 1.026 5.373 1.00 73.14 C ATOM 601 O PHE A 427 -6.960 -0.131 5.019 1.00 12.20 O ATOM 602 CB PHE A 427 -6.178 2.651 3.770 1.00 73.32 C ATOM 603 CG PHE A 427 -5.749 4.115 3.641 1.00 65.32 C ATOM 604 CD1 PHE A 427 -4.981 4.686 4.609 1.00 14.10 C ATOM 605 CD2 PHE A 427 -6.135 4.844 2.561 1.00 62.54 C ATOM 606 CE1 PHE A 427 -4.583 6.044 4.489 1.00 73.15 C ATOM 607 CE2 PHE A 427 -5.736 6.203 2.441 1.00 43.40 C ATOM 608 CZ PHE A 427 -4.969 6.774 3.408 1.00 24.22 C ATOM 0 H PHE A 427 -4.509 0.851 4.682 1.00 10.42 H new ATOM 0 HA PHE A 427 -6.287 2.884 5.939 1.00 21.20 H new ATOM 0 HB2 PHE A 427 -5.546 2.040 3.126 1.00 73.32 H new ATOM 0 HB3 PHE A 427 -7.200 2.549 3.404 1.00 73.32 H new ATOM 0 HD1 PHE A 427 -4.675 4.107 5.468 1.00 14.10 H new ATOM 0 HD2 PHE A 427 -6.745 4.391 1.794 1.00 62.54 H new ATOM 0 HE1 PHE A 427 -3.973 6.497 5.257 1.00 73.15 H new ATOM 0 HE2 PHE A 427 -6.042 6.782 1.582 1.00 43.40 H new ATOM 0 HZ PHE A 427 -4.666 7.807 3.318 1.00 24.22 H new ATOM 823 N GLN A 443 -6.974 7.264 -2.643 1.00 25.41 N ATOM 824 CA GLN A 443 -6.070 7.739 -3.677 1.00 34.54 C ATOM 825 C GLN A 443 -5.076 8.744 -3.094 1.00 55.25 C ATOM 826 O GLN A 443 -4.069 9.064 -3.723 1.00 23.33 O ATOM 827 CB GLN A 443 -6.847 8.350 -4.845 1.00 54.55 C ATOM 828 CG GLN A 443 -7.607 9.602 -4.403 1.00 42.11 C ATOM 829 CD GLN A 443 -8.698 9.967 -5.412 1.00 62.42 C ATOM 830 OE1 GLN A 443 -8.367 9.724 -6.678 1.00 33.23 O flip ATOM 831 NE2 GLN A 443 -9.767 10.439 -5.065 1.00 12.41 N flip ATOM 0 HA GLN A 443 -5.510 6.887 -4.062 1.00 34.54 H new ATOM 0 HB2 GLN A 443 -6.159 8.604 -5.651 1.00 54.55 H new ATOM 0 HB3 GLN A 443 -7.548 7.616 -5.243 1.00 54.55 H new ATOM 0 HG2 GLN A 443 -8.055 9.433 -3.424 1.00 42.11 H new ATOM 0 HG3 GLN A 443 -6.912 10.435 -4.297 1.00 42.11 H new ATOM 0 HE21 GLN A 443 -9.956 10.600 -4.076 1.00 12.41 H new ATOM 0 HE22 GLN A 443 -10.472 10.673 -5.764 1.00 12.41 H new ATOM 838 N ASP A 444 -5.394 9.217 -1.898 1.00 3.22 N ATOM 839 CA ASP A 444 -4.543 10.180 -1.222 1.00 65.11 C ATOM 840 C ASP A 444 -3.165 9.558 -0.985 1.00 21.22 C ATOM 841 O ASP A 444 -2.202 10.265 -0.689 1.00 0.42 O ATOM 842 CB ASP A 444 -5.125 10.571 0.139 1.00 74.51 C ATOM 843 CG ASP A 444 -4.520 11.832 0.761 1.00 12.31 C ATOM 844 OD1 ASP A 444 -4.639 12.936 0.210 1.00 44.53 O ATOM 845 OD2 ASP A 444 -3.896 11.644 1.875 1.00 54.50 O ATOM 0 H ASP A 444 -6.231 8.950 -1.379 1.00 3.22 H new ATOM 0 HA ASP A 444 -4.471 11.067 -1.852 1.00 65.11 H new ATOM 0 HB2 ASP A 444 -6.200 10.717 0.030 1.00 74.51 H new ATOM 0 HB3 ASP A 444 -4.985 9.740 0.830 1.00 74.51 H new ATOM 850 N ALA A 445 -3.113 8.241 -1.124 1.00 51.24 N ATOM 851 CA ALA A 445 -1.870 7.515 -0.929 1.00 44.40 C ATOM 852 C ALA A 445 -1.148 7.380 -2.271 1.00 12.25 C ATOM 853 O ALA A 445 0.081 7.369 -2.321 1.00 25.54 O ATOM 854 CB ALA A 445 -2.165 6.158 -0.286 1.00 72.22 C ATOM 0 H ALA A 445 -3.913 7.658 -1.370 1.00 51.24 H new ATOM 0 HA ALA A 445 -1.210 8.059 -0.253 1.00 44.40 H new ATOM 0 HB1 ALA A 445 -1.232 5.614 -0.140 1.00 72.22 H new ATOM 0 HB2 ALA A 445 -2.651 6.310 0.678 1.00 72.22 H new ATOM 0 HB3 ALA A 445 -2.823 5.582 -0.937 1.00 72.22 H new ATOM 860 N ILE A 446 -1.942 7.280 -3.327 1.00 42.01 N ATOM 861 CA ILE A 446 -1.394 7.147 -4.666 1.00 1.14 C ATOM 862 C ILE A 446 -0.463 8.325 -4.952 1.00 51.24 C ATOM 863 O ILE A 446 0.513 8.187 -5.688 1.00 45.31 O ATOM 864 CB ILE A 446 -2.518 6.987 -5.692 1.00 4.25 C ATOM 865 CG1 ILE A 446 -2.971 5.528 -5.787 1.00 74.33 C ATOM 866 CG2 ILE A 446 -2.102 7.549 -7.052 1.00 11.32 C ATOM 867 CD1 ILE A 446 -4.052 5.359 -6.855 1.00 54.31 C ATOM 0 H ILE A 446 -2.961 7.288 -3.282 1.00 42.01 H new ATOM 0 HA ILE A 446 -0.793 6.241 -4.743 1.00 1.14 H new ATOM 0 HB ILE A 446 -3.376 7.568 -5.353 1.00 4.25 H new ATOM 0 HG12 ILE A 446 -2.117 4.893 -6.025 1.00 74.33 H new ATOM 0 HG13 ILE A 446 -3.354 5.199 -4.821 1.00 74.33 H new ATOM 0 HG21 ILE A 446 -2.918 7.423 -7.763 1.00 11.32 H new ATOM 0 HG22 ILE A 446 -1.869 8.609 -6.952 1.00 11.32 H new ATOM 0 HG23 ILE A 446 -1.222 7.016 -7.412 1.00 11.32 H new ATOM 0 HD11 ILE A 446 -4.356 4.313 -6.902 1.00 54.31 H new ATOM 0 HD12 ILE A 446 -4.914 5.977 -6.602 1.00 54.31 H new ATOM 0 HD13 ILE A 446 -3.658 5.666 -7.824 1.00 54.31 H new ATOM 878 N ASP A 447 -0.798 9.461 -4.355 1.00 20.45 N ATOM 879 CA ASP A 447 -0.004 10.664 -4.536 1.00 75.23 C ATOM 880 C ASP A 447 0.969 10.810 -3.364 1.00 20.45 C ATOM 881 O ASP A 447 2.181 10.892 -3.564 1.00 2.51 O ATOM 882 CB ASP A 447 -0.892 11.909 -4.571 1.00 30.23 C ATOM 883 CG ASP A 447 -1.994 11.949 -3.511 1.00 24.22 C ATOM 884 OD1 ASP A 447 -2.636 10.929 -3.220 1.00 42.20 O ATOM 885 OD2 ASP A 447 -2.185 13.102 -2.965 1.00 31.23 O ATOM 0 H ASP A 447 -1.609 9.573 -3.746 1.00 20.45 H new ATOM 0 HA ASP A 447 0.531 10.575 -5.481 1.00 75.23 H new ATOM 0 HB2 ASP A 447 -0.261 12.790 -4.451 1.00 30.23 H new ATOM 0 HB3 ASP A 447 -1.354 11.980 -5.556 1.00 30.23 H new ATOM 890 N HIS A 448 0.402 10.837 -2.167 1.00 73.42 N ATOM 891 CA HIS A 448 1.205 10.972 -0.963 1.00 5.35 C ATOM 892 C HIS A 448 2.169 9.789 -0.854 1.00 72.31 C ATOM 893 O HIS A 448 3.386 9.972 -0.881 1.00 24.01 O ATOM 894 CB HIS A 448 0.313 11.123 0.270 1.00 41.51 C ATOM 895 CG HIS A 448 -0.627 12.304 0.208 1.00 10.14 C ATOM 896 ND1 HIS A 448 -0.738 13.114 -0.909 1.00 40.53 N ATOM 897 CD2 HIS A 448 -1.496 12.801 1.133 1.00 35.15 C ATOM 898 CE1 HIS A 448 -1.637 14.054 -0.654 1.00 52.32 C ATOM 899 NE2 HIS A 448 -2.106 13.860 0.611 1.00 22.04 N ATOM 0 H HIS A 448 -0.603 10.768 -2.005 1.00 73.42 H new ATOM 0 HA HIS A 448 1.804 11.881 -1.021 1.00 5.35 H new ATOM 0 HB2 HIS A 448 -0.272 10.212 0.396 1.00 41.51 H new ATOM 0 HB3 HIS A 448 0.945 11.221 1.153 1.00 41.51 H new ATOM 0 HD2 HIS A 448 -1.661 12.402 2.123 1.00 35.15 H new ATOM 0 HE1 HIS A 448 -1.944 14.837 -1.331 1.00 52.32 H new ATOM 0 HE2 HIS A 448 -2.808 14.433 1.079 1.00 22.04 H new ATOM 906 N SER A 449 1.591 8.603 -0.735 1.00 43.13 N ATOM 907 CA SER A 449 2.384 7.391 -0.622 1.00 64.44 C ATOM 908 C SER A 449 3.047 7.073 -1.964 1.00 45.32 C ATOM 909 O SER A 449 2.582 7.520 -3.012 1.00 5.35 O ATOM 910 CB SER A 449 1.527 6.212 -0.162 1.00 44.42 C ATOM 911 OG SER A 449 1.093 5.408 -1.255 1.00 50.32 O ATOM 0 H SER A 449 0.582 8.456 -0.714 1.00 43.13 H new ATOM 0 HA SER A 449 3.157 7.557 0.128 1.00 64.44 H new ATOM 0 HB2 SER A 449 2.099 5.599 0.535 1.00 44.42 H new ATOM 0 HB3 SER A 449 0.658 6.585 0.381 1.00 44.42 H new ATOM 0 HG SER A 449 0.757 5.985 -1.972 1.00 50.32 H new ATOM 916 N ALA A 450 4.123 6.303 -1.889 1.00 41.34 N ATOM 917 CA ALA A 450 4.855 5.920 -3.085 1.00 53.41 C ATOM 918 C ALA A 450 4.030 4.906 -3.878 1.00 5.33 C ATOM 919 O ALA A 450 3.390 5.257 -4.868 1.00 35.21 O ATOM 920 CB ALA A 450 6.228 5.375 -2.691 1.00 4.30 C ATOM 0 H ALA A 450 4.506 5.934 -1.018 1.00 41.34 H new ATOM 0 HA ALA A 450 5.021 6.785 -3.727 1.00 53.41 H new ATOM 0 HB1 ALA A 450 6.777 5.088 -3.588 1.00 4.30 H new ATOM 0 HB2 ALA A 450 6.785 6.144 -2.156 1.00 4.30 H new ATOM 0 HB3 ALA A 450 6.103 4.504 -2.048 1.00 4.30 H new ATOM 926 N PHE A 451 4.071 3.666 -3.413 1.00 32.24 N ATOM 927 CA PHE A 451 3.335 2.595 -4.067 1.00 23.02 C ATOM 928 C PHE A 451 2.260 2.024 -3.141 1.00 53.35 C ATOM 929 O PHE A 451 2.541 1.676 -1.996 1.00 50.24 O ATOM 930 CB PHE A 451 4.344 1.494 -4.396 1.00 62.34 C ATOM 931 CG PHE A 451 5.668 2.012 -4.962 1.00 63.33 C ATOM 932 CD1 PHE A 451 6.578 2.599 -4.137 1.00 22.31 C ATOM 933 CD2 PHE A 451 5.936 1.886 -6.290 1.00 25.23 C ATOM 934 CE1 PHE A 451 7.807 3.079 -4.663 1.00 72.11 C ATOM 935 CE2 PHE A 451 7.165 2.367 -6.815 1.00 1.11 C ATOM 936 CZ PHE A 451 8.073 2.952 -5.990 1.00 50.15 C ATOM 0 H PHE A 451 4.602 3.378 -2.591 1.00 32.24 H new ATOM 0 HA PHE A 451 2.842 2.975 -4.962 1.00 23.02 H new ATOM 0 HB2 PHE A 451 4.547 0.920 -3.492 1.00 62.34 H new ATOM 0 HB3 PHE A 451 3.896 0.808 -5.116 1.00 62.34 H new ATOM 0 HD1 PHE A 451 6.366 2.700 -3.083 1.00 22.31 H new ATOM 0 HD2 PHE A 451 5.214 1.420 -6.945 1.00 25.23 H new ATOM 0 HE1 PHE A 451 8.530 3.545 -4.009 1.00 72.11 H new ATOM 0 HE2 PHE A 451 7.378 2.268 -7.869 1.00 1.11 H new ATOM 0 HZ PHE A 451 9.008 3.317 -6.390 1.00 50.15 H new ATOM 945 N ILE A 452 1.047 1.948 -3.673 1.00 3.35 N ATOM 946 CA ILE A 452 -0.073 1.426 -2.909 1.00 4.13 C ATOM 947 C ILE A 452 0.121 -0.077 -2.688 1.00 73.55 C ATOM 948 O ILE A 452 0.381 -0.818 -3.635 1.00 45.14 O ATOM 949 CB ILE A 452 -1.397 1.780 -3.588 1.00 42.13 C ATOM 950 CG1 ILE A 452 -1.514 3.290 -3.805 1.00 44.12 C ATOM 951 CG2 ILE A 452 -2.584 1.220 -2.801 1.00 33.24 C ATOM 952 CD1 ILE A 452 -1.662 4.025 -2.469 1.00 73.30 C ATOM 0 H ILE A 452 0.817 2.239 -4.623 1.00 3.35 H new ATOM 0 HA ILE A 452 -0.111 1.892 -1.924 1.00 4.13 H new ATOM 0 HB ILE A 452 -1.413 1.311 -4.572 1.00 42.13 H new ATOM 0 HG12 ILE A 452 -0.631 3.655 -4.330 1.00 44.12 H new ATOM 0 HG13 ILE A 452 -2.374 3.505 -4.440 1.00 44.12 H new ATOM 0 HG21 ILE A 452 -3.513 1.486 -3.305 1.00 33.24 H new ATOM 0 HG22 ILE A 452 -2.501 0.135 -2.741 1.00 33.24 H new ATOM 0 HG23 ILE A 452 -2.584 1.640 -1.795 1.00 33.24 H new ATOM 0 HD11 ILE A 452 -1.743 5.097 -2.650 1.00 73.30 H new ATOM 0 HD12 ILE A 452 -2.559 3.674 -1.958 1.00 73.30 H new ATOM 0 HD13 ILE A 452 -0.789 3.828 -1.846 1.00 73.30 H new ATOM 963 N ILE A 453 -0.009 -0.480 -1.433 1.00 14.41 N ATOM 964 CA ILE A 453 0.150 -1.879 -1.076 1.00 45.52 C ATOM 965 C ILE A 453 -1.222 -2.478 -0.754 1.00 55.43 C ATOM 966 O ILE A 453 -1.943 -1.964 0.100 1.00 53.53 O ATOM 967 CB ILE A 453 1.167 -2.032 0.056 1.00 62.25 C ATOM 968 CG1 ILE A 453 2.582 -2.210 -0.498 1.00 11.00 C ATOM 969 CG2 ILE A 453 0.772 -3.172 0.999 1.00 74.34 C ATOM 970 CD1 ILE A 453 3.631 -1.782 0.529 1.00 31.20 C ATOM 0 H ILE A 453 -0.223 0.138 -0.650 1.00 14.41 H new ATOM 0 HA ILE A 453 0.556 -2.442 -1.916 1.00 45.52 H new ATOM 0 HB ILE A 453 1.165 -1.114 0.643 1.00 62.25 H new ATOM 0 HG12 ILE A 453 2.741 -3.253 -0.772 1.00 11.00 H new ATOM 0 HG13 ILE A 453 2.697 -1.621 -1.408 1.00 11.00 H new ATOM 0 HG21 ILE A 453 1.512 -3.259 1.795 1.00 74.34 H new ATOM 0 HG22 ILE A 453 -0.205 -2.962 1.434 1.00 74.34 H new ATOM 0 HG23 ILE A 453 0.728 -4.107 0.441 1.00 74.34 H new ATOM 0 HD11 ILE A 453 4.628 -1.919 0.110 1.00 31.20 H new ATOM 0 HD12 ILE A 453 3.485 -0.732 0.782 1.00 31.20 H new ATOM 0 HD13 ILE A 453 3.529 -2.390 1.428 1.00 31.20 H new ATOM 981 N LEU A 454 -1.541 -3.555 -1.457 1.00 3.43 N ATOM 982 CA LEU A 454 -2.814 -4.228 -1.257 1.00 71.33 C ATOM 983 C LEU A 454 -2.590 -5.495 -0.429 1.00 14.34 C ATOM 984 O LEU A 454 -2.086 -6.494 -0.941 1.00 42.25 O ATOM 985 CB LEU A 454 -3.502 -4.483 -2.600 1.00 41.33 C ATOM 986 CG LEU A 454 -3.890 -3.239 -3.401 1.00 20.43 C ATOM 987 CD1 LEU A 454 -4.564 -2.198 -2.507 1.00 73.21 C ATOM 988 CD2 LEU A 454 -2.679 -2.663 -4.140 1.00 2.21 C ATOM 0 H LEU A 454 -0.941 -3.978 -2.165 1.00 3.43 H new ATOM 0 HA LEU A 454 -3.497 -3.594 -0.692 1.00 71.33 H new ATOM 0 HB2 LEU A 454 -2.841 -5.095 -3.214 1.00 41.33 H new ATOM 0 HB3 LEU A 454 -4.403 -5.070 -2.419 1.00 41.33 H new ATOM 0 HG LEU A 454 -4.619 -3.533 -4.156 1.00 20.43 H new ATOM 0 HD11 LEU A 454 -4.829 -1.324 -3.102 1.00 73.21 H new ATOM 0 HD12 LEU A 454 -5.465 -2.625 -2.067 1.00 73.21 H new ATOM 0 HD13 LEU A 454 -3.878 -1.902 -1.713 1.00 73.21 H new ATOM 0 HD21 LEU A 454 -2.982 -1.779 -4.702 1.00 2.21 H new ATOM 0 HD22 LEU A 454 -1.909 -2.388 -3.419 1.00 2.21 H new ATOM 0 HD23 LEU A 454 -2.282 -3.411 -4.827 1.00 2.21 H new ATOM 999 N LEU A 455 -2.977 -5.413 0.835 1.00 13.24 N ATOM 1000 CA LEU A 455 -2.826 -6.542 1.738 1.00 24.32 C ATOM 1001 C LEU A 455 -3.805 -7.646 1.336 1.00 4.42 C ATOM 1002 O LEU A 455 -4.914 -7.720 1.864 1.00 22.22 O ATOM 1003 CB LEU A 455 -2.973 -6.088 3.192 1.00 52.14 C ATOM 1004 CG LEU A 455 -2.214 -6.914 4.233 1.00 73.41 C ATOM 1005 CD1 LEU A 455 -0.764 -7.141 3.800 1.00 52.42 C ATOM 1006 CD2 LEU A 455 -2.305 -6.267 5.616 1.00 62.05 C ATOM 0 H LEU A 455 -3.395 -4.583 1.256 1.00 13.24 H new ATOM 0 HA LEU A 455 -1.823 -6.962 1.659 1.00 24.32 H new ATOM 0 HB2 LEU A 455 -2.638 -5.053 3.264 1.00 52.14 H new ATOM 0 HB3 LEU A 455 -4.032 -6.099 3.450 1.00 52.14 H new ATOM 0 HG LEU A 455 -2.686 -7.894 4.304 1.00 73.41 H new ATOM 0 HD11 LEU A 455 -0.246 -7.730 4.557 1.00 52.42 H new ATOM 0 HD12 LEU A 455 -0.747 -7.675 2.850 1.00 52.42 H new ATOM 0 HD13 LEU A 455 -0.264 -6.179 3.684 1.00 52.42 H new ATOM 0 HD21 LEU A 455 -1.758 -6.873 6.338 1.00 62.05 H new ATOM 0 HD22 LEU A 455 -1.872 -5.267 5.579 1.00 62.05 H new ATOM 0 HD23 LEU A 455 -3.350 -6.199 5.918 1.00 62.05 H new ATOM 1017 N LEU A 456 -3.360 -8.478 0.406 1.00 50.32 N ATOM 1018 CA LEU A 456 -4.183 -9.574 -0.073 1.00 23.35 C ATOM 1019 C LEU A 456 -4.412 -10.570 1.067 1.00 63.15 C ATOM 1020 O LEU A 456 -3.605 -11.473 1.278 1.00 63.31 O ATOM 1021 CB LEU A 456 -3.564 -10.203 -1.323 1.00 24.22 C ATOM 1022 CG LEU A 456 -3.228 -9.239 -2.463 1.00 62.15 C ATOM 1023 CD1 LEU A 456 -3.129 -9.979 -3.797 1.00 20.13 C ATOM 1024 CD2 LEU A 456 -4.233 -8.087 -2.519 1.00 55.23 C ATOM 0 H LEU A 456 -2.439 -8.415 -0.028 1.00 50.32 H new ATOM 0 HA LEU A 456 -5.163 -9.208 -0.380 1.00 23.35 H new ATOM 0 HB2 LEU A 456 -2.651 -10.721 -1.031 1.00 24.22 H new ATOM 0 HB3 LEU A 456 -4.251 -10.959 -1.703 1.00 24.22 H new ATOM 0 HG LEU A 456 -2.249 -8.803 -2.265 1.00 62.15 H new ATOM 0 HD11 LEU A 456 -2.889 -9.270 -4.589 1.00 20.13 H new ATOM 0 HD12 LEU A 456 -2.346 -10.734 -3.737 1.00 20.13 H new ATOM 0 HD13 LEU A 456 -4.082 -10.461 -4.017 1.00 20.13 H new ATOM 0 HD21 LEU A 456 -3.972 -7.416 -3.337 1.00 55.23 H new ATOM 0 HD22 LEU A 456 -5.234 -8.485 -2.682 1.00 55.23 H new ATOM 0 HD23 LEU A 456 -4.209 -7.538 -1.578 1.00 55.23 H new ATOM 1035 N THR A 457 -5.516 -10.372 1.771 1.00 54.35 N ATOM 1036 CA THR A 457 -5.861 -11.239 2.884 1.00 13.25 C ATOM 1037 C THR A 457 -7.308 -11.723 2.754 1.00 73.14 C ATOM 1038 O THR A 457 -8.171 -10.988 2.278 1.00 50.24 O ATOM 1039 CB THR A 457 -5.590 -10.476 4.181 1.00 74.13 C ATOM 1040 OG1 THR A 457 -6.667 -9.548 4.269 1.00 42.15 O ATOM 1041 CG2 THR A 457 -4.344 -9.592 4.091 1.00 35.21 C ATOM 0 H THR A 457 -6.184 -9.623 1.592 1.00 54.35 H new ATOM 0 HA THR A 457 -5.248 -12.140 2.887 1.00 13.25 H new ATOM 0 HB THR A 457 -5.474 -11.184 5.001 1.00 74.13 H new ATOM 0 HG1 THR A 457 -6.329 -8.683 4.582 1.00 42.15 H new ATOM 0 HG21 THR A 457 -4.197 -9.073 5.038 1.00 35.21 H new ATOM 0 HG22 THR A 457 -3.473 -10.212 3.878 1.00 35.21 H new ATOM 0 HG23 THR A 457 -4.473 -8.861 3.293 1.00 35.21 H new ATOM 1049 N SER A 458 -7.527 -12.956 3.186 1.00 35.02 N ATOM 1050 CA SER A 458 -8.853 -13.546 3.124 1.00 64.13 C ATOM 1051 C SER A 458 -9.851 -12.668 3.882 1.00 32.14 C ATOM 1052 O SER A 458 -11.060 -12.788 3.688 1.00 35.11 O ATOM 1053 CB SER A 458 -8.851 -14.964 3.697 1.00 23.12 C ATOM 1054 OG SER A 458 -8.453 -14.987 5.065 1.00 31.33 O ATOM 0 H SER A 458 -6.808 -13.563 3.580 1.00 35.02 H new ATOM 0 HA SER A 458 -9.153 -13.606 2.078 1.00 64.13 H new ATOM 0 HB2 SER A 458 -9.848 -15.395 3.602 1.00 23.12 H new ATOM 0 HB3 SER A 458 -8.177 -15.590 3.113 1.00 23.12 H new ATOM 0 HG SER A 458 -7.690 -15.593 5.174 1.00 31.33 H new ATOM 1059 N ASN A 459 -9.310 -11.807 4.729 1.00 62.21 N ATOM 1060 CA ASN A 459 -10.136 -10.909 5.517 1.00 54.41 C ATOM 1061 C ASN A 459 -10.428 -9.647 4.705 1.00 51.34 C ATOM 1062 O ASN A 459 -11.436 -8.978 4.929 1.00 34.12 O ATOM 1063 CB ASN A 459 -9.425 -10.490 6.804 1.00 44.12 C ATOM 1064 CG ASN A 459 -9.485 -11.605 7.851 1.00 23.41 C ATOM 1065 OD1 ASN A 459 -9.790 -12.749 7.560 1.00 40.23 O ATOM 1066 ND2 ASN A 459 -9.174 -11.208 9.081 1.00 24.20 N ATOM 0 H ASN A 459 -8.307 -11.712 4.888 1.00 62.21 H new ATOM 0 HA ASN A 459 -11.057 -11.435 5.770 1.00 54.41 H new ATOM 0 HB2 ASN A 459 -8.385 -10.246 6.586 1.00 44.12 H new ATOM 0 HB3 ASN A 459 -9.888 -9.587 7.202 1.00 44.12 H new ATOM 0 HD21 ASN A 459 -9.182 -11.878 9.850 1.00 24.20 H new ATOM 0 HD22 ASN A 459 -8.928 -10.234 9.255 1.00 24.20 H new ATOM 1072 N PHE A 460 -9.527 -9.356 3.779 1.00 62.34 N ATOM 1073 CA PHE A 460 -9.674 -8.184 2.932 1.00 63.44 C ATOM 1074 C PHE A 460 -10.058 -8.583 1.506 1.00 34.33 C ATOM 1075 O PHE A 460 -10.069 -9.765 1.170 1.00 33.12 O ATOM 1076 CB PHE A 460 -8.316 -7.479 2.904 1.00 24.13 C ATOM 1077 CG PHE A 460 -8.281 -6.229 2.021 1.00 42.52 C ATOM 1078 CD1 PHE A 460 -9.109 -5.184 2.293 1.00 33.03 C ATOM 1079 CD2 PHE A 460 -7.424 -6.164 0.968 1.00 22.11 C ATOM 1080 CE1 PHE A 460 -9.077 -4.024 1.473 1.00 60.45 C ATOM 1081 CE2 PHE A 460 -7.393 -5.004 0.150 1.00 34.54 C ATOM 1082 CZ PHE A 460 -8.219 -3.959 0.419 1.00 61.12 C ATOM 0 H PHE A 460 -8.692 -9.912 3.596 1.00 62.34 H new ATOM 0 HA PHE A 460 -10.460 -7.538 3.324 1.00 63.44 H new ATOM 0 HB2 PHE A 460 -8.042 -7.200 3.921 1.00 24.13 H new ATOM 0 HB3 PHE A 460 -7.561 -8.181 2.552 1.00 24.13 H new ATOM 0 HD1 PHE A 460 -9.789 -5.236 3.130 1.00 33.03 H new ATOM 0 HD2 PHE A 460 -6.767 -6.994 0.754 1.00 22.11 H new ATOM 0 HE1 PHE A 460 -9.734 -3.194 1.686 1.00 60.45 H new ATOM 0 HE2 PHE A 460 -6.712 -4.952 -0.687 1.00 34.54 H new ATOM 0 HZ PHE A 460 -8.194 -3.077 -0.204 1.00 61.12 H new ATOM 1091 N ASP A 461 -10.363 -7.572 0.704 1.00 3.22 N ATOM 1092 CA ASP A 461 -10.747 -7.802 -0.677 1.00 32.12 C ATOM 1093 C ASP A 461 -9.698 -7.182 -1.603 1.00 32.14 C ATOM 1094 O ASP A 461 -9.178 -6.105 -1.323 1.00 74.45 O ATOM 1095 CB ASP A 461 -12.096 -7.153 -0.990 1.00 2.41 C ATOM 1096 CG ASP A 461 -12.454 -5.952 -0.113 1.00 54.21 C ATOM 1097 OD1 ASP A 461 -12.781 -4.868 -0.618 1.00 10.34 O ATOM 1098 OD2 ASP A 461 -12.386 -6.165 1.158 1.00 13.03 O ATOM 0 H ASP A 461 -10.352 -6.592 0.986 1.00 3.22 H new ATOM 0 HA ASP A 461 -10.821 -8.878 -0.831 1.00 32.12 H new ATOM 0 HB2 ASP A 461 -12.096 -6.835 -2.033 1.00 2.41 H new ATOM 0 HB3 ASP A 461 -12.877 -7.906 -0.886 1.00 2.41 H new ATOM 1103 N CYS A 462 -9.418 -7.892 -2.687 1.00 12.13 N ATOM 1104 CA CYS A 462 -8.441 -7.425 -3.656 1.00 14.12 C ATOM 1105 C CYS A 462 -9.177 -6.621 -4.731 1.00 21.41 C ATOM 1106 O CYS A 462 -8.832 -5.471 -4.995 1.00 5.31 O ATOM 1107 CB CYS A 462 -7.641 -8.584 -4.256 1.00 2.11 C ATOM 1108 SG CYS A 462 -7.296 -9.838 -2.969 1.00 31.34 S ATOM 0 H CYS A 462 -9.851 -8.787 -2.915 1.00 12.13 H new ATOM 0 HA CYS A 462 -7.711 -6.784 -3.161 1.00 14.12 H new ATOM 0 HB2 CYS A 462 -8.199 -9.036 -5.076 1.00 2.11 H new ATOM 0 HB3 CYS A 462 -6.705 -8.213 -4.674 1.00 2.11 H new ATOM 0 HG CYS A 462 -7.993 -10.909 -3.208 1.00 31.34 H new ATOM 1113 N ARG A 463 -10.174 -7.262 -5.323 1.00 42.35 N ATOM 1114 CA ARG A 463 -10.961 -6.620 -6.363 1.00 73.22 C ATOM 1115 C ARG A 463 -11.197 -5.148 -6.020 1.00 34.33 C ATOM 1116 O ARG A 463 -10.841 -4.262 -6.795 1.00 32.05 O ATOM 1117 CB ARG A 463 -12.311 -7.319 -6.542 1.00 43.53 C ATOM 1118 CG ARG A 463 -12.219 -8.434 -7.583 1.00 60.30 C ATOM 1119 CD ARG A 463 -11.668 -9.720 -6.963 1.00 51.31 C ATOM 1120 NE ARG A 463 -12.457 -10.081 -5.765 1.00 32.25 N ATOM 1121 CZ ARG A 463 -11.978 -10.812 -4.736 1.00 22.21 C ATOM 1122 NH1 ARG A 463 -10.707 -11.268 -4.751 1.00 50.13 N ATOM 1123 NH2 ARG A 463 -12.771 -11.078 -3.714 1.00 75.21 N ATOM 0 H ARG A 463 -10.455 -8.218 -5.103 1.00 42.35 H new ATOM 0 HA ARG A 463 -10.400 -6.692 -7.295 1.00 73.22 H new ATOM 0 HB2 ARG A 463 -12.639 -7.733 -5.589 1.00 43.53 H new ATOM 0 HB3 ARG A 463 -13.063 -6.592 -6.849 1.00 43.53 H new ATOM 0 HG2 ARG A 463 -13.206 -8.624 -8.006 1.00 60.30 H new ATOM 0 HG3 ARG A 463 -11.576 -8.117 -8.404 1.00 60.30 H new ATOM 0 HD2 ARG A 463 -11.706 -10.530 -7.691 1.00 51.31 H new ATOM 0 HD3 ARG A 463 -10.621 -9.584 -6.692 1.00 51.31 H new ATOM 0 HE ARG A 463 -13.423 -9.758 -5.713 1.00 32.25 H new ATOM 0 HH11 ARG A 463 -10.100 -11.061 -5.544 1.00 50.13 H new ATOM 0 HH12 ARG A 463 -10.354 -11.820 -3.969 1.00 50.13 H new ATOM 0 HH21 ARG A 463 -13.731 -10.732 -3.710 1.00 75.21 H new ATOM 0 HH22 ARG A 463 -12.424 -11.629 -2.929 1.00 75.21 H new ATOM 1133 N LEU A 464 -11.795 -4.933 -4.857 1.00 61.42 N ATOM 1134 CA LEU A 464 -12.081 -3.583 -4.402 1.00 22.35 C ATOM 1135 C LEU A 464 -10.857 -2.698 -4.643 1.00 53.44 C ATOM 1136 O LEU A 464 -10.906 -1.772 -5.451 1.00 11.01 O ATOM 1137 CB LEU A 464 -12.553 -3.599 -2.947 1.00 53.04 C ATOM 1138 CG LEU A 464 -13.040 -2.260 -2.386 1.00 75.03 C ATOM 1139 CD1 LEU A 464 -11.913 -1.532 -1.649 1.00 72.11 C ATOM 1140 CD2 LEU A 464 -13.657 -1.396 -3.488 1.00 11.12 C ATOM 0 H LEU A 464 -12.089 -5.671 -4.217 1.00 61.42 H new ATOM 0 HA LEU A 464 -12.902 -3.152 -4.975 1.00 22.35 H new ATOM 0 HB2 LEU A 464 -13.361 -4.324 -2.856 1.00 53.04 H new ATOM 0 HB3 LEU A 464 -11.733 -3.955 -2.323 1.00 53.04 H new ATOM 0 HG LEU A 464 -13.825 -2.460 -1.657 1.00 75.03 H new ATOM 0 HD11 LEU A 464 -12.285 -0.584 -1.260 1.00 72.11 H new ATOM 0 HD12 LEU A 464 -11.560 -2.149 -0.823 1.00 72.11 H new ATOM 0 HD13 LEU A 464 -11.090 -1.343 -2.338 1.00 72.11 H new ATOM 0 HD21 LEU A 464 -13.995 -0.451 -3.063 1.00 11.12 H new ATOM 0 HD22 LEU A 464 -12.911 -1.201 -4.258 1.00 11.12 H new ATOM 0 HD23 LEU A 464 -14.505 -1.920 -3.929 1.00 11.12 H new ATOM 1151 N SER A 465 -9.789 -3.013 -3.926 1.00 42.44 N ATOM 1152 CA SER A 465 -8.554 -2.255 -4.050 1.00 30.43 C ATOM 1153 C SER A 465 -8.213 -2.053 -5.528 1.00 31.43 C ATOM 1154 O SER A 465 -8.161 -0.921 -6.006 1.00 53.31 O ATOM 1155 CB SER A 465 -7.402 -2.960 -3.332 1.00 3.32 C ATOM 1156 OG SER A 465 -7.605 -4.369 -3.250 1.00 31.21 O ATOM 0 H SER A 465 -9.752 -3.782 -3.257 1.00 42.44 H new ATOM 0 HA SER A 465 -8.699 -1.282 -3.580 1.00 30.43 H new ATOM 0 HB2 SER A 465 -6.469 -2.758 -3.859 1.00 3.32 H new ATOM 0 HB3 SER A 465 -7.296 -2.550 -2.328 1.00 3.32 H new ATOM 0 HG SER A 465 -8.077 -4.679 -4.051 1.00 31.21 H new ATOM 1161 N LEU A 466 -7.988 -3.167 -6.209 1.00 52.23 N ATOM 1162 CA LEU A 466 -7.653 -3.126 -7.622 1.00 71.21 C ATOM 1163 C LEU A 466 -8.690 -2.279 -8.364 1.00 25.14 C ATOM 1164 O LEU A 466 -8.413 -1.755 -9.441 1.00 62.14 O ATOM 1165 CB LEU A 466 -7.504 -4.543 -8.180 1.00 63.22 C ATOM 1166 CG LEU A 466 -7.616 -4.681 -9.699 1.00 1.11 C ATOM 1167 CD1 LEU A 466 -9.041 -4.390 -10.172 1.00 54.25 C ATOM 1168 CD2 LEU A 466 -6.584 -3.800 -10.407 1.00 13.02 C ATOM 0 H LEU A 466 -8.031 -4.104 -5.808 1.00 52.23 H new ATOM 0 HA LEU A 466 -6.685 -2.647 -7.769 1.00 71.21 H new ATOM 0 HB2 LEU A 466 -6.535 -4.934 -7.870 1.00 63.22 H new ATOM 0 HB3 LEU A 466 -8.264 -5.175 -7.721 1.00 63.22 H new ATOM 0 HG LEU A 466 -7.394 -5.714 -9.966 1.00 1.11 H new ATOM 0 HD11 LEU A 466 -9.093 -4.495 -11.256 1.00 54.25 H new ATOM 0 HD12 LEU A 466 -9.730 -5.094 -9.706 1.00 54.25 H new ATOM 0 HD13 LEU A 466 -9.317 -3.373 -9.892 1.00 54.25 H new ATOM 0 HD21 LEU A 466 -6.685 -3.917 -11.486 1.00 13.02 H new ATOM 0 HD22 LEU A 466 -6.750 -2.757 -10.138 1.00 13.02 H new ATOM 0 HD23 LEU A 466 -5.581 -4.098 -10.102 1.00 13.02 H new ATOM 1179 N HIS A 467 -9.863 -2.173 -7.757 1.00 3.33 N ATOM 1180 CA HIS A 467 -10.943 -1.400 -8.346 1.00 62.03 C ATOM 1181 C HIS A 467 -10.810 0.067 -7.930 1.00 2.43 C ATOM 1182 O HIS A 467 -11.225 0.964 -8.663 1.00 21.45 O ATOM 1183 CB HIS A 467 -12.302 -1.999 -7.978 1.00 14.40 C ATOM 1184 CG HIS A 467 -13.403 -0.976 -7.830 1.00 1.02 C ATOM 1185 ND1 HIS A 467 -13.728 -0.074 -8.827 1.00 71.02 N ATOM 1186 CD2 HIS A 467 -14.251 -0.723 -6.791 1.00 15.42 C ATOM 1187 CE1 HIS A 467 -14.728 0.684 -8.398 1.00 32.33 C ATOM 1188 NE2 HIS A 467 -15.050 0.279 -7.135 1.00 32.42 N ATOM 0 H HIS A 467 -10.089 -2.610 -6.863 1.00 3.33 H new ATOM 0 HA HIS A 467 -10.874 -1.441 -9.433 1.00 62.03 H new ATOM 0 HB2 HIS A 467 -12.590 -2.719 -8.744 1.00 14.40 H new ATOM 0 HB3 HIS A 467 -12.204 -2.550 -7.043 1.00 14.40 H new ATOM 0 HD2 HIS A 467 -14.269 -1.249 -5.848 1.00 15.42 H new ATOM 0 HE1 HIS A 467 -15.204 1.481 -8.950 1.00 32.33 H new ATOM 0 HE2 HIS A 467 -15.784 0.680 -6.552 1.00 32.42 H new ATOM 1195 N GLN A 468 -10.229 0.265 -6.756 1.00 31.00 N ATOM 1196 CA GLN A 468 -10.036 1.608 -6.234 1.00 43.11 C ATOM 1197 C GLN A 468 -8.769 2.230 -6.826 1.00 61.22 C ATOM 1198 O GLN A 468 -8.837 3.238 -7.526 1.00 33.21 O ATOM 1199 CB GLN A 468 -9.979 1.599 -4.705 1.00 15.21 C ATOM 1200 CG GLN A 468 -11.248 0.979 -4.114 1.00 62.53 C ATOM 1201 CD GLN A 468 -11.614 1.644 -2.785 1.00 4.42 C ATOM 1202 OE1 GLN A 468 -12.647 2.275 -2.641 1.00 14.12 O ATOM 1203 NE2 GLN A 468 -10.712 1.465 -1.824 1.00 34.50 N ATOM 0 H GLN A 468 -9.886 -0.481 -6.151 1.00 31.00 H new ATOM 0 HA GLN A 468 -10.890 2.218 -6.529 1.00 43.11 H new ATOM 0 HB2 GLN A 468 -9.106 1.037 -4.373 1.00 15.21 H new ATOM 0 HB3 GLN A 468 -9.861 2.618 -4.336 1.00 15.21 H new ATOM 0 HG2 GLN A 468 -12.073 1.088 -4.819 1.00 62.53 H new ATOM 0 HG3 GLN A 468 -11.098 -0.090 -3.961 1.00 62.53 H new ATOM 0 HE21 GLN A 468 -9.867 0.925 -2.012 1.00 34.50 H new ATOM 0 HE22 GLN A 468 -10.865 1.868 -0.899 1.00 34.50 H new ATOM 1210 N VAL A 469 -7.643 1.602 -6.521 1.00 73.34 N ATOM 1211 CA VAL A 469 -6.362 2.081 -7.014 1.00 43.24 C ATOM 1212 C VAL A 469 -6.508 2.497 -8.480 1.00 24.54 C ATOM 1213 O VAL A 469 -5.995 3.538 -8.887 1.00 33.24 O ATOM 1214 CB VAL A 469 -5.286 1.016 -6.799 1.00 22.34 C ATOM 1215 CG1 VAL A 469 -5.463 -0.148 -7.776 1.00 21.33 C ATOM 1216 CG2 VAL A 469 -3.885 1.619 -6.911 1.00 74.55 C ATOM 0 H VAL A 469 -7.591 0.766 -5.939 1.00 73.34 H new ATOM 0 HA VAL A 469 -6.043 2.962 -6.456 1.00 43.24 H new ATOM 0 HB VAL A 469 -5.401 0.625 -5.788 1.00 22.34 H new ATOM 0 HG11 VAL A 469 -4.685 -0.891 -7.601 1.00 21.33 H new ATOM 0 HG12 VAL A 469 -6.441 -0.605 -7.625 1.00 21.33 H new ATOM 0 HG13 VAL A 469 -5.389 0.221 -8.799 1.00 21.33 H new ATOM 0 HG21 VAL A 469 -3.140 0.839 -6.754 1.00 74.55 H new ATOM 0 HG22 VAL A 469 -3.753 2.052 -7.903 1.00 74.55 H new ATOM 0 HG23 VAL A 469 -3.762 2.396 -6.157 1.00 74.55 H new ATOM 1226 N ASN A 470 -7.209 1.660 -9.231 1.00 34.51 N ATOM 1227 CA ASN A 470 -7.428 1.927 -10.642 1.00 55.25 C ATOM 1228 C ASN A 470 -8.202 3.237 -10.795 1.00 51.15 C ATOM 1229 O ASN A 470 -7.665 4.226 -11.293 1.00 31.50 O ATOM 1230 CB ASN A 470 -8.252 0.814 -11.292 1.00 61.10 C ATOM 1231 CG ASN A 470 -7.345 -0.281 -11.857 1.00 21.40 C ATOM 1232 OD1 ASN A 470 -6.564 -0.861 -10.949 1.00 72.32 O flip ATOM 1233 ND2 ASN A 470 -7.352 -0.580 -13.040 1.00 41.40 N flip ATOM 0 H ASN A 470 -7.632 0.797 -8.889 1.00 34.51 H new ATOM 0 HA ASN A 470 -6.454 1.987 -11.128 1.00 55.25 H new ATOM 0 HB2 ASN A 470 -8.933 0.384 -10.557 1.00 61.10 H new ATOM 0 HB3 ASN A 470 -8.866 1.230 -12.090 1.00 61.10 H new ATOM 0 HD21 ASN A 470 -7.976 -0.095 -13.685 1.00 41.40 H new ATOM 0 HD22 ASN A 470 -6.734 -1.315 -13.384 1.00 41.40 H new ATOM 1239 N GLN A 471 -9.451 3.204 -10.356 1.00 52.03 N ATOM 1240 CA GLN A 471 -10.305 4.379 -10.438 1.00 13.24 C ATOM 1241 C GLN A 471 -9.500 5.642 -10.128 1.00 2.23 C ATOM 1242 O GLN A 471 -9.599 6.638 -10.844 1.00 4.32 O ATOM 1243 CB GLN A 471 -11.506 4.249 -9.500 1.00 54.01 C ATOM 1244 CG GLN A 471 -12.385 3.059 -9.894 1.00 24.40 C ATOM 1245 CD GLN A 471 -13.527 3.501 -10.810 1.00 11.50 C ATOM 1246 OE1 GLN A 471 -13.737 2.969 -11.886 1.00 22.54 O ATOM 1247 NE2 GLN A 471 -14.254 4.504 -10.322 1.00 35.41 N ATOM 0 H GLN A 471 -9.893 2.383 -9.942 1.00 52.03 H new ATOM 0 HA GLN A 471 -10.688 4.457 -11.456 1.00 13.24 H new ATOM 0 HB2 GLN A 471 -11.159 4.125 -8.474 1.00 54.01 H new ATOM 0 HB3 GLN A 471 -12.095 5.166 -9.529 1.00 54.01 H new ATOM 0 HG2 GLN A 471 -11.779 2.306 -10.399 1.00 24.40 H new ATOM 0 HG3 GLN A 471 -12.793 2.591 -8.998 1.00 24.40 H new ATOM 0 HE21 GLN A 471 -14.024 4.905 -9.413 1.00 35.41 H new ATOM 0 HE22 GLN A 471 -15.041 4.871 -10.857 1.00 35.41 H new ATOM 1254 N ALA A 472 -8.722 5.562 -9.059 1.00 44.15 N ATOM 1255 CA ALA A 472 -7.900 6.686 -8.645 1.00 43.05 C ATOM 1256 C ALA A 472 -6.893 7.012 -9.750 1.00 34.22 C ATOM 1257 O ALA A 472 -6.786 8.159 -10.179 1.00 13.11 O ATOM 1258 CB ALA A 472 -7.219 6.360 -7.314 1.00 1.35 C ATOM 0 H ALA A 472 -8.643 4.735 -8.467 1.00 44.15 H new ATOM 0 HA ALA A 472 -8.515 7.572 -8.488 1.00 43.05 H new ATOM 0 HB1 ALA A 472 -6.603 7.204 -7.004 1.00 1.35 H new ATOM 0 HB2 ALA A 472 -7.977 6.167 -6.555 1.00 1.35 H new ATOM 0 HB3 ALA A 472 -6.591 5.477 -7.433 1.00 1.35 H new ATOM 1264 N MET A 473 -6.181 5.981 -10.179 1.00 61.21 N ATOM 1265 CA MET A 473 -5.187 6.143 -11.226 1.00 34.25 C ATOM 1266 C MET A 473 -5.781 6.854 -12.442 1.00 74.12 C ATOM 1267 O MET A 473 -5.428 7.996 -12.733 1.00 2.13 O ATOM 1268 CB MET A 473 -4.659 4.768 -11.645 1.00 54.03 C ATOM 1269 CG MET A 473 -3.579 4.277 -10.680 1.00 44.25 C ATOM 1270 SD MET A 473 -3.621 2.496 -10.573 1.00 72.44 S ATOM 1271 CE MET A 473 -1.952 2.181 -10.019 1.00 25.23 C ATOM 0 H MET A 473 -6.273 5.030 -9.821 1.00 61.21 H new ATOM 0 HA MET A 473 -4.372 6.753 -10.836 1.00 34.25 H new ATOM 0 HB2 MET A 473 -5.480 4.052 -11.672 1.00 54.03 H new ATOM 0 HB3 MET A 473 -4.252 4.823 -12.654 1.00 54.03 H new ATOM 0 HG2 MET A 473 -2.598 4.606 -11.021 1.00 44.25 H new ATOM 0 HG3 MET A 473 -3.736 4.713 -9.693 1.00 44.25 H new ATOM 0 HE1 MET A 473 -1.597 1.243 -10.447 1.00 25.23 H new ATOM 0 HE2 MET A 473 -1.302 2.995 -10.340 1.00 25.23 H new ATOM 0 HE3 MET A 473 -1.937 2.112 -8.931 1.00 25.23 H new ATOM 1279 N MET A 474 -6.676 6.151 -13.121 1.00 54.01 N ATOM 1280 CA MET A 474 -7.323 6.701 -14.300 1.00 5.34 C ATOM 1281 C MET A 474 -8.006 8.033 -13.978 1.00 33.00 C ATOM 1282 O MET A 474 -8.332 8.801 -14.881 1.00 74.13 O ATOM 1283 CB MET A 474 -8.362 5.708 -14.823 1.00 52.52 C ATOM 1284 CG MET A 474 -9.162 5.094 -13.671 1.00 0.10 C ATOM 1285 SD MET A 474 -10.828 4.737 -14.206 1.00 72.34 S ATOM 1286 CE MET A 474 -11.727 5.938 -13.239 1.00 32.02 C ATOM 0 H MET A 474 -6.968 5.205 -12.877 1.00 54.01 H new ATOM 0 HA MET A 474 -6.562 6.878 -15.060 1.00 5.34 H new ATOM 0 HB2 MET A 474 -9.039 6.213 -15.512 1.00 52.52 H new ATOM 0 HB3 MET A 474 -7.865 4.919 -15.386 1.00 52.52 H new ATOM 0 HG2 MET A 474 -8.678 4.180 -13.328 1.00 0.10 H new ATOM 0 HG3 MET A 474 -9.182 5.781 -12.825 1.00 0.10 H new ATOM 0 HE1 MET A 474 -12.524 6.370 -13.845 1.00 32.02 H new ATOM 0 HE2 MET A 474 -12.159 5.451 -12.365 1.00 32.02 H new ATOM 0 HE3 MET A 474 -11.048 6.727 -12.916 1.00 32.02 H new ATOM 1294 N SER A 475 -8.203 8.264 -12.689 1.00 52.22 N ATOM 1295 CA SER A 475 -8.842 9.489 -12.237 1.00 53.24 C ATOM 1296 C SER A 475 -7.805 10.609 -12.124 1.00 34.25 C ATOM 1297 O SER A 475 -8.140 11.786 -12.255 1.00 32.13 O ATOM 1298 CB SER A 475 -9.546 9.281 -10.895 1.00 32.51 C ATOM 1299 OG SER A 475 -10.830 8.686 -11.052 1.00 54.31 O ATOM 0 H SER A 475 -7.932 7.624 -11.943 1.00 52.22 H new ATOM 0 HA SER A 475 -9.596 9.772 -12.972 1.00 53.24 H new ATOM 0 HB2 SER A 475 -8.929 8.649 -10.256 1.00 32.51 H new ATOM 0 HB3 SER A 475 -9.651 10.240 -10.388 1.00 32.51 H new ATOM 0 HG SER A 475 -10.754 7.714 -10.957 1.00 54.31 H new ATOM 1304 N ASN A 476 -6.566 10.203 -11.885 1.00 3.34 N ATOM 1305 CA ASN A 476 -5.479 11.157 -11.754 1.00 11.41 C ATOM 1306 C ASN A 476 -4.249 10.627 -12.496 1.00 41.45 C ATOM 1307 O ASN A 476 -3.396 9.971 -11.901 1.00 0.14 O ATOM 1308 CB ASN A 476 -5.095 11.357 -10.287 1.00 3.32 C ATOM 1309 CG ASN A 476 -3.981 12.397 -10.147 1.00 11.42 C ATOM 1310 OD1 ASN A 476 -3.863 13.324 -10.930 1.00 54.34 O ATOM 1311 ND2 ASN A 476 -3.174 12.191 -9.111 1.00 4.44 N ATOM 0 H ASN A 476 -6.292 9.226 -11.779 1.00 3.34 H new ATOM 0 HA ASN A 476 -5.812 12.107 -12.172 1.00 11.41 H new ATOM 0 HB2 ASN A 476 -5.969 11.677 -9.719 1.00 3.32 H new ATOM 0 HB3 ASN A 476 -4.767 10.409 -9.861 1.00 3.32 H new ATOM 0 HD21 ASN A 476 -2.399 12.830 -8.933 1.00 4.44 H new ATOM 0 HD22 ASN A 476 -3.330 11.394 -8.494 1.00 4.44 H new ATOM 1317 N LEU A 477 -4.198 10.933 -13.784 1.00 51.34 N ATOM 1318 CA LEU A 477 -3.088 10.497 -14.614 1.00 45.12 C ATOM 1319 C LEU A 477 -2.250 11.712 -15.017 1.00 42.01 C ATOM 1320 O LEU A 477 -1.085 11.572 -15.386 1.00 41.12 O ATOM 1321 CB LEU A 477 -3.597 9.678 -15.802 1.00 23.22 C ATOM 1322 CG LEU A 477 -4.599 8.570 -15.472 1.00 14.33 C ATOM 1323 CD1 LEU A 477 -5.444 8.214 -16.697 1.00 0.41 C ATOM 1324 CD2 LEU A 477 -3.892 7.346 -14.889 1.00 71.11 C ATOM 0 H LEU A 477 -4.908 11.478 -14.273 1.00 51.34 H new ATOM 0 HA LEU A 477 -2.433 9.830 -14.054 1.00 45.12 H new ATOM 0 HB2 LEU A 477 -4.061 10.359 -16.516 1.00 23.22 H new ATOM 0 HB3 LEU A 477 -2.739 9.228 -16.302 1.00 23.22 H new ATOM 0 HG LEU A 477 -5.280 8.942 -14.707 1.00 14.33 H new ATOM 0 HD11 LEU A 477 -6.148 7.424 -16.436 1.00 0.41 H new ATOM 0 HD12 LEU A 477 -5.993 9.095 -17.029 1.00 0.41 H new ATOM 0 HD13 LEU A 477 -4.793 7.869 -17.500 1.00 0.41 H new ATOM 0 HD21 LEU A 477 -4.628 6.574 -14.664 1.00 71.11 H new ATOM 0 HD22 LEU A 477 -3.173 6.962 -15.613 1.00 71.11 H new ATOM 0 HD23 LEU A 477 -3.370 7.628 -13.974 1.00 71.11 H new ATOM 1335 N THR A 478 -2.877 12.876 -14.935 1.00 42.50 N ATOM 1336 CA THR A 478 -2.203 14.115 -15.288 1.00 12.33 C ATOM 1337 C THR A 478 -1.255 14.544 -14.167 1.00 3.31 C ATOM 1338 O THR A 478 -0.599 15.580 -14.266 1.00 61.44 O ATOM 1339 CB THR A 478 -3.273 15.160 -15.611 1.00 10.54 C ATOM 1340 OG1 THR A 478 -2.617 16.071 -16.487 1.00 41.34 O ATOM 1341 CG2 THR A 478 -3.644 16.013 -14.396 1.00 40.43 C ATOM 0 H THR A 478 -3.844 12.988 -14.630 1.00 42.50 H new ATOM 0 HA THR A 478 -1.576 13.987 -16.170 1.00 12.33 H new ATOM 0 HB THR A 478 -4.165 14.660 -15.990 1.00 10.54 H new ATOM 0 HG1 THR A 478 -1.720 16.266 -16.144 1.00 41.34 H new ATOM 0 HG21 THR A 478 -4.407 16.738 -14.680 1.00 40.43 H new ATOM 0 HG22 THR A 478 -4.031 15.371 -13.605 1.00 40.43 H new ATOM 0 HG23 THR A 478 -2.759 16.539 -14.037 1.00 40.43 H new ATOM 1349 N ARG A 479 -1.213 13.726 -13.126 1.00 30.54 N ATOM 1350 CA ARG A 479 -0.354 14.008 -11.988 1.00 1.23 C ATOM 1351 C ARG A 479 0.892 13.121 -12.030 1.00 73.32 C ATOM 1352 O ARG A 479 1.981 13.591 -12.358 1.00 23.13 O ATOM 1353 CB ARG A 479 -1.094 13.772 -10.669 1.00 54.53 C ATOM 1354 CG ARG A 479 -1.963 14.979 -10.304 1.00 63.41 C ATOM 1355 CD ARG A 479 -1.096 16.191 -9.955 1.00 51.34 C ATOM 1356 NE ARG A 479 -1.823 17.080 -9.020 1.00 0.35 N ATOM 1357 CZ ARG A 479 -2.061 16.781 -7.725 1.00 54.43 C ATOM 1358 NH1 ARG A 479 -1.632 15.614 -7.200 1.00 43.41 N ATOM 1359 NH2 ARG A 479 -2.720 17.649 -6.980 1.00 32.32 N ATOM 0 H ARG A 479 -1.759 12.868 -13.046 1.00 30.54 H new ATOM 0 HA ARG A 479 -0.060 15.056 -12.046 1.00 1.23 H new ATOM 0 HB2 ARG A 479 -1.718 12.882 -10.752 1.00 54.53 H new ATOM 0 HB3 ARG A 479 -0.374 13.583 -9.873 1.00 54.53 H new ATOM 0 HG2 ARG A 479 -2.620 15.225 -11.138 1.00 63.41 H new ATOM 0 HG3 ARG A 479 -2.603 14.729 -9.458 1.00 63.41 H new ATOM 0 HD2 ARG A 479 -0.160 15.861 -9.503 1.00 51.34 H new ATOM 0 HD3 ARG A 479 -0.837 16.737 -10.862 1.00 51.34 H new ATOM 0 HE ARG A 479 -2.165 17.973 -9.376 1.00 0.35 H new ATOM 0 HH11 ARG A 479 -1.123 14.949 -7.783 1.00 43.41 H new ATOM 0 HH12 ARG A 479 -1.817 15.397 -6.221 1.00 43.41 H new ATOM 0 HH21 ARG A 479 -3.040 18.529 -7.385 1.00 32.32 H new ATOM 0 HH22 ARG A 479 -2.909 17.440 -6.000 1.00 32.32 H new ATOM 1369 N GLN A 480 0.692 11.856 -11.694 1.00 43.41 N ATOM 1370 CA GLN A 480 1.785 10.900 -11.690 1.00 24.11 C ATOM 1371 C GLN A 480 1.534 9.800 -12.723 1.00 75.10 C ATOM 1372 O GLN A 480 2.470 9.311 -13.354 1.00 51.30 O ATOM 1373 CB GLN A 480 1.987 10.304 -10.295 1.00 3.11 C ATOM 1374 CG GLN A 480 1.039 9.126 -10.059 1.00 31.32 C ATOM 1375 CD GLN A 480 0.772 8.929 -8.566 1.00 63.21 C ATOM 1376 OE1 GLN A 480 -0.368 9.469 -8.144 1.00 10.04 O flip ATOM 1377 NE2 GLN A 480 1.550 8.325 -7.844 1.00 12.51 N flip ATOM 0 H GLN A 480 -0.212 11.470 -11.422 1.00 43.41 H new ATOM 0 HA GLN A 480 2.700 11.425 -11.962 1.00 24.11 H new ATOM 0 HB2 GLN A 480 3.019 9.973 -10.183 1.00 3.11 H new ATOM 0 HB3 GLN A 480 1.815 11.071 -9.540 1.00 3.11 H new ATOM 0 HG2 GLN A 480 0.098 9.302 -10.580 1.00 31.32 H new ATOM 0 HG3 GLN A 480 1.471 8.217 -10.478 1.00 31.32 H new ATOM 0 HE21 GLN A 480 2.408 7.935 -8.233 1.00 12.51 H new ATOM 0 HE22 GLN A 480 1.341 8.211 -6.852 1.00 12.51 H new ATOM 1384 N GLY A 481 0.266 9.446 -12.867 1.00 35.14 N ATOM 1385 CA GLY A 481 -0.120 8.414 -13.815 1.00 44.12 C ATOM 1386 C GLY A 481 0.856 7.236 -13.770 1.00 53.52 C ATOM 1387 O GLY A 481 1.411 6.846 -14.795 1.00 12.24 O ATOM 0 H GLY A 481 -0.508 9.855 -12.343 1.00 35.14 H new ATOM 0 HA2 GLY A 481 -1.127 8.065 -13.588 1.00 44.12 H new ATOM 0 HA3 GLY A 481 -0.146 8.831 -14.822 1.00 44.12 H new ATOM 1391 N SER A 482 1.033 6.702 -12.571 1.00 23.23 N ATOM 1392 CA SER A 482 1.932 5.576 -12.379 1.00 5.51 C ATOM 1393 C SER A 482 1.134 4.331 -11.983 1.00 44.32 C ATOM 1394 O SER A 482 0.839 4.127 -10.806 1.00 73.23 O ATOM 1395 CB SER A 482 2.988 5.889 -11.317 1.00 74.12 C ATOM 1396 OG SER A 482 4.065 6.658 -11.847 1.00 41.51 O ATOM 0 H SER A 482 0.570 7.028 -11.723 1.00 23.23 H new ATOM 0 HA SER A 482 2.448 5.386 -13.320 1.00 5.51 H new ATOM 0 HB2 SER A 482 2.525 6.433 -10.494 1.00 74.12 H new ATOM 0 HB3 SER A 482 3.376 4.957 -10.905 1.00 74.12 H new ATOM 0 HG SER A 482 4.717 6.839 -11.139 1.00 41.51 H new ATOM 1401 N PRO A 483 0.800 3.511 -13.015 1.00 43.22 N ATOM 1402 CA PRO A 483 0.043 2.292 -12.786 1.00 40.33 C ATOM 1403 C PRO A 483 0.924 1.207 -12.164 1.00 70.23 C ATOM 1404 O PRO A 483 0.463 0.094 -11.916 1.00 44.12 O ATOM 1405 CB PRO A 483 -0.502 1.905 -14.152 1.00 4.50 C ATOM 1406 CG PRO A 483 0.348 2.653 -15.165 1.00 53.00 C ATOM 1407 CD PRO A 483 1.132 3.721 -14.420 1.00 40.45 C ATOM 0 HA PRO A 483 -0.769 2.429 -12.072 1.00 40.33 H new ATOM 0 HB2 PRO A 483 -0.438 0.828 -14.307 1.00 4.50 H new ATOM 0 HB3 PRO A 483 -1.553 2.179 -14.245 1.00 4.50 H new ATOM 0 HG2 PRO A 483 1.026 1.968 -15.674 1.00 53.00 H new ATOM 0 HG3 PRO A 483 -0.282 3.106 -15.931 1.00 53.00 H new ATOM 0 HD2 PRO A 483 2.203 3.619 -14.593 1.00 40.45 H new ATOM 0 HD3 PRO A 483 0.850 4.721 -14.749 1.00 40.45 H new ATOM 1412 N ASP A 484 2.177 1.570 -11.929 1.00 13.43 N ATOM 1413 CA ASP A 484 3.126 0.641 -11.341 1.00 23.01 C ATOM 1414 C ASP A 484 3.273 0.946 -9.848 1.00 32.30 C ATOM 1415 O ASP A 484 4.313 0.664 -9.254 1.00 62.30 O ATOM 1416 CB ASP A 484 4.505 0.779 -11.990 1.00 25.42 C ATOM 1417 CG ASP A 484 4.846 2.184 -12.493 1.00 20.03 C ATOM 1418 OD1 ASP A 484 4.008 2.864 -13.104 1.00 5.42 O ATOM 1419 OD2 ASP A 484 6.045 2.579 -12.231 1.00 63.21 O ATOM 0 H ASP A 484 2.556 2.494 -12.135 1.00 13.43 H new ATOM 0 HA ASP A 484 2.752 -0.370 -11.500 1.00 23.01 H new ATOM 0 HB2 ASP A 484 5.262 0.475 -11.267 1.00 25.42 H new ATOM 0 HB3 ASP A 484 4.567 0.085 -12.828 1.00 25.42 H new ATOM 1424 N CYS A 485 2.219 1.519 -9.288 1.00 2.10 N ATOM 1425 CA CYS A 485 2.217 1.866 -7.877 1.00 65.21 C ATOM 1426 C CYS A 485 1.305 0.883 -7.141 1.00 52.23 C ATOM 1427 O CYS A 485 0.780 1.198 -6.073 1.00 20.44 O ATOM 1428 CB CYS A 485 1.792 3.318 -7.651 1.00 1.04 C ATOM 1429 SG CYS A 485 0.057 3.552 -8.182 1.00 14.25 S ATOM 0 H CYS A 485 1.360 1.752 -9.786 1.00 2.10 H new ATOM 0 HA CYS A 485 3.229 1.787 -7.480 1.00 65.21 H new ATOM 0 HB2 CYS A 485 1.896 3.576 -6.597 1.00 1.04 H new ATOM 0 HB3 CYS A 485 2.445 3.988 -8.210 1.00 1.04 H new ATOM 0 HG CYS A 485 0.031 4.211 -9.302 1.00 14.25 H new ATOM 1434 N VAL A 486 1.143 -0.287 -7.741 1.00 53.32 N ATOM 1435 CA VAL A 486 0.303 -1.318 -7.156 1.00 13.10 C ATOM 1436 C VAL A 486 1.179 -2.480 -6.687 1.00 74.22 C ATOM 1437 O VAL A 486 1.949 -3.036 -7.469 1.00 3.04 O ATOM 1438 CB VAL A 486 -0.773 -1.746 -8.158 1.00 25.22 C ATOM 1439 CG1 VAL A 486 -1.885 -2.534 -7.463 1.00 13.22 C ATOM 1440 CG2 VAL A 486 -1.340 -0.537 -8.903 1.00 21.13 C ATOM 0 H VAL A 486 1.579 -0.544 -8.626 1.00 53.32 H new ATOM 0 HA VAL A 486 -0.220 -0.933 -6.281 1.00 13.10 H new ATOM 0 HB VAL A 486 -0.306 -2.402 -8.893 1.00 25.22 H new ATOM 0 HG11 VAL A 486 -2.637 -2.826 -8.196 1.00 13.22 H new ATOM 0 HG12 VAL A 486 -1.464 -3.426 -7.000 1.00 13.22 H new ATOM 0 HG13 VAL A 486 -2.348 -1.912 -6.697 1.00 13.22 H new ATOM 0 HG21 VAL A 486 -2.102 -0.869 -9.608 1.00 21.13 H new ATOM 0 HG22 VAL A 486 -1.784 0.155 -8.188 1.00 21.13 H new ATOM 0 HG23 VAL A 486 -0.538 -0.035 -9.445 1.00 21.13 H new ATOM 1450 N ILE A 487 1.035 -2.813 -5.413 1.00 40.33 N ATOM 1451 CA ILE A 487 1.805 -3.900 -4.832 1.00 43.31 C ATOM 1452 C ILE A 487 0.893 -4.740 -3.934 1.00 42.21 C ATOM 1453 O ILE A 487 0.698 -4.416 -2.764 1.00 1.14 O ATOM 1454 CB ILE A 487 3.042 -3.355 -4.113 1.00 15.33 C ATOM 1455 CG1 ILE A 487 3.528 -2.059 -4.767 1.00 62.20 C ATOM 1456 CG2 ILE A 487 4.145 -4.413 -4.044 1.00 53.23 C ATOM 1457 CD1 ILE A 487 4.085 -2.328 -6.166 1.00 33.20 C ATOM 0 H ILE A 487 0.397 -2.349 -4.767 1.00 40.33 H new ATOM 0 HA ILE A 487 2.183 -4.560 -5.613 1.00 43.31 H new ATOM 0 HB ILE A 487 2.764 -3.113 -3.087 1.00 15.33 H new ATOM 0 HG12 ILE A 487 2.704 -1.348 -4.830 1.00 62.20 H new ATOM 0 HG13 ILE A 487 4.298 -1.601 -4.147 1.00 62.20 H new ATOM 0 HG21 ILE A 487 5.013 -4.001 -3.529 1.00 53.23 H new ATOM 0 HG22 ILE A 487 3.780 -5.284 -3.500 1.00 53.23 H new ATOM 0 HG23 ILE A 487 4.429 -4.709 -5.054 1.00 53.23 H new ATOM 0 HD11 ILE A 487 4.424 -1.391 -6.609 1.00 33.20 H new ATOM 0 HD12 ILE A 487 4.924 -3.021 -6.097 1.00 33.20 H new ATOM 0 HD13 ILE A 487 3.305 -2.764 -6.791 1.00 33.20 H new ATOM 1468 N PRO A 488 0.347 -5.832 -4.533 1.00 22.14 N ATOM 1469 CA PRO A 488 -0.538 -6.723 -3.801 1.00 74.23 C ATOM 1470 C PRO A 488 0.251 -7.605 -2.833 1.00 1.35 C ATOM 1471 O PRO A 488 0.851 -8.599 -3.240 1.00 45.51 O ATOM 1472 CB PRO A 488 -1.267 -7.518 -4.871 1.00 42.40 C ATOM 1473 CG PRO A 488 -0.436 -7.378 -6.135 1.00 60.45 C ATOM 1474 CD PRO A 488 0.557 -6.247 -5.917 1.00 2.22 C ATOM 0 HA PRO A 488 -1.247 -6.188 -3.169 1.00 74.23 H new ATOM 0 HB2 PRO A 488 -1.364 -8.564 -4.582 1.00 42.40 H new ATOM 0 HB3 PRO A 488 -2.276 -7.134 -5.023 1.00 42.40 H new ATOM 0 HG2 PRO A 488 0.087 -8.309 -6.353 1.00 60.45 H new ATOM 0 HG3 PRO A 488 -1.076 -7.164 -6.991 1.00 60.45 H new ATOM 0 HD2 PRO A 488 1.581 -6.583 -6.079 1.00 2.22 H new ATOM 0 HD3 PRO A 488 0.378 -5.424 -6.609 1.00 2.22 H new ATOM 1479 N PHE A 489 0.224 -7.212 -1.567 1.00 15.44 N ATOM 1480 CA PHE A 489 0.929 -7.955 -0.537 1.00 61.05 C ATOM 1481 C PHE A 489 0.149 -9.208 -0.134 1.00 14.12 C ATOM 1482 O PHE A 489 -1.014 -9.366 -0.504 1.00 31.15 O ATOM 1483 CB PHE A 489 1.049 -7.032 0.677 1.00 50.42 C ATOM 1484 CG PHE A 489 2.264 -7.322 1.561 1.00 14.22 C ATOM 1485 CD1 PHE A 489 2.166 -8.221 2.578 1.00 32.12 C ATOM 1486 CD2 PHE A 489 3.441 -6.682 1.332 1.00 52.15 C ATOM 1487 CE1 PHE A 489 3.293 -8.491 3.398 1.00 52.10 C ATOM 1488 CE2 PHE A 489 4.568 -6.951 2.152 1.00 10.32 C ATOM 1489 CZ PHE A 489 4.470 -7.850 3.168 1.00 21.13 C ATOM 0 H PHE A 489 -0.276 -6.388 -1.232 1.00 15.44 H new ATOM 0 HA PHE A 489 1.905 -8.270 -0.907 1.00 61.05 H new ATOM 0 HB2 PHE A 489 1.102 -5.999 0.332 1.00 50.42 H new ATOM 0 HB3 PHE A 489 0.145 -7.121 1.279 1.00 50.42 H new ATOM 0 HD1 PHE A 489 1.231 -8.729 2.761 1.00 32.12 H new ATOM 0 HD2 PHE A 489 3.519 -5.968 0.525 1.00 52.15 H new ATOM 0 HE1 PHE A 489 3.216 -9.205 4.204 1.00 52.10 H new ATOM 0 HE2 PHE A 489 5.503 -6.442 1.969 1.00 10.32 H new ATOM 0 HZ PHE A 489 5.327 -8.055 3.792 1.00 21.13 H new ATOM 1498 N LEU A 490 0.819 -10.067 0.619 1.00 54.20 N ATOM 1499 CA LEU A 490 0.204 -11.301 1.076 1.00 34.22 C ATOM 1500 C LEU A 490 0.834 -11.719 2.405 1.00 44.23 C ATOM 1501 O LEU A 490 1.925 -12.285 2.429 1.00 43.23 O ATOM 1502 CB LEU A 490 0.289 -12.377 -0.008 1.00 53.03 C ATOM 1503 CG LEU A 490 0.308 -13.826 0.483 1.00 51.13 C ATOM 1504 CD1 LEU A 490 -0.701 -14.034 1.614 1.00 33.32 C ATOM 1505 CD2 LEU A 490 0.080 -14.801 -0.674 1.00 32.10 C ATOM 0 H LEU A 490 1.783 -9.933 0.924 1.00 54.20 H new ATOM 0 HA LEU A 490 -0.860 -11.149 1.260 1.00 34.22 H new ATOM 0 HB2 LEU A 490 -0.559 -12.254 -0.681 1.00 53.03 H new ATOM 0 HB3 LEU A 490 1.190 -12.202 -0.596 1.00 53.03 H new ATOM 0 HG LEU A 490 1.297 -14.035 0.890 1.00 51.13 H new ATOM 0 HD11 LEU A 490 -0.668 -15.072 1.945 1.00 33.32 H new ATOM 0 HD12 LEU A 490 -0.452 -13.379 2.449 1.00 33.32 H new ATOM 0 HD13 LEU A 490 -1.703 -13.800 1.255 1.00 33.32 H new ATOM 0 HD21 LEU A 490 0.098 -15.824 -0.297 1.00 32.10 H new ATOM 0 HD22 LEU A 490 -0.888 -14.601 -1.133 1.00 32.10 H new ATOM 0 HD23 LEU A 490 0.867 -14.674 -1.417 1.00 32.10 H new ATOM 1516 N PRO A 491 0.100 -11.416 3.511 1.00 13.41 N ATOM 1517 CA PRO A 491 0.575 -11.754 4.841 1.00 72.34 C ATOM 1518 C PRO A 491 0.429 -13.253 5.112 1.00 72.14 C ATOM 1519 O PRO A 491 -0.499 -13.889 4.615 1.00 41.33 O ATOM 1520 CB PRO A 491 -0.253 -10.895 5.784 1.00 22.03 C ATOM 1521 CG PRO A 491 -1.471 -10.457 4.988 1.00 23.04 C ATOM 1522 CD PRO A 491 -1.198 -10.747 3.520 1.00 44.12 C ATOM 0 HA PRO A 491 1.638 -11.554 4.972 1.00 72.34 H new ATOM 0 HB2 PRO A 491 -0.547 -11.459 6.669 1.00 22.03 H new ATOM 0 HB3 PRO A 491 0.318 -10.033 6.130 1.00 22.03 H new ATOM 0 HG2 PRO A 491 -2.359 -10.992 5.324 1.00 23.04 H new ATOM 0 HG3 PRO A 491 -1.663 -9.395 5.138 1.00 23.04 H new ATOM 0 HD2 PRO A 491 -1.974 -11.381 3.090 1.00 44.12 H new ATOM 0 HD3 PRO A 491 -1.175 -9.829 2.932 1.00 44.12 H new ATOM 1527 N LEU A 492 1.358 -13.773 5.900 1.00 73.14 N ATOM 1528 CA LEU A 492 1.345 -15.184 6.243 1.00 3.40 C ATOM 1529 C LEU A 492 -0.025 -15.551 6.820 1.00 33.21 C ATOM 1530 O LEU A 492 -0.555 -16.624 6.536 1.00 35.50 O ATOM 1531 CB LEU A 492 2.513 -15.521 7.172 1.00 0.22 C ATOM 1532 CG LEU A 492 3.901 -15.520 6.531 1.00 52.04 C ATOM 1533 CD1 LEU A 492 4.199 -14.172 5.872 1.00 55.11 C ATOM 1534 CD2 LEU A 492 4.975 -15.909 7.549 1.00 22.43 C ATOM 0 H LEU A 492 2.125 -13.242 6.311 1.00 73.14 H new ATOM 0 HA LEU A 492 1.491 -15.794 5.352 1.00 3.40 H new ATOM 0 HB2 LEU A 492 2.514 -14.807 7.995 1.00 0.22 H new ATOM 0 HB3 LEU A 492 2.335 -16.506 7.604 1.00 0.22 H new ATOM 0 HG LEU A 492 3.914 -16.274 5.744 1.00 52.04 H new ATOM 0 HD11 LEU A 492 5.192 -14.198 5.424 1.00 55.11 H new ATOM 0 HD12 LEU A 492 3.457 -13.973 5.099 1.00 55.11 H new ATOM 0 HD13 LEU A 492 4.161 -13.383 6.623 1.00 55.11 H new ATOM 0 HD21 LEU A 492 5.953 -15.901 7.067 1.00 22.43 H new ATOM 0 HD22 LEU A 492 4.970 -15.196 8.373 1.00 22.43 H new ATOM 0 HD23 LEU A 492 4.768 -16.908 7.932 1.00 22.43 H new ATOM 1545 N GLU A 493 -0.560 -14.638 7.618 1.00 63.55 N ATOM 1546 CA GLU A 493 -1.856 -14.853 8.236 1.00 53.51 C ATOM 1547 C GLU A 493 -2.897 -15.215 7.174 1.00 3.52 C ATOM 1548 O GLU A 493 -3.863 -15.920 7.463 1.00 12.20 O ATOM 1549 CB GLU A 493 -2.293 -13.623 9.034 1.00 70.24 C ATOM 1550 CG GLU A 493 -1.695 -13.642 10.443 1.00 0.11 C ATOM 1551 CD GLU A 493 -2.155 -14.880 11.215 1.00 44.13 C ATOM 1552 OE1 GLU A 493 -3.187 -14.835 11.900 1.00 42.20 O ATOM 1553 OE2 GLU A 493 -1.397 -15.916 11.088 1.00 71.44 O ATOM 0 H GLU A 493 -0.119 -13.748 7.850 1.00 63.55 H new ATOM 0 HA GLU A 493 -1.771 -15.687 8.933 1.00 53.51 H new ATOM 0 HB2 GLU A 493 -1.979 -12.718 8.514 1.00 70.24 H new ATOM 0 HB3 GLU A 493 -3.381 -13.594 9.097 1.00 70.24 H new ATOM 0 HG2 GLU A 493 -0.607 -13.631 10.381 1.00 0.11 H new ATOM 0 HG3 GLU A 493 -1.993 -12.742 10.981 1.00 0.11 H new ATOM 1559 N SER A 494 -2.665 -14.717 5.970 1.00 71.34 N ATOM 1560 CA SER A 494 -3.569 -14.979 4.863 1.00 2.44 C ATOM 1561 C SER A 494 -2.859 -15.806 3.791 1.00 33.31 C ATOM 1562 O SER A 494 -1.675 -16.114 3.921 1.00 43.54 O ATOM 1563 CB SER A 494 -4.099 -13.674 4.263 1.00 4.33 C ATOM 1564 OG SER A 494 -5.382 -13.332 4.782 1.00 44.11 O ATOM 0 H SER A 494 -1.863 -14.132 5.736 1.00 71.34 H new ATOM 0 HA SER A 494 -4.420 -15.544 5.244 1.00 2.44 H new ATOM 0 HB2 SER A 494 -3.396 -12.867 4.471 1.00 4.33 H new ATOM 0 HB3 SER A 494 -4.160 -13.771 3.179 1.00 4.33 H new ATOM 0 HG SER A 494 -5.323 -13.222 5.754 1.00 44.11 H new ATOM 1569 N SER A 495 -3.610 -16.143 2.753 1.00 54.12 N ATOM 1570 CA SER A 495 -3.068 -16.928 1.657 1.00 2.11 C ATOM 1571 C SER A 495 -3.737 -16.525 0.342 1.00 3.33 C ATOM 1572 O SER A 495 -4.827 -15.956 0.345 1.00 31.10 O ATOM 1573 CB SER A 495 -3.251 -18.425 1.909 1.00 23.25 C ATOM 1574 OG SER A 495 -2.026 -19.062 2.265 1.00 11.32 O ATOM 0 H SER A 495 -4.591 -15.886 2.648 1.00 54.12 H new ATOM 0 HA SER A 495 -1.999 -16.727 1.589 1.00 2.11 H new ATOM 0 HB2 SER A 495 -3.980 -18.572 2.706 1.00 23.25 H new ATOM 0 HB3 SER A 495 -3.657 -18.896 1.014 1.00 23.25 H new ATOM 0 HG SER A 495 -2.186 -20.016 2.419 1.00 11.32 H new ATOM 1579 N PRO A 496 -3.038 -16.847 -0.779 1.00 14.12 N ATOM 1580 CA PRO A 496 -3.553 -16.525 -2.100 1.00 51.42 C ATOM 1581 C PRO A 496 -4.688 -17.473 -2.492 1.00 35.33 C ATOM 1582 O PRO A 496 -5.548 -17.119 -3.297 1.00 72.23 O ATOM 1583 CB PRO A 496 -2.352 -16.620 -3.026 1.00 72.44 C ATOM 1584 CG PRO A 496 -1.314 -17.440 -2.277 1.00 51.34 C ATOM 1585 CD PRO A 496 -1.745 -17.521 -0.821 1.00 34.42 C ATOM 0 HA PRO A 496 -3.996 -15.530 -2.147 1.00 51.42 H new ATOM 0 HB2 PRO A 496 -2.622 -17.097 -3.968 1.00 72.44 H new ATOM 0 HB3 PRO A 496 -1.967 -15.630 -3.269 1.00 72.44 H new ATOM 0 HG2 PRO A 496 -1.233 -18.438 -2.707 1.00 51.34 H new ATOM 0 HG3 PRO A 496 -0.331 -16.977 -2.359 1.00 51.34 H new ATOM 0 HD2 PRO A 496 -1.827 -18.556 -0.489 1.00 34.42 H new ATOM 0 HD3 PRO A 496 -1.023 -17.033 -0.167 1.00 34.42 H new ATOM 1590 N ALA A 497 -4.653 -18.661 -1.906 1.00 52.32 N ATOM 1591 CA ALA A 497 -5.666 -19.664 -2.184 1.00 13.43 C ATOM 1592 C ALA A 497 -7.006 -19.201 -1.607 1.00 31.25 C ATOM 1593 O ALA A 497 -8.063 -19.649 -2.048 1.00 44.53 O ATOM 1594 CB ALA A 497 -5.220 -21.013 -1.617 1.00 54.42 C ATOM 0 H ALA A 497 -3.938 -18.951 -1.239 1.00 52.32 H new ATOM 0 HA ALA A 497 -5.796 -19.791 -3.259 1.00 13.43 H new ATOM 0 HB1 ALA A 497 -5.981 -21.765 -1.826 1.00 54.42 H new ATOM 0 HB2 ALA A 497 -4.279 -21.310 -2.081 1.00 54.42 H new ATOM 0 HB3 ALA A 497 -5.082 -20.927 -0.539 1.00 54.42 H new ATOM 1600 N GLN A 498 -6.917 -18.315 -0.627 1.00 55.34 N ATOM 1601 CA GLN A 498 -8.108 -17.788 0.015 1.00 45.15 C ATOM 1602 C GLN A 498 -8.772 -16.735 -0.876 1.00 51.33 C ATOM 1603 O GLN A 498 -9.892 -16.304 -0.606 1.00 30.04 O ATOM 1604 CB GLN A 498 -7.778 -17.209 1.394 1.00 51.34 C ATOM 1605 CG GLN A 498 -6.693 -18.033 2.089 1.00 31.42 C ATOM 1606 CD GLN A 498 -6.760 -17.859 3.606 1.00 42.52 C ATOM 1607 OE1 GLN A 498 -6.503 -16.796 4.148 1.00 31.23 O ATOM 1608 NE2 GLN A 498 -7.120 -18.960 4.261 1.00 44.33 N ATOM 0 H GLN A 498 -6.038 -17.949 -0.262 1.00 55.34 H new ATOM 0 HA GLN A 498 -8.811 -18.609 0.160 1.00 45.15 H new ATOM 0 HB2 GLN A 498 -7.444 -16.177 1.289 1.00 51.34 H new ATOM 0 HB3 GLN A 498 -8.677 -17.192 2.010 1.00 51.34 H new ATOM 0 HG2 GLN A 498 -6.812 -19.086 1.835 1.00 31.42 H new ATOM 0 HG3 GLN A 498 -5.711 -17.727 1.727 1.00 31.42 H new ATOM 0 HE21 GLN A 498 -7.321 -19.817 3.746 1.00 44.33 H new ATOM 0 HE22 GLN A 498 -7.195 -18.947 5.278 1.00 44.33 H new ATOM 1615 N LEU A 499 -8.052 -16.352 -1.920 1.00 64.15 N ATOM 1616 CA LEU A 499 -8.558 -15.359 -2.853 1.00 23.23 C ATOM 1617 C LEU A 499 -9.178 -16.068 -4.059 1.00 71.43 C ATOM 1618 O LEU A 499 -8.889 -17.235 -4.313 1.00 72.52 O ATOM 1619 CB LEU A 499 -7.456 -14.363 -3.224 1.00 22.23 C ATOM 1620 CG LEU A 499 -6.507 -13.961 -2.094 1.00 53.15 C ATOM 1621 CD1 LEU A 499 -5.658 -12.753 -2.495 1.00 23.13 C ATOM 1622 CD2 LEU A 499 -7.277 -13.713 -0.795 1.00 44.11 C ATOM 0 H LEU A 499 -7.123 -16.711 -2.141 1.00 64.15 H new ATOM 0 HA LEU A 499 -9.348 -14.768 -2.390 1.00 23.23 H new ATOM 0 HB2 LEU A 499 -6.865 -14.791 -4.033 1.00 22.23 H new ATOM 0 HB3 LEU A 499 -7.926 -13.461 -3.615 1.00 22.23 H new ATOM 0 HG LEU A 499 -5.823 -14.790 -1.911 1.00 53.15 H new ATOM 0 HD11 LEU A 499 -4.992 -12.488 -1.674 1.00 23.13 H new ATOM 0 HD12 LEU A 499 -5.067 -13.000 -3.377 1.00 23.13 H new ATOM 0 HD13 LEU A 499 -6.310 -11.909 -2.721 1.00 23.13 H new ATOM 0 HD21 LEU A 499 -6.579 -13.429 -0.007 1.00 44.11 H new ATOM 0 HD22 LEU A 499 -7.999 -12.911 -0.947 1.00 44.11 H new ATOM 0 HD23 LEU A 499 -7.802 -14.623 -0.504 1.00 44.11 H new ATOM 1633 N SER A 500 -10.020 -15.330 -4.768 1.00 32.34 N ATOM 1634 CA SER A 500 -10.684 -15.874 -5.941 1.00 10.41 C ATOM 1635 C SER A 500 -9.649 -16.240 -7.006 1.00 13.45 C ATOM 1636 O SER A 500 -8.531 -15.729 -6.991 1.00 32.31 O ATOM 1637 CB SER A 500 -11.701 -14.880 -6.508 1.00 42.12 C ATOM 1638 OG SER A 500 -12.815 -15.538 -7.104 1.00 12.20 O ATOM 0 H SER A 500 -10.257 -14.362 -4.553 1.00 32.34 H new ATOM 0 HA SER A 500 -11.222 -16.774 -5.643 1.00 10.41 H new ATOM 0 HB2 SER A 500 -12.051 -14.225 -5.710 1.00 42.12 H new ATOM 0 HB3 SER A 500 -11.214 -14.247 -7.250 1.00 42.12 H new ATOM 0 HG SER A 500 -13.442 -14.870 -7.452 1.00 12.20 H new ATOM 1643 N SER A 501 -10.059 -17.122 -7.904 1.00 12.14 N ATOM 1644 CA SER A 501 -9.181 -17.564 -8.976 1.00 42.35 C ATOM 1645 C SER A 501 -8.915 -16.409 -9.942 1.00 35.20 C ATOM 1646 O SER A 501 -8.053 -16.510 -10.815 1.00 12.43 O ATOM 1647 CB SER A 501 -9.781 -18.754 -9.724 1.00 34.34 C ATOM 1648 OG SER A 501 -9.110 -19.004 -10.957 1.00 40.31 O ATOM 0 H SER A 501 -10.988 -17.544 -7.913 1.00 12.14 H new ATOM 0 HA SER A 501 -8.238 -17.886 -8.535 1.00 42.35 H new ATOM 0 HB2 SER A 501 -9.726 -19.642 -9.095 1.00 34.34 H new ATOM 0 HB3 SER A 501 -10.837 -18.565 -9.918 1.00 34.34 H new ATOM 0 HG SER A 501 -8.467 -18.286 -11.131 1.00 40.31 H new ATOM 1653 N ASP A 502 -9.670 -15.335 -9.756 1.00 22.31 N ATOM 1654 CA ASP A 502 -9.525 -14.164 -10.600 1.00 55.25 C ATOM 1655 C ASP A 502 -8.336 -13.333 -10.115 1.00 74.44 C ATOM 1656 O ASP A 502 -7.601 -12.763 -10.920 1.00 1.14 O ATOM 1657 CB ASP A 502 -10.775 -13.282 -10.537 1.00 62.42 C ATOM 1658 CG ASP A 502 -12.083 -13.988 -10.897 1.00 63.14 C ATOM 1659 OD1 ASP A 502 -13.177 -13.430 -10.726 1.00 1.42 O ATOM 1660 OD2 ASP A 502 -11.946 -15.176 -11.380 1.00 50.22 O ATOM 0 H ASP A 502 -10.384 -15.253 -9.032 1.00 22.31 H new ATOM 0 HA ASP A 502 -9.374 -14.504 -11.624 1.00 55.25 H new ATOM 0 HB2 ASP A 502 -10.864 -12.876 -9.529 1.00 62.42 H new ATOM 0 HB3 ASP A 502 -10.639 -12.436 -11.211 1.00 62.42 H new ATOM 1665 N THR A 503 -8.183 -13.290 -8.800 1.00 61.32 N ATOM 1666 CA THR A 503 -7.094 -12.539 -8.196 1.00 15.21 C ATOM 1667 C THR A 503 -5.803 -12.739 -8.992 1.00 72.14 C ATOM 1668 O THR A 503 -5.164 -11.770 -9.399 1.00 52.52 O ATOM 1669 CB THR A 503 -6.978 -12.968 -6.732 1.00 13.35 C ATOM 1670 OG1 THR A 503 -8.312 -12.879 -6.238 1.00 0.45 O ATOM 1671 CG2 THR A 503 -6.199 -11.959 -5.887 1.00 64.33 C ATOM 0 H THR A 503 -8.795 -13.763 -8.135 1.00 61.32 H new ATOM 0 HA THR A 503 -7.291 -11.467 -8.221 1.00 15.21 H new ATOM 0 HB THR A 503 -6.490 -13.941 -6.676 1.00 13.35 H new ATOM 0 HG1 THR A 503 -8.708 -13.775 -6.203 1.00 0.45 H new ATOM 0 HG21 THR A 503 -6.146 -12.311 -4.857 1.00 64.33 H new ATOM 0 HG22 THR A 503 -5.190 -11.852 -6.286 1.00 64.33 H new ATOM 0 HG23 THR A 503 -6.705 -10.994 -5.915 1.00 64.33 H new ATOM 1679 N ALA A 504 -5.458 -14.001 -9.192 1.00 5.14 N ATOM 1680 CA ALA A 504 -4.255 -14.341 -9.932 1.00 10.11 C ATOM 1681 C ALA A 504 -4.201 -13.514 -11.217 1.00 75.02 C ATOM 1682 O ALA A 504 -3.137 -13.041 -11.612 1.00 73.31 O ATOM 1683 CB ALA A 504 -4.231 -15.847 -10.205 1.00 54.24 C ATOM 0 H ALA A 504 -5.991 -14.802 -8.854 1.00 5.14 H new ATOM 0 HA ALA A 504 -3.366 -14.102 -9.349 1.00 10.11 H new ATOM 0 HB1 ALA A 504 -3.328 -16.102 -10.760 1.00 54.24 H new ATOM 0 HB2 ALA A 504 -4.240 -16.388 -9.259 1.00 54.24 H new ATOM 0 HB3 ALA A 504 -5.108 -16.125 -10.790 1.00 54.24 H new ATOM 1689 N SER A 505 -5.364 -13.363 -11.835 1.00 64.02 N ATOM 1690 CA SER A 505 -5.463 -12.600 -13.067 1.00 23.30 C ATOM 1691 C SER A 505 -5.475 -11.102 -12.757 1.00 54.45 C ATOM 1692 O SER A 505 -5.065 -10.289 -13.583 1.00 12.51 O ATOM 1693 CB SER A 505 -6.716 -12.989 -13.857 1.00 22.52 C ATOM 1694 OG SER A 505 -6.680 -14.351 -14.275 1.00 14.43 O ATOM 0 H SER A 505 -6.245 -13.756 -11.505 1.00 64.02 H new ATOM 0 HA SER A 505 -4.593 -12.830 -13.682 1.00 23.30 H new ATOM 0 HB2 SER A 505 -7.600 -12.822 -13.241 1.00 22.52 H new ATOM 0 HB3 SER A 505 -6.809 -12.344 -14.730 1.00 22.52 H new ATOM 0 HG SER A 505 -7.497 -14.562 -14.774 1.00 14.43 H new ATOM 1699 N LEU A 506 -5.953 -10.782 -11.561 1.00 71.02 N ATOM 1700 CA LEU A 506 -6.025 -9.396 -11.132 1.00 64.11 C ATOM 1701 C LEU A 506 -4.608 -8.841 -10.975 1.00 21.50 C ATOM 1702 O LEU A 506 -4.391 -7.636 -11.101 1.00 20.11 O ATOM 1703 CB LEU A 506 -6.876 -9.273 -9.866 1.00 74.03 C ATOM 1704 CG LEU A 506 -8.324 -9.752 -9.984 1.00 61.11 C ATOM 1705 CD1 LEU A 506 -8.999 -9.796 -8.612 1.00 4.44 C ATOM 1706 CD2 LEU A 506 -9.107 -8.894 -10.981 1.00 10.43 C ATOM 0 H LEU A 506 -6.293 -11.459 -10.878 1.00 71.02 H new ATOM 0 HA LEU A 506 -6.524 -8.788 -11.887 1.00 64.11 H new ATOM 0 HB2 LEU A 506 -6.391 -9.837 -9.069 1.00 74.03 H new ATOM 0 HB3 LEU A 506 -6.884 -8.228 -9.557 1.00 74.03 H new ATOM 0 HG LEU A 506 -8.317 -10.770 -10.373 1.00 61.11 H new ATOM 0 HD11 LEU A 506 -10.027 -10.140 -8.723 1.00 4.44 H new ATOM 0 HD12 LEU A 506 -8.456 -10.481 -7.961 1.00 4.44 H new ATOM 0 HD13 LEU A 506 -8.995 -8.799 -8.173 1.00 4.44 H new ATOM 0 HD21 LEU A 506 -10.133 -9.256 -11.046 1.00 10.43 H new ATOM 0 HD22 LEU A 506 -9.109 -7.857 -10.646 1.00 10.43 H new ATOM 0 HD23 LEU A 506 -8.638 -8.957 -11.963 1.00 10.43 H new ATOM 1717 N LEU A 507 -3.678 -9.747 -10.704 1.00 53.34 N ATOM 1718 CA LEU A 507 -2.287 -9.362 -10.530 1.00 44.32 C ATOM 1719 C LEU A 507 -1.415 -10.170 -11.492 1.00 72.41 C ATOM 1720 O LEU A 507 -0.226 -10.365 -11.244 1.00 14.32 O ATOM 1721 CB LEU A 507 -1.874 -9.499 -9.063 1.00 0.03 C ATOM 1722 CG LEU A 507 -2.409 -10.731 -8.327 1.00 43.15 C ATOM 1723 CD1 LEU A 507 -1.384 -11.255 -7.321 1.00 10.53 C ATOM 1724 CD2 LEU A 507 -3.758 -10.433 -7.670 1.00 73.41 C ATOM 0 H LEU A 507 -3.861 -10.745 -10.601 1.00 53.34 H new ATOM 0 HA LEU A 507 -2.148 -8.310 -10.780 1.00 44.32 H new ATOM 0 HB2 LEU A 507 -0.785 -9.515 -9.013 1.00 0.03 H new ATOM 0 HB3 LEU A 507 -2.205 -8.609 -8.528 1.00 0.03 H new ATOM 0 HG LEU A 507 -2.575 -11.522 -9.058 1.00 43.15 H new ATOM 0 HD11 LEU A 507 -1.788 -12.130 -6.812 1.00 10.53 H new ATOM 0 HD12 LEU A 507 -0.468 -11.531 -7.844 1.00 10.53 H new ATOM 0 HD13 LEU A 507 -1.163 -10.479 -6.588 1.00 10.53 H new ATOM 0 HD21 LEU A 507 -4.116 -11.324 -7.154 1.00 73.41 H new ATOM 0 HD22 LEU A 507 -3.642 -9.620 -6.953 1.00 73.41 H new ATOM 0 HD23 LEU A 507 -4.479 -10.142 -8.434 1.00 73.41 H new ATOM 1735 N SER A 508 -2.040 -10.616 -12.573 1.00 22.03 N ATOM 1736 CA SER A 508 -1.334 -11.397 -13.574 1.00 10.35 C ATOM 1737 C SER A 508 -0.070 -10.660 -14.020 1.00 63.12 C ATOM 1738 O SER A 508 0.930 -11.288 -14.362 1.00 71.42 O ATOM 1739 CB SER A 508 -2.233 -11.686 -14.780 1.00 65.32 C ATOM 1740 OG SER A 508 -2.002 -12.986 -15.317 1.00 75.20 O ATOM 0 H SER A 508 -3.026 -10.451 -12.777 1.00 22.03 H new ATOM 0 HA SER A 508 -1.051 -12.350 -13.127 1.00 10.35 H new ATOM 0 HB2 SER A 508 -3.278 -11.596 -14.483 1.00 65.32 H new ATOM 0 HB3 SER A 508 -2.056 -10.938 -15.552 1.00 65.32 H new ATOM 0 HG SER A 508 -2.595 -13.134 -16.083 1.00 75.20 H new ATOM 1745 N GLY A 509 -0.156 -9.339 -13.999 1.00 61.24 N ATOM 1746 CA GLY A 509 0.969 -8.509 -14.397 1.00 61.42 C ATOM 1747 C GLY A 509 1.648 -7.885 -13.175 1.00 2.30 C ATOM 1748 O GLY A 509 2.849 -7.622 -13.195 1.00 3.14 O ATOM 0 H GLY A 509 -0.987 -8.822 -13.713 1.00 61.24 H new ATOM 0 HA2 GLY A 509 1.690 -9.109 -14.952 1.00 61.42 H new ATOM 0 HA3 GLY A 509 0.626 -7.722 -15.068 1.00 61.42 H new ATOM 1752 N LEU A 510 0.849 -7.667 -12.141 1.00 61.34 N ATOM 1753 CA LEU A 510 1.358 -7.079 -10.912 1.00 33.25 C ATOM 1754 C LEU A 510 2.419 -8.002 -10.312 1.00 22.24 C ATOM 1755 O LEU A 510 2.733 -9.047 -10.882 1.00 72.14 O ATOM 1756 CB LEU A 510 0.208 -6.758 -9.956 1.00 23.35 C ATOM 1757 CG LEU A 510 -0.860 -5.801 -10.488 1.00 43.02 C ATOM 1758 CD1 LEU A 510 -1.738 -5.274 -9.351 1.00 4.14 C ATOM 1759 CD2 LEU A 510 -0.226 -4.666 -11.294 1.00 44.12 C ATOM 0 H LEU A 510 -0.147 -7.887 -12.128 1.00 61.34 H new ATOM 0 HA LEU A 510 1.845 -6.126 -11.118 1.00 33.25 H new ATOM 0 HB2 LEU A 510 -0.277 -7.693 -9.676 1.00 23.35 H new ATOM 0 HB3 LEU A 510 0.628 -6.332 -9.045 1.00 23.35 H new ATOM 0 HG LEU A 510 -1.508 -6.355 -11.167 1.00 43.02 H new ATOM 0 HD11 LEU A 510 -2.489 -4.596 -9.756 1.00 4.14 H new ATOM 0 HD12 LEU A 510 -2.233 -6.110 -8.856 1.00 4.14 H new ATOM 0 HD13 LEU A 510 -1.118 -4.741 -8.630 1.00 4.14 H new ATOM 0 HD21 LEU A 510 -1.007 -4.000 -11.661 1.00 44.12 H new ATOM 0 HD22 LEU A 510 0.459 -4.106 -10.657 1.00 44.12 H new ATOM 0 HD23 LEU A 510 0.322 -5.082 -12.139 1.00 44.12 H new ATOM 1770 N VAL A 511 2.943 -7.586 -9.169 1.00 51.24 N ATOM 1771 CA VAL A 511 3.962 -8.363 -8.483 1.00 34.30 C ATOM 1772 C VAL A 511 3.452 -8.753 -7.095 1.00 22.50 C ATOM 1773 O VAL A 511 3.620 -8.002 -6.135 1.00 55.44 O ATOM 1774 CB VAL A 511 5.276 -7.580 -8.441 1.00 61.13 C ATOM 1775 CG1 VAL A 511 6.237 -8.178 -7.411 1.00 72.32 C ATOM 1776 CG2 VAL A 511 5.923 -7.520 -9.827 1.00 45.14 C ATOM 0 H VAL A 511 2.681 -6.719 -8.700 1.00 51.24 H new ATOM 0 HA VAL A 511 4.167 -9.287 -9.024 1.00 34.30 H new ATOM 0 HB VAL A 511 5.049 -6.559 -8.134 1.00 61.13 H new ATOM 0 HG11 VAL A 511 7.163 -7.603 -7.401 1.00 72.32 H new ATOM 0 HG12 VAL A 511 5.778 -8.144 -6.423 1.00 72.32 H new ATOM 0 HG13 VAL A 511 6.455 -9.213 -7.675 1.00 72.32 H new ATOM 0 HG21 VAL A 511 6.855 -6.958 -9.769 1.00 45.14 H new ATOM 0 HG22 VAL A 511 6.130 -8.532 -10.176 1.00 45.14 H new ATOM 0 HG23 VAL A 511 5.245 -7.027 -10.524 1.00 45.14 H new ATOM 1786 N ARG A 512 2.841 -9.926 -7.032 1.00 10.32 N ATOM 1787 CA ARG A 512 2.306 -10.426 -5.777 1.00 43.24 C ATOM 1788 C ARG A 512 3.391 -10.420 -4.698 1.00 62.31 C ATOM 1789 O ARG A 512 4.284 -11.267 -4.705 1.00 1.25 O ATOM 1790 CB ARG A 512 1.762 -11.846 -5.935 1.00 21.52 C ATOM 1791 CG ARG A 512 1.175 -12.360 -4.619 1.00 40.03 C ATOM 1792 CD ARG A 512 -0.038 -13.256 -4.873 1.00 21.24 C ATOM 1793 NE ARG A 512 0.407 -14.623 -5.226 1.00 13.34 N ATOM 1794 CZ ARG A 512 -0.326 -15.494 -5.951 1.00 71.05 C ATOM 1795 NH1 ARG A 512 -1.549 -15.147 -6.409 1.00 61.25 N ATOM 1796 NH2 ARG A 512 0.170 -16.690 -6.208 1.00 20.14 N ATOM 0 H ARG A 512 2.704 -10.546 -7.831 1.00 10.32 H new ATOM 0 HA ARG A 512 1.489 -9.768 -5.480 1.00 43.24 H new ATOM 0 HB2 ARG A 512 0.995 -11.861 -6.709 1.00 21.52 H new ATOM 0 HB3 ARG A 512 2.561 -12.510 -6.265 1.00 21.52 H new ATOM 0 HG2 ARG A 512 1.935 -12.917 -4.071 1.00 40.03 H new ATOM 0 HG3 ARG A 512 0.884 -11.517 -3.993 1.00 40.03 H new ATOM 0 HD2 ARG A 512 -0.669 -13.288 -3.985 1.00 21.24 H new ATOM 0 HD3 ARG A 512 -0.644 -12.842 -5.679 1.00 21.24 H new ATOM 0 HE ARG A 512 1.325 -14.926 -4.901 1.00 13.34 H new ATOM 0 HH11 ARG A 512 -1.925 -14.220 -6.208 1.00 61.25 H new ATOM 0 HH12 ARG A 512 -2.096 -15.812 -6.956 1.00 61.25 H new ATOM 0 HH21 ARG A 512 1.094 -16.944 -5.860 1.00 20.14 H new ATOM 0 HH22 ARG A 512 -0.371 -17.360 -6.755 1.00 20.14 H new ATOM 1806 N LEU A 513 3.280 -9.456 -3.796 1.00 2.30 N ATOM 1807 CA LEU A 513 4.239 -9.328 -2.714 1.00 25.42 C ATOM 1808 C LEU A 513 3.846 -10.271 -1.574 1.00 54.53 C ATOM 1809 O LEU A 513 2.693 -10.281 -1.144 1.00 11.24 O ATOM 1810 CB LEU A 513 4.373 -7.865 -2.285 1.00 4.40 C ATOM 1811 CG LEU A 513 5.790 -7.386 -1.966 1.00 21.52 C ATOM 1812 CD1 LEU A 513 6.730 -7.632 -3.148 1.00 42.32 C ATOM 1813 CD2 LEU A 513 5.788 -5.919 -1.531 1.00 2.34 C ATOM 0 H LEU A 513 2.539 -8.755 -3.793 1.00 2.30 H new ATOM 0 HA LEU A 513 5.232 -9.629 -3.048 1.00 25.42 H new ATOM 0 HB2 LEU A 513 3.968 -7.236 -3.078 1.00 4.40 H new ATOM 0 HB3 LEU A 513 3.751 -7.707 -1.404 1.00 4.40 H new ATOM 0 HG LEU A 513 6.168 -7.970 -1.127 1.00 21.52 H new ATOM 0 HD11 LEU A 513 7.731 -7.283 -2.896 1.00 42.32 H new ATOM 0 HD12 LEU A 513 6.763 -8.699 -3.371 1.00 42.32 H new ATOM 0 HD13 LEU A 513 6.366 -7.090 -4.021 1.00 42.32 H new ATOM 0 HD21 LEU A 513 6.808 -5.604 -1.310 1.00 2.34 H new ATOM 0 HD22 LEU A 513 5.383 -5.302 -2.333 1.00 2.34 H new ATOM 0 HD23 LEU A 513 5.172 -5.805 -0.639 1.00 2.34 H new ATOM 1824 N ASP A 514 4.823 -11.038 -1.118 1.00 70.13 N ATOM 1825 CA ASP A 514 4.594 -11.980 -0.037 1.00 12.11 C ATOM 1826 C ASP A 514 5.531 -11.655 1.128 1.00 51.12 C ATOM 1827 O ASP A 514 6.469 -10.874 0.974 1.00 31.13 O ATOM 1828 CB ASP A 514 4.879 -13.415 -0.487 1.00 74.41 C ATOM 1829 CG ASP A 514 3.697 -14.136 -1.138 1.00 74.25 C ATOM 1830 OD1 ASP A 514 2.699 -13.508 -1.522 1.00 23.03 O ATOM 1831 OD2 ASP A 514 3.831 -15.414 -1.248 1.00 24.52 O ATOM 0 H ASP A 514 5.777 -11.027 -1.478 1.00 70.13 H new ATOM 0 HA ASP A 514 3.550 -11.897 0.265 1.00 12.11 H new ATOM 0 HB2 ASP A 514 5.709 -13.400 -1.193 1.00 74.41 H new ATOM 0 HB3 ASP A 514 5.206 -13.993 0.378 1.00 74.41 H new ATOM 1836 N GLU A 515 5.246 -12.271 2.265 1.00 74.24 N ATOM 1837 CA GLU A 515 6.052 -12.056 3.455 1.00 21.11 C ATOM 1838 C GLU A 515 6.764 -13.349 3.854 1.00 22.04 C ATOM 1839 O GLU A 515 7.676 -13.331 4.681 1.00 11.43 O ATOM 1840 CB GLU A 515 5.199 -11.522 4.608 1.00 54.21 C ATOM 1841 CG GLU A 515 5.966 -11.579 5.931 1.00 14.33 C ATOM 1842 CD GLU A 515 7.240 -10.736 5.863 1.00 13.32 C ATOM 1843 OE1 GLU A 515 8.305 -11.185 6.311 1.00 73.21 O ATOM 1844 OE2 GLU A 515 7.096 -9.574 5.318 1.00 24.23 O ATOM 0 H GLU A 515 4.468 -12.919 2.388 1.00 74.24 H new ATOM 0 HA GLU A 515 6.807 -11.303 3.227 1.00 21.11 H new ATOM 0 HB2 GLU A 515 4.902 -10.494 4.400 1.00 54.21 H new ATOM 0 HB3 GLU A 515 4.283 -12.108 4.689 1.00 54.21 H new ATOM 0 HG2 GLU A 515 5.330 -11.219 6.740 1.00 14.33 H new ATOM 0 HG3 GLU A 515 6.222 -12.613 6.163 1.00 14.33 H new ATOM 1850 N HIS A 516 6.322 -14.442 3.249 1.00 62.35 N ATOM 1851 CA HIS A 516 6.907 -15.742 3.531 1.00 33.13 C ATOM 1852 C HIS A 516 7.949 -16.078 2.463 1.00 62.20 C ATOM 1853 O HIS A 516 8.803 -16.939 2.674 1.00 33.33 O ATOM 1854 CB HIS A 516 5.818 -16.811 3.653 1.00 23.23 C ATOM 1855 CG HIS A 516 4.611 -16.563 2.780 1.00 64.51 C ATOM 1856 ND1 HIS A 516 3.313 -16.721 3.233 1.00 52.12 N ATOM 1857 CD2 HIS A 516 4.521 -16.166 1.478 1.00 2.20 C ATOM 1858 CE1 HIS A 516 2.486 -16.431 2.239 1.00 51.05 C ATOM 1859 NE2 HIS A 516 3.236 -16.088 1.153 1.00 41.32 N ATOM 0 H HIS A 516 5.566 -14.454 2.565 1.00 62.35 H new ATOM 0 HA HIS A 516 7.419 -15.714 4.493 1.00 33.13 H new ATOM 0 HB2 HIS A 516 6.245 -17.781 3.397 1.00 23.23 H new ATOM 0 HB3 HIS A 516 5.496 -16.869 4.693 1.00 23.23 H new ATOM 0 HD2 HIS A 516 5.353 -15.952 0.823 1.00 2.20 H new ATOM 0 HE1 HIS A 516 1.407 -16.461 2.282 1.00 51.05 H new ATOM 0 HE2 HIS A 516 2.870 -15.816 0.241 1.00 41.32 H new ATOM 1866 N SER A 517 7.846 -15.383 1.341 1.00 65.24 N ATOM 1867 CA SER A 517 8.772 -15.596 0.241 1.00 11.45 C ATOM 1868 C SER A 517 10.149 -15.033 0.598 1.00 33.02 C ATOM 1869 O SER A 517 10.256 -13.919 1.108 1.00 12.32 O ATOM 1870 CB SER A 517 8.252 -14.953 -1.047 1.00 33.21 C ATOM 1871 OG SER A 517 8.576 -15.727 -2.198 1.00 35.51 O ATOM 0 H SER A 517 7.136 -14.672 1.169 1.00 65.24 H new ATOM 0 HA SER A 517 8.860 -16.669 0.070 1.00 11.45 H new ATOM 0 HB2 SER A 517 7.170 -14.835 -0.982 1.00 33.21 H new ATOM 0 HB3 SER A 517 8.676 -13.954 -1.151 1.00 33.21 H new ATOM 0 HG SER A 517 8.226 -15.284 -2.999 1.00 35.51 H new ATOM 1876 N GLN A 518 11.169 -15.830 0.314 1.00 34.51 N ATOM 1877 CA GLN A 518 12.535 -15.425 0.599 1.00 32.32 C ATOM 1878 C GLN A 518 13.057 -14.502 -0.505 1.00 2.31 C ATOM 1879 O GLN A 518 14.221 -14.106 -0.489 1.00 51.51 O ATOM 1880 CB GLN A 518 13.444 -16.644 0.767 1.00 60.10 C ATOM 1881 CG GLN A 518 13.349 -17.571 -0.446 1.00 64.42 C ATOM 1882 CD GLN A 518 14.641 -18.371 -0.627 1.00 32.11 C ATOM 1883 OE1 GLN A 518 15.035 -19.162 0.215 1.00 21.11 O ATOM 1884 NE2 GLN A 518 15.275 -18.123 -1.769 1.00 21.41 N ATOM 0 H GLN A 518 11.077 -16.753 -0.110 1.00 34.51 H new ATOM 0 HA GLN A 518 12.541 -14.874 1.540 1.00 32.32 H new ATOM 0 HB2 GLN A 518 14.475 -16.317 0.899 1.00 60.10 H new ATOM 0 HB3 GLN A 518 13.164 -17.189 1.668 1.00 60.10 H new ATOM 0 HG2 GLN A 518 12.509 -18.254 -0.321 1.00 64.42 H new ATOM 0 HG3 GLN A 518 13.152 -16.983 -1.343 1.00 64.42 H new ATOM 0 HE21 GLN A 518 14.890 -17.448 -2.430 1.00 21.41 H new ATOM 0 HE22 GLN A 518 16.147 -18.607 -1.984 1.00 21.41 H new ATOM 1891 N ILE A 519 12.169 -14.186 -1.436 1.00 10.35 N ATOM 1892 CA ILE A 519 12.523 -13.317 -2.545 1.00 1.01 C ATOM 1893 C ILE A 519 11.846 -11.957 -2.358 1.00 60.52 C ATOM 1894 O ILE A 519 12.324 -10.946 -2.872 1.00 31.21 O ATOM 1895 CB ILE A 519 12.195 -13.990 -3.879 1.00 70.24 C ATOM 1896 CG1 ILE A 519 11.538 -13.001 -4.845 1.00 34.42 C ATOM 1897 CG2 ILE A 519 11.340 -15.240 -3.668 1.00 71.24 C ATOM 1898 CD1 ILE A 519 12.553 -11.977 -5.357 1.00 5.12 C ATOM 0 H ILE A 519 11.204 -14.517 -1.445 1.00 10.35 H new ATOM 0 HA ILE A 519 13.598 -13.138 -2.561 1.00 1.01 H new ATOM 0 HB ILE A 519 13.130 -14.314 -4.337 1.00 70.24 H new ATOM 0 HG12 ILE A 519 11.106 -13.542 -5.687 1.00 34.42 H new ATOM 0 HG13 ILE A 519 10.719 -12.486 -4.343 1.00 34.42 H new ATOM 0 HG21 ILE A 519 11.122 -15.698 -4.632 1.00 71.24 H new ATOM 0 HG22 ILE A 519 11.882 -15.950 -3.043 1.00 71.24 H new ATOM 0 HG23 ILE A 519 10.406 -14.964 -3.178 1.00 71.24 H new ATOM 0 HD11 ILE A 519 12.060 -11.287 -6.041 1.00 5.12 H new ATOM 0 HD12 ILE A 519 12.965 -11.421 -4.515 1.00 5.12 H new ATOM 0 HD13 ILE A 519 13.358 -12.493 -5.880 1.00 5.12 H new ATOM 1909 N PHE A 520 10.745 -11.977 -1.623 1.00 41.34 N ATOM 1910 CA PHE A 520 9.998 -10.758 -1.362 1.00 55.23 C ATOM 1911 C PHE A 520 10.940 -9.583 -1.095 1.00 52.11 C ATOM 1912 O PHE A 520 10.651 -8.451 -1.482 1.00 65.15 O ATOM 1913 CB PHE A 520 9.150 -11.011 -0.113 1.00 73.33 C ATOM 1914 CG PHE A 520 8.787 -9.742 0.659 1.00 53.34 C ATOM 1915 CD1 PHE A 520 8.203 -8.696 0.013 1.00 60.33 C ATOM 1916 CD2 PHE A 520 9.045 -9.657 1.991 1.00 73.40 C ATOM 1917 CE1 PHE A 520 7.864 -7.517 0.729 1.00 21.53 C ATOM 1918 CE2 PHE A 520 8.707 -8.479 2.708 1.00 53.34 C ATOM 1919 CZ PHE A 520 8.124 -7.435 2.061 1.00 61.24 C ATOM 0 H PHE A 520 10.352 -12.818 -1.200 1.00 41.34 H new ATOM 0 HA PHE A 520 9.384 -10.507 -2.227 1.00 55.23 H new ATOM 0 HB2 PHE A 520 8.232 -11.521 -0.406 1.00 73.33 H new ATOM 0 HB3 PHE A 520 9.691 -11.686 0.551 1.00 73.33 H new ATOM 0 HD1 PHE A 520 7.997 -8.763 -1.045 1.00 60.33 H new ATOM 0 HD2 PHE A 520 9.508 -10.487 2.505 1.00 73.40 H new ATOM 0 HE1 PHE A 520 7.401 -6.687 0.216 1.00 21.53 H new ATOM 0 HE2 PHE A 520 8.913 -8.412 3.766 1.00 53.34 H new ATOM 0 HZ PHE A 520 7.867 -6.539 2.606 1.00 61.24 H new ATOM 1928 N ALA A 521 12.048 -9.891 -0.438 1.00 72.42 N ATOM 1929 CA ALA A 521 13.035 -8.874 -0.115 1.00 32.23 C ATOM 1930 C ALA A 521 13.453 -8.151 -1.397 1.00 72.31 C ATOM 1931 O ALA A 521 13.501 -6.923 -1.434 1.00 43.12 O ATOM 1932 CB ALA A 521 14.220 -9.523 0.602 1.00 20.24 C ATOM 0 H ALA A 521 12.285 -10.831 -0.120 1.00 72.42 H new ATOM 0 HA ALA A 521 12.614 -8.130 0.561 1.00 32.23 H new ATOM 0 HB1 ALA A 521 14.960 -8.761 0.844 1.00 20.24 H new ATOM 0 HB2 ALA A 521 13.874 -9.998 1.520 1.00 20.24 H new ATOM 0 HB3 ALA A 521 14.671 -10.274 -0.047 1.00 20.24 H new ATOM 1938 N ARG A 522 13.745 -8.944 -2.417 1.00 14.34 N ATOM 1939 CA ARG A 522 14.157 -8.395 -3.698 1.00 54.35 C ATOM 1940 C ARG A 522 12.953 -7.799 -4.434 1.00 24.20 C ATOM 1941 O ARG A 522 13.116 -6.994 -5.348 1.00 24.12 O ATOM 1942 CB ARG A 522 14.802 -9.468 -4.577 1.00 3.53 C ATOM 1943 CG ARG A 522 16.157 -9.898 -4.010 1.00 12.25 C ATOM 1944 CD ARG A 522 15.979 -10.845 -2.822 1.00 43.22 C ATOM 1945 NE ARG A 522 17.279 -11.451 -2.457 1.00 64.21 N ATOM 1946 CZ ARG A 522 17.482 -12.197 -1.350 1.00 62.51 C ATOM 1947 NH1 ARG A 522 16.471 -12.435 -0.490 1.00 4.44 N ATOM 1948 NH2 ARG A 522 18.686 -12.689 -1.123 1.00 60.11 N ATOM 0 H ARG A 522 13.705 -9.963 -2.383 1.00 14.34 H new ATOM 0 HA ARG A 522 14.891 -7.613 -3.501 1.00 54.35 H new ATOM 0 HB2 ARG A 522 14.142 -10.332 -4.646 1.00 3.53 H new ATOM 0 HB3 ARG A 522 14.932 -9.085 -5.589 1.00 3.53 H new ATOM 0 HG2 ARG A 522 16.741 -10.390 -4.788 1.00 12.25 H new ATOM 0 HG3 ARG A 522 16.720 -9.019 -3.697 1.00 12.25 H new ATOM 0 HD2 ARG A 522 15.571 -10.300 -1.971 1.00 43.22 H new ATOM 0 HD3 ARG A 522 15.262 -11.627 -3.074 1.00 43.22 H new ATOM 0 HE ARG A 522 18.071 -11.295 -3.081 1.00 64.21 H new ATOM 0 HH11 ARG A 522 15.544 -12.050 -0.673 1.00 4.44 H new ATOM 0 HH12 ARG A 522 16.633 -13.000 0.344 1.00 4.44 H new ATOM 0 HH21 ARG A 522 19.445 -12.503 -1.779 1.00 60.11 H new ATOM 0 HH22 ARG A 522 18.857 -13.255 -0.292 1.00 60.11 H new ATOM 1958 N LYS A 523 11.771 -8.222 -4.006 1.00 63.34 N ATOM 1959 CA LYS A 523 10.542 -7.741 -4.612 1.00 21.13 C ATOM 1960 C LYS A 523 10.267 -6.313 -4.135 1.00 1.32 C ATOM 1961 O LYS A 523 9.910 -5.446 -4.931 1.00 52.31 O ATOM 1962 CB LYS A 523 9.394 -8.713 -4.336 1.00 10.43 C ATOM 1963 CG LYS A 523 9.771 -10.138 -4.746 1.00 10.34 C ATOM 1964 CD LYS A 523 10.254 -10.180 -6.197 1.00 20.23 C ATOM 1965 CE LYS A 523 9.191 -9.623 -7.145 1.00 61.43 C ATOM 1966 NZ LYS A 523 9.299 -10.262 -8.476 1.00 1.32 N ATOM 0 H LYS A 523 11.640 -8.892 -3.248 1.00 63.34 H new ATOM 0 HA LYS A 523 10.642 -7.701 -5.697 1.00 21.13 H new ATOM 0 HB2 LYS A 523 9.141 -8.691 -3.276 1.00 10.43 H new ATOM 0 HB3 LYS A 523 8.506 -8.397 -4.883 1.00 10.43 H new ATOM 0 HG2 LYS A 523 10.553 -10.515 -4.087 1.00 10.34 H new ATOM 0 HG3 LYS A 523 8.909 -10.795 -4.626 1.00 10.34 H new ATOM 0 HD2 LYS A 523 11.173 -9.602 -6.295 1.00 20.23 H new ATOM 0 HD3 LYS A 523 10.492 -11.207 -6.475 1.00 20.23 H new ATOM 0 HE2 LYS A 523 8.198 -9.797 -6.731 1.00 61.43 H new ATOM 0 HE3 LYS A 523 9.311 -8.544 -7.242 1.00 61.43 H new ATOM 0 HZ1 LYS A 523 8.570 -9.873 -9.108 1.00 1.32 H new ATOM 0 HZ2 LYS A 523 10.240 -10.074 -8.876 1.00 1.32 H new ATOM 0 HZ3 LYS A 523 9.162 -11.289 -8.380 1.00 1.32 H new ATOM 1975 N VAL A 524 10.444 -6.113 -2.837 1.00 32.41 N ATOM 1976 CA VAL A 524 10.221 -4.805 -2.245 1.00 4.11 C ATOM 1977 C VAL A 524 11.355 -3.864 -2.652 1.00 12.22 C ATOM 1978 O VAL A 524 11.119 -2.694 -2.951 1.00 10.11 O ATOM 1979 CB VAL A 524 10.068 -4.937 -0.728 1.00 2.22 C ATOM 1980 CG1 VAL A 524 11.431 -4.891 -0.034 1.00 71.51 C ATOM 1981 CG2 VAL A 524 9.135 -3.859 -0.174 1.00 11.12 C ATOM 0 H VAL A 524 10.739 -6.835 -2.179 1.00 32.41 H new ATOM 0 HA VAL A 524 9.292 -4.372 -2.616 1.00 4.11 H new ATOM 0 HB VAL A 524 9.618 -5.908 -0.520 1.00 2.22 H new ATOM 0 HG11 VAL A 524 11.294 -4.987 1.043 1.00 71.51 H new ATOM 0 HG12 VAL A 524 12.051 -5.711 -0.395 1.00 71.51 H new ATOM 0 HG13 VAL A 524 11.920 -3.942 -0.255 1.00 71.51 H new ATOM 0 HG21 VAL A 524 9.044 -3.976 0.906 1.00 11.12 H new ATOM 0 HG22 VAL A 524 9.543 -2.874 -0.399 1.00 11.12 H new ATOM 0 HG23 VAL A 524 8.152 -3.958 -0.634 1.00 11.12 H new ATOM 1991 N ALA A 525 12.563 -4.410 -2.650 1.00 72.25 N ATOM 1992 CA ALA A 525 13.735 -3.633 -3.016 1.00 15.52 C ATOM 1993 C ALA A 525 13.755 -3.431 -4.533 1.00 55.33 C ATOM 1994 O ALA A 525 14.632 -2.747 -5.060 1.00 3.14 O ATOM 1995 CB ALA A 525 14.994 -4.337 -2.505 1.00 54.55 C ATOM 0 H ALA A 525 12.755 -5.380 -2.401 1.00 72.25 H new ATOM 0 HA ALA A 525 13.702 -2.647 -2.553 1.00 15.52 H new ATOM 0 HB1 ALA A 525 15.873 -3.754 -2.779 1.00 54.55 H new ATOM 0 HB2 ALA A 525 14.944 -4.430 -1.420 1.00 54.55 H new ATOM 0 HB3 ALA A 525 15.062 -5.329 -2.951 1.00 54.55 H new ATOM 2001 N ASN A 526 12.778 -4.036 -5.191 1.00 15.33 N ATOM 2002 CA ASN A 526 12.671 -3.931 -6.637 1.00 23.14 C ATOM 2003 C ASN A 526 11.656 -2.843 -6.991 1.00 62.12 C ATOM 2004 O ASN A 526 11.812 -2.147 -7.994 1.00 22.53 O ATOM 2005 CB ASN A 526 12.188 -5.246 -7.250 1.00 24.34 C ATOM 2006 CG ASN A 526 13.363 -6.071 -7.777 1.00 73.44 C ATOM 2007 OD1 ASN A 526 14.432 -5.559 -8.068 1.00 24.44 O ATOM 2008 ND2 ASN A 526 13.108 -7.371 -7.884 1.00 44.11 N ATOM 0 H ASN A 526 12.052 -4.601 -4.750 1.00 15.33 H new ATOM 0 HA ASN A 526 13.658 -3.690 -7.032 1.00 23.14 H new ATOM 0 HB2 ASN A 526 11.642 -5.821 -6.502 1.00 24.34 H new ATOM 0 HB3 ASN A 526 11.492 -5.038 -8.063 1.00 24.34 H new ATOM 0 HD21 ASN A 526 13.829 -8.006 -8.227 1.00 44.11 H new ATOM 0 HD22 ASN A 526 12.191 -7.734 -7.623 1.00 44.11 H new ATOM 2014 N THR A 527 10.639 -2.729 -6.149 1.00 33.05 N ATOM 2015 CA THR A 527 9.599 -1.737 -6.362 1.00 0.33 C ATOM 2016 C THR A 527 9.823 -0.527 -5.455 1.00 22.30 C ATOM 2017 O THR A 527 9.893 0.605 -5.931 1.00 71.11 O ATOM 2018 CB THR A 527 8.246 -2.417 -6.144 1.00 3.31 C ATOM 2019 OG1 THR A 527 7.295 -1.384 -6.384 1.00 52.24 O ATOM 2020 CG2 THR A 527 8.014 -2.804 -4.681 1.00 33.51 C ATOM 0 H THR A 527 10.513 -3.307 -5.318 1.00 33.05 H new ATOM 0 HA THR A 527 9.624 -1.350 -7.380 1.00 0.33 H new ATOM 0 HB THR A 527 8.183 -3.307 -6.770 1.00 3.31 H new ATOM 0 HG1 THR A 527 6.655 -1.350 -5.643 1.00 52.24 H new ATOM 0 HG21 THR A 527 7.040 -3.283 -4.581 1.00 33.51 H new ATOM 0 HG22 THR A 527 8.793 -3.496 -4.360 1.00 33.51 H new ATOM 0 HG23 THR A 527 8.044 -1.909 -4.059 1.00 33.51 H new ATOM 2028 N PHE A 528 9.931 -0.806 -4.165 1.00 62.32 N ATOM 2029 CA PHE A 528 10.148 0.247 -3.186 1.00 13.15 C ATOM 2030 C PHE A 528 11.635 0.581 -3.059 1.00 30.12 C ATOM 2031 O PHE A 528 12.200 0.507 -1.968 1.00 71.04 O ATOM 2032 CB PHE A 528 9.640 -0.280 -1.843 1.00 11.54 C ATOM 2033 CG PHE A 528 8.114 -0.309 -1.723 1.00 13.13 C ATOM 2034 CD1 PHE A 528 7.416 0.855 -1.646 1.00 53.42 C ATOM 2035 CD2 PHE A 528 7.456 -1.500 -1.694 1.00 44.14 C ATOM 2036 CE1 PHE A 528 6.000 0.828 -1.535 1.00 31.20 C ATOM 2037 CE2 PHE A 528 6.041 -1.527 -1.582 1.00 74.32 C ATOM 2038 CZ PHE A 528 5.343 -0.362 -1.506 1.00 34.12 C ATOM 0 H PHE A 528 9.872 -1.746 -3.774 1.00 62.32 H new ATOM 0 HA PHE A 528 9.625 1.153 -3.493 1.00 13.15 H new ATOM 0 HB2 PHE A 528 10.025 -1.288 -1.691 1.00 11.54 H new ATOM 0 HB3 PHE A 528 10.045 0.341 -1.044 1.00 11.54 H new ATOM 0 HD1 PHE A 528 7.938 1.800 -1.669 1.00 53.42 H new ATOM 0 HD2 PHE A 528 8.010 -2.425 -1.756 1.00 44.14 H new ATOM 0 HE1 PHE A 528 5.445 1.753 -1.474 1.00 31.20 H new ATOM 0 HE2 PHE A 528 5.519 -2.472 -1.557 1.00 74.32 H new ATOM 0 HZ PHE A 528 4.266 -0.382 -1.423 1.00 34.12 H new ATOM 2047 N LYS A 529 12.227 0.939 -4.189 1.00 64.55 N ATOM 2048 CA LYS A 529 13.638 1.285 -4.218 1.00 45.21 C ATOM 2049 C LYS A 529 13.841 2.642 -3.540 1.00 13.35 C ATOM 2050 O LYS A 529 12.924 3.459 -3.495 1.00 44.25 O ATOM 2051 CB LYS A 529 14.175 1.226 -5.649 1.00 23.33 C ATOM 2052 CG LYS A 529 14.342 -0.222 -6.112 1.00 32.33 C ATOM 2053 CD LYS A 529 14.587 -0.291 -7.620 1.00 14.23 C ATOM 2054 CE LYS A 529 14.986 -1.704 -8.049 1.00 51.20 C ATOM 2055 NZ LYS A 529 15.979 -1.654 -9.145 1.00 73.33 N ATOM 0 H LYS A 529 11.755 0.997 -5.091 1.00 64.55 H new ATOM 0 HA LYS A 529 14.220 0.556 -3.654 1.00 45.21 H new ATOM 0 HB2 LYS A 529 13.493 1.750 -6.319 1.00 23.33 H new ATOM 0 HB3 LYS A 529 15.134 1.742 -5.703 1.00 23.33 H new ATOM 0 HG2 LYS A 529 15.176 -0.683 -5.583 1.00 32.33 H new ATOM 0 HG3 LYS A 529 13.449 -0.794 -5.859 1.00 32.33 H new ATOM 0 HD2 LYS A 529 13.686 0.013 -8.152 1.00 14.23 H new ATOM 0 HD3 LYS A 529 15.373 0.412 -7.896 1.00 14.23 H new ATOM 0 HE2 LYS A 529 15.402 -2.244 -7.199 1.00 51.20 H new ATOM 0 HE3 LYS A 529 14.103 -2.254 -8.375 1.00 51.20 H new ATOM 0 HZ1 LYS A 529 16.238 -2.622 -9.423 1.00 73.33 H new ATOM 0 HZ2 LYS A 529 15.570 -1.157 -9.962 1.00 73.33 H new ATOM 0 HZ3 LYS A 529 16.828 -1.148 -8.821 1.00 73.33 H new ATOM 2064 N PRO A 530 15.080 2.843 -3.017 1.00 45.23 N ATOM 2065 CA PRO A 530 15.415 4.088 -2.344 1.00 32.41 C ATOM 2066 C PRO A 530 15.617 5.219 -3.354 1.00 64.10 C ATOM 2067 O PRO A 530 15.715 6.385 -2.974 1.00 2.00 O ATOM 2068 CB PRO A 530 16.667 3.775 -1.541 1.00 51.01 C ATOM 2069 CG PRO A 530 17.251 2.513 -2.153 1.00 34.13 C ATOM 2070 CD PRO A 530 16.190 1.897 -3.053 1.00 63.41 C ATOM 0 HA PRO A 530 14.618 4.443 -1.691 1.00 32.41 H new ATOM 0 HB2 PRO A 530 17.379 4.599 -1.591 1.00 51.01 H new ATOM 0 HB3 PRO A 530 16.428 3.624 -0.488 1.00 51.01 H new ATOM 0 HG2 PRO A 530 18.149 2.746 -2.726 1.00 34.13 H new ATOM 0 HG3 PRO A 530 17.544 1.811 -1.373 1.00 34.13 H new ATOM 0 HD2 PRO A 530 16.562 1.761 -4.069 1.00 63.41 H new ATOM 0 HD3 PRO A 530 15.885 0.915 -2.691 1.00 63.41 H new ATOM 2075 N HIS A 531 15.674 4.836 -4.620 1.00 62.44 N ATOM 2076 CA HIS A 531 15.865 5.804 -5.688 1.00 2.31 C ATOM 2077 C HIS A 531 14.513 6.143 -6.320 1.00 42.45 C ATOM 2078 O HIS A 531 14.405 7.097 -7.089 1.00 65.13 O ATOM 2079 CB HIS A 531 16.886 5.295 -6.708 1.00 43.52 C ATOM 2080 CG HIS A 531 16.278 4.504 -7.842 1.00 62.24 C ATOM 2081 ND1 HIS A 531 16.391 3.129 -7.942 1.00 63.40 N ATOM 2082 CD2 HIS A 531 15.552 4.910 -8.923 1.00 44.34 C ATOM 2083 CE1 HIS A 531 15.758 2.735 -9.036 1.00 44.12 C ATOM 2084 NE2 HIS A 531 15.240 3.840 -9.643 1.00 41.41 N ATOM 0 H HIS A 531 15.591 3.868 -4.932 1.00 62.44 H new ATOM 0 HA HIS A 531 16.278 6.726 -5.279 1.00 2.31 H new ATOM 0 HB2 HIS A 531 17.427 6.146 -7.121 1.00 43.52 H new ATOM 0 HB3 HIS A 531 17.618 4.671 -6.194 1.00 43.52 H new ATOM 0 HD1 HIS A 531 16.879 2.521 -7.284 1.00 63.40 H new ATOM 0 HD2 HIS A 531 15.278 5.929 -9.154 1.00 44.34 H new ATOM 0 HE1 HIS A 531 15.668 1.717 -9.386 1.00 44.12 H new ATOM 2091 N ARG A 532 13.517 5.343 -5.971 1.00 34.10 N ATOM 2092 CA ARG A 532 12.176 5.546 -6.495 1.00 32.13 C ATOM 2093 C ARG A 532 11.326 6.322 -5.489 1.00 54.40 C ATOM 2094 O ARG A 532 10.577 7.223 -5.866 1.00 33.12 O ATOM 2095 CB ARG A 532 11.497 4.210 -6.802 1.00 74.31 C ATOM 2096 CG ARG A 532 12.343 3.374 -7.765 1.00 23.15 C ATOM 2097 CD ARG A 532 12.225 3.898 -9.197 1.00 1.01 C ATOM 2098 NE ARG A 532 12.401 2.788 -10.159 1.00 14.34 N ATOM 2099 CZ ARG A 532 12.539 2.956 -11.492 1.00 2.32 C ATOM 2100 NH1 ARG A 532 12.522 4.192 -12.032 1.00 73.51 N ATOM 2101 NH2 ARG A 532 12.690 1.892 -12.258 1.00 24.35 N ATOM 0 H ARG A 532 13.611 4.553 -5.332 1.00 34.10 H new ATOM 0 HA ARG A 532 12.264 6.117 -7.419 1.00 32.13 H new ATOM 0 HB2 ARG A 532 11.340 3.657 -5.876 1.00 74.31 H new ATOM 0 HB3 ARG A 532 10.514 4.389 -7.237 1.00 74.31 H new ATOM 0 HG2 ARG A 532 13.387 3.396 -7.451 1.00 23.15 H new ATOM 0 HG3 ARG A 532 12.021 2.333 -7.727 1.00 23.15 H new ATOM 0 HD2 ARG A 532 11.251 4.365 -9.343 1.00 1.01 H new ATOM 0 HD3 ARG A 532 12.977 4.667 -9.375 1.00 1.01 H new ATOM 0 HE ARG A 532 12.419 1.836 -9.793 1.00 14.34 H new ATOM 0 HH11 ARG A 532 12.404 5.009 -11.433 1.00 73.51 H new ATOM 0 HH12 ARG A 532 12.627 4.310 -13.040 1.00 73.51 H new ATOM 0 HH21 ARG A 532 12.701 0.961 -11.841 1.00 24.35 H new ATOM 0 HH22 ARG A 532 12.796 2.001 -13.267 1.00 24.35 H new ATOM 2111 N LEU A 533 11.467 5.946 -4.226 1.00 73.15 N ATOM 2112 CA LEU A 533 10.721 6.597 -3.162 1.00 32.22 C ATOM 2113 C LEU A 533 10.835 8.114 -3.319 1.00 55.02 C ATOM 2114 O LEU A 533 9.875 8.841 -3.070 1.00 13.11 O ATOM 2115 CB LEU A 533 11.179 6.083 -1.796 1.00 32.22 C ATOM 2116 CG LEU A 533 10.397 4.897 -1.227 1.00 15.22 C ATOM 2117 CD1 LEU A 533 8.889 5.129 -1.344 1.00 73.21 C ATOM 2118 CD2 LEU A 533 10.829 3.587 -1.891 1.00 41.41 C ATOM 0 H LEU A 533 12.087 5.198 -3.916 1.00 73.15 H new ATOM 0 HA LEU A 533 9.662 6.349 -3.232 1.00 32.22 H new ATOM 0 HB2 LEU A 533 12.228 5.798 -1.871 1.00 32.22 H new ATOM 0 HB3 LEU A 533 11.122 6.906 -1.083 1.00 32.22 H new ATOM 0 HG LEU A 533 10.628 4.812 -0.165 1.00 15.22 H new ATOM 0 HD11 LEU A 533 8.356 4.272 -0.933 1.00 73.21 H new ATOM 0 HD12 LEU A 533 8.615 6.027 -0.790 1.00 73.21 H new ATOM 0 HD13 LEU A 533 8.620 5.254 -2.393 1.00 73.21 H new ATOM 0 HD21 LEU A 533 10.258 2.760 -1.469 1.00 41.41 H new ATOM 0 HD22 LEU A 533 10.645 3.645 -2.964 1.00 41.41 H new ATOM 0 HD23 LEU A 533 11.892 3.422 -1.714 1.00 41.41 H new