USER MOD reduce.3.24.130724 H: found=0, std=0, add=714, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 715 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 390 GLN :FLIP amide:sc= -1.22! C(o=-1.8!,f=-1.3!) USER MOD Set 1.2: A 402 GLN :FLIP amide:sc= -0.0632 F(o=-1.8,f=-1.3) USER MOD Single : A 368 ASN :FLIP amide:sc= 0.259 F(o=-1.5,f=0.26) USER MOD Single : A 369 THR OG1 : rot 180:sc= 0.0429 USER MOD Single : A 372 SER OG : rot 180:sc= 0 USER MOD Single : A 373 SER OG : rot 180:sc= 0 USER MOD Single : A 376 TYR OH : rot 78:sc= -1.54! USER MOD Single : A 377 GLN : amide:sc= -0.159 X(o=-0.16,f=-0.16) USER MOD Single : A 384 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 389 SER OG : rot 180:sc= 0 USER MOD Single : A 399 ASN : amide:sc= -0.455 X(o=-0.46,f=0) USER MOD Single : A 401 THR OG1 : rot 180:sc= -0.825 USER MOD Single : A 406 SER OG : rot -43:sc= 1.21 USER MOD Single : A 411 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 416 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 417 THR OG1 : rot 180:sc= 0 USER MOD Single : A 419 SER OG : rot 180:sc= 0 USER MOD Single : A 420 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 421 SER OG : rot 180:sc= 0 USER MOD Single : A 425 ASN : amide:sc= -0.521 X(o=-0.52,f=-0.8) USER MOD Single : A 429 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 430 GLN : amide:sc= -0.0169 K(o=-0.017,f=-1.1) USER MOD Single : A 431 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 434 GLN : amide:sc= -1.82 K(o=-1.8,f=-6.1!) USER MOD Single : A 444 TYR OH : rot 180:sc= -0.132 USER MOD Single : A 445 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 451 SER OG : rot 180:sc= 0.0191 USER MOD Single : A 453 ASN : amide:sc= 0.203 X(o=0.2,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 368 -6.985 13.171 -13.466 1.00 0.00 N ATOM 2 CA ASN A 368 -8.167 13.049 -12.572 1.00 0.00 C ATOM 3 C ASN A 368 -8.427 11.594 -12.195 1.00 0.00 C ATOM 4 O ASN A 368 -9.305 10.943 -12.760 1.00 0.00 O ATOM 5 CB ASN A 368 -9.383 13.635 -13.289 1.00 0.00 C ATOM 6 CG ASN A 368 -9.641 12.971 -14.627 1.00 0.00 C ATOM 7 OD1 ASN A 368 -10.913 12.831 -14.984 1.00 0.00 O flip ATOM 8 ND2 ASN A 368 -8.709 12.589 -15.333 1.00 0.00 N flip ATOM 0 HA ASN A 368 -7.975 13.597 -11.649 1.00 0.00 H new ATOM 0 HB2 ASN A 368 -10.263 13.524 -12.656 1.00 0.00 H new ATOM 0 HB3 ASN A 368 -9.232 14.704 -13.440 1.00 0.00 H new ATOM 0 HD21 ASN A 368 -7.747 12.716 -15.020 1.00 0.00 H new ATOM 0 HD22 ASN A 368 -8.899 12.145 -16.231 1.00 0.00 H new ATOM 15 N THR A 369 -7.656 11.089 -11.237 1.00 0.00 N ATOM 16 CA THR A 369 -7.802 9.711 -10.785 1.00 0.00 C ATOM 17 C THR A 369 -8.747 9.620 -9.592 1.00 0.00 C ATOM 18 O THR A 369 -8.340 9.826 -8.448 1.00 0.00 O ATOM 19 CB THR A 369 -6.442 9.102 -10.396 1.00 0.00 C ATOM 20 OG1 THR A 369 -5.594 10.112 -9.834 1.00 0.00 O ATOM 21 CG2 THR A 369 -5.762 8.479 -11.606 1.00 0.00 C ATOM 0 H THR A 369 -6.924 11.614 -10.759 1.00 0.00 H new ATOM 0 HA THR A 369 -8.220 9.147 -11.619 1.00 0.00 H new ATOM 0 HB THR A 369 -6.618 8.322 -9.655 1.00 0.00 H new ATOM 0 HG1 THR A 369 -4.732 9.716 -9.588 1.00 0.00 H new ATOM 0 HG21 THR A 369 -4.803 8.055 -11.307 1.00 0.00 H new ATOM 0 HG22 THR A 369 -6.395 7.691 -12.014 1.00 0.00 H new ATOM 0 HG23 THR A 369 -5.599 9.243 -12.366 1.00 0.00 H new ATOM 29 N GLU A 370 -10.010 9.311 -9.867 1.00 0.00 N ATOM 30 CA GLU A 370 -11.014 9.193 -8.816 1.00 0.00 C ATOM 31 C GLU A 370 -10.753 7.966 -7.948 1.00 0.00 C ATOM 32 O GLU A 370 -10.974 6.833 -8.374 1.00 0.00 O ATOM 33 CB GLU A 370 -12.414 9.112 -9.426 1.00 0.00 C ATOM 34 CG GLU A 370 -12.563 8.004 -10.457 1.00 0.00 C ATOM 35 CD GLU A 370 -13.772 7.126 -10.200 1.00 0.00 C ATOM 36 OE1 GLU A 370 -14.710 7.592 -9.518 1.00 0.00 O ATOM 37 OE2 GLU A 370 -13.782 5.973 -10.680 1.00 0.00 O ATOM 0 H GLU A 370 -10.362 9.138 -10.808 1.00 0.00 H new ATOM 0 HA GLU A 370 -10.950 10.081 -8.187 1.00 0.00 H new ATOM 0 HB2 GLU A 370 -13.141 8.956 -8.629 1.00 0.00 H new ATOM 0 HB3 GLU A 370 -12.654 10.067 -9.893 1.00 0.00 H new ATOM 0 HG2 GLU A 370 -12.644 8.446 -11.450 1.00 0.00 H new ATOM 0 HG3 GLU A 370 -11.664 7.388 -10.455 1.00 0.00 H new ATOM 44 N VAL A 371 -10.284 8.201 -6.726 1.00 0.00 N ATOM 45 CA VAL A 371 -9.995 7.115 -5.797 1.00 0.00 C ATOM 46 C VAL A 371 -11.267 6.632 -5.108 1.00 0.00 C ATOM 47 O VAL A 371 -11.962 7.407 -4.451 1.00 0.00 O ATOM 48 CB VAL A 371 -8.976 7.547 -4.726 1.00 0.00 C ATOM 49 CG1 VAL A 371 -8.557 6.359 -3.874 1.00 0.00 C ATOM 50 CG2 VAL A 371 -7.763 8.199 -5.372 1.00 0.00 C ATOM 0 H VAL A 371 -10.096 9.133 -6.357 1.00 0.00 H new ATOM 0 HA VAL A 371 -9.569 6.301 -6.383 1.00 0.00 H new ATOM 0 HB VAL A 371 -9.453 8.281 -4.077 1.00 0.00 H new ATOM 0 HG11 VAL A 371 -7.837 6.685 -3.124 1.00 0.00 H new ATOM 0 HG12 VAL A 371 -9.433 5.940 -3.379 1.00 0.00 H new ATOM 0 HG13 VAL A 371 -8.101 5.599 -4.508 1.00 0.00 H new ATOM 0 HG21 VAL A 371 -7.055 8.497 -4.599 1.00 0.00 H new ATOM 0 HG22 VAL A 371 -7.285 7.489 -6.047 1.00 0.00 H new ATOM 0 HG23 VAL A 371 -8.078 9.078 -5.933 1.00 0.00 H new ATOM 60 N SER A 372 -11.564 5.346 -5.260 1.00 0.00 N ATOM 61 CA SER A 372 -12.754 4.760 -4.653 1.00 0.00 C ATOM 62 C SER A 372 -12.401 4.022 -3.365 1.00 0.00 C ATOM 63 O SER A 372 -11.227 3.807 -3.064 1.00 0.00 O ATOM 64 CB SER A 372 -13.434 3.802 -5.633 1.00 0.00 C ATOM 65 OG SER A 372 -13.613 4.410 -6.900 1.00 0.00 O ATOM 0 H SER A 372 -10.998 4.690 -5.798 1.00 0.00 H new ATOM 0 HA SER A 372 -13.443 5.569 -4.410 1.00 0.00 H new ATOM 0 HB2 SER A 372 -12.832 2.900 -5.741 1.00 0.00 H new ATOM 0 HB3 SER A 372 -14.401 3.494 -5.234 1.00 0.00 H new ATOM 0 HG SER A 372 -14.048 3.777 -7.508 1.00 0.00 H new ATOM 71 N SER A 373 -13.424 3.636 -2.612 1.00 0.00 N ATOM 72 CA SER A 373 -13.224 2.920 -1.357 1.00 0.00 C ATOM 73 C SER A 373 -12.562 1.566 -1.596 1.00 0.00 C ATOM 74 O SER A 373 -11.956 0.993 -0.690 1.00 0.00 O ATOM 75 CB SER A 373 -14.560 2.727 -0.637 1.00 0.00 C ATOM 76 OG SER A 373 -15.467 1.986 -1.435 1.00 0.00 O ATOM 0 H SER A 373 -14.401 3.807 -2.848 1.00 0.00 H new ATOM 0 HA SER A 373 -12.563 3.519 -0.731 1.00 0.00 H new ATOM 0 HB2 SER A 373 -14.396 2.210 0.308 1.00 0.00 H new ATOM 0 HB3 SER A 373 -14.991 3.699 -0.398 1.00 0.00 H new ATOM 0 HG SER A 373 -16.312 1.875 -0.952 1.00 0.00 H new ATOM 82 N GLU A 374 -12.680 1.056 -2.821 1.00 0.00 N ATOM 83 CA GLU A 374 -12.092 -0.231 -3.176 1.00 0.00 C ATOM 84 C GLU A 374 -10.613 -0.286 -2.798 1.00 0.00 C ATOM 85 O GLU A 374 -10.066 -1.360 -2.544 1.00 0.00 O ATOM 86 CB GLU A 374 -12.254 -0.494 -4.674 1.00 0.00 C ATOM 87 CG GLU A 374 -13.702 -0.489 -5.139 1.00 0.00 C ATOM 88 CD GLU A 374 -14.379 -1.833 -4.945 1.00 0.00 C ATOM 89 OE1 GLU A 374 -14.071 -2.514 -3.946 1.00 0.00 O ATOM 90 OE2 GLU A 374 -15.218 -2.203 -5.795 1.00 0.00 O ATOM 0 H GLU A 374 -13.178 1.516 -3.583 1.00 0.00 H new ATOM 0 HA GLU A 374 -12.618 -1.004 -2.616 1.00 0.00 H new ATOM 0 HB2 GLU A 374 -11.700 0.263 -5.229 1.00 0.00 H new ATOM 0 HB3 GLU A 374 -11.807 -1.458 -4.916 1.00 0.00 H new ATOM 0 HG2 GLU A 374 -14.254 0.275 -4.591 1.00 0.00 H new ATOM 0 HG3 GLU A 374 -13.741 -0.215 -6.193 1.00 0.00 H new ATOM 97 N ILE A 375 -9.971 0.878 -2.764 1.00 0.00 N ATOM 98 CA ILE A 375 -8.557 0.961 -2.416 1.00 0.00 C ATOM 99 C ILE A 375 -8.294 0.370 -1.033 1.00 0.00 C ATOM 100 O ILE A 375 -7.343 -0.388 -0.842 1.00 0.00 O ATOM 101 CB ILE A 375 -8.056 2.419 -2.450 1.00 0.00 C ATOM 102 CG1 ILE A 375 -6.550 2.475 -2.177 1.00 0.00 C ATOM 103 CG2 ILE A 375 -8.815 3.266 -1.439 1.00 0.00 C ATOM 104 CD1 ILE A 375 -5.726 1.685 -3.169 1.00 0.00 C ATOM 0 H ILE A 375 -10.407 1.776 -2.973 1.00 0.00 H new ATOM 0 HA ILE A 375 -8.012 0.382 -3.161 1.00 0.00 H new ATOM 0 HB ILE A 375 -8.240 2.824 -3.445 1.00 0.00 H new ATOM 0 HG12 ILE A 375 -6.224 3.515 -2.193 1.00 0.00 H new ATOM 0 HG13 ILE A 375 -6.357 2.096 -1.173 1.00 0.00 H new ATOM 0 HG21 ILE A 375 -8.449 4.292 -1.476 1.00 0.00 H new ATOM 0 HG22 ILE A 375 -9.878 3.251 -1.677 1.00 0.00 H new ATOM 0 HG23 ILE A 375 -8.662 2.862 -0.438 1.00 0.00 H new ATOM 0 HD11 ILE A 375 -4.670 1.770 -2.914 1.00 0.00 H new ATOM 0 HD12 ILE A 375 -6.024 0.637 -3.137 1.00 0.00 H new ATOM 0 HD13 ILE A 375 -5.890 2.078 -4.172 1.00 0.00 H new ATOM 116 N TYR A 376 -9.145 0.720 -0.074 1.00 0.00 N ATOM 117 CA TYR A 376 -9.005 0.223 1.291 1.00 0.00 C ATOM 118 C TYR A 376 -9.262 -1.279 1.351 1.00 0.00 C ATOM 119 O TYR A 376 -8.533 -2.017 2.014 1.00 0.00 O ATOM 120 CB TYR A 376 -9.972 0.955 2.223 1.00 0.00 C ATOM 121 CG TYR A 376 -9.632 2.414 2.429 1.00 0.00 C ATOM 122 CD1 TYR A 376 -10.128 3.389 1.573 1.00 0.00 C ATOM 123 CD2 TYR A 376 -8.816 2.816 3.478 1.00 0.00 C ATOM 124 CE1 TYR A 376 -9.820 4.724 1.757 1.00 0.00 C ATOM 125 CE2 TYR A 376 -8.503 4.148 3.670 1.00 0.00 C ATOM 126 CZ TYR A 376 -9.008 5.098 2.807 1.00 0.00 C ATOM 127 OH TYR A 376 -8.700 6.426 2.992 1.00 0.00 O ATOM 0 H TYR A 376 -9.938 1.345 -0.216 1.00 0.00 H new ATOM 0 HA TYR A 376 -7.982 0.412 1.618 1.00 0.00 H new ATOM 0 HB2 TYR A 376 -10.981 0.880 1.817 1.00 0.00 H new ATOM 0 HB3 TYR A 376 -9.980 0.453 3.190 1.00 0.00 H new ATOM 0 HD1 TYR A 376 -10.765 3.099 0.750 1.00 0.00 H new ATOM 0 HD2 TYR A 376 -8.419 2.075 4.156 1.00 0.00 H new ATOM 0 HE1 TYR A 376 -10.213 5.470 1.082 1.00 0.00 H new ATOM 0 HE2 TYR A 376 -7.867 4.444 4.491 1.00 0.00 H new ATOM 0 HH TYR A 376 -9.461 6.884 3.407 1.00 0.00 H new ATOM 137 N GLN A 377 -10.303 -1.724 0.657 1.00 0.00 N ATOM 138 CA GLN A 377 -10.659 -3.138 0.632 1.00 0.00 C ATOM 139 C GLN A 377 -9.598 -3.955 -0.100 1.00 0.00 C ATOM 140 O GLN A 377 -9.381 -5.127 0.208 1.00 0.00 O ATOM 141 CB GLN A 377 -12.020 -3.331 -0.039 1.00 0.00 C ATOM 142 CG GLN A 377 -12.819 -4.492 0.531 1.00 0.00 C ATOM 143 CD GLN A 377 -13.222 -4.269 1.976 1.00 0.00 C ATOM 144 OE1 GLN A 377 -13.962 -3.336 2.290 1.00 0.00 O ATOM 145 NE2 GLN A 377 -12.736 -5.127 2.866 1.00 0.00 N ATOM 0 H GLN A 377 -10.916 -1.125 0.103 1.00 0.00 H new ATOM 0 HA GLN A 377 -10.716 -3.490 1.662 1.00 0.00 H new ATOM 0 HB2 GLN A 377 -12.601 -2.415 0.066 1.00 0.00 H new ATOM 0 HB3 GLN A 377 -11.870 -3.493 -1.106 1.00 0.00 H new ATOM 0 HG2 GLN A 377 -13.714 -4.643 -0.073 1.00 0.00 H new ATOM 0 HG3 GLN A 377 -12.228 -5.405 0.459 1.00 0.00 H new ATOM 0 HE21 GLN A 377 -12.126 -5.886 2.562 1.00 0.00 H new ATOM 0 HE22 GLN A 377 -12.973 -5.027 3.853 1.00 0.00 H new ATOM 154 N TRP A 378 -8.941 -3.330 -1.071 1.00 0.00 N ATOM 155 CA TRP A 378 -7.903 -4.001 -1.846 1.00 0.00 C ATOM 156 C TRP A 378 -6.682 -4.295 -0.982 1.00 0.00 C ATOM 157 O TRP A 378 -6.094 -5.374 -1.068 1.00 0.00 O ATOM 158 CB TRP A 378 -7.497 -3.142 -3.046 1.00 0.00 C ATOM 159 CG TRP A 378 -8.534 -3.102 -4.129 1.00 0.00 C ATOM 160 CD1 TRP A 378 -9.523 -4.018 -4.353 1.00 0.00 C ATOM 161 CD2 TRP A 378 -8.682 -2.096 -5.136 1.00 0.00 C ATOM 162 NE1 TRP A 378 -10.277 -3.640 -5.438 1.00 0.00 N ATOM 163 CE2 TRP A 378 -9.780 -2.464 -5.935 1.00 0.00 C ATOM 164 CE3 TRP A 378 -7.994 -0.918 -5.439 1.00 0.00 C ATOM 165 CZ2 TRP A 378 -10.204 -1.696 -7.018 1.00 0.00 C ATOM 166 CZ3 TRP A 378 -8.416 -0.157 -6.513 1.00 0.00 C ATOM 167 CH2 TRP A 378 -9.512 -0.548 -7.291 1.00 0.00 C ATOM 0 H TRP A 378 -9.108 -2.361 -1.340 1.00 0.00 H new ATOM 0 HA TRP A 378 -8.308 -4.947 -2.205 1.00 0.00 H new ATOM 0 HB2 TRP A 378 -7.299 -2.126 -2.705 1.00 0.00 H new ATOM 0 HB3 TRP A 378 -6.565 -3.527 -3.460 1.00 0.00 H new ATOM 0 HD1 TRP A 378 -9.688 -4.908 -3.764 1.00 0.00 H new ATOM 0 HE1 TRP A 378 -11.076 -4.152 -5.812 1.00 0.00 H new ATOM 0 HE3 TRP A 378 -7.147 -0.608 -4.844 1.00 0.00 H new ATOM 0 HZ2 TRP A 378 -11.049 -1.996 -7.620 1.00 0.00 H new ATOM 0 HZ3 TRP A 378 -7.891 0.755 -6.756 1.00 0.00 H new ATOM 0 HH2 TRP A 378 -9.817 0.069 -8.123 1.00 0.00 H new ATOM 178 N VAL A 379 -6.304 -3.329 -0.151 1.00 0.00 N ATOM 179 CA VAL A 379 -5.151 -3.485 0.729 1.00 0.00 C ATOM 180 C VAL A 379 -5.333 -4.671 1.670 1.00 0.00 C ATOM 181 O VAL A 379 -4.410 -5.459 1.878 1.00 0.00 O ATOM 182 CB VAL A 379 -4.906 -2.216 1.565 1.00 0.00 C ATOM 183 CG1 VAL A 379 -3.590 -2.319 2.321 1.00 0.00 C ATOM 184 CG2 VAL A 379 -4.922 -0.979 0.676 1.00 0.00 C ATOM 0 H VAL A 379 -6.779 -2.430 -0.068 1.00 0.00 H new ATOM 0 HA VAL A 379 -4.287 -3.662 0.088 1.00 0.00 H new ATOM 0 HB VAL A 379 -5.711 -2.123 2.294 1.00 0.00 H new ATOM 0 HG11 VAL A 379 -3.435 -1.413 2.906 1.00 0.00 H new ATOM 0 HG12 VAL A 379 -3.620 -3.181 2.988 1.00 0.00 H new ATOM 0 HG13 VAL A 379 -2.771 -2.438 1.611 1.00 0.00 H new ATOM 0 HG21 VAL A 379 -4.747 -0.092 1.284 1.00 0.00 H new ATOM 0 HG22 VAL A 379 -4.139 -1.062 -0.078 1.00 0.00 H new ATOM 0 HG23 VAL A 379 -5.891 -0.897 0.184 1.00 0.00 H new ATOM 194 N ARG A 380 -6.528 -4.792 2.239 1.00 0.00 N ATOM 195 CA ARG A 380 -6.831 -5.882 3.159 1.00 0.00 C ATOM 196 C ARG A 380 -6.680 -7.234 2.470 1.00 0.00 C ATOM 197 O ARG A 380 -5.912 -8.087 2.919 1.00 0.00 O ATOM 198 CB ARG A 380 -8.249 -5.732 3.711 1.00 0.00 C ATOM 199 CG ARG A 380 -8.489 -4.410 4.422 1.00 0.00 C ATOM 200 CD ARG A 380 -9.805 -4.420 5.185 1.00 0.00 C ATOM 201 NE ARG A 380 -9.788 -5.369 6.294 1.00 0.00 N ATOM 202 CZ ARG A 380 -10.886 -5.833 6.889 1.00 0.00 C ATOM 203 NH1 ARG A 380 -12.085 -5.435 6.484 1.00 0.00 N ATOM 204 NH2 ARG A 380 -10.782 -6.695 7.891 1.00 0.00 N ATOM 0 H ARG A 380 -7.303 -4.148 2.079 1.00 0.00 H new ATOM 0 HA ARG A 380 -6.121 -5.835 3.985 1.00 0.00 H new ATOM 0 HB2 ARG A 380 -8.961 -5.829 2.891 1.00 0.00 H new ATOM 0 HB3 ARG A 380 -8.448 -6.549 4.404 1.00 0.00 H new ATOM 0 HG2 ARG A 380 -7.669 -4.212 5.112 1.00 0.00 H new ATOM 0 HG3 ARG A 380 -8.495 -3.599 3.693 1.00 0.00 H new ATOM 0 HD2 ARG A 380 -10.010 -3.420 5.567 1.00 0.00 H new ATOM 0 HD3 ARG A 380 -10.617 -4.674 4.504 1.00 0.00 H new ATOM 0 HE ARG A 380 -8.883 -5.696 6.633 1.00 0.00 H new ATOM 0 HH11 ARG A 380 -12.169 -4.771 5.714 1.00 0.00 H new ATOM 0 HH12 ARG A 380 -12.923 -5.793 6.942 1.00 0.00 H new ATOM 0 HH21 ARG A 380 -9.862 -7.002 8.206 1.00 0.00 H new ATOM 0 HH22 ARG A 380 -11.622 -7.051 8.347 1.00 0.00 H new ATOM 218 N ASP A 381 -7.415 -7.423 1.381 1.00 0.00 N ATOM 219 CA ASP A 381 -7.364 -8.673 0.631 1.00 0.00 C ATOM 220 C ASP A 381 -5.965 -8.916 0.073 1.00 0.00 C ATOM 221 O ASP A 381 -5.425 -10.016 0.185 1.00 0.00 O ATOM 222 CB ASP A 381 -8.382 -8.649 -0.510 1.00 0.00 C ATOM 223 CG ASP A 381 -9.686 -9.330 -0.137 1.00 0.00 C ATOM 224 OD1 ASP A 381 -10.518 -8.687 0.539 1.00 0.00 O ATOM 225 OD2 ASP A 381 -9.873 -10.503 -0.518 1.00 0.00 O ATOM 0 H ASP A 381 -8.054 -6.727 0.997 1.00 0.00 H new ATOM 0 HA ASP A 381 -7.611 -9.487 1.313 1.00 0.00 H new ATOM 0 HB2 ASP A 381 -8.583 -7.616 -0.792 1.00 0.00 H new ATOM 0 HB3 ASP A 381 -7.955 -9.141 -1.384 1.00 0.00 H new ATOM 230 N GLU A 382 -5.382 -7.881 -0.525 1.00 0.00 N ATOM 231 CA GLU A 382 -4.045 -7.982 -1.099 1.00 0.00 C ATOM 232 C GLU A 382 -3.029 -8.419 -0.048 1.00 0.00 C ATOM 233 O GLU A 382 -2.067 -9.121 -0.355 1.00 0.00 O ATOM 234 CB GLU A 382 -3.626 -6.642 -1.706 1.00 0.00 C ATOM 235 CG GLU A 382 -2.256 -6.674 -2.363 1.00 0.00 C ATOM 236 CD GLU A 382 -2.284 -7.313 -3.738 1.00 0.00 C ATOM 237 OE1 GLU A 382 -2.281 -8.560 -3.813 1.00 0.00 O ATOM 238 OE2 GLU A 382 -2.309 -6.566 -4.739 1.00 0.00 O ATOM 0 H GLU A 382 -5.815 -6.963 -0.624 1.00 0.00 H new ATOM 0 HA GLU A 382 -4.072 -8.737 -1.885 1.00 0.00 H new ATOM 0 HB2 GLU A 382 -4.367 -6.340 -2.446 1.00 0.00 H new ATOM 0 HB3 GLU A 382 -3.627 -5.882 -0.924 1.00 0.00 H new ATOM 0 HG2 GLU A 382 -1.873 -5.657 -2.447 1.00 0.00 H new ATOM 0 HG3 GLU A 382 -1.564 -7.223 -1.725 1.00 0.00 H new ATOM 245 N LEU A 383 -3.249 -7.994 1.191 1.00 0.00 N ATOM 246 CA LEU A 383 -2.352 -8.339 2.287 1.00 0.00 C ATOM 247 C LEU A 383 -2.484 -9.814 2.654 1.00 0.00 C ATOM 248 O LEU A 383 -1.522 -10.441 3.102 1.00 0.00 O ATOM 249 CB LEU A 383 -2.649 -7.469 3.510 1.00 0.00 C ATOM 250 CG LEU A 383 -1.957 -6.105 3.517 1.00 0.00 C ATOM 251 CD1 LEU A 383 -2.406 -5.285 4.716 1.00 0.00 C ATOM 252 CD2 LEU A 383 -0.446 -6.275 3.520 1.00 0.00 C ATOM 0 H LEU A 383 -4.041 -7.410 1.461 1.00 0.00 H new ATOM 0 HA LEU A 383 -1.329 -8.155 1.958 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -3.726 -7.313 3.573 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -2.352 -8.015 4.406 1.00 0.00 H new ATOM 0 HG LEU A 383 -2.241 -5.570 2.611 1.00 0.00 H new ATOM 0 HD11 LEU A 383 -1.903 -4.318 4.704 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -3.485 -5.134 4.670 1.00 0.00 H new ATOM 0 HD13 LEU A 383 -2.153 -5.815 5.634 1.00 0.00 H new ATOM 0 HD21 LEU A 383 0.030 -5.295 3.525 1.00 0.00 H new ATOM 0 HD22 LEU A 383 -0.144 -6.830 4.408 1.00 0.00 H new ATOM 0 HD23 LEU A 383 -0.140 -6.823 2.629 1.00 0.00 H new ATOM 264 N LYS A 384 -3.679 -10.363 2.463 1.00 0.00 N ATOM 265 CA LYS A 384 -3.935 -11.764 2.774 1.00 0.00 C ATOM 266 C LYS A 384 -3.507 -12.666 1.620 1.00 0.00 C ATOM 267 O LYS A 384 -3.032 -13.781 1.834 1.00 0.00 O ATOM 268 CB LYS A 384 -5.418 -11.977 3.081 1.00 0.00 C ATOM 269 CG LYS A 384 -5.670 -12.937 4.234 1.00 0.00 C ATOM 270 CD LYS A 384 -6.880 -13.819 3.970 1.00 0.00 C ATOM 271 CE LYS A 384 -6.469 -15.202 3.487 1.00 0.00 C ATOM 272 NZ LYS A 384 -7.346 -16.268 4.042 1.00 0.00 N ATOM 0 H LYS A 384 -4.485 -9.859 2.094 1.00 0.00 H new ATOM 0 HA LYS A 384 -3.348 -12.028 3.653 1.00 0.00 H new ATOM 0 HB2 LYS A 384 -5.874 -11.015 3.314 1.00 0.00 H new ATOM 0 HB3 LYS A 384 -5.914 -12.357 2.188 1.00 0.00 H new ATOM 0 HG2 LYS A 384 -4.790 -13.561 4.388 1.00 0.00 H new ATOM 0 HG3 LYS A 384 -5.824 -12.371 5.153 1.00 0.00 H new ATOM 0 HD2 LYS A 384 -7.470 -13.912 4.882 1.00 0.00 H new ATOM 0 HD3 LYS A 384 -7.519 -13.347 3.224 1.00 0.00 H new ATOM 0 HE2 LYS A 384 -6.506 -15.232 2.398 1.00 0.00 H new ATOM 0 HE3 LYS A 384 -5.436 -15.395 3.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 384 -7.032 -17.194 3.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 384 -7.291 -16.257 5.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 384 -8.328 -16.099 3.745 1.00 0.00 H new ATOM 286 N ARG A 385 -3.679 -12.174 0.398 1.00 0.00 N ATOM 287 CA ARG A 385 -3.311 -12.935 -0.792 1.00 0.00 C ATOM 288 C ARG A 385 -1.801 -12.920 -1.001 1.00 0.00 C ATOM 289 O ARG A 385 -1.226 -13.878 -1.520 1.00 0.00 O ATOM 290 CB ARG A 385 -4.014 -12.367 -2.024 1.00 0.00 C ATOM 291 CG ARG A 385 -5.532 -12.410 -1.934 1.00 0.00 C ATOM 292 CD ARG A 385 -6.175 -12.392 -3.312 1.00 0.00 C ATOM 293 NE ARG A 385 -6.914 -13.621 -3.588 1.00 0.00 N ATOM 294 CZ ARG A 385 -7.849 -13.729 -4.531 1.00 0.00 C ATOM 295 NH1 ARG A 385 -8.161 -12.686 -5.288 1.00 0.00 N ATOM 296 NH2 ARG A 385 -8.472 -14.885 -4.716 1.00 0.00 N ATOM 0 H ARG A 385 -4.071 -11.252 0.205 1.00 0.00 H new ATOM 0 HA ARG A 385 -3.629 -13.967 -0.646 1.00 0.00 H new ATOM 0 HB2 ARG A 385 -3.696 -11.335 -2.169 1.00 0.00 H new ATOM 0 HB3 ARG A 385 -3.695 -12.926 -2.904 1.00 0.00 H new ATOM 0 HG2 ARG A 385 -5.840 -13.309 -1.400 1.00 0.00 H new ATOM 0 HG3 ARG A 385 -5.887 -11.558 -1.355 1.00 0.00 H new ATOM 0 HD2 ARG A 385 -6.850 -11.539 -3.386 1.00 0.00 H new ATOM 0 HD3 ARG A 385 -5.404 -12.255 -4.070 1.00 0.00 H new ATOM 0 HE ARG A 385 -6.702 -14.445 -3.026 1.00 0.00 H new ATOM 0 HH11 ARG A 385 -7.684 -11.795 -5.150 1.00 0.00 H new ATOM 0 HH12 ARG A 385 -8.878 -12.775 -6.008 1.00 0.00 H new ATOM 0 HH21 ARG A 385 -8.235 -15.690 -4.137 1.00 0.00 H new ATOM 0 HH22 ARG A 385 -9.188 -14.969 -5.438 1.00 0.00 H new ATOM 310 N ALA A 386 -1.163 -11.827 -0.598 1.00 0.00 N ATOM 311 CA ALA A 386 0.281 -11.686 -0.742 1.00 0.00 C ATOM 312 C ALA A 386 1.017 -12.380 0.399 1.00 0.00 C ATOM 313 O ALA A 386 1.999 -13.087 0.178 1.00 0.00 O ATOM 314 CB ALA A 386 0.664 -10.216 -0.803 1.00 0.00 C ATOM 0 H ALA A 386 -1.624 -11.025 -0.168 1.00 0.00 H new ATOM 0 HA ALA A 386 0.577 -12.166 -1.675 1.00 0.00 H new ATOM 0 HB1 ALA A 386 1.745 -10.126 -0.911 1.00 0.00 H new ATOM 0 HB2 ALA A 386 0.174 -9.747 -1.657 1.00 0.00 H new ATOM 0 HB3 ALA A 386 0.348 -9.719 0.114 1.00 0.00 H new ATOM 320 N GLY A 387 0.536 -12.170 1.621 1.00 0.00 N ATOM 321 CA GLY A 387 1.162 -12.782 2.778 1.00 0.00 C ATOM 322 C GLY A 387 2.479 -12.122 3.141 1.00 0.00 C ATOM 323 O GLY A 387 3.535 -12.751 3.076 1.00 0.00 O ATOM 0 H GLY A 387 -0.275 -11.588 1.830 1.00 0.00 H new ATOM 0 HA2 GLY A 387 0.483 -12.723 3.629 1.00 0.00 H new ATOM 0 HA3 GLY A 387 1.332 -13.840 2.578 1.00 0.00 H new ATOM 327 N ILE A 388 2.416 -10.852 3.524 1.00 0.00 N ATOM 328 CA ILE A 388 3.611 -10.106 3.898 1.00 0.00 C ATOM 329 C ILE A 388 3.348 -9.220 5.112 1.00 0.00 C ATOM 330 O ILE A 388 2.199 -9.012 5.504 1.00 0.00 O ATOM 331 CB ILE A 388 4.114 -9.230 2.736 1.00 0.00 C ATOM 332 CG1 ILE A 388 3.020 -8.259 2.288 1.00 0.00 C ATOM 333 CG2 ILE A 388 4.566 -10.101 1.573 1.00 0.00 C ATOM 334 CD1 ILE A 388 3.513 -7.186 1.344 1.00 0.00 C ATOM 0 H ILE A 388 1.549 -10.317 3.584 1.00 0.00 H new ATOM 0 HA ILE A 388 4.377 -10.840 4.146 1.00 0.00 H new ATOM 0 HB ILE A 388 4.968 -8.649 3.083 1.00 0.00 H new ATOM 0 HG12 ILE A 388 2.224 -8.822 1.801 1.00 0.00 H new ATOM 0 HG13 ILE A 388 2.584 -7.785 3.167 1.00 0.00 H new ATOM 0 HG21 ILE A 388 4.919 -9.467 0.759 1.00 0.00 H new ATOM 0 HG22 ILE A 388 5.374 -10.755 1.901 1.00 0.00 H new ATOM 0 HG23 ILE A 388 3.729 -10.706 1.225 1.00 0.00 H new ATOM 0 HD11 ILE A 388 2.684 -6.535 1.069 1.00 0.00 H new ATOM 0 HD12 ILE A 388 4.289 -6.598 1.835 1.00 0.00 H new ATOM 0 HD13 ILE A 388 3.923 -7.651 0.447 1.00 0.00 H new ATOM 346 N SER A 389 4.420 -8.699 5.701 1.00 0.00 N ATOM 347 CA SER A 389 4.304 -7.834 6.870 1.00 0.00 C ATOM 348 C SER A 389 3.923 -6.416 6.463 1.00 0.00 C ATOM 349 O SER A 389 4.247 -5.965 5.364 1.00 0.00 O ATOM 350 CB SER A 389 5.622 -7.817 7.647 1.00 0.00 C ATOM 351 OG SER A 389 5.389 -7.797 9.045 1.00 0.00 O ATOM 0 H SER A 389 5.377 -8.860 5.389 1.00 0.00 H new ATOM 0 HA SER A 389 3.516 -8.232 7.509 1.00 0.00 H new ATOM 0 HB2 SER A 389 6.213 -8.695 7.386 1.00 0.00 H new ATOM 0 HB3 SER A 389 6.206 -6.943 7.360 1.00 0.00 H new ATOM 0 HG SER A 389 6.246 -7.788 9.519 1.00 0.00 H new ATOM 357 N GLN A 390 3.232 -5.714 7.356 1.00 0.00 N ATOM 358 CA GLN A 390 2.805 -4.346 7.091 1.00 0.00 C ATOM 359 C GLN A 390 4.008 -3.441 6.840 1.00 0.00 C ATOM 360 O GLN A 390 3.925 -2.482 6.072 1.00 0.00 O ATOM 361 CB GLN A 390 1.985 -3.809 8.265 1.00 0.00 C ATOM 362 CG GLN A 390 0.983 -2.738 7.868 1.00 0.00 C ATOM 363 CD GLN A 390 0.797 -1.685 8.944 1.00 0.00 C ATOM 364 OE1 GLN A 390 -0.431 -1.553 9.436 1.00 0.00 O flip ATOM 365 NE2 GLN A 390 1.744 -1.000 9.328 1.00 0.00 N flip ATOM 0 H GLN A 390 2.956 -6.071 8.271 1.00 0.00 H new ATOM 0 HA GLN A 390 2.183 -4.352 6.196 1.00 0.00 H new ATOM 0 HB2 GLN A 390 1.453 -4.637 8.734 1.00 0.00 H new ATOM 0 HB3 GLN A 390 2.663 -3.400 9.014 1.00 0.00 H new ATOM 0 HG2 GLN A 390 1.316 -2.257 6.948 1.00 0.00 H new ATOM 0 HG3 GLN A 390 0.022 -3.206 7.653 1.00 0.00 H new ATOM 0 HE21 GLN A 390 2.670 -1.136 8.922 1.00 0.00 H new ATOM 0 HE22 GLN A 390 1.604 -0.296 10.053 1.00 0.00 H new ATOM 374 N ALA A 391 5.123 -3.754 7.491 1.00 0.00 N ATOM 375 CA ALA A 391 6.342 -2.970 7.337 1.00 0.00 C ATOM 376 C ALA A 391 6.832 -2.993 5.892 1.00 0.00 C ATOM 377 O ALA A 391 7.294 -1.979 5.367 1.00 0.00 O ATOM 378 CB ALA A 391 7.424 -3.490 8.271 1.00 0.00 C ATOM 0 H ALA A 391 5.207 -4.545 8.130 1.00 0.00 H new ATOM 0 HA ALA A 391 6.116 -1.937 7.599 1.00 0.00 H new ATOM 0 HB1 ALA A 391 8.329 -2.896 8.146 1.00 0.00 H new ATOM 0 HB2 ALA A 391 7.081 -3.415 9.303 1.00 0.00 H new ATOM 0 HB3 ALA A 391 7.639 -4.532 8.035 1.00 0.00 H new ATOM 384 N VAL A 392 6.725 -4.153 5.256 1.00 0.00 N ATOM 385 CA VAL A 392 7.156 -4.308 3.872 1.00 0.00 C ATOM 386 C VAL A 392 6.153 -3.679 2.911 1.00 0.00 C ATOM 387 O VAL A 392 6.534 -3.013 1.949 1.00 0.00 O ATOM 388 CB VAL A 392 7.343 -5.792 3.503 1.00 0.00 C ATOM 389 CG1 VAL A 392 7.953 -5.926 2.114 1.00 0.00 C ATOM 390 CG2 VAL A 392 8.204 -6.499 4.539 1.00 0.00 C ATOM 0 H VAL A 392 6.343 -5.000 5.676 1.00 0.00 H new ATOM 0 HA VAL A 392 8.114 -3.796 3.780 1.00 0.00 H new ATOM 0 HB VAL A 392 6.363 -6.268 3.493 1.00 0.00 H new ATOM 0 HG11 VAL A 392 8.077 -6.981 1.871 1.00 0.00 H new ATOM 0 HG12 VAL A 392 7.294 -5.460 1.381 1.00 0.00 H new ATOM 0 HG13 VAL A 392 8.925 -5.432 2.094 1.00 0.00 H new ATOM 0 HG21 VAL A 392 8.324 -7.546 4.260 1.00 0.00 H new ATOM 0 HG22 VAL A 392 9.183 -6.022 4.586 1.00 0.00 H new ATOM 0 HG23 VAL A 392 7.723 -6.437 5.515 1.00 0.00 H new ATOM 400 N PHE A 393 4.870 -3.895 3.180 1.00 0.00 N ATOM 401 CA PHE A 393 3.810 -3.349 2.339 1.00 0.00 C ATOM 402 C PHE A 393 3.872 -1.826 2.307 1.00 0.00 C ATOM 403 O PHE A 393 3.858 -1.216 1.238 1.00 0.00 O ATOM 404 CB PHE A 393 2.441 -3.806 2.848 1.00 0.00 C ATOM 405 CG PHE A 393 1.330 -3.581 1.862 1.00 0.00 C ATOM 406 CD1 PHE A 393 0.750 -2.331 1.723 1.00 0.00 C ATOM 407 CD2 PHE A 393 0.866 -4.623 1.073 1.00 0.00 C ATOM 408 CE1 PHE A 393 -0.272 -2.122 0.818 1.00 0.00 C ATOM 409 CE2 PHE A 393 -0.156 -4.420 0.165 1.00 0.00 C ATOM 410 CZ PHE A 393 -0.726 -3.168 0.037 1.00 0.00 C ATOM 0 H PHE A 393 4.539 -4.444 3.973 1.00 0.00 H new ATOM 0 HA PHE A 393 3.955 -3.721 1.325 1.00 0.00 H new ATOM 0 HB2 PHE A 393 2.489 -4.867 3.094 1.00 0.00 H new ATOM 0 HB3 PHE A 393 2.210 -3.275 3.772 1.00 0.00 H new ATOM 0 HD1 PHE A 393 1.101 -1.510 2.330 1.00 0.00 H new ATOM 0 HD2 PHE A 393 1.308 -5.604 1.169 1.00 0.00 H new ATOM 0 HE1 PHE A 393 -0.716 -1.142 0.721 1.00 0.00 H new ATOM 0 HE2 PHE A 393 -0.509 -5.239 -0.444 1.00 0.00 H new ATOM 0 HZ PHE A 393 -1.525 -3.007 -0.672 1.00 0.00 H new ATOM 420 N ALA A 394 3.939 -1.217 3.486 1.00 0.00 N ATOM 421 CA ALA A 394 4.002 0.236 3.593 1.00 0.00 C ATOM 422 C ALA A 394 5.267 0.781 2.936 1.00 0.00 C ATOM 423 O ALA A 394 5.272 1.892 2.406 1.00 0.00 O ATOM 424 CB ALA A 394 3.939 0.660 5.053 1.00 0.00 C ATOM 0 H ALA A 394 3.951 -1.707 4.381 1.00 0.00 H new ATOM 0 HA ALA A 394 3.143 0.652 3.067 1.00 0.00 H new ATOM 0 HB1 ALA A 394 3.987 1.747 5.119 1.00 0.00 H new ATOM 0 HB2 ALA A 394 3.005 0.311 5.493 1.00 0.00 H new ATOM 0 HB3 ALA A 394 4.780 0.226 5.594 1.00 0.00 H new ATOM 430 N ARG A 395 6.334 -0.007 2.977 1.00 0.00 N ATOM 431 CA ARG A 395 7.604 0.398 2.385 1.00 0.00 C ATOM 432 C ARG A 395 7.470 0.572 0.875 1.00 0.00 C ATOM 433 O ARG A 395 7.658 1.668 0.348 1.00 0.00 O ATOM 434 CB ARG A 395 8.689 -0.635 2.697 1.00 0.00 C ATOM 435 CG ARG A 395 10.047 -0.018 2.999 1.00 0.00 C ATOM 436 CD ARG A 395 11.115 -0.519 2.039 1.00 0.00 C ATOM 437 NE ARG A 395 10.820 -0.158 0.655 1.00 0.00 N ATOM 438 CZ ARG A 395 11.726 -0.153 -0.320 1.00 0.00 C ATOM 439 NH1 ARG A 395 12.985 -0.487 -0.066 1.00 0.00 N ATOM 440 NH2 ARG A 395 11.373 0.189 -1.551 1.00 0.00 N ATOM 0 H ARG A 395 6.346 -0.929 3.413 1.00 0.00 H new ATOM 0 HA ARG A 395 7.889 1.356 2.819 1.00 0.00 H new ATOM 0 HB2 ARG A 395 8.374 -1.235 3.551 1.00 0.00 H new ATOM 0 HB3 ARG A 395 8.788 -1.314 1.850 1.00 0.00 H new ATOM 0 HG2 ARG A 395 9.977 1.068 2.932 1.00 0.00 H new ATOM 0 HG3 ARG A 395 10.336 -0.256 4.023 1.00 0.00 H new ATOM 0 HD2 ARG A 395 12.082 -0.104 2.324 1.00 0.00 H new ATOM 0 HD3 ARG A 395 11.197 -1.603 2.121 1.00 0.00 H new ATOM 0 HE ARG A 395 9.863 0.106 0.422 1.00 0.00 H new ATOM 0 HH11 ARG A 395 13.262 -0.749 0.880 1.00 0.00 H new ATOM 0 HH12 ARG A 395 13.675 -0.482 -0.817 1.00 0.00 H new ATOM 0 HH21 ARG A 395 10.407 0.448 -1.751 1.00 0.00 H new ATOM 0 HH22 ARG A 395 12.067 0.193 -2.298 1.00 0.00 H new ATOM 454 N VAL A 396 7.143 -0.517 0.186 1.00 0.00 N ATOM 455 CA VAL A 396 6.983 -0.484 -1.263 1.00 0.00 C ATOM 456 C VAL A 396 5.838 0.439 -1.666 1.00 0.00 C ATOM 457 O VAL A 396 5.914 1.133 -2.680 1.00 0.00 O ATOM 458 CB VAL A 396 6.717 -1.891 -1.832 1.00 0.00 C ATOM 459 CG1 VAL A 396 7.926 -2.790 -1.618 1.00 0.00 C ATOM 460 CG2 VAL A 396 5.474 -2.497 -1.198 1.00 0.00 C ATOM 0 H VAL A 396 6.984 -1.432 0.608 1.00 0.00 H new ATOM 0 HA VAL A 396 7.917 -0.105 -1.677 1.00 0.00 H new ATOM 0 HB VAL A 396 6.543 -1.803 -2.904 1.00 0.00 H new ATOM 0 HG11 VAL A 396 7.720 -3.780 -2.026 1.00 0.00 H new ATOM 0 HG12 VAL A 396 8.792 -2.362 -2.123 1.00 0.00 H new ATOM 0 HG13 VAL A 396 8.133 -2.873 -0.551 1.00 0.00 H new ATOM 0 HG21 VAL A 396 5.302 -3.490 -1.612 1.00 0.00 H new ATOM 0 HG22 VAL A 396 5.616 -2.573 -0.120 1.00 0.00 H new ATOM 0 HG23 VAL A 396 4.613 -1.863 -1.407 1.00 0.00 H new ATOM 470 N ALA A 397 4.776 0.440 -0.866 1.00 0.00 N ATOM 471 CA ALA A 397 3.615 1.277 -1.139 1.00 0.00 C ATOM 472 C ALA A 397 3.953 2.754 -0.979 1.00 0.00 C ATOM 473 O ALA A 397 3.898 3.522 -1.939 1.00 0.00 O ATOM 474 CB ALA A 397 2.463 0.893 -0.222 1.00 0.00 C ATOM 0 H ALA A 397 4.696 -0.130 -0.024 1.00 0.00 H new ATOM 0 HA ALA A 397 3.313 1.112 -2.173 1.00 0.00 H new ATOM 0 HB1 ALA A 397 1.601 1.526 -0.436 1.00 0.00 H new ATOM 0 HB2 ALA A 397 2.197 -0.151 -0.389 1.00 0.00 H new ATOM 0 HB3 ALA A 397 2.764 1.029 0.817 1.00 0.00 H new ATOM 480 N PHE A 398 4.301 3.147 0.243 1.00 0.00 N ATOM 481 CA PHE A 398 4.647 4.534 0.530 1.00 0.00 C ATOM 482 C PHE A 398 5.619 4.620 1.702 1.00 0.00 C ATOM 483 O PHE A 398 5.249 4.366 2.849 1.00 0.00 O ATOM 484 CB PHE A 398 3.386 5.343 0.837 1.00 0.00 C ATOM 485 CG PHE A 398 2.570 4.778 1.966 1.00 0.00 C ATOM 486 CD1 PHE A 398 1.851 3.606 1.800 1.00 0.00 C ATOM 487 CD2 PHE A 398 2.523 5.420 3.194 1.00 0.00 C ATOM 488 CE1 PHE A 398 1.100 3.083 2.835 1.00 0.00 C ATOM 489 CE2 PHE A 398 1.774 4.903 4.233 1.00 0.00 C ATOM 490 CZ PHE A 398 1.062 3.732 4.054 1.00 0.00 C ATOM 0 H PHE A 398 4.351 2.524 1.049 1.00 0.00 H new ATOM 0 HA PHE A 398 5.132 4.952 -0.352 1.00 0.00 H new ATOM 0 HB2 PHE A 398 3.671 6.366 1.082 1.00 0.00 H new ATOM 0 HB3 PHE A 398 2.767 5.391 -0.059 1.00 0.00 H new ATOM 0 HD1 PHE A 398 1.878 3.094 0.849 1.00 0.00 H new ATOM 0 HD2 PHE A 398 3.078 6.335 3.340 1.00 0.00 H new ATOM 0 HE1 PHE A 398 0.544 2.169 2.691 1.00 0.00 H new ATOM 0 HE2 PHE A 398 1.745 5.413 5.184 1.00 0.00 H new ATOM 0 HZ PHE A 398 0.477 3.325 4.866 1.00 0.00 H new ATOM 500 N ASN A 399 6.865 4.981 1.409 1.00 0.00 N ATOM 501 CA ASN A 399 7.889 5.099 2.439 1.00 0.00 C ATOM 502 C ASN A 399 7.629 6.315 3.325 1.00 0.00 C ATOM 503 O ASN A 399 8.034 7.431 3.000 1.00 0.00 O ATOM 504 CB ASN A 399 9.276 5.203 1.799 1.00 0.00 C ATOM 505 CG ASN A 399 10.072 3.920 1.936 1.00 0.00 C ATOM 506 OD1 ASN A 399 10.352 3.242 0.946 1.00 0.00 O ATOM 507 ND2 ASN A 399 10.439 3.578 3.165 1.00 0.00 N ATOM 0 H ASN A 399 7.189 5.197 0.466 1.00 0.00 H new ATOM 0 HA ASN A 399 7.851 4.205 3.061 1.00 0.00 H new ATOM 0 HB2 ASN A 399 9.168 5.450 0.743 1.00 0.00 H new ATOM 0 HB3 ASN A 399 9.827 6.021 2.263 1.00 0.00 H new ATOM 0 HD21 ASN A 399 10.975 2.724 3.318 1.00 0.00 H new ATOM 0 HD22 ASN A 399 10.185 4.170 3.956 1.00 0.00 H new ATOM 514 N ARG A 400 6.947 6.089 4.443 1.00 0.00 N ATOM 515 CA ARG A 400 6.631 7.166 5.376 1.00 0.00 C ATOM 516 C ARG A 400 6.740 6.682 6.819 1.00 0.00 C ATOM 517 O ARG A 400 7.649 7.076 7.551 1.00 0.00 O ATOM 518 CB ARG A 400 5.225 7.703 5.110 1.00 0.00 C ATOM 519 CG ARG A 400 5.097 8.452 3.793 1.00 0.00 C ATOM 520 CD ARG A 400 4.619 9.880 4.003 1.00 0.00 C ATOM 521 NE ARG A 400 5.713 10.842 3.924 1.00 0.00 N ATOM 522 CZ ARG A 400 5.540 12.155 3.797 1.00 0.00 C ATOM 523 NH1 ARG A 400 4.315 12.667 3.734 1.00 0.00 N ATOM 524 NH2 ARG A 400 6.590 12.961 3.732 1.00 0.00 N ATOM 0 H ARG A 400 6.603 5.171 4.725 1.00 0.00 H new ATOM 0 HA ARG A 400 7.352 7.969 5.225 1.00 0.00 H new ATOM 0 HB2 ARG A 400 4.521 6.871 5.115 1.00 0.00 H new ATOM 0 HB3 ARG A 400 4.939 8.368 5.925 1.00 0.00 H new ATOM 0 HG2 ARG A 400 6.061 8.462 3.285 1.00 0.00 H new ATOM 0 HG3 ARG A 400 4.399 7.926 3.142 1.00 0.00 H new ATOM 0 HD2 ARG A 400 3.867 10.124 3.253 1.00 0.00 H new ATOM 0 HD3 ARG A 400 4.136 9.961 4.977 1.00 0.00 H new ATOM 0 HE ARG A 400 6.668 10.487 3.969 1.00 0.00 H new ATOM 0 HH11 ARG A 400 3.502 12.053 3.783 1.00 0.00 H new ATOM 0 HH12 ARG A 400 4.188 13.674 3.637 1.00 0.00 H new ATOM 0 HH21 ARG A 400 7.533 12.575 3.779 1.00 0.00 H new ATOM 0 HH22 ARG A 400 6.455 13.967 3.635 1.00 0.00 H new ATOM 538 N THR A 401 5.806 5.827 7.220 1.00 0.00 N ATOM 539 CA THR A 401 5.794 5.288 8.575 1.00 0.00 C ATOM 540 C THR A 401 5.023 3.973 8.634 1.00 0.00 C ATOM 541 O THR A 401 4.287 3.631 7.708 1.00 0.00 O ATOM 542 CB THR A 401 5.170 6.283 9.571 1.00 0.00 C ATOM 543 OG1 THR A 401 4.263 7.158 8.888 1.00 0.00 O ATOM 544 CG2 THR A 401 6.248 7.104 10.262 1.00 0.00 C ATOM 0 H THR A 401 5.047 5.492 6.626 1.00 0.00 H new ATOM 0 HA THR A 401 6.832 5.111 8.855 1.00 0.00 H new ATOM 0 HB THR A 401 4.627 5.714 10.326 1.00 0.00 H new ATOM 0 HG1 THR A 401 3.869 7.786 9.529 1.00 0.00 H new ATOM 0 HG21 THR A 401 5.784 7.800 10.961 1.00 0.00 H new ATOM 0 HG22 THR A 401 6.920 6.439 10.805 1.00 0.00 H new ATOM 0 HG23 THR A 401 6.814 7.662 9.516 1.00 0.00 H new ATOM 552 N GLN A 402 5.198 3.240 9.727 1.00 0.00 N ATOM 553 CA GLN A 402 4.519 1.961 9.909 1.00 0.00 C ATOM 554 C GLN A 402 3.158 2.152 10.570 1.00 0.00 C ATOM 555 O GLN A 402 2.258 1.327 10.407 1.00 0.00 O ATOM 556 CB GLN A 402 5.381 1.017 10.749 1.00 0.00 C ATOM 557 CG GLN A 402 4.911 -0.428 10.716 1.00 0.00 C ATOM 558 CD GLN A 402 4.361 -0.895 12.049 1.00 0.00 C ATOM 559 OE1 GLN A 402 3.129 -1.390 12.042 1.00 0.00 O flip ATOM 560 NE2 GLN A 402 5.035 -0.812 13.076 1.00 0.00 N flip ATOM 0 H GLN A 402 5.805 3.509 10.502 1.00 0.00 H new ATOM 0 HA GLN A 402 4.363 1.520 8.925 1.00 0.00 H new ATOM 0 HB2 GLN A 402 6.410 1.064 10.392 1.00 0.00 H new ATOM 0 HB3 GLN A 402 5.386 1.365 11.782 1.00 0.00 H new ATOM 0 HG2 GLN A 402 4.142 -0.538 9.952 1.00 0.00 H new ATOM 0 HG3 GLN A 402 5.743 -1.070 10.426 1.00 0.00 H new ATOM 0 HE21 GLN A 402 5.978 -0.425 13.037 1.00 0.00 H new ATOM 0 HE22 GLN A 402 4.650 -1.130 13.966 1.00 0.00 H new ATOM 569 N GLY A 403 3.013 3.242 11.318 1.00 0.00 N ATOM 570 CA GLY A 403 1.756 3.515 11.992 1.00 0.00 C ATOM 571 C GLY A 403 0.754 4.218 11.096 1.00 0.00 C ATOM 572 O GLY A 403 -0.455 4.106 11.301 1.00 0.00 O ATOM 0 H GLY A 403 3.742 3.940 11.469 1.00 0.00 H new ATOM 0 HA2 GLY A 403 1.327 2.578 12.346 1.00 0.00 H new ATOM 0 HA3 GLY A 403 1.946 4.130 12.871 1.00 0.00 H new ATOM 576 N LEU A 404 1.254 4.944 10.102 1.00 0.00 N ATOM 577 CA LEU A 404 0.391 5.667 9.173 1.00 0.00 C ATOM 578 C LEU A 404 -0.563 4.715 8.459 1.00 0.00 C ATOM 579 O LEU A 404 -1.757 4.990 8.341 1.00 0.00 O ATOM 580 CB LEU A 404 1.233 6.427 8.147 1.00 0.00 C ATOM 581 CG LEU A 404 0.454 7.414 7.274 1.00 0.00 C ATOM 582 CD1 LEU A 404 -0.055 8.578 8.111 1.00 0.00 C ATOM 583 CD2 LEU A 404 1.325 7.917 6.133 1.00 0.00 C ATOM 0 H LEU A 404 2.252 5.048 9.918 1.00 0.00 H new ATOM 0 HA LEU A 404 -0.200 6.380 9.748 1.00 0.00 H new ATOM 0 HB2 LEU A 404 2.016 6.971 8.674 1.00 0.00 H new ATOM 0 HB3 LEU A 404 1.728 5.704 7.499 1.00 0.00 H new ATOM 0 HG LEU A 404 -0.405 6.895 6.848 1.00 0.00 H new ATOM 0 HD11 LEU A 404 -0.606 9.270 7.475 1.00 0.00 H new ATOM 0 HD12 LEU A 404 -0.713 8.202 8.894 1.00 0.00 H new ATOM 0 HD13 LEU A 404 0.790 9.097 8.565 1.00 0.00 H new ATOM 0 HD21 LEU A 404 0.756 8.618 5.522 1.00 0.00 H new ATOM 0 HD22 LEU A 404 2.202 8.420 6.539 1.00 0.00 H new ATOM 0 HD23 LEU A 404 1.642 7.074 5.518 1.00 0.00 H new ATOM 595 N LEU A 405 -0.030 3.593 7.987 1.00 0.00 N ATOM 596 CA LEU A 405 -0.836 2.601 7.285 1.00 0.00 C ATOM 597 C LEU A 405 -1.952 2.073 8.180 1.00 0.00 C ATOM 598 O LEU A 405 -3.068 1.834 7.721 1.00 0.00 O ATOM 599 CB LEU A 405 0.043 1.441 6.809 1.00 0.00 C ATOM 600 CG LEU A 405 -0.602 0.526 5.769 1.00 0.00 C ATOM 601 CD1 LEU A 405 0.438 0.033 4.772 1.00 0.00 C ATOM 602 CD2 LEU A 405 -1.290 -0.649 6.447 1.00 0.00 C ATOM 0 H LEU A 405 0.956 3.348 8.078 1.00 0.00 H new ATOM 0 HA LEU A 405 -1.287 3.085 6.419 1.00 0.00 H new ATOM 0 HB2 LEU A 405 0.963 1.850 6.391 1.00 0.00 H new ATOM 0 HB3 LEU A 405 0.326 0.841 7.674 1.00 0.00 H new ATOM 0 HG LEU A 405 -1.354 1.099 5.226 1.00 0.00 H new ATOM 0 HD11 LEU A 405 -0.040 -0.617 4.039 1.00 0.00 H new ATOM 0 HD12 LEU A 405 0.887 0.886 4.263 1.00 0.00 H new ATOM 0 HD13 LEU A 405 1.213 -0.523 5.300 1.00 0.00 H new ATOM 0 HD21 LEU A 405 -1.744 -1.290 5.691 1.00 0.00 H new ATOM 0 HD22 LEU A 405 -0.557 -1.221 7.016 1.00 0.00 H new ATOM 0 HD23 LEU A 405 -2.063 -0.279 7.121 1.00 0.00 H new ATOM 614 N SER A 406 -1.642 1.892 9.460 1.00 0.00 N ATOM 615 CA SER A 406 -2.620 1.393 10.420 1.00 0.00 C ATOM 616 C SER A 406 -3.700 2.437 10.691 1.00 0.00 C ATOM 617 O SER A 406 -4.849 2.098 10.970 1.00 0.00 O ATOM 618 CB SER A 406 -1.928 1.007 11.729 1.00 0.00 C ATOM 619 OG SER A 406 -1.673 2.147 12.528 1.00 0.00 O ATOM 0 H SER A 406 -0.722 2.083 9.856 1.00 0.00 H new ATOM 0 HA SER A 406 -3.094 0.510 9.992 1.00 0.00 H new ATOM 0 HB2 SER A 406 -2.553 0.305 12.281 1.00 0.00 H new ATOM 0 HB3 SER A 406 -0.991 0.495 11.511 1.00 0.00 H new ATOM 0 HG SER A 406 -1.333 2.873 11.964 1.00 0.00 H new ATOM 625 N GLU A 407 -3.321 3.708 10.607 1.00 0.00 N ATOM 626 CA GLU A 407 -4.255 4.802 10.844 1.00 0.00 C ATOM 627 C GLU A 407 -5.229 4.949 9.679 1.00 0.00 C ATOM 628 O GLU A 407 -6.418 5.194 9.878 1.00 0.00 O ATOM 629 CB GLU A 407 -3.496 6.112 11.059 1.00 0.00 C ATOM 630 CG GLU A 407 -4.307 7.174 11.782 1.00 0.00 C ATOM 631 CD GLU A 407 -4.405 6.918 13.273 1.00 0.00 C ATOM 632 OE1 GLU A 407 -3.348 6.788 13.923 1.00 0.00 O ATOM 633 OE2 GLU A 407 -5.541 6.848 13.789 1.00 0.00 O ATOM 0 H GLU A 407 -2.373 4.006 10.376 1.00 0.00 H new ATOM 0 HA GLU A 407 -4.826 4.570 11.743 1.00 0.00 H new ATOM 0 HB2 GLU A 407 -2.590 5.908 11.630 1.00 0.00 H new ATOM 0 HB3 GLU A 407 -3.182 6.503 10.091 1.00 0.00 H new ATOM 0 HG2 GLU A 407 -3.852 8.150 11.614 1.00 0.00 H new ATOM 0 HG3 GLU A 407 -5.310 7.212 11.357 1.00 0.00 H new ATOM 640 N ILE A 408 -4.714 4.799 8.462 1.00 0.00 N ATOM 641 CA ILE A 408 -5.538 4.917 7.266 1.00 0.00 C ATOM 642 C ILE A 408 -6.464 3.713 7.117 1.00 0.00 C ATOM 643 O ILE A 408 -7.661 3.867 6.869 1.00 0.00 O ATOM 644 CB ILE A 408 -4.672 5.043 5.996 1.00 0.00 C ATOM 645 CG1 ILE A 408 -3.625 6.145 6.173 1.00 0.00 C ATOM 646 CG2 ILE A 408 -5.546 5.328 4.784 1.00 0.00 C ATOM 647 CD1 ILE A 408 -2.368 5.921 5.361 1.00 0.00 C ATOM 0 H ILE A 408 -3.731 4.596 8.279 1.00 0.00 H new ATOM 0 HA ILE A 408 -6.135 5.822 7.381 1.00 0.00 H new ATOM 0 HB ILE A 408 -4.155 4.098 5.833 1.00 0.00 H new ATOM 0 HG12 ILE A 408 -4.065 7.101 5.890 1.00 0.00 H new ATOM 0 HG13 ILE A 408 -3.359 6.216 7.228 1.00 0.00 H new ATOM 0 HG21 ILE A 408 -4.920 5.414 3.896 1.00 0.00 H new ATOM 0 HG22 ILE A 408 -6.257 4.513 4.649 1.00 0.00 H new ATOM 0 HG23 ILE A 408 -6.088 6.261 4.938 1.00 0.00 H new ATOM 0 HD11 ILE A 408 -1.671 6.741 5.536 1.00 0.00 H new ATOM 0 HD12 ILE A 408 -1.905 4.981 5.660 1.00 0.00 H new ATOM 0 HD13 ILE A 408 -2.622 5.880 4.302 1.00 0.00 H new ATOM 659 N LEU A 409 -5.905 2.518 7.269 1.00 0.00 N ATOM 660 CA LEU A 409 -6.682 1.290 7.152 1.00 0.00 C ATOM 661 C LEU A 409 -7.750 1.217 8.239 1.00 0.00 C ATOM 662 O LEU A 409 -8.851 0.716 8.007 1.00 0.00 O ATOM 663 CB LEU A 409 -5.763 0.070 7.239 1.00 0.00 C ATOM 664 CG LEU A 409 -5.222 -0.430 5.899 1.00 0.00 C ATOM 665 CD1 LEU A 409 -6.341 -1.030 5.062 1.00 0.00 C ATOM 666 CD2 LEU A 409 -4.538 0.700 5.144 1.00 0.00 C ATOM 0 H LEU A 409 -4.916 2.373 7.474 1.00 0.00 H new ATOM 0 HA LEU A 409 -7.178 1.293 6.181 1.00 0.00 H new ATOM 0 HB2 LEU A 409 -4.920 0.315 7.885 1.00 0.00 H new ATOM 0 HB3 LEU A 409 -6.308 -0.743 7.720 1.00 0.00 H new ATOM 0 HG LEU A 409 -4.484 -1.208 6.095 1.00 0.00 H new ATOM 0 HD11 LEU A 409 -5.937 -1.380 4.112 1.00 0.00 H new ATOM 0 HD12 LEU A 409 -6.787 -1.868 5.598 1.00 0.00 H new ATOM 0 HD13 LEU A 409 -7.102 -0.272 4.875 1.00 0.00 H new ATOM 0 HD21 LEU A 409 -4.159 0.325 4.193 1.00 0.00 H new ATOM 0 HD22 LEU A 409 -5.255 1.500 4.959 1.00 0.00 H new ATOM 0 HD23 LEU A 409 -3.709 1.085 5.738 1.00 0.00 H new ATOM 678 N ARG A 410 -7.418 1.717 9.423 1.00 0.00 N ATOM 679 CA ARG A 410 -8.349 1.709 10.545 1.00 0.00 C ATOM 680 C ARG A 410 -9.465 2.728 10.335 1.00 0.00 C ATOM 681 O ARG A 410 -10.633 2.451 10.605 1.00 0.00 O ATOM 682 CB ARG A 410 -7.612 2.004 11.851 1.00 0.00 C ATOM 683 CG ARG A 410 -6.904 0.795 12.438 1.00 0.00 C ATOM 684 CD ARG A 410 -7.768 0.093 13.474 1.00 0.00 C ATOM 685 NE ARG A 410 -6.965 -0.544 14.515 1.00 0.00 N ATOM 686 CZ ARG A 410 -6.260 -1.659 14.329 1.00 0.00 C ATOM 687 NH1 ARG A 410 -6.257 -2.260 13.147 1.00 0.00 N ATOM 688 NH2 ARG A 410 -5.558 -2.172 15.329 1.00 0.00 N ATOM 0 H ARG A 410 -6.510 2.133 9.631 1.00 0.00 H new ATOM 0 HA ARG A 410 -8.795 0.716 10.605 1.00 0.00 H new ATOM 0 HB2 ARG A 410 -6.880 2.793 11.675 1.00 0.00 H new ATOM 0 HB3 ARG A 410 -8.324 2.387 12.582 1.00 0.00 H new ATOM 0 HG2 ARG A 410 -6.651 0.097 11.640 1.00 0.00 H new ATOM 0 HG3 ARG A 410 -5.966 1.108 12.897 1.00 0.00 H new ATOM 0 HD2 ARG A 410 -8.446 0.815 13.930 1.00 0.00 H new ATOM 0 HD3 ARG A 410 -8.386 -0.658 12.982 1.00 0.00 H new ATOM 0 HE ARG A 410 -6.943 -0.110 15.438 1.00 0.00 H new ATOM 0 HH11 ARG A 410 -6.796 -1.869 12.375 1.00 0.00 H new ATOM 0 HH12 ARG A 410 -5.715 -3.113 13.010 1.00 0.00 H new ATOM 0 HH21 ARG A 410 -5.558 -1.713 16.240 1.00 0.00 H new ATOM 0 HH22 ARG A 410 -5.018 -3.026 15.188 1.00 0.00 H new ATOM 702 N LYS A 411 -9.096 3.911 9.852 1.00 0.00 N ATOM 703 CA LYS A 411 -10.064 4.972 9.606 1.00 0.00 C ATOM 704 C LYS A 411 -11.105 4.533 8.581 1.00 0.00 C ATOM 705 O LYS A 411 -12.306 4.690 8.795 1.00 0.00 O ATOM 706 CB LYS A 411 -9.354 6.237 9.120 1.00 0.00 C ATOM 707 CG LYS A 411 -8.938 7.172 10.245 1.00 0.00 C ATOM 708 CD LYS A 411 -9.830 8.402 10.309 1.00 0.00 C ATOM 709 CE LYS A 411 -9.472 9.405 9.225 1.00 0.00 C ATOM 710 NZ LYS A 411 -8.555 10.464 9.728 1.00 0.00 N ATOM 0 H LYS A 411 -8.133 4.158 9.624 1.00 0.00 H new ATOM 0 HA LYS A 411 -10.574 5.188 10.545 1.00 0.00 H new ATOM 0 HB2 LYS A 411 -8.470 5.951 8.551 1.00 0.00 H new ATOM 0 HB3 LYS A 411 -10.013 6.774 8.437 1.00 0.00 H new ATOM 0 HG2 LYS A 411 -8.981 6.640 11.196 1.00 0.00 H new ATOM 0 HG3 LYS A 411 -7.903 7.480 10.099 1.00 0.00 H new ATOM 0 HD2 LYS A 411 -10.873 8.103 10.200 1.00 0.00 H new ATOM 0 HD3 LYS A 411 -9.734 8.872 11.288 1.00 0.00 H new ATOM 0 HE2 LYS A 411 -9.002 8.885 8.390 1.00 0.00 H new ATOM 0 HE3 LYS A 411 -10.383 9.866 8.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 411 -8.335 11.128 8.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 411 -9.013 10.978 10.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 411 -7.675 10.028 10.070 1.00 0.00 H new ATOM 724 N GLU A 412 -10.633 3.983 7.466 1.00 0.00 N ATOM 725 CA GLU A 412 -11.524 3.521 6.408 1.00 0.00 C ATOM 726 C GLU A 412 -12.366 4.670 5.863 1.00 0.00 C ATOM 727 O GLU A 412 -13.512 4.478 5.462 1.00 0.00 O ATOM 728 CB GLU A 412 -12.437 2.410 6.930 1.00 0.00 C ATOM 729 CG GLU A 412 -12.952 1.484 5.840 1.00 0.00 C ATOM 730 CD GLU A 412 -14.137 0.652 6.293 1.00 0.00 C ATOM 731 OE1 GLU A 412 -15.160 1.246 6.691 1.00 0.00 O ATOM 732 OE2 GLU A 412 -14.040 -0.593 6.251 1.00 0.00 O ATOM 0 H GLU A 412 -9.641 3.847 7.272 1.00 0.00 H new ATOM 0 HA GLU A 412 -10.910 3.128 5.598 1.00 0.00 H new ATOM 0 HB2 GLU A 412 -11.893 1.821 7.669 1.00 0.00 H new ATOM 0 HB3 GLU A 412 -13.286 2.860 7.444 1.00 0.00 H new ATOM 0 HG2 GLU A 412 -13.239 2.076 4.971 1.00 0.00 H new ATOM 0 HG3 GLU A 412 -12.148 0.821 5.522 1.00 0.00 H new ATOM 739 N GLU A 413 -11.786 5.867 5.854 1.00 0.00 N ATOM 740 CA GLU A 413 -12.482 7.049 5.358 1.00 0.00 C ATOM 741 C GLU A 413 -12.218 7.252 3.869 1.00 0.00 C ATOM 742 O GLU A 413 -11.068 7.296 3.433 1.00 0.00 O ATOM 743 CB GLU A 413 -12.044 8.289 6.139 1.00 0.00 C ATOM 744 CG GLU A 413 -13.170 9.282 6.384 1.00 0.00 C ATOM 745 CD GLU A 413 -12.951 10.115 7.632 1.00 0.00 C ATOM 746 OE1 GLU A 413 -13.323 9.647 8.729 1.00 0.00 O ATOM 747 OE2 GLU A 413 -12.407 11.232 7.513 1.00 0.00 O ATOM 0 H GLU A 413 -10.837 6.043 6.184 1.00 0.00 H new ATOM 0 HA GLU A 413 -13.552 6.897 5.501 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -11.631 7.977 7.098 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -11.243 8.788 5.594 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -13.261 9.943 5.522 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -14.113 8.742 6.473 1.00 0.00 H new ATOM 754 N ASP A 414 -13.291 7.373 3.095 1.00 0.00 N ATOM 755 CA ASP A 414 -13.176 7.573 1.655 1.00 0.00 C ATOM 756 C ASP A 414 -12.422 8.863 1.343 1.00 0.00 C ATOM 757 O ASP A 414 -12.452 9.812 2.125 1.00 0.00 O ATOM 758 CB ASP A 414 -14.564 7.611 1.012 1.00 0.00 C ATOM 759 CG ASP A 414 -15.085 6.228 0.676 1.00 0.00 C ATOM 760 OD1 ASP A 414 -14.598 5.248 1.279 1.00 0.00 O ATOM 761 OD2 ASP A 414 -15.980 6.125 -0.189 1.00 0.00 O ATOM 0 H ASP A 414 -14.250 7.336 3.440 1.00 0.00 H new ATOM 0 HA ASP A 414 -12.614 6.736 1.241 1.00 0.00 H new ATOM 0 HB2 ASP A 414 -15.261 8.104 1.689 1.00 0.00 H new ATOM 0 HB3 ASP A 414 -14.524 8.211 0.103 1.00 0.00 H new ATOM 766 N PRO A 415 -11.732 8.913 0.191 1.00 0.00 N ATOM 767 CA PRO A 415 -10.966 10.089 -0.223 1.00 0.00 C ATOM 768 C PRO A 415 -11.830 11.139 -0.914 1.00 0.00 C ATOM 769 O PRO A 415 -11.459 11.668 -1.961 1.00 0.00 O ATOM 770 CB PRO A 415 -9.956 9.499 -1.202 1.00 0.00 C ATOM 771 CG PRO A 415 -10.677 8.357 -1.837 1.00 0.00 C ATOM 772 CD PRO A 415 -11.635 7.822 -0.799 1.00 0.00 C ATOM 0 HA PRO A 415 -10.520 10.612 0.623 1.00 0.00 H new ATOM 0 HB2 PRO A 415 -9.646 10.235 -1.944 1.00 0.00 H new ATOM 0 HB3 PRO A 415 -9.055 9.164 -0.689 1.00 0.00 H new ATOM 0 HG2 PRO A 415 -11.214 8.684 -2.728 1.00 0.00 H new ATOM 0 HG3 PRO A 415 -9.977 7.584 -2.153 1.00 0.00 H new ATOM 0 HD2 PRO A 415 -12.607 7.590 -1.234 1.00 0.00 H new ATOM 0 HD3 PRO A 415 -11.261 6.904 -0.346 1.00 0.00 H new ATOM 780 N LYS A 416 -12.982 11.440 -0.323 1.00 0.00 N ATOM 781 CA LYS A 416 -13.895 12.428 -0.886 1.00 0.00 C ATOM 782 C LYS A 416 -13.752 13.766 -0.169 1.00 0.00 C ATOM 783 O LYS A 416 -13.894 14.826 -0.778 1.00 0.00 O ATOM 784 CB LYS A 416 -15.339 11.934 -0.787 1.00 0.00 C ATOM 785 CG LYS A 416 -15.568 10.586 -1.452 1.00 0.00 C ATOM 786 CD LYS A 416 -15.881 10.739 -2.931 1.00 0.00 C ATOM 787 CE LYS A 416 -15.101 9.743 -3.776 1.00 0.00 C ATOM 788 NZ LYS A 416 -15.955 9.107 -4.817 1.00 0.00 N ATOM 0 H LYS A 416 -13.305 11.014 0.546 1.00 0.00 H new ATOM 0 HA LYS A 416 -13.639 12.568 -1.936 1.00 0.00 H new ATOM 0 HB2 LYS A 416 -15.619 11.863 0.264 1.00 0.00 H new ATOM 0 HB3 LYS A 416 -15.999 12.672 -1.244 1.00 0.00 H new ATOM 0 HG2 LYS A 416 -14.682 9.964 -1.329 1.00 0.00 H new ATOM 0 HG3 LYS A 416 -16.391 10.070 -0.957 1.00 0.00 H new ATOM 0 HD2 LYS A 416 -16.949 10.597 -3.094 1.00 0.00 H new ATOM 0 HD3 LYS A 416 -15.642 11.753 -3.251 1.00 0.00 H new ATOM 0 HE2 LYS A 416 -14.263 10.251 -4.254 1.00 0.00 H new ATOM 0 HE3 LYS A 416 -14.680 8.972 -3.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 416 -15.386 8.436 -5.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 416 -16.740 8.601 -4.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 416 -16.337 9.840 -5.448 1.00 0.00 H new ATOM 802 N THR A 417 -13.470 13.710 1.128 1.00 0.00 N ATOM 803 CA THR A 417 -13.307 14.916 1.930 1.00 0.00 C ATOM 804 C THR A 417 -12.021 14.863 2.747 1.00 0.00 C ATOM 805 O THR A 417 -11.946 15.420 3.841 1.00 0.00 O ATOM 806 CB THR A 417 -14.499 15.122 2.882 1.00 0.00 C ATOM 807 OG1 THR A 417 -15.664 14.474 2.358 1.00 0.00 O ATOM 808 CG2 THR A 417 -14.783 16.604 3.081 1.00 0.00 C ATOM 0 H THR A 417 -13.349 12.840 1.647 1.00 0.00 H new ATOM 0 HA THR A 417 -13.258 15.754 1.235 1.00 0.00 H new ATOM 0 HB THR A 417 -14.244 14.684 3.847 1.00 0.00 H new ATOM 0 HG1 THR A 417 -16.417 14.609 2.971 1.00 0.00 H new ATOM 0 HG21 THR A 417 -15.629 16.725 3.757 1.00 0.00 H new ATOM 0 HG22 THR A 417 -13.905 17.089 3.508 1.00 0.00 H new ATOM 0 HG23 THR A 417 -15.018 17.062 2.120 1.00 0.00 H new ATOM 816 N ALA A 418 -11.011 14.191 2.206 1.00 0.00 N ATOM 817 CA ALA A 418 -9.726 14.063 2.885 1.00 0.00 C ATOM 818 C ALA A 418 -8.813 15.240 2.556 1.00 0.00 C ATOM 819 O ALA A 418 -9.219 16.185 1.882 1.00 0.00 O ATOM 820 CB ALA A 418 -9.058 12.751 2.507 1.00 0.00 C ATOM 0 H ALA A 418 -11.057 13.726 1.299 1.00 0.00 H new ATOM 0 HA ALA A 418 -9.908 14.067 3.960 1.00 0.00 H new ATOM 0 HB1 ALA A 418 -8.100 12.669 3.021 1.00 0.00 H new ATOM 0 HB2 ALA A 418 -9.699 11.919 2.799 1.00 0.00 H new ATOM 0 HB3 ALA A 418 -8.895 12.723 1.430 1.00 0.00 H new ATOM 826 N SER A 419 -7.576 15.173 3.037 1.00 0.00 N ATOM 827 CA SER A 419 -6.603 16.231 2.794 1.00 0.00 C ATOM 828 C SER A 419 -5.655 15.851 1.662 1.00 0.00 C ATOM 829 O SER A 419 -5.760 14.765 1.090 1.00 0.00 O ATOM 830 CB SER A 419 -5.805 16.521 4.066 1.00 0.00 C ATOM 831 OG SER A 419 -5.044 15.394 4.460 1.00 0.00 O ATOM 0 H SER A 419 -7.224 14.397 3.597 1.00 0.00 H new ATOM 0 HA SER A 419 -7.147 17.129 2.501 1.00 0.00 H new ATOM 0 HB2 SER A 419 -5.142 17.370 3.897 1.00 0.00 H new ATOM 0 HB3 SER A 419 -6.486 16.803 4.869 1.00 0.00 H new ATOM 0 HG SER A 419 -4.542 15.607 5.274 1.00 0.00 H new ATOM 837 N GLN A 420 -4.731 16.750 1.341 1.00 0.00 N ATOM 838 CA GLN A 420 -3.764 16.507 0.277 1.00 0.00 C ATOM 839 C GLN A 420 -2.883 15.307 0.602 1.00 0.00 C ATOM 840 O GLN A 420 -2.751 14.385 -0.202 1.00 0.00 O ATOM 841 CB GLN A 420 -2.895 17.747 0.058 1.00 0.00 C ATOM 842 CG GLN A 420 -1.942 17.621 -1.119 1.00 0.00 C ATOM 843 CD GLN A 420 -2.616 17.902 -2.448 1.00 0.00 C ATOM 844 OE1 GLN A 420 -3.248 18.942 -2.630 1.00 0.00 O ATOM 845 NE2 GLN A 420 -2.486 16.971 -3.386 1.00 0.00 N ATOM 0 H GLN A 420 -4.631 17.654 1.803 1.00 0.00 H new ATOM 0 HA GLN A 420 -4.316 16.290 -0.637 1.00 0.00 H new ATOM 0 HB2 GLN A 420 -3.541 18.610 -0.099 1.00 0.00 H new ATOM 0 HB3 GLN A 420 -2.319 17.941 0.963 1.00 0.00 H new ATOM 0 HG2 GLN A 420 -1.111 18.313 -0.984 1.00 0.00 H new ATOM 0 HG3 GLN A 420 -1.521 16.616 -1.135 1.00 0.00 H new ATOM 0 HE21 GLN A 420 -1.953 16.123 -3.193 1.00 0.00 H new ATOM 0 HE22 GLN A 420 -2.919 17.104 -4.300 1.00 0.00 H new ATOM 854 N SER A 421 -2.283 15.323 1.788 1.00 0.00 N ATOM 855 CA SER A 421 -1.412 14.235 2.221 1.00 0.00 C ATOM 856 C SER A 421 -2.161 12.907 2.227 1.00 0.00 C ATOM 857 O SER A 421 -1.571 11.849 2.008 1.00 0.00 O ATOM 858 CB SER A 421 -0.854 14.525 3.615 1.00 0.00 C ATOM 859 OG SER A 421 0.360 13.827 3.834 1.00 0.00 O ATOM 0 H SER A 421 -2.384 16.078 2.467 1.00 0.00 H new ATOM 0 HA SER A 421 -0.586 14.162 1.514 1.00 0.00 H new ATOM 0 HB2 SER A 421 -0.687 15.596 3.727 1.00 0.00 H new ATOM 0 HB3 SER A 421 -1.585 14.236 4.370 1.00 0.00 H new ATOM 0 HG SER A 421 0.697 14.030 4.731 1.00 0.00 H new ATOM 865 N LEU A 422 -3.465 12.968 2.481 1.00 0.00 N ATOM 866 CA LEU A 422 -4.292 11.768 2.516 1.00 0.00 C ATOM 867 C LEU A 422 -4.457 11.179 1.118 1.00 0.00 C ATOM 868 O LEU A 422 -4.537 9.962 0.953 1.00 0.00 O ATOM 869 CB LEU A 422 -5.666 12.088 3.112 1.00 0.00 C ATOM 870 CG LEU A 422 -6.405 10.892 3.716 1.00 0.00 C ATOM 871 CD1 LEU A 422 -6.840 9.927 2.625 1.00 0.00 C ATOM 872 CD2 LEU A 422 -5.527 10.184 4.738 1.00 0.00 C ATOM 0 H LEU A 422 -3.970 13.835 2.665 1.00 0.00 H new ATOM 0 HA LEU A 422 -3.792 11.031 3.145 1.00 0.00 H new ATOM 0 HB2 LEU A 422 -5.542 12.847 3.885 1.00 0.00 H new ATOM 0 HB3 LEU A 422 -6.290 12.525 2.333 1.00 0.00 H new ATOM 0 HG LEU A 422 -7.297 11.259 4.224 1.00 0.00 H new ATOM 0 HD11 LEU A 422 -7.364 9.083 3.074 1.00 0.00 H new ATOM 0 HD12 LEU A 422 -7.505 10.439 1.930 1.00 0.00 H new ATOM 0 HD13 LEU A 422 -5.963 9.566 2.088 1.00 0.00 H new ATOM 0 HD21 LEU A 422 -6.068 9.336 5.157 1.00 0.00 H new ATOM 0 HD22 LEU A 422 -4.617 9.830 4.253 1.00 0.00 H new ATOM 0 HD23 LEU A 422 -5.266 10.878 5.536 1.00 0.00 H new ATOM 884 N LEU A 423 -4.504 12.050 0.115 1.00 0.00 N ATOM 885 CA LEU A 423 -4.658 11.615 -1.268 1.00 0.00 C ATOM 886 C LEU A 423 -3.338 11.088 -1.821 1.00 0.00 C ATOM 887 O LEU A 423 -3.309 10.089 -2.540 1.00 0.00 O ATOM 888 CB LEU A 423 -5.163 12.771 -2.134 1.00 0.00 C ATOM 889 CG LEU A 423 -6.684 12.880 -2.248 1.00 0.00 C ATOM 890 CD1 LEU A 423 -7.246 11.701 -3.025 1.00 0.00 C ATOM 891 CD2 LEU A 423 -7.315 12.959 -0.864 1.00 0.00 C ATOM 0 H LEU A 423 -4.438 13.061 0.234 1.00 0.00 H new ATOM 0 HA LEU A 423 -5.389 10.807 -1.291 1.00 0.00 H new ATOM 0 HB2 LEU A 423 -4.777 13.705 -1.726 1.00 0.00 H new ATOM 0 HB3 LEU A 423 -4.746 12.663 -3.135 1.00 0.00 H new ATOM 0 HG LEU A 423 -6.926 13.794 -2.790 1.00 0.00 H new ATOM 0 HD11 LEU A 423 -8.330 11.795 -3.096 1.00 0.00 H new ATOM 0 HD12 LEU A 423 -6.816 11.687 -4.027 1.00 0.00 H new ATOM 0 HD13 LEU A 423 -6.996 10.773 -2.510 1.00 0.00 H new ATOM 0 HD21 LEU A 423 -8.398 13.036 -0.962 1.00 0.00 H new ATOM 0 HD22 LEU A 423 -7.065 12.062 -0.298 1.00 0.00 H new ATOM 0 HD23 LEU A 423 -6.935 13.836 -0.340 1.00 0.00 H new ATOM 903 N VAL A 424 -2.246 11.766 -1.482 1.00 0.00 N ATOM 904 CA VAL A 424 -0.923 11.366 -1.945 1.00 0.00 C ATOM 905 C VAL A 424 -0.583 9.953 -1.484 1.00 0.00 C ATOM 906 O VAL A 424 -0.150 9.117 -2.278 1.00 0.00 O ATOM 907 CB VAL A 424 0.165 12.333 -1.441 1.00 0.00 C ATOM 908 CG1 VAL A 424 1.502 12.017 -2.093 1.00 0.00 C ATOM 909 CG2 VAL A 424 -0.238 13.777 -1.705 1.00 0.00 C ATOM 0 H VAL A 424 -2.252 12.595 -0.888 1.00 0.00 H new ATOM 0 HA VAL A 424 -0.948 11.394 -3.034 1.00 0.00 H new ATOM 0 HB VAL A 424 0.271 12.202 -0.364 1.00 0.00 H new ATOM 0 HG11 VAL A 424 2.259 12.710 -1.725 1.00 0.00 H new ATOM 0 HG12 VAL A 424 1.794 10.996 -1.847 1.00 0.00 H new ATOM 0 HG13 VAL A 424 1.412 12.118 -3.175 1.00 0.00 H new ATOM 0 HG21 VAL A 424 0.543 14.445 -1.342 1.00 0.00 H new ATOM 0 HG22 VAL A 424 -0.375 13.927 -2.776 1.00 0.00 H new ATOM 0 HG23 VAL A 424 -1.172 13.995 -1.186 1.00 0.00 H new ATOM 919 N ASN A 425 -0.782 9.692 -0.197 1.00 0.00 N ATOM 920 CA ASN A 425 -0.497 8.379 0.371 1.00 0.00 C ATOM 921 C ASN A 425 -1.427 7.320 -0.210 1.00 0.00 C ATOM 922 O ASN A 425 -0.997 6.213 -0.536 1.00 0.00 O ATOM 923 CB ASN A 425 -0.635 8.417 1.894 1.00 0.00 C ATOM 924 CG ASN A 425 0.304 9.419 2.534 1.00 0.00 C ATOM 925 OD1 ASN A 425 1.411 9.650 2.047 1.00 0.00 O ATOM 926 ND2 ASN A 425 -0.132 10.022 3.634 1.00 0.00 N ATOM 0 H ASN A 425 -1.140 10.372 0.473 1.00 0.00 H new ATOM 0 HA ASN A 425 0.529 8.115 0.113 1.00 0.00 H new ATOM 0 HB2 ASN A 425 -1.663 8.667 2.157 1.00 0.00 H new ATOM 0 HB3 ASN A 425 -0.435 7.425 2.299 1.00 0.00 H new ATOM 0 HD21 ASN A 425 0.458 10.706 4.109 1.00 0.00 H new ATOM 0 HD22 ASN A 425 -1.056 9.801 4.004 1.00 0.00 H new ATOM 933 N LEU A 426 -2.704 7.666 -0.337 1.00 0.00 N ATOM 934 CA LEU A 426 -3.697 6.745 -0.880 1.00 0.00 C ATOM 935 C LEU A 426 -3.402 6.428 -2.343 1.00 0.00 C ATOM 936 O LEU A 426 -3.676 5.326 -2.817 1.00 0.00 O ATOM 937 CB LEU A 426 -5.101 7.337 -0.743 1.00 0.00 C ATOM 938 CG LEU A 426 -5.900 6.835 0.463 1.00 0.00 C ATOM 939 CD1 LEU A 426 -5.100 7.012 1.744 1.00 0.00 C ATOM 940 CD2 LEU A 426 -7.232 7.564 0.558 1.00 0.00 C ATOM 0 H LEU A 426 -3.076 8.578 -0.071 1.00 0.00 H new ATOM 0 HA LEU A 426 -3.647 5.817 -0.311 1.00 0.00 H new ATOM 0 HB2 LEU A 426 -5.017 8.422 -0.678 1.00 0.00 H new ATOM 0 HB3 LEU A 426 -5.663 7.115 -1.650 1.00 0.00 H new ATOM 0 HG LEU A 426 -6.098 5.772 0.328 1.00 0.00 H new ATOM 0 HD11 LEU A 426 -5.684 6.650 2.590 1.00 0.00 H new ATOM 0 HD12 LEU A 426 -4.172 6.445 1.674 1.00 0.00 H new ATOM 0 HD13 LEU A 426 -4.871 8.068 1.887 1.00 0.00 H new ATOM 0 HD21 LEU A 426 -7.788 7.196 1.420 1.00 0.00 H new ATOM 0 HD22 LEU A 426 -7.054 8.633 0.671 1.00 0.00 H new ATOM 0 HD23 LEU A 426 -7.810 7.386 -0.349 1.00 0.00 H new ATOM 952 N ARG A 427 -2.842 7.402 -3.053 1.00 0.00 N ATOM 953 CA ARG A 427 -2.510 7.226 -4.461 1.00 0.00 C ATOM 954 C ARG A 427 -1.418 6.176 -4.637 1.00 0.00 C ATOM 955 O ARG A 427 -1.474 5.356 -5.553 1.00 0.00 O ATOM 956 CB ARG A 427 -2.055 8.554 -5.070 1.00 0.00 C ATOM 957 CG ARG A 427 -2.295 8.651 -6.568 1.00 0.00 C ATOM 958 CD ARG A 427 -1.016 8.977 -7.324 1.00 0.00 C ATOM 959 NE ARG A 427 -0.451 10.265 -6.920 1.00 0.00 N ATOM 960 CZ ARG A 427 0.567 10.402 -6.070 1.00 0.00 C ATOM 961 NH1 ARG A 427 1.135 9.338 -5.514 1.00 0.00 N ATOM 962 NH2 ARG A 427 1.016 11.612 -5.770 1.00 0.00 N ATOM 0 H ARG A 427 -2.609 8.321 -2.676 1.00 0.00 H new ATOM 0 HA ARG A 427 -3.407 6.883 -4.978 1.00 0.00 H new ATOM 0 HB2 ARG A 427 -2.579 9.370 -4.573 1.00 0.00 H new ATOM 0 HB3 ARG A 427 -0.992 8.690 -4.871 1.00 0.00 H new ATOM 0 HG2 ARG A 427 -2.703 7.708 -6.933 1.00 0.00 H new ATOM 0 HG3 ARG A 427 -3.041 9.420 -6.768 1.00 0.00 H new ATOM 0 HD2 ARG A 427 -0.282 8.190 -7.151 1.00 0.00 H new ATOM 0 HD3 ARG A 427 -1.222 8.992 -8.394 1.00 0.00 H new ATOM 0 HE ARG A 427 -0.862 11.112 -7.314 1.00 0.00 H new ATOM 0 HH11 ARG A 427 0.793 8.403 -5.736 1.00 0.00 H new ATOM 0 HH12 ARG A 427 1.913 9.456 -4.865 1.00 0.00 H new ATOM 0 HH21 ARG A 427 0.583 12.435 -6.189 1.00 0.00 H new ATOM 0 HH22 ARG A 427 1.795 11.720 -5.120 1.00 0.00 H new ATOM 976 N ALA A 428 -0.428 6.205 -3.751 1.00 0.00 N ATOM 977 CA ALA A 428 0.676 5.255 -3.807 1.00 0.00 C ATOM 978 C ALA A 428 0.175 3.821 -3.680 1.00 0.00 C ATOM 979 O ALA A 428 0.520 2.958 -4.486 1.00 0.00 O ATOM 980 CB ALA A 428 1.689 5.561 -2.713 1.00 0.00 C ATOM 0 H ALA A 428 -0.368 6.876 -2.986 1.00 0.00 H new ATOM 0 HA ALA A 428 1.162 5.357 -4.778 1.00 0.00 H new ATOM 0 HB1 ALA A 428 2.509 4.844 -2.765 1.00 0.00 H new ATOM 0 HB2 ALA A 428 2.079 6.569 -2.850 1.00 0.00 H new ATOM 0 HB3 ALA A 428 1.205 5.489 -1.739 1.00 0.00 H new ATOM 986 N MET A 429 -0.642 3.573 -2.661 1.00 0.00 N ATOM 987 CA MET A 429 -1.192 2.243 -2.428 1.00 0.00 C ATOM 988 C MET A 429 -2.039 1.789 -3.614 1.00 0.00 C ATOM 989 O MET A 429 -2.075 0.603 -3.944 1.00 0.00 O ATOM 990 CB MET A 429 -2.034 2.233 -1.151 1.00 0.00 C ATOM 991 CG MET A 429 -1.209 2.113 0.120 1.00 0.00 C ATOM 992 SD MET A 429 -2.155 1.445 1.503 1.00 0.00 S ATOM 993 CE MET A 429 -2.806 2.948 2.225 1.00 0.00 C ATOM 0 H MET A 429 -0.938 4.276 -1.984 1.00 0.00 H new ATOM 0 HA MET A 429 -0.360 1.548 -2.312 1.00 0.00 H new ATOM 0 HB2 MET A 429 -2.623 3.149 -1.107 1.00 0.00 H new ATOM 0 HB3 MET A 429 -2.739 1.403 -1.197 1.00 0.00 H new ATOM 0 HG2 MET A 429 -0.348 1.472 -0.070 1.00 0.00 H new ATOM 0 HG3 MET A 429 -0.821 3.095 0.391 1.00 0.00 H new ATOM 0 HE1 MET A 429 -3.415 2.700 3.094 1.00 0.00 H new ATOM 0 HE2 MET A 429 -1.981 3.591 2.532 1.00 0.00 H new ATOM 0 HE3 MET A 429 -3.419 3.469 1.489 1.00 0.00 H new ATOM 1003 N GLN A 430 -2.719 2.738 -4.248 1.00 0.00 N ATOM 1004 CA GLN A 430 -3.565 2.435 -5.395 1.00 0.00 C ATOM 1005 C GLN A 430 -2.722 2.061 -6.610 1.00 0.00 C ATOM 1006 O GLN A 430 -2.954 1.034 -7.247 1.00 0.00 O ATOM 1007 CB GLN A 430 -4.459 3.632 -5.728 1.00 0.00 C ATOM 1008 CG GLN A 430 -5.596 3.297 -6.679 1.00 0.00 C ATOM 1009 CD GLN A 430 -6.339 4.530 -7.156 1.00 0.00 C ATOM 1010 OE1 GLN A 430 -5.772 5.620 -7.230 1.00 0.00 O ATOM 1011 NE2 GLN A 430 -7.616 4.361 -7.480 1.00 0.00 N ATOM 0 H GLN A 430 -2.700 3.724 -3.986 1.00 0.00 H new ATOM 0 HA GLN A 430 -4.193 1.583 -5.135 1.00 0.00 H new ATOM 0 HB2 GLN A 430 -4.876 4.032 -4.804 1.00 0.00 H new ATOM 0 HB3 GLN A 430 -3.848 4.420 -6.169 1.00 0.00 H new ATOM 0 HG2 GLN A 430 -5.198 2.761 -7.541 1.00 0.00 H new ATOM 0 HG3 GLN A 430 -6.296 2.626 -6.181 1.00 0.00 H new ATOM 0 HE21 GLN A 430 -8.044 3.438 -7.403 1.00 0.00 H new ATOM 0 HE22 GLN A 430 -8.169 5.154 -7.806 1.00 0.00 H new ATOM 1020 N ASN A 431 -1.743 2.903 -6.926 1.00 0.00 N ATOM 1021 CA ASN A 431 -0.865 2.661 -8.064 1.00 0.00 C ATOM 1022 C ASN A 431 -0.104 1.350 -7.897 1.00 0.00 C ATOM 1023 O ASN A 431 0.157 0.643 -8.871 1.00 0.00 O ATOM 1024 CB ASN A 431 0.120 3.818 -8.231 1.00 0.00 C ATOM 1025 CG ASN A 431 -0.452 4.950 -9.063 1.00 0.00 C ATOM 1026 OD1 ASN A 431 -0.752 6.026 -8.546 1.00 0.00 O ATOM 1027 ND2 ASN A 431 -0.605 4.710 -10.361 1.00 0.00 N ATOM 0 H ASN A 431 -1.538 3.759 -6.410 1.00 0.00 H new ATOM 0 HA ASN A 431 -1.484 2.589 -8.958 1.00 0.00 H new ATOM 0 HB2 ASN A 431 0.399 4.198 -7.248 1.00 0.00 H new ATOM 0 HB3 ASN A 431 1.032 3.450 -8.701 1.00 0.00 H new ATOM 0 HD21 ASN A 431 -0.985 5.433 -10.972 1.00 0.00 H new ATOM 0 HD22 ASN A 431 -0.343 3.803 -10.746 1.00 0.00 H new ATOM 1034 N PHE A 432 0.252 1.033 -6.655 1.00 0.00 N ATOM 1035 CA PHE A 432 0.986 -0.192 -6.360 1.00 0.00 C ATOM 1036 C PHE A 432 0.072 -1.410 -6.455 1.00 0.00 C ATOM 1037 O PHE A 432 0.513 -2.501 -6.817 1.00 0.00 O ATOM 1038 CB PHE A 432 1.606 -0.114 -4.963 1.00 0.00 C ATOM 1039 CG PHE A 432 2.563 -1.234 -4.668 1.00 0.00 C ATOM 1040 CD1 PHE A 432 3.729 -1.378 -5.403 1.00 0.00 C ATOM 1041 CD2 PHE A 432 2.297 -2.142 -3.656 1.00 0.00 C ATOM 1042 CE1 PHE A 432 4.612 -2.406 -5.134 1.00 0.00 C ATOM 1043 CE2 PHE A 432 3.175 -3.173 -3.382 1.00 0.00 C ATOM 1044 CZ PHE A 432 4.334 -3.305 -4.122 1.00 0.00 C ATOM 0 H PHE A 432 0.044 1.607 -5.838 1.00 0.00 H new ATOM 0 HA PHE A 432 1.781 -0.298 -7.099 1.00 0.00 H new ATOM 0 HB2 PHE A 432 2.129 0.837 -4.859 1.00 0.00 H new ATOM 0 HB3 PHE A 432 0.809 -0.123 -4.220 1.00 0.00 H new ATOM 0 HD1 PHE A 432 3.950 -0.678 -6.195 1.00 0.00 H new ATOM 0 HD2 PHE A 432 1.392 -2.043 -3.074 1.00 0.00 H new ATOM 0 HE1 PHE A 432 5.518 -2.507 -5.714 1.00 0.00 H new ATOM 0 HE2 PHE A 432 2.956 -3.874 -2.591 1.00 0.00 H new ATOM 0 HZ PHE A 432 5.022 -4.110 -3.910 1.00 0.00 H new ATOM 1054 N LEU A 433 -1.202 -1.216 -6.129 1.00 0.00 N ATOM 1055 CA LEU A 433 -2.176 -2.298 -6.178 1.00 0.00 C ATOM 1056 C LEU A 433 -2.699 -2.499 -7.597 1.00 0.00 C ATOM 1057 O LEU A 433 -3.037 -3.614 -7.994 1.00 0.00 O ATOM 1058 CB LEU A 433 -3.341 -2.008 -5.230 1.00 0.00 C ATOM 1059 CG LEU A 433 -3.035 -2.208 -3.745 1.00 0.00 C ATOM 1060 CD1 LEU A 433 -3.999 -1.406 -2.887 1.00 0.00 C ATOM 1061 CD2 LEU A 433 -3.097 -3.684 -3.384 1.00 0.00 C ATOM 0 H LEU A 433 -1.583 -0.319 -5.828 1.00 0.00 H new ATOM 0 HA LEU A 433 -1.677 -3.214 -5.861 1.00 0.00 H new ATOM 0 HB2 LEU A 433 -3.666 -0.979 -5.383 1.00 0.00 H new ATOM 0 HB3 LEU A 433 -4.179 -2.650 -5.502 1.00 0.00 H new ATOM 0 HG LEU A 433 -2.025 -1.848 -3.550 1.00 0.00 H new ATOM 0 HD11 LEU A 433 -3.765 -1.562 -1.834 1.00 0.00 H new ATOM 0 HD12 LEU A 433 -3.905 -0.347 -3.127 1.00 0.00 H new ATOM 0 HD13 LEU A 433 -5.020 -1.733 -3.084 1.00 0.00 H new ATOM 0 HD21 LEU A 433 -2.877 -3.809 -2.324 1.00 0.00 H new ATOM 0 HD22 LEU A 433 -4.095 -4.069 -3.595 1.00 0.00 H new ATOM 0 HD23 LEU A 433 -2.364 -4.234 -3.974 1.00 0.00 H new ATOM 1073 N GLN A 434 -2.760 -1.412 -8.358 1.00 0.00 N ATOM 1074 CA GLN A 434 -3.241 -1.466 -9.734 1.00 0.00 C ATOM 1075 C GLN A 434 -2.156 -1.988 -10.672 1.00 0.00 C ATOM 1076 O GLN A 434 -2.453 -2.555 -11.723 1.00 0.00 O ATOM 1077 CB GLN A 434 -3.705 -0.080 -10.189 1.00 0.00 C ATOM 1078 CG GLN A 434 -5.209 0.116 -10.105 1.00 0.00 C ATOM 1079 CD GLN A 434 -5.764 -0.207 -8.732 1.00 0.00 C ATOM 1080 OE1 GLN A 434 -5.819 0.653 -7.853 1.00 0.00 O ATOM 1081 NE2 GLN A 434 -6.181 -1.454 -8.541 1.00 0.00 N ATOM 0 H GLN A 434 -2.482 -0.482 -8.045 1.00 0.00 H new ATOM 0 HA GLN A 434 -4.086 -2.154 -9.770 1.00 0.00 H new ATOM 0 HB2 GLN A 434 -3.214 0.677 -9.578 1.00 0.00 H new ATOM 0 HB3 GLN A 434 -3.383 0.082 -11.218 1.00 0.00 H new ATOM 0 HG2 GLN A 434 -5.452 1.148 -10.357 1.00 0.00 H new ATOM 0 HG3 GLN A 434 -5.696 -0.516 -10.847 1.00 0.00 H new ATOM 0 HE21 GLN A 434 -6.117 -2.135 -9.298 1.00 0.00 H new ATOM 0 HE22 GLN A 434 -6.565 -1.730 -7.638 1.00 0.00 H new ATOM 1090 N LEU A 435 -0.898 -1.793 -10.286 1.00 0.00 N ATOM 1091 CA LEU A 435 0.230 -2.244 -11.095 1.00 0.00 C ATOM 1092 C LEU A 435 0.135 -3.742 -11.383 1.00 0.00 C ATOM 1093 O LEU A 435 -0.558 -4.475 -10.677 1.00 0.00 O ATOM 1094 CB LEU A 435 1.548 -1.932 -10.386 1.00 0.00 C ATOM 1095 CG LEU A 435 2.146 -0.561 -10.703 1.00 0.00 C ATOM 1096 CD1 LEU A 435 3.147 -0.155 -9.633 1.00 0.00 C ATOM 1097 CD2 LEU A 435 2.804 -0.571 -12.074 1.00 0.00 C ATOM 0 H LEU A 435 -0.634 -1.326 -9.418 1.00 0.00 H new ATOM 0 HA LEU A 435 0.199 -1.710 -12.044 1.00 0.00 H new ATOM 0 HB2 LEU A 435 1.389 -2.002 -9.310 1.00 0.00 H new ATOM 0 HB3 LEU A 435 2.276 -2.699 -10.651 1.00 0.00 H new ATOM 0 HG LEU A 435 1.339 0.172 -10.714 1.00 0.00 H new ATOM 0 HD11 LEU A 435 3.562 0.823 -9.876 1.00 0.00 H new ATOM 0 HD12 LEU A 435 2.646 -0.107 -8.666 1.00 0.00 H new ATOM 0 HD13 LEU A 435 3.951 -0.890 -9.589 1.00 0.00 H new ATOM 0 HD21 LEU A 435 3.224 0.413 -12.283 1.00 0.00 H new ATOM 0 HD22 LEU A 435 3.599 -1.316 -12.090 1.00 0.00 H new ATOM 0 HD23 LEU A 435 2.061 -0.817 -12.833 1.00 0.00 H new ATOM 1109 N PRO A 436 0.835 -4.216 -12.429 1.00 0.00 N ATOM 1110 CA PRO A 436 0.828 -5.632 -12.807 1.00 0.00 C ATOM 1111 C PRO A 436 1.150 -6.549 -11.633 1.00 0.00 C ATOM 1112 O PRO A 436 1.998 -6.230 -10.798 1.00 0.00 O ATOM 1113 CB PRO A 436 1.925 -5.721 -13.872 1.00 0.00 C ATOM 1114 CG PRO A 436 2.004 -4.351 -14.448 1.00 0.00 C ATOM 1115 CD PRO A 436 1.688 -3.408 -13.321 1.00 0.00 C ATOM 0 HA PRO A 436 -0.153 -5.954 -13.157 1.00 0.00 H new ATOM 0 HB2 PRO A 436 2.877 -6.023 -13.436 1.00 0.00 H new ATOM 0 HB3 PRO A 436 1.677 -6.458 -14.636 1.00 0.00 H new ATOM 0 HG2 PRO A 436 2.997 -4.155 -14.854 1.00 0.00 H new ATOM 0 HG3 PRO A 436 1.295 -4.231 -15.267 1.00 0.00 H new ATOM 0 HD2 PRO A 436 2.592 -3.070 -12.815 1.00 0.00 H new ATOM 0 HD3 PRO A 436 1.169 -2.518 -13.676 1.00 0.00 H new ATOM 1123 N GLU A 437 0.470 -7.689 -11.573 1.00 0.00 N ATOM 1124 CA GLU A 437 0.685 -8.653 -10.500 1.00 0.00 C ATOM 1125 C GLU A 437 2.103 -9.209 -10.545 1.00 0.00 C ATOM 1126 O GLU A 437 2.738 -9.406 -9.508 1.00 0.00 O ATOM 1127 CB GLU A 437 -0.328 -9.794 -10.601 1.00 0.00 C ATOM 1128 CG GLU A 437 -0.228 -10.798 -9.464 1.00 0.00 C ATOM 1129 CD GLU A 437 -1.064 -12.039 -9.706 1.00 0.00 C ATOM 1130 OE1 GLU A 437 -2.277 -11.895 -9.967 1.00 0.00 O ATOM 1131 OE2 GLU A 437 -0.507 -13.154 -9.634 1.00 0.00 O ATOM 0 H GLU A 437 -0.235 -7.968 -12.255 1.00 0.00 H new ATOM 0 HA GLU A 437 0.547 -8.138 -9.549 1.00 0.00 H new ATOM 0 HB2 GLU A 437 -1.334 -9.375 -10.617 1.00 0.00 H new ATOM 0 HB3 GLU A 437 -0.184 -10.314 -11.548 1.00 0.00 H new ATOM 0 HG2 GLU A 437 0.814 -11.087 -9.330 1.00 0.00 H new ATOM 0 HG3 GLU A 437 -0.549 -10.324 -8.536 1.00 0.00 H new ATOM 1138 N ALA A 438 2.596 -9.465 -11.753 1.00 0.00 N ATOM 1139 CA ALA A 438 3.940 -10.000 -11.933 1.00 0.00 C ATOM 1140 C ALA A 438 4.993 -9.023 -11.422 1.00 0.00 C ATOM 1141 O ALA A 438 6.046 -9.429 -10.930 1.00 0.00 O ATOM 1142 CB ALA A 438 4.186 -10.325 -13.399 1.00 0.00 C ATOM 0 H ALA A 438 2.084 -9.310 -12.622 1.00 0.00 H new ATOM 0 HA ALA A 438 4.020 -10.917 -11.350 1.00 0.00 H new ATOM 0 HB1 ALA A 438 5.193 -10.724 -13.519 1.00 0.00 H new ATOM 0 HB2 ALA A 438 3.460 -11.066 -13.734 1.00 0.00 H new ATOM 0 HB3 ALA A 438 4.081 -9.419 -13.995 1.00 0.00 H new ATOM 1148 N GLU A 439 4.701 -7.731 -11.540 1.00 0.00 N ATOM 1149 CA GLU A 439 5.623 -6.695 -11.090 1.00 0.00 C ATOM 1150 C GLU A 439 5.664 -6.630 -9.566 1.00 0.00 C ATOM 1151 O GLU A 439 6.729 -6.463 -8.970 1.00 0.00 O ATOM 1152 CB GLU A 439 5.215 -5.336 -11.663 1.00 0.00 C ATOM 1153 CG GLU A 439 6.126 -4.848 -12.778 1.00 0.00 C ATOM 1154 CD GLU A 439 7.067 -3.750 -12.324 1.00 0.00 C ATOM 1155 OE1 GLU A 439 6.660 -2.569 -12.349 1.00 0.00 O ATOM 1156 OE2 GLU A 439 8.214 -4.071 -11.941 1.00 0.00 O ATOM 0 H GLU A 439 3.833 -7.377 -11.943 1.00 0.00 H new ATOM 0 HA GLU A 439 6.620 -6.947 -11.451 1.00 0.00 H new ATOM 0 HB2 GLU A 439 4.195 -5.402 -12.041 1.00 0.00 H new ATOM 0 HB3 GLU A 439 5.210 -4.599 -10.860 1.00 0.00 H new ATOM 0 HG2 GLU A 439 6.709 -5.687 -13.159 1.00 0.00 H new ATOM 0 HG3 GLU A 439 5.518 -4.481 -13.605 1.00 0.00 H new ATOM 1163 N ARG A 440 4.498 -6.764 -8.942 1.00 0.00 N ATOM 1164 CA ARG A 440 4.400 -6.720 -7.487 1.00 0.00 C ATOM 1165 C ARG A 440 5.241 -7.822 -6.851 1.00 0.00 C ATOM 1166 O ARG A 440 5.908 -7.603 -5.840 1.00 0.00 O ATOM 1167 CB ARG A 440 2.942 -6.858 -7.049 1.00 0.00 C ATOM 1168 CG ARG A 440 2.086 -5.650 -7.392 1.00 0.00 C ATOM 1169 CD ARG A 440 0.837 -5.587 -6.527 1.00 0.00 C ATOM 1170 NE ARG A 440 0.021 -6.792 -6.655 1.00 0.00 N ATOM 1171 CZ ARG A 440 -0.744 -7.061 -7.710 1.00 0.00 C ATOM 1172 NH1 ARG A 440 -0.801 -6.212 -8.730 1.00 0.00 N ATOM 1173 NH2 ARG A 440 -1.455 -8.179 -7.746 1.00 0.00 N ATOM 0 H ARG A 440 3.608 -6.904 -9.421 1.00 0.00 H new ATOM 0 HA ARG A 440 4.783 -5.756 -7.151 1.00 0.00 H new ATOM 0 HB2 ARG A 440 2.512 -7.742 -7.519 1.00 0.00 H new ATOM 0 HB3 ARG A 440 2.909 -7.022 -5.972 1.00 0.00 H new ATOM 0 HG2 ARG A 440 2.670 -4.739 -7.257 1.00 0.00 H new ATOM 0 HG3 ARG A 440 1.800 -5.692 -8.443 1.00 0.00 H new ATOM 0 HD2 ARG A 440 1.125 -5.453 -5.484 1.00 0.00 H new ATOM 0 HD3 ARG A 440 0.245 -4.716 -6.809 1.00 0.00 H new ATOM 0 HE ARG A 440 0.039 -7.467 -5.890 1.00 0.00 H new ATOM 0 HH11 ARG A 440 -0.257 -5.350 -8.707 1.00 0.00 H new ATOM 0 HH12 ARG A 440 -1.389 -6.423 -9.537 1.00 0.00 H new ATOM 0 HH21 ARG A 440 -1.416 -8.834 -6.965 1.00 0.00 H new ATOM 0 HH22 ARG A 440 -2.041 -8.385 -8.555 1.00 0.00 H new ATOM 1187 N ASP A 441 5.204 -9.008 -7.450 1.00 0.00 N ATOM 1188 CA ASP A 441 5.963 -10.145 -6.941 1.00 0.00 C ATOM 1189 C ASP A 441 7.459 -9.853 -6.959 1.00 0.00 C ATOM 1190 O ASP A 441 8.164 -10.120 -5.987 1.00 0.00 O ATOM 1191 CB ASP A 441 5.664 -11.394 -7.773 1.00 0.00 C ATOM 1192 CG ASP A 441 5.620 -12.654 -6.928 1.00 0.00 C ATOM 1193 OD1 ASP A 441 4.597 -12.874 -6.247 1.00 0.00 O ATOM 1194 OD2 ASP A 441 6.607 -13.418 -6.948 1.00 0.00 O ATOM 0 H ASP A 441 4.657 -9.207 -8.288 1.00 0.00 H new ATOM 0 HA ASP A 441 5.660 -10.322 -5.909 1.00 0.00 H new ATOM 0 HB2 ASP A 441 4.709 -11.268 -8.283 1.00 0.00 H new ATOM 0 HB3 ASP A 441 6.425 -11.504 -8.545 1.00 0.00 H new ATOM 1199 N ARG A 442 7.937 -9.302 -8.070 1.00 0.00 N ATOM 1200 CA ARG A 442 9.351 -8.974 -8.214 1.00 0.00 C ATOM 1201 C ARG A 442 9.783 -7.959 -7.159 1.00 0.00 C ATOM 1202 O ARG A 442 10.861 -8.077 -6.577 1.00 0.00 O ATOM 1203 CB ARG A 442 9.629 -8.423 -9.612 1.00 0.00 C ATOM 1204 CG ARG A 442 11.046 -8.684 -10.098 1.00 0.00 C ATOM 1205 CD ARG A 442 11.104 -8.787 -11.614 1.00 0.00 C ATOM 1206 NE ARG A 442 12.322 -8.188 -12.156 1.00 0.00 N ATOM 1207 CZ ARG A 442 13.512 -8.784 -12.136 1.00 0.00 C ATOM 1208 NH1 ARG A 442 13.651 -9.993 -11.603 1.00 0.00 N ATOM 1209 NH2 ARG A 442 14.569 -8.171 -12.651 1.00 0.00 N ATOM 0 H ARG A 442 7.366 -9.073 -8.884 1.00 0.00 H new ATOM 0 HA ARG A 442 9.927 -9.888 -8.071 1.00 0.00 H new ATOM 0 HB2 ARG A 442 8.925 -8.867 -10.315 1.00 0.00 H new ATOM 0 HB3 ARG A 442 9.445 -7.349 -9.613 1.00 0.00 H new ATOM 0 HG2 ARG A 442 11.701 -7.881 -9.761 1.00 0.00 H new ATOM 0 HG3 ARG A 442 11.420 -9.607 -9.655 1.00 0.00 H new ATOM 0 HD2 ARG A 442 11.053 -9.835 -11.909 1.00 0.00 H new ATOM 0 HD3 ARG A 442 10.234 -8.292 -12.045 1.00 0.00 H new ATOM 0 HE ARG A 442 12.256 -7.260 -12.574 1.00 0.00 H new ATOM 0 HH11 ARG A 442 12.842 -10.471 -11.205 1.00 0.00 H new ATOM 0 HH12 ARG A 442 14.566 -10.443 -11.591 1.00 0.00 H new ATOM 0 HH21 ARG A 442 14.470 -7.243 -13.062 1.00 0.00 H new ATOM 0 HH22 ARG A 442 15.481 -8.628 -12.636 1.00 0.00 H new ATOM 1223 N ILE A 443 8.936 -6.964 -6.919 1.00 0.00 N ATOM 1224 CA ILE A 443 9.231 -5.929 -5.936 1.00 0.00 C ATOM 1225 C ILE A 443 9.140 -6.480 -4.517 1.00 0.00 C ATOM 1226 O ILE A 443 9.888 -6.067 -3.630 1.00 0.00 O ATOM 1227 CB ILE A 443 8.273 -4.731 -6.074 1.00 0.00 C ATOM 1228 CG1 ILE A 443 8.228 -4.247 -7.524 1.00 0.00 C ATOM 1229 CG2 ILE A 443 8.698 -3.601 -5.147 1.00 0.00 C ATOM 1230 CD1 ILE A 443 6.949 -3.519 -7.880 1.00 0.00 C ATOM 0 H ILE A 443 8.039 -6.853 -7.392 1.00 0.00 H new ATOM 0 HA ILE A 443 10.249 -5.591 -6.128 1.00 0.00 H new ATOM 0 HB ILE A 443 7.272 -5.054 -5.788 1.00 0.00 H new ATOM 0 HG12 ILE A 443 9.075 -3.585 -7.704 1.00 0.00 H new ATOM 0 HG13 ILE A 443 8.346 -5.103 -8.188 1.00 0.00 H new ATOM 0 HG21 ILE A 443 8.011 -2.762 -5.257 1.00 0.00 H new ATOM 0 HG22 ILE A 443 8.681 -3.951 -4.115 1.00 0.00 H new ATOM 0 HG23 ILE A 443 9.707 -3.279 -5.404 1.00 0.00 H new ATOM 0 HD11 ILE A 443 6.987 -3.205 -8.923 1.00 0.00 H new ATOM 0 HD12 ILE A 443 6.098 -4.185 -7.733 1.00 0.00 H new ATOM 0 HD13 ILE A 443 6.839 -2.643 -7.241 1.00 0.00 H new ATOM 1242 N TYR A 444 8.217 -7.413 -4.307 1.00 0.00 N ATOM 1243 CA TYR A 444 8.028 -8.020 -2.995 1.00 0.00 C ATOM 1244 C TYR A 444 9.241 -8.856 -2.600 1.00 0.00 C ATOM 1245 O TYR A 444 9.572 -8.969 -1.420 1.00 0.00 O ATOM 1246 CB TYR A 444 6.769 -8.889 -2.988 1.00 0.00 C ATOM 1247 CG TYR A 444 5.485 -8.098 -2.878 1.00 0.00 C ATOM 1248 CD1 TYR A 444 5.364 -7.059 -1.965 1.00 0.00 C ATOM 1249 CD2 TYR A 444 4.396 -8.391 -3.688 1.00 0.00 C ATOM 1250 CE1 TYR A 444 4.191 -6.334 -1.861 1.00 0.00 C ATOM 1251 CE2 TYR A 444 3.221 -7.669 -3.591 1.00 0.00 C ATOM 1252 CZ TYR A 444 3.124 -6.642 -2.677 1.00 0.00 C ATOM 1253 OH TYR A 444 1.957 -5.922 -2.577 1.00 0.00 O ATOM 0 H TYR A 444 7.588 -7.765 -5.029 1.00 0.00 H new ATOM 0 HA TYR A 444 7.911 -7.218 -2.266 1.00 0.00 H new ATOM 0 HB2 TYR A 444 6.743 -9.482 -3.902 1.00 0.00 H new ATOM 0 HB3 TYR A 444 6.826 -9.589 -2.155 1.00 0.00 H new ATOM 0 HD1 TYR A 444 6.199 -6.813 -1.326 1.00 0.00 H new ATOM 0 HD2 TYR A 444 4.468 -9.195 -4.405 1.00 0.00 H new ATOM 0 HE1 TYR A 444 4.111 -5.530 -1.144 1.00 0.00 H new ATOM 0 HE2 TYR A 444 2.383 -7.909 -4.229 1.00 0.00 H new ATOM 0 HH TYR A 444 1.305 -6.265 -3.223 1.00 0.00 H new ATOM 1263 N GLN A 445 9.899 -9.439 -3.596 1.00 0.00 N ATOM 1264 CA GLN A 445 11.077 -10.265 -3.353 1.00 0.00 C ATOM 1265 C GLN A 445 12.347 -9.421 -3.376 1.00 0.00 C ATOM 1266 O GLN A 445 13.147 -9.458 -2.441 1.00 0.00 O ATOM 1267 CB GLN A 445 11.170 -11.377 -4.399 1.00 0.00 C ATOM 1268 CG GLN A 445 10.472 -12.663 -3.985 1.00 0.00 C ATOM 1269 CD GLN A 445 10.670 -13.782 -4.988 1.00 0.00 C ATOM 1270 OE1 GLN A 445 11.792 -14.228 -5.224 1.00 0.00 O ATOM 1271 NE2 GLN A 445 9.577 -14.243 -5.585 1.00 0.00 N ATOM 0 H GLN A 445 9.637 -9.355 -4.578 1.00 0.00 H new ATOM 0 HA GLN A 445 10.979 -10.713 -2.364 1.00 0.00 H new ATOM 0 HB2 GLN A 445 10.735 -11.022 -5.334 1.00 0.00 H new ATOM 0 HB3 GLN A 445 12.220 -11.591 -4.597 1.00 0.00 H new ATOM 0 HG2 GLN A 445 10.849 -12.980 -3.013 1.00 0.00 H new ATOM 0 HG3 GLN A 445 9.406 -12.471 -3.866 1.00 0.00 H new ATOM 0 HE21 GLN A 445 8.666 -13.844 -5.359 1.00 0.00 H new ATOM 0 HE22 GLN A 445 9.649 -14.996 -6.269 1.00 0.00 H new ATOM 1280 N ASP A 446 12.526 -8.660 -4.451 1.00 0.00 N ATOM 1281 CA ASP A 446 13.699 -7.807 -4.597 1.00 0.00 C ATOM 1282 C ASP A 446 13.737 -6.744 -3.504 1.00 0.00 C ATOM 1283 O ASP A 446 13.031 -5.738 -3.580 1.00 0.00 O ATOM 1284 CB ASP A 446 13.702 -7.141 -5.974 1.00 0.00 C ATOM 1285 CG ASP A 446 15.050 -6.540 -6.322 1.00 0.00 C ATOM 1286 OD1 ASP A 446 16.053 -7.284 -6.313 1.00 0.00 O ATOM 1287 OD2 ASP A 446 15.103 -5.324 -6.603 1.00 0.00 O ATOM 0 H ASP A 446 11.873 -8.617 -5.234 1.00 0.00 H new ATOM 0 HA ASP A 446 14.587 -8.432 -4.502 1.00 0.00 H new ATOM 0 HB2 ASP A 446 13.429 -7.876 -6.731 1.00 0.00 H new ATOM 0 HB3 ASP A 446 12.942 -6.360 -5.999 1.00 0.00 H new ATOM 1292 N GLU A 447 14.566 -6.973 -2.491 1.00 0.00 N ATOM 1293 CA GLU A 447 14.696 -6.034 -1.383 1.00 0.00 C ATOM 1294 C GLU A 447 16.121 -5.494 -1.294 1.00 0.00 C ATOM 1295 O GLU A 447 16.936 -5.714 -2.190 1.00 0.00 O ATOM 1296 CB GLU A 447 14.307 -6.710 -0.066 1.00 0.00 C ATOM 1297 CG GLU A 447 12.993 -6.207 0.510 1.00 0.00 C ATOM 1298 CD GLU A 447 12.808 -6.594 1.965 1.00 0.00 C ATOM 1299 OE1 GLU A 447 12.796 -7.807 2.259 1.00 0.00 O ATOM 1300 OE2 GLU A 447 12.674 -5.682 2.808 1.00 0.00 O ATOM 0 H GLU A 447 15.158 -7.800 -2.414 1.00 0.00 H new ATOM 0 HA GLU A 447 14.021 -5.197 -1.565 1.00 0.00 H new ATOM 0 HB2 GLU A 447 14.236 -7.786 -0.226 1.00 0.00 H new ATOM 0 HB3 GLU A 447 15.100 -6.548 0.664 1.00 0.00 H new ATOM 0 HG2 GLU A 447 12.952 -5.122 0.419 1.00 0.00 H new ATOM 0 HG3 GLU A 447 12.166 -6.608 -0.077 1.00 0.00 H new ATOM 1307 N ARG A 448 16.413 -4.788 -0.206 1.00 0.00 N ATOM 1308 CA ARG A 448 17.739 -4.218 -0.001 1.00 0.00 C ATOM 1309 C ARG A 448 18.723 -5.283 0.472 1.00 0.00 C ATOM 1310 O ARG A 448 18.543 -5.883 1.532 1.00 0.00 O ATOM 1311 CB ARG A 448 17.674 -3.080 1.019 1.00 0.00 C ATOM 1312 CG ARG A 448 17.112 -1.786 0.453 1.00 0.00 C ATOM 1313 CD ARG A 448 18.220 -0.829 0.041 1.00 0.00 C ATOM 1314 NE ARG A 448 17.908 -0.134 -1.205 1.00 0.00 N ATOM 1315 CZ ARG A 448 18.512 0.984 -1.601 1.00 0.00 C ATOM 1316 NH1 ARG A 448 19.459 1.536 -0.854 1.00 0.00 N ATOM 1317 NH2 ARG A 448 18.169 1.552 -2.751 1.00 0.00 N ATOM 0 H ARG A 448 15.750 -4.597 0.546 1.00 0.00 H new ATOM 0 HA ARG A 448 18.089 -3.824 -0.955 1.00 0.00 H new ATOM 0 HB2 ARG A 448 17.060 -3.394 1.863 1.00 0.00 H new ATOM 0 HB3 ARG A 448 18.676 -2.893 1.406 1.00 0.00 H new ATOM 0 HG2 ARG A 448 16.483 -2.008 -0.409 1.00 0.00 H new ATOM 0 HG3 ARG A 448 16.476 -1.308 1.198 1.00 0.00 H new ATOM 0 HD2 ARG A 448 18.381 -0.098 0.833 1.00 0.00 H new ATOM 0 HD3 ARG A 448 19.152 -1.382 -0.076 1.00 0.00 H new ATOM 0 HE ARG A 448 17.185 -0.528 -1.807 1.00 0.00 H new ATOM 0 HH11 ARG A 448 19.728 1.104 0.030 1.00 0.00 H new ATOM 0 HH12 ARG A 448 19.918 2.393 -1.163 1.00 0.00 H new ATOM 0 HH21 ARG A 448 17.443 1.132 -3.331 1.00 0.00 H new ATOM 0 HH22 ARG A 448 18.632 2.409 -3.055 1.00 0.00 H new ATOM 1331 N GLU A 449 19.764 -5.513 -0.321 1.00 0.00 N ATOM 1332 CA GLU A 449 20.777 -6.507 0.017 1.00 0.00 C ATOM 1333 C GLU A 449 21.586 -6.067 1.232 1.00 0.00 C ATOM 1334 O GLU A 449 21.419 -4.955 1.733 1.00 0.00 O ATOM 1335 CB GLU A 449 21.710 -6.740 -1.175 1.00 0.00 C ATOM 1336 CG GLU A 449 22.219 -8.169 -1.275 1.00 0.00 C ATOM 1337 CD GLU A 449 21.711 -8.885 -2.511 1.00 0.00 C ATOM 1338 OE1 GLU A 449 21.471 -8.209 -3.534 1.00 0.00 O ATOM 1339 OE2 GLU A 449 21.550 -10.123 -2.456 1.00 0.00 O ATOM 0 H GLU A 449 19.929 -5.025 -1.202 1.00 0.00 H new ATOM 0 HA GLU A 449 20.269 -7.440 0.260 1.00 0.00 H new ATOM 0 HB2 GLU A 449 21.183 -6.485 -2.094 1.00 0.00 H new ATOM 0 HB3 GLU A 449 22.561 -6.064 -1.098 1.00 0.00 H new ATOM 0 HG2 GLU A 449 23.309 -8.162 -1.286 1.00 0.00 H new ATOM 0 HG3 GLU A 449 21.913 -8.723 -0.387 1.00 0.00 H new ATOM 1346 N ARG A 450 22.465 -6.946 1.700 1.00 0.00 N ATOM 1347 CA ARG A 450 23.302 -6.649 2.858 1.00 0.00 C ATOM 1348 C ARG A 450 24.546 -5.872 2.444 1.00 0.00 C ATOM 1349 O ARG A 450 24.831 -4.803 2.985 1.00 0.00 O ATOM 1350 CB ARG A 450 23.706 -7.943 3.567 1.00 0.00 C ATOM 1351 CG ARG A 450 24.258 -7.722 4.966 1.00 0.00 C ATOM 1352 CD ARG A 450 25.777 -7.734 4.977 1.00 0.00 C ATOM 1353 NE ARG A 450 26.313 -8.197 6.254 1.00 0.00 N ATOM 1354 CZ ARG A 450 26.395 -7.435 7.342 1.00 0.00 C ATOM 1355 NH1 ARG A 450 25.980 -6.174 7.312 1.00 0.00 N ATOM 1356 NH2 ARG A 450 26.896 -7.934 8.464 1.00 0.00 N ATOM 0 H ARG A 450 22.617 -7.870 1.296 1.00 0.00 H new ATOM 0 HA ARG A 450 22.723 -6.033 3.546 1.00 0.00 H new ATOM 0 HB2 ARG A 450 22.839 -8.601 3.627 1.00 0.00 H new ATOM 0 HB3 ARG A 450 24.456 -8.458 2.966 1.00 0.00 H new ATOM 0 HG2 ARG A 450 23.898 -6.769 5.353 1.00 0.00 H new ATOM 0 HG3 ARG A 450 23.883 -8.499 5.633 1.00 0.00 H new ATOM 0 HD2 ARG A 450 26.140 -8.379 4.177 1.00 0.00 H new ATOM 0 HD3 ARG A 450 26.149 -6.730 4.771 1.00 0.00 H new ATOM 0 HE ARG A 450 26.644 -9.160 6.316 1.00 0.00 H new ATOM 0 HH11 ARG A 450 25.596 -5.784 6.452 1.00 0.00 H new ATOM 0 HH12 ARG A 450 26.046 -5.595 8.149 1.00 0.00 H new ATOM 0 HH21 ARG A 450 27.218 -8.901 8.493 1.00 0.00 H new ATOM 0 HH22 ARG A 450 26.959 -7.350 9.298 1.00 0.00 H new ATOM 1370 N SER A 451 25.284 -6.413 1.481 1.00 0.00 N ATOM 1371 CA SER A 451 26.499 -5.769 0.994 1.00 0.00 C ATOM 1372 C SER A 451 26.224 -4.986 -0.284 1.00 0.00 C ATOM 1373 O SER A 451 26.100 -5.564 -1.365 1.00 0.00 O ATOM 1374 CB SER A 451 27.589 -6.813 0.742 1.00 0.00 C ATOM 1375 OG SER A 451 27.025 -8.072 0.418 1.00 0.00 O ATOM 0 H SER A 451 25.062 -7.296 1.022 1.00 0.00 H new ATOM 0 HA SER A 451 26.843 -5.072 1.759 1.00 0.00 H new ATOM 0 HB2 SER A 451 28.234 -6.480 -0.071 1.00 0.00 H new ATOM 0 HB3 SER A 451 28.216 -6.909 1.628 1.00 0.00 H new ATOM 0 HG SER A 451 27.742 -8.721 0.260 1.00 0.00 H new ATOM 1381 N LEU A 452 26.130 -3.665 -0.154 1.00 0.00 N ATOM 1382 CA LEU A 452 25.871 -2.802 -1.300 1.00 0.00 C ATOM 1383 C LEU A 452 27.177 -2.359 -1.954 1.00 0.00 C ATOM 1384 O LEU A 452 27.512 -1.173 -1.957 1.00 0.00 O ATOM 1385 CB LEU A 452 25.058 -1.578 -0.868 1.00 0.00 C ATOM 1386 CG LEU A 452 23.541 -1.760 -0.917 1.00 0.00 C ATOM 1387 CD1 LEU A 452 22.844 -0.626 -0.181 1.00 0.00 C ATOM 1388 CD2 LEU A 452 23.061 -1.838 -2.359 1.00 0.00 C ATOM 0 H LEU A 452 26.229 -3.171 0.733 1.00 0.00 H new ATOM 0 HA LEU A 452 25.297 -3.371 -2.031 1.00 0.00 H new ATOM 0 HB2 LEU A 452 25.344 -1.311 0.149 1.00 0.00 H new ATOM 0 HB3 LEU A 452 25.329 -0.737 -1.506 1.00 0.00 H new ATOM 0 HG LEU A 452 23.289 -2.697 -0.420 1.00 0.00 H new ATOM 0 HD11 LEU A 452 21.765 -0.772 -0.226 1.00 0.00 H new ATOM 0 HD12 LEU A 452 23.166 -0.616 0.860 1.00 0.00 H new ATOM 0 HD13 LEU A 452 23.101 0.324 -0.649 1.00 0.00 H new ATOM 0 HD21 LEU A 452 21.979 -1.968 -2.376 1.00 0.00 H new ATOM 0 HD22 LEU A 452 23.324 -0.918 -2.880 1.00 0.00 H new ATOM 0 HD23 LEU A 452 23.536 -2.685 -2.855 1.00 0.00 H new ATOM 1400 N ASN A 453 27.912 -3.319 -2.504 1.00 0.00 N ATOM 1401 CA ASN A 453 29.182 -3.029 -3.160 1.00 0.00 C ATOM 1402 C ASN A 453 29.361 -3.893 -4.404 1.00 0.00 C ATOM 1403 O ASN A 453 29.246 -3.409 -5.530 1.00 0.00 O ATOM 1404 CB ASN A 453 30.344 -3.256 -2.190 1.00 0.00 C ATOM 1405 CG ASN A 453 31.170 -2.003 -1.975 1.00 0.00 C ATOM 1406 OD1 ASN A 453 32.368 -1.980 -2.256 1.00 0.00 O ATOM 1407 ND2 ASN A 453 30.532 -0.952 -1.472 1.00 0.00 N ATOM 0 H ASN A 453 27.650 -4.305 -2.509 1.00 0.00 H new ATOM 0 HA ASN A 453 29.175 -1.983 -3.467 1.00 0.00 H new ATOM 0 HB2 ASN A 453 29.953 -3.599 -1.232 1.00 0.00 H new ATOM 0 HB3 ASN A 453 30.985 -4.049 -2.575 1.00 0.00 H new ATOM 0 HD21 ASN A 453 31.036 -0.081 -1.304 1.00 0.00 H new ATOM 0 HD22 ASN A 453 29.538 -1.016 -1.254 1.00 0.00 H new ATOM 1414 N ALA A 454 29.642 -5.174 -4.193 1.00 0.00 N ATOM 1415 CA ALA A 454 29.837 -6.106 -5.297 1.00 0.00 C ATOM 1416 C ALA A 454 28.558 -6.270 -6.110 1.00 0.00 C ATOM 1417 O ALA A 454 27.499 -6.577 -5.562 1.00 0.00 O ATOM 1418 CB ALA A 454 30.307 -7.454 -4.773 1.00 0.00 C ATOM 0 H ALA A 454 29.740 -5.591 -3.267 1.00 0.00 H new ATOM 0 HA ALA A 454 30.604 -5.696 -5.954 1.00 0.00 H new ATOM 0 HB1 ALA A 454 30.448 -8.140 -5.608 1.00 0.00 H new ATOM 0 HB2 ALA A 454 31.251 -7.329 -4.242 1.00 0.00 H new ATOM 0 HB3 ALA A 454 29.559 -7.861 -4.092 1.00 0.00 H new ATOM 1424 N ALA A 455 28.662 -6.062 -7.417 1.00 0.00 N ATOM 1425 CA ALA A 455 27.512 -6.186 -8.305 1.00 0.00 C ATOM 1426 C ALA A 455 27.463 -7.567 -8.949 1.00 0.00 C ATOM 1427 O ALA A 455 26.361 -7.990 -9.358 1.00 0.00 O ATOM 1428 CB ALA A 455 27.553 -5.104 -9.376 1.00 0.00 C ATOM 0 H ALA A 455 29.531 -5.807 -7.886 1.00 0.00 H new ATOM 0 HA ALA A 455 26.608 -6.059 -7.709 1.00 0.00 H new ATOM 0 HB1 ALA A 455 26.689 -5.208 -10.032 1.00 0.00 H new ATOM 0 HB2 ALA A 455 27.533 -4.122 -8.903 1.00 0.00 H new ATOM 0 HB3 ALA A 455 28.467 -5.206 -9.961 1.00 0.00 H new TER 1434 ALA A 455