USER MOD reduce.3.24.130724 H: found=0, std=0, add=714, rem=0, adj=13 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 368 ASN : amide:sc= 0.319 K(o=1.5,f=0.57) USER MOD Set 1.2: A 369 THR OG1 : rot 67:sc= 1.14 USER MOD Single : A 372 SER OG : rot 180:sc= 0 USER MOD Single : A 373 SER OG : rot -6:sc=0.000586 USER MOD Single : A 376 TYR OH : rot -132:sc= -0.907! USER MOD Single : A 377 GLN : amide:sc= 0 X(o=0,f=0) 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 390 GLN : amide:sc= -0.134 X(o=-0.13,f=-0.39) USER MOD Single : A 399 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 401 THR OG1 : rot 180:sc= 0.0544 USER MOD Single : A 402 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 406 SER OG : rot 180:sc= 0 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= 0.00395 USER MOD Single : A 419 SER OG : rot 180:sc= 0 USER MOD Single : A 420 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 421 SER OG : rot 180:sc= 0 USER MOD Single : A 425 ASN : amide:sc= 0.707 K(o=0.71,f=-0.22!) USER MOD Single : A 429 MET CE :methyl 174:sc= 0 (180deg=-0.0426) USER MOD Single : A 430 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 431 ASN : amide:sc= -0.0226 X(o=-0.023,f=0) USER MOD Single : A 434 GLN : amide:sc= -0.0677 K(o=-0.068,f=-1.7!) USER MOD Single : A 444 TYR OH : rot -23:sc= 0.52 USER MOD Single : A 445 GLN : amide:sc=-0.00192 X(o=-0.0019,f=0.015) USER MOD Single : A 451 SER OG : rot 41:sc= 0.647 USER MOD Single : A 453 ASN : amide:sc= -1.46 K(o=-1.5,f=-3!) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 368 -6.925 6.862 -10.753 1.00 0.00 N ATOM 2 CA ASN A 368 -7.194 7.576 -12.029 1.00 0.00 C ATOM 3 C ASN A 368 -7.596 9.028 -11.779 1.00 0.00 C ATOM 4 O ASN A 368 -7.088 9.942 -12.429 1.00 0.00 O ATOM 5 CB ASN A 368 -8.308 6.841 -12.778 1.00 0.00 C ATOM 6 CG ASN A 368 -9.567 6.695 -11.946 1.00 0.00 C ATOM 7 OD1 ASN A 368 -10.470 7.530 -12.014 1.00 0.00 O ATOM 8 ND2 ASN A 368 -9.633 5.630 -11.155 1.00 0.00 N ATOM 0 HA ASN A 368 -6.283 7.587 -12.628 1.00 0.00 H new ATOM 0 HB2 ASN A 368 -8.543 7.381 -13.695 1.00 0.00 H new ATOM 0 HB3 ASN A 368 -7.954 5.853 -13.072 1.00 0.00 H new ATOM 0 HD21 ASN A 368 -10.456 5.478 -10.572 1.00 0.00 H new ATOM 0 HD22 ASN A 368 -8.861 4.964 -11.131 1.00 0.00 H new ATOM 15 N THR A 369 -8.510 9.233 -10.837 1.00 0.00 N ATOM 16 CA THR A 369 -8.976 10.572 -10.504 1.00 0.00 C ATOM 17 C THR A 369 -9.416 10.657 -9.045 1.00 0.00 C ATOM 18 O THR A 369 -8.961 11.523 -8.300 1.00 0.00 O ATOM 19 CB THR A 369 -10.149 10.999 -11.409 1.00 0.00 C ATOM 20 OG1 THR A 369 -10.204 10.162 -12.569 1.00 0.00 O ATOM 21 CG2 THR A 369 -10.006 12.454 -11.833 1.00 0.00 C ATOM 0 H THR A 369 -8.942 8.488 -10.291 1.00 0.00 H new ATOM 0 HA THR A 369 -8.136 11.248 -10.666 1.00 0.00 H new ATOM 0 HB THR A 369 -11.073 10.892 -10.841 1.00 0.00 H new ATOM 0 HG1 THR A 369 -10.442 9.249 -12.303 1.00 0.00 H new ATOM 0 HG21 THR A 369 -10.845 12.731 -12.471 1.00 0.00 H new ATOM 0 HG22 THR A 369 -9.996 13.091 -10.949 1.00 0.00 H new ATOM 0 HG23 THR A 369 -9.074 12.583 -12.384 1.00 0.00 H new ATOM 29 N GLU A 370 -10.301 9.750 -8.647 1.00 0.00 N ATOM 30 CA GLU A 370 -10.802 9.722 -7.278 1.00 0.00 C ATOM 31 C GLU A 370 -10.659 8.328 -6.677 1.00 0.00 C ATOM 32 O GLU A 370 -11.192 7.354 -7.206 1.00 0.00 O ATOM 33 CB GLU A 370 -12.268 10.159 -7.238 1.00 0.00 C ATOM 34 CG GLU A 370 -12.454 11.639 -6.944 1.00 0.00 C ATOM 35 CD GLU A 370 -13.605 12.246 -7.720 1.00 0.00 C ATOM 36 OE1 GLU A 370 -13.450 12.465 -8.940 1.00 0.00 O ATOM 37 OE2 GLU A 370 -14.663 12.506 -7.108 1.00 0.00 O ATOM 0 H GLU A 370 -10.686 9.025 -9.252 1.00 0.00 H new ATOM 0 HA GLU A 370 -10.208 10.418 -6.686 1.00 0.00 H new ATOM 0 HB2 GLU A 370 -12.734 9.926 -8.195 1.00 0.00 H new ATOM 0 HB3 GLU A 370 -12.791 9.578 -6.479 1.00 0.00 H new ATOM 0 HG2 GLU A 370 -12.628 11.775 -5.877 1.00 0.00 H new ATOM 0 HG3 GLU A 370 -11.535 12.172 -7.187 1.00 0.00 H new ATOM 44 N VAL A 371 -9.933 8.239 -5.566 1.00 0.00 N ATOM 45 CA VAL A 371 -9.721 6.964 -4.893 1.00 0.00 C ATOM 46 C VAL A 371 -10.992 6.492 -4.197 1.00 0.00 C ATOM 47 O VAL A 371 -11.488 7.144 -3.278 1.00 0.00 O ATOM 48 CB VAL A 371 -8.586 7.059 -3.856 1.00 0.00 C ATOM 49 CG1 VAL A 371 -8.245 5.680 -3.309 1.00 0.00 C ATOM 50 CG2 VAL A 371 -7.357 7.717 -4.467 1.00 0.00 C ATOM 0 H VAL A 371 -9.483 9.035 -5.114 1.00 0.00 H new ATOM 0 HA VAL A 371 -9.442 6.243 -5.661 1.00 0.00 H new ATOM 0 HB VAL A 371 -8.927 7.679 -3.027 1.00 0.00 H new ATOM 0 HG11 VAL A 371 -7.441 5.767 -2.578 1.00 0.00 H new ATOM 0 HG12 VAL A 371 -9.125 5.250 -2.831 1.00 0.00 H new ATOM 0 HG13 VAL A 371 -7.924 5.034 -4.126 1.00 0.00 H new ATOM 0 HG21 VAL A 371 -6.566 7.775 -3.719 1.00 0.00 H new ATOM 0 HG22 VAL A 371 -7.012 7.126 -5.315 1.00 0.00 H new ATOM 0 HG23 VAL A 371 -7.612 8.722 -4.804 1.00 0.00 H new ATOM 60 N SER A 372 -11.518 5.354 -4.641 1.00 0.00 N ATOM 61 CA SER A 372 -12.733 4.795 -4.062 1.00 0.00 C ATOM 62 C SER A 372 -12.410 3.929 -2.848 1.00 0.00 C ATOM 63 O SER A 372 -11.244 3.671 -2.550 1.00 0.00 O ATOM 64 CB SER A 372 -13.488 3.969 -5.105 1.00 0.00 C ATOM 65 OG SER A 372 -14.006 4.796 -6.134 1.00 0.00 O ATOM 0 H SER A 372 -11.121 4.801 -5.401 1.00 0.00 H new ATOM 0 HA SER A 372 -13.364 5.623 -3.738 1.00 0.00 H new ATOM 0 HB2 SER A 372 -12.820 3.223 -5.535 1.00 0.00 H new ATOM 0 HB3 SER A 372 -14.303 3.428 -4.624 1.00 0.00 H new ATOM 0 HG SER A 372 -14.482 4.244 -6.789 1.00 0.00 H new ATOM 71 N SER A 373 -13.452 3.484 -2.153 1.00 0.00 N ATOM 72 CA SER A 373 -13.282 2.645 -0.972 1.00 0.00 C ATOM 73 C SER A 373 -12.602 1.325 -1.328 1.00 0.00 C ATOM 74 O SER A 373 -11.984 0.685 -0.476 1.00 0.00 O ATOM 75 CB SER A 373 -14.636 2.374 -0.315 1.00 0.00 C ATOM 76 OG SER A 373 -15.257 3.581 0.091 1.00 0.00 O ATOM 0 H SER A 373 -14.423 3.690 -2.387 1.00 0.00 H new ATOM 0 HA SER A 373 -12.644 3.180 -0.269 1.00 0.00 H new ATOM 0 HB2 SER A 373 -15.284 1.846 -1.015 1.00 0.00 H new ATOM 0 HB3 SER A 373 -14.501 1.723 0.548 1.00 0.00 H new ATOM 0 HG SER A 373 -14.639 4.329 -0.047 1.00 0.00 H new ATOM 82 N GLU A 374 -12.723 0.919 -2.590 1.00 0.00 N ATOM 83 CA GLU A 374 -12.120 -0.326 -3.056 1.00 0.00 C ATOM 84 C GLU A 374 -10.632 -0.376 -2.725 1.00 0.00 C ATOM 85 O GLU A 374 -10.059 -1.453 -2.556 1.00 0.00 O ATOM 86 CB GLU A 374 -12.323 -0.480 -4.564 1.00 0.00 C ATOM 87 CG GLU A 374 -13.783 -0.481 -4.984 1.00 0.00 C ATOM 88 CD GLU A 374 -13.954 -0.498 -6.492 1.00 0.00 C ATOM 89 OE1 GLU A 374 -13.429 -1.427 -7.139 1.00 0.00 O ATOM 90 OE2 GLU A 374 -14.613 0.420 -7.024 1.00 0.00 O ATOM 0 H GLU A 374 -13.233 1.434 -3.307 1.00 0.00 H new ATOM 0 HA GLU A 374 -12.613 -1.150 -2.541 1.00 0.00 H new ATOM 0 HB2 GLU A 374 -11.807 0.332 -5.076 1.00 0.00 H new ATOM 0 HB3 GLU A 374 -11.859 -1.410 -4.892 1.00 0.00 H new ATOM 0 HG2 GLU A 374 -14.280 -1.351 -4.555 1.00 0.00 H new ATOM 0 HG3 GLU A 374 -14.276 0.401 -4.576 1.00 0.00 H new ATOM 97 N ILE A 375 -10.008 0.796 -2.632 1.00 0.00 N ATOM 98 CA ILE A 375 -8.587 0.883 -2.322 1.00 0.00 C ATOM 99 C ILE A 375 -8.274 0.207 -0.989 1.00 0.00 C ATOM 100 O ILE A 375 -7.232 -0.431 -0.834 1.00 0.00 O ATOM 101 CB ILE A 375 -8.109 2.349 -2.273 1.00 0.00 C ATOM 102 CG1 ILE A 375 -6.596 2.413 -2.053 1.00 0.00 C ATOM 103 CG2 ILE A 375 -8.843 3.112 -1.179 1.00 0.00 C ATOM 104 CD1 ILE A 375 -5.791 1.960 -3.252 1.00 0.00 C ATOM 0 H ILE A 375 -10.466 1.697 -2.767 1.00 0.00 H new ATOM 0 HA ILE A 375 -8.055 0.366 -3.121 1.00 0.00 H new ATOM 0 HB ILE A 375 -8.336 2.818 -3.230 1.00 0.00 H new ATOM 0 HG12 ILE A 375 -6.316 3.437 -1.803 1.00 0.00 H new ATOM 0 HG13 ILE A 375 -6.335 1.793 -1.195 1.00 0.00 H new ATOM 0 HG21 ILE A 375 -8.494 4.144 -1.158 1.00 0.00 H new ATOM 0 HG22 ILE A 375 -9.914 3.095 -1.380 1.00 0.00 H new ATOM 0 HG23 ILE A 375 -8.647 2.643 -0.215 1.00 0.00 H new ATOM 0 HD11 ILE A 375 -4.727 2.032 -3.024 1.00 0.00 H new ATOM 0 HD12 ILE A 375 -6.042 0.926 -3.489 1.00 0.00 H new ATOM 0 HD13 ILE A 375 -6.023 2.595 -4.107 1.00 0.00 H new ATOM 116 N TYR A 376 -9.182 0.354 -0.030 1.00 0.00 N ATOM 117 CA TYR A 376 -9.003 -0.242 1.290 1.00 0.00 C ATOM 118 C TYR A 376 -9.267 -1.743 1.249 1.00 0.00 C ATOM 119 O TYR A 376 -8.531 -2.529 1.845 1.00 0.00 O ATOM 120 CB TYR A 376 -9.936 0.424 2.303 1.00 0.00 C ATOM 121 CG TYR A 376 -9.637 1.889 2.531 1.00 0.00 C ATOM 122 CD1 TYR A 376 -8.547 2.284 3.297 1.00 0.00 C ATOM 123 CD2 TYR A 376 -10.445 2.877 1.982 1.00 0.00 C ATOM 124 CE1 TYR A 376 -8.270 3.622 3.508 1.00 0.00 C ATOM 125 CE2 TYR A 376 -10.175 4.216 2.189 1.00 0.00 C ATOM 126 CZ TYR A 376 -9.087 4.583 2.953 1.00 0.00 C ATOM 127 OH TYR A 376 -8.815 5.915 3.161 1.00 0.00 O ATOM 0 H TYR A 376 -10.049 0.880 -0.141 1.00 0.00 H new ATOM 0 HA TYR A 376 -7.970 -0.081 1.597 1.00 0.00 H new ATOM 0 HB2 TYR A 376 -10.965 0.321 1.959 1.00 0.00 H new ATOM 0 HB3 TYR A 376 -9.864 -0.105 3.253 1.00 0.00 H new ATOM 0 HD1 TYR A 376 -7.906 1.533 3.735 1.00 0.00 H new ATOM 0 HD2 TYR A 376 -11.298 2.594 1.384 1.00 0.00 H new ATOM 0 HE1 TYR A 376 -7.418 3.912 4.105 1.00 0.00 H new ATOM 0 HE2 TYR A 376 -10.813 4.972 1.755 1.00 0.00 H new ATOM 0 HH TYR A 376 -9.634 6.377 3.436 1.00 0.00 H new ATOM 137 N GLN A 377 -10.321 -2.135 0.542 1.00 0.00 N ATOM 138 CA GLN A 377 -10.681 -3.543 0.423 1.00 0.00 C ATOM 139 C GLN A 377 -9.590 -4.325 -0.302 1.00 0.00 C ATOM 140 O GLN A 377 -9.382 -5.509 -0.038 1.00 0.00 O ATOM 141 CB GLN A 377 -12.014 -3.689 -0.318 1.00 0.00 C ATOM 142 CG GLN A 377 -13.075 -4.430 0.477 1.00 0.00 C ATOM 143 CD GLN A 377 -12.765 -5.907 0.626 1.00 0.00 C ATOM 144 OE1 GLN A 377 -12.828 -6.667 -0.341 1.00 0.00 O ATOM 145 NE2 GLN A 377 -12.427 -6.321 1.842 1.00 0.00 N ATOM 0 H GLN A 377 -10.941 -1.498 0.043 1.00 0.00 H new ATOM 0 HA GLN A 377 -10.786 -3.953 1.428 1.00 0.00 H new ATOM 0 HB2 GLN A 377 -12.389 -2.698 -0.572 1.00 0.00 H new ATOM 0 HB3 GLN A 377 -11.842 -4.215 -1.257 1.00 0.00 H new ATOM 0 HG2 GLN A 377 -13.164 -3.979 1.466 1.00 0.00 H new ATOM 0 HG3 GLN A 377 -14.041 -4.313 -0.015 1.00 0.00 H new ATOM 0 HE21 GLN A 377 -12.388 -5.656 2.614 1.00 0.00 H new ATOM 0 HE22 GLN A 377 -12.207 -7.304 2.003 1.00 0.00 H new ATOM 154 N TRP A 378 -8.897 -3.654 -1.217 1.00 0.00 N ATOM 155 CA TRP A 378 -7.827 -4.287 -1.980 1.00 0.00 C ATOM 156 C TRP A 378 -6.612 -4.555 -1.098 1.00 0.00 C ATOM 157 O TRP A 378 -6.015 -5.630 -1.155 1.00 0.00 O ATOM 158 CB TRP A 378 -7.427 -3.406 -3.165 1.00 0.00 C ATOM 159 CG TRP A 378 -8.513 -3.246 -4.184 1.00 0.00 C ATOM 160 CD1 TRP A 378 -9.609 -4.045 -4.349 1.00 0.00 C ATOM 161 CD2 TRP A 378 -8.610 -2.222 -5.182 1.00 0.00 C ATOM 162 NE1 TRP A 378 -10.379 -3.581 -5.388 1.00 0.00 N ATOM 163 CE2 TRP A 378 -9.785 -2.463 -5.915 1.00 0.00 C ATOM 164 CE3 TRP A 378 -7.814 -1.127 -5.525 1.00 0.00 C ATOM 165 CZ2 TRP A 378 -10.186 -1.648 -6.971 1.00 0.00 C ATOM 166 CZ3 TRP A 378 -8.211 -0.318 -6.574 1.00 0.00 C ATOM 167 CH2 TRP A 378 -9.388 -0.582 -7.285 1.00 0.00 C ATOM 0 H TRP A 378 -9.057 -2.673 -1.448 1.00 0.00 H new ATOM 0 HA TRP A 378 -8.198 -5.241 -2.354 1.00 0.00 H new ATOM 0 HB2 TRP A 378 -7.139 -2.422 -2.795 1.00 0.00 H new ATOM 0 HB3 TRP A 378 -6.548 -3.835 -3.646 1.00 0.00 H new ATOM 0 HD1 TRP A 378 -9.837 -4.914 -3.750 1.00 0.00 H new ATOM 0 HE1 TRP A 378 -11.250 -4.000 -5.714 1.00 0.00 H new ATOM 0 HE3 TRP A 378 -6.905 -0.916 -4.981 1.00 0.00 H new ATOM 0 HZ2 TRP A 378 -11.093 -1.850 -7.521 1.00 0.00 H new ATOM 0 HZ3 TRP A 378 -7.603 0.531 -6.849 1.00 0.00 H new ATOM 0 HH2 TRP A 378 -9.672 0.069 -8.098 1.00 0.00 H new ATOM 178 N VAL A 379 -6.249 -3.568 -0.284 1.00 0.00 N ATOM 179 CA VAL A 379 -5.105 -3.696 0.611 1.00 0.00 C ATOM 180 C VAL A 379 -5.289 -4.863 1.575 1.00 0.00 C ATOM 181 O VAL A 379 -4.325 -5.527 1.953 1.00 0.00 O ATOM 182 CB VAL A 379 -4.876 -2.405 1.420 1.00 0.00 C ATOM 183 CG1 VAL A 379 -3.592 -2.502 2.232 1.00 0.00 C ATOM 184 CG2 VAL A 379 -4.841 -1.194 0.499 1.00 0.00 C ATOM 0 H VAL A 379 -6.731 -2.671 -0.226 1.00 0.00 H new ATOM 0 HA VAL A 379 -4.233 -3.881 -0.016 1.00 0.00 H new ATOM 0 HB VAL A 379 -5.709 -2.282 2.112 1.00 0.00 H new ATOM 0 HG11 VAL A 379 -3.448 -1.581 2.796 1.00 0.00 H new ATOM 0 HG12 VAL A 379 -3.660 -3.343 2.922 1.00 0.00 H new ATOM 0 HG13 VAL A 379 -2.747 -2.652 1.560 1.00 0.00 H new ATOM 0 HG21 VAL A 379 -4.678 -0.292 1.090 1.00 0.00 H new ATOM 0 HG22 VAL A 379 -4.030 -1.308 -0.221 1.00 0.00 H new ATOM 0 HG23 VAL A 379 -5.789 -1.114 -0.032 1.00 0.00 H new ATOM 194 N ARG A 380 -6.534 -5.106 1.972 1.00 0.00 N ATOM 195 CA ARG A 380 -6.843 -6.192 2.894 1.00 0.00 C ATOM 196 C ARG A 380 -6.809 -7.540 2.180 1.00 0.00 C ATOM 197 O ARG A 380 -6.236 -8.506 2.683 1.00 0.00 O ATOM 198 CB ARG A 380 -8.219 -5.973 3.531 1.00 0.00 C ATOM 199 CG ARG A 380 -8.156 -5.341 4.912 1.00 0.00 C ATOM 200 CD ARG A 380 -7.884 -6.381 5.987 1.00 0.00 C ATOM 201 NE ARG A 380 -8.038 -5.831 7.332 1.00 0.00 N ATOM 202 CZ ARG A 380 -9.213 -5.642 7.927 1.00 0.00 C ATOM 203 NH1 ARG A 380 -10.339 -5.960 7.300 1.00 0.00 N ATOM 204 NH2 ARG A 380 -9.263 -5.138 9.152 1.00 0.00 N ATOM 0 H ARG A 380 -7.345 -4.566 1.670 1.00 0.00 H new ATOM 0 HA ARG A 380 -6.084 -6.197 3.677 1.00 0.00 H new ATOM 0 HB2 ARG A 380 -8.816 -5.338 2.877 1.00 0.00 H new ATOM 0 HB3 ARG A 380 -8.734 -6.931 3.602 1.00 0.00 H new ATOM 0 HG2 ARG A 380 -7.373 -4.583 4.931 1.00 0.00 H new ATOM 0 HG3 ARG A 380 -9.097 -4.833 5.125 1.00 0.00 H new ATOM 0 HD2 ARG A 380 -8.566 -7.222 5.859 1.00 0.00 H new ATOM 0 HD3 ARG A 380 -6.873 -6.770 5.868 1.00 0.00 H new ATOM 0 HE ARG A 380 -7.194 -5.577 7.846 1.00 0.00 H new ATOM 0 HH11 ARG A 380 -10.306 -6.351 6.358 1.00 0.00 H new ATOM 0 HH12 ARG A 380 -11.238 -5.814 7.760 1.00 0.00 H new ATOM 0 HH21 ARG A 380 -8.400 -4.895 9.639 1.00 0.00 H new ATOM 0 HH22 ARG A 380 -10.164 -4.993 9.608 1.00 0.00 H new ATOM 218 N ASP A 381 -7.426 -7.597 1.004 1.00 0.00 N ATOM 219 CA ASP A 381 -7.464 -8.827 0.222 1.00 0.00 C ATOM 220 C ASP A 381 -6.075 -9.195 -0.285 1.00 0.00 C ATOM 221 O ASP A 381 -5.694 -10.366 -0.289 1.00 0.00 O ATOM 222 CB ASP A 381 -8.425 -8.673 -0.959 1.00 0.00 C ATOM 223 CG ASP A 381 -9.072 -9.986 -1.353 1.00 0.00 C ATOM 224 OD1 ASP A 381 -9.320 -10.819 -0.455 1.00 0.00 O ATOM 225 OD2 ASP A 381 -9.334 -10.183 -2.558 1.00 0.00 O ATOM 0 H ASP A 381 -7.906 -6.807 0.572 1.00 0.00 H new ATOM 0 HA ASP A 381 -7.817 -9.629 0.870 1.00 0.00 H new ATOM 0 HB2 ASP A 381 -9.201 -7.952 -0.701 1.00 0.00 H new ATOM 0 HB3 ASP A 381 -7.884 -8.267 -1.814 1.00 0.00 H new ATOM 230 N GLU A 382 -5.319 -8.189 -0.714 1.00 0.00 N ATOM 231 CA GLU A 382 -3.970 -8.408 -1.223 1.00 0.00 C ATOM 232 C GLU A 382 -3.026 -8.833 -0.103 1.00 0.00 C ATOM 233 O GLU A 382 -2.081 -9.589 -0.328 1.00 0.00 O ATOM 234 CB GLU A 382 -3.444 -7.139 -1.896 1.00 0.00 C ATOM 235 CG GLU A 382 -2.529 -7.411 -3.077 1.00 0.00 C ATOM 236 CD GLU A 382 -3.294 -7.742 -4.343 1.00 0.00 C ATOM 237 OE1 GLU A 382 -4.321 -8.446 -4.249 1.00 0.00 O ATOM 238 OE2 GLU A 382 -2.866 -7.297 -5.429 1.00 0.00 O ATOM 0 H GLU A 382 -5.618 -7.214 -0.719 1.00 0.00 H new ATOM 0 HA GLU A 382 -4.013 -9.210 -1.959 1.00 0.00 H new ATOM 0 HB2 GLU A 382 -4.290 -6.539 -2.233 1.00 0.00 H new ATOM 0 HB3 GLU A 382 -2.905 -6.544 -1.159 1.00 0.00 H new ATOM 0 HG2 GLU A 382 -1.901 -6.538 -3.254 1.00 0.00 H new ATOM 0 HG3 GLU A 382 -1.863 -8.238 -2.833 1.00 0.00 H new ATOM 245 N LEU A 383 -3.288 -8.341 1.104 1.00 0.00 N ATOM 246 CA LEU A 383 -2.462 -8.670 2.259 1.00 0.00 C ATOM 247 C LEU A 383 -2.673 -10.117 2.686 1.00 0.00 C ATOM 248 O LEU A 383 -1.756 -10.770 3.185 1.00 0.00 O ATOM 249 CB LEU A 383 -2.779 -7.731 3.423 1.00 0.00 C ATOM 250 CG LEU A 383 -2.023 -6.401 3.409 1.00 0.00 C ATOM 251 CD1 LEU A 383 -2.576 -5.460 4.467 1.00 0.00 C ATOM 252 CD2 LEU A 383 -0.534 -6.632 3.623 1.00 0.00 C ATOM 0 H LEU A 383 -4.066 -7.713 1.307 1.00 0.00 H new ATOM 0 HA LEU A 383 -1.418 -8.544 1.974 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -3.849 -7.523 3.420 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -2.557 -8.247 4.357 1.00 0.00 H new ATOM 0 HG LEU A 383 -2.162 -5.937 2.433 1.00 0.00 H new ATOM 0 HD11 LEU A 383 -2.025 -4.520 4.441 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -3.630 -5.269 4.268 1.00 0.00 H new ATOM 0 HD13 LEU A 383 -2.469 -5.916 5.451 1.00 0.00 H new ATOM 0 HD21 LEU A 383 -0.012 -5.675 3.610 1.00 0.00 H new ATOM 0 HD22 LEU A 383 -0.376 -7.119 4.585 1.00 0.00 H new ATOM 0 HD23 LEU A 383 -0.146 -7.268 2.827 1.00 0.00 H new ATOM 264 N LYS A 384 -3.889 -10.617 2.487 1.00 0.00 N ATOM 265 CA LYS A 384 -4.223 -11.989 2.851 1.00 0.00 C ATOM 266 C LYS A 384 -3.963 -12.940 1.687 1.00 0.00 C ATOM 267 O LYS A 384 -3.624 -14.105 1.888 1.00 0.00 O ATOM 268 CB LYS A 384 -5.686 -12.083 3.284 1.00 0.00 C ATOM 269 CG LYS A 384 -5.999 -13.322 4.109 1.00 0.00 C ATOM 270 CD LYS A 384 -7.383 -13.867 3.794 1.00 0.00 C ATOM 271 CE LYS A 384 -7.989 -14.578 4.993 1.00 0.00 C ATOM 272 NZ LYS A 384 -7.968 -16.058 4.829 1.00 0.00 N ATOM 0 H LYS A 384 -4.660 -10.091 2.075 1.00 0.00 H new ATOM 0 HA LYS A 384 -3.585 -12.282 3.685 1.00 0.00 H new ATOM 0 HB2 LYS A 384 -5.942 -11.196 3.864 1.00 0.00 H new ATOM 0 HB3 LYS A 384 -6.320 -12.078 2.397 1.00 0.00 H new ATOM 0 HG2 LYS A 384 -5.251 -14.090 3.912 1.00 0.00 H new ATOM 0 HG3 LYS A 384 -5.935 -13.080 5.170 1.00 0.00 H new ATOM 0 HD2 LYS A 384 -8.035 -13.050 3.487 1.00 0.00 H new ATOM 0 HD3 LYS A 384 -7.320 -14.558 2.954 1.00 0.00 H new ATOM 0 HE2 LYS A 384 -7.439 -14.305 5.893 1.00 0.00 H new ATOM 0 HE3 LYS A 384 -9.017 -14.243 5.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 384 -8.390 -16.506 5.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 384 -8.514 -16.321 3.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 384 -6.985 -16.381 4.721 1.00 0.00 H new ATOM 286 N ARG A 385 -4.124 -12.433 0.469 1.00 0.00 N ATOM 287 CA ARG A 385 -3.908 -13.238 -0.729 1.00 0.00 C ATOM 288 C ARG A 385 -2.420 -13.342 -1.052 1.00 0.00 C ATOM 289 O ARG A 385 -1.958 -14.358 -1.569 1.00 0.00 O ATOM 290 CB ARG A 385 -4.659 -12.634 -1.916 1.00 0.00 C ATOM 291 CG ARG A 385 -6.148 -12.941 -1.916 1.00 0.00 C ATOM 292 CD ARG A 385 -6.506 -13.976 -2.972 1.00 0.00 C ATOM 293 NE ARG A 385 -7.699 -14.736 -2.611 1.00 0.00 N ATOM 294 CZ ARG A 385 -8.183 -15.744 -3.333 1.00 0.00 C ATOM 295 NH1 ARG A 385 -7.578 -16.115 -4.455 1.00 0.00 N ATOM 296 NH2 ARG A 385 -9.274 -16.382 -2.934 1.00 0.00 N ATOM 0 H ARG A 385 -4.403 -11.469 0.285 1.00 0.00 H new ATOM 0 HA ARG A 385 -4.291 -14.240 -0.538 1.00 0.00 H new ATOM 0 HB2 ARG A 385 -4.520 -11.553 -1.911 1.00 0.00 H new ATOM 0 HB3 ARG A 385 -4.220 -13.008 -2.841 1.00 0.00 H new ATOM 0 HG2 ARG A 385 -6.445 -13.306 -0.933 1.00 0.00 H new ATOM 0 HG3 ARG A 385 -6.709 -12.025 -2.099 1.00 0.00 H new ATOM 0 HD2 ARG A 385 -6.669 -13.477 -3.927 1.00 0.00 H new ATOM 0 HD3 ARG A 385 -5.668 -14.660 -3.108 1.00 0.00 H new ATOM 0 HE ARG A 385 -8.191 -14.479 -1.755 1.00 0.00 H new ATOM 0 HH11 ARG A 385 -6.738 -15.627 -4.767 1.00 0.00 H new ATOM 0 HH12 ARG A 385 -7.953 -16.888 -5.005 1.00 0.00 H new ATOM 0 HH21 ARG A 385 -9.743 -16.101 -2.073 1.00 0.00 H new ATOM 0 HH22 ARG A 385 -9.644 -17.154 -3.488 1.00 0.00 H new ATOM 310 N ALA A 386 -1.678 -12.284 -0.743 1.00 0.00 N ATOM 311 CA ALA A 386 -0.242 -12.257 -1.001 1.00 0.00 C ATOM 312 C ALA A 386 0.524 -13.006 0.082 1.00 0.00 C ATOM 313 O ALA A 386 1.319 -13.900 -0.210 1.00 0.00 O ATOM 314 CB ALA A 386 0.248 -10.820 -1.101 1.00 0.00 C ATOM 0 H ALA A 386 -2.046 -11.435 -0.314 1.00 0.00 H new ATOM 0 HA ALA A 386 -0.058 -12.759 -1.951 1.00 0.00 H new ATOM 0 HB1 ALA A 386 1.321 -10.814 -1.294 1.00 0.00 H new ATOM 0 HB2 ALA A 386 -0.270 -10.315 -1.916 1.00 0.00 H new ATOM 0 HB3 ALA A 386 0.045 -10.300 -0.165 1.00 0.00 H new ATOM 320 N GLY A 387 0.282 -12.637 1.336 1.00 0.00 N ATOM 321 CA GLY A 387 0.958 -13.284 2.443 1.00 0.00 C ATOM 322 C GLY A 387 2.215 -12.549 2.865 1.00 0.00 C ATOM 323 O GLY A 387 3.311 -13.110 2.837 1.00 0.00 O ATOM 0 H GLY A 387 -0.371 -11.901 1.604 1.00 0.00 H new ATOM 0 HA2 GLY A 387 0.277 -13.350 3.292 1.00 0.00 H new ATOM 0 HA3 GLY A 387 1.215 -14.305 2.161 1.00 0.00 H new ATOM 327 N ILE A 388 2.058 -11.289 3.258 1.00 0.00 N ATOM 328 CA ILE A 388 3.189 -10.475 3.686 1.00 0.00 C ATOM 329 C ILE A 388 2.818 -9.608 4.884 1.00 0.00 C ATOM 330 O ILE A 388 1.683 -9.639 5.360 1.00 0.00 O ATOM 331 CB ILE A 388 3.692 -9.567 2.548 1.00 0.00 C ATOM 332 CG1 ILE A 388 2.521 -8.822 1.904 1.00 0.00 C ATOM 333 CG2 ILE A 388 4.442 -10.386 1.509 1.00 0.00 C ATOM 334 CD1 ILE A 388 2.951 -7.691 0.996 1.00 0.00 C ATOM 0 H ILE A 388 1.158 -10.810 3.289 1.00 0.00 H new ATOM 0 HA ILE A 388 3.985 -11.164 3.969 1.00 0.00 H new ATOM 0 HB ILE A 388 4.379 -8.832 2.967 1.00 0.00 H new ATOM 0 HG12 ILE A 388 1.922 -9.530 1.331 1.00 0.00 H new ATOM 0 HG13 ILE A 388 1.879 -8.423 2.689 1.00 0.00 H new ATOM 0 HG21 ILE A 388 4.791 -9.730 0.711 1.00 0.00 H new ATOM 0 HG22 ILE A 388 5.297 -10.874 1.978 1.00 0.00 H new ATOM 0 HG23 ILE A 388 3.777 -11.142 1.092 1.00 0.00 H new ATOM 0 HD11 ILE A 388 2.070 -7.208 0.574 1.00 0.00 H new ATOM 0 HD12 ILE A 388 3.525 -6.963 1.569 1.00 0.00 H new ATOM 0 HD13 ILE A 388 3.569 -8.087 0.190 1.00 0.00 H new ATOM 346 N SER A 389 3.783 -8.833 5.370 1.00 0.00 N ATOM 347 CA SER A 389 3.558 -7.957 6.513 1.00 0.00 C ATOM 348 C SER A 389 3.150 -6.560 6.054 1.00 0.00 C ATOM 349 O SER A 389 3.550 -6.107 4.982 1.00 0.00 O ATOM 350 CB SER A 389 4.818 -7.876 7.377 1.00 0.00 C ATOM 351 OG SER A 389 4.740 -8.766 8.477 1.00 0.00 O ATOM 0 H SER A 389 4.728 -8.794 4.989 1.00 0.00 H new ATOM 0 HA SER A 389 2.746 -8.377 7.107 1.00 0.00 H new ATOM 0 HB2 SER A 389 5.693 -8.115 6.773 1.00 0.00 H new ATOM 0 HB3 SER A 389 4.950 -6.856 7.739 1.00 0.00 H new ATOM 0 HG SER A 389 5.558 -8.697 9.013 1.00 0.00 H new ATOM 357 N GLN A 390 2.350 -5.884 6.873 1.00 0.00 N ATOM 358 CA GLN A 390 1.888 -4.539 6.551 1.00 0.00 C ATOM 359 C GLN A 390 3.065 -3.591 6.340 1.00 0.00 C ATOM 360 O GLN A 390 2.972 -2.630 5.575 1.00 0.00 O ATOM 361 CB GLN A 390 0.981 -4.010 7.667 1.00 0.00 C ATOM 362 CG GLN A 390 -0.494 -4.006 7.300 1.00 0.00 C ATOM 363 CD GLN A 390 -1.382 -4.411 8.460 1.00 0.00 C ATOM 364 OE1 GLN A 390 -2.336 -5.171 8.289 1.00 0.00 O ATOM 365 NE2 GLN A 390 -1.074 -3.904 9.648 1.00 0.00 N ATOM 0 H GLN A 390 2.009 -6.246 7.764 1.00 0.00 H new ATOM 0 HA GLN A 390 1.320 -4.589 5.622 1.00 0.00 H new ATOM 0 HB2 GLN A 390 1.123 -4.619 8.559 1.00 0.00 H new ATOM 0 HB3 GLN A 390 1.286 -2.995 7.922 1.00 0.00 H new ATOM 0 HG2 GLN A 390 -0.778 -3.010 6.960 1.00 0.00 H new ATOM 0 HG3 GLN A 390 -0.659 -4.687 6.465 1.00 0.00 H new ATOM 0 HE21 GLN A 390 -0.274 -3.278 9.744 1.00 0.00 H new ATOM 0 HE22 GLN A 390 -1.637 -4.141 10.465 1.00 0.00 H new ATOM 374 N ALA A 391 4.171 -3.868 7.022 1.00 0.00 N ATOM 375 CA ALA A 391 5.366 -3.039 6.909 1.00 0.00 C ATOM 376 C ALA A 391 5.869 -2.994 5.469 1.00 0.00 C ATOM 377 O ALA A 391 6.141 -1.921 4.931 1.00 0.00 O ATOM 378 CB ALA A 391 6.456 -3.557 7.836 1.00 0.00 C ATOM 0 H ALA A 391 4.265 -4.659 7.658 1.00 0.00 H new ATOM 0 HA ALA A 391 5.104 -2.023 7.206 1.00 0.00 H new ATOM 0 HB1 ALA A 391 7.342 -2.929 7.742 1.00 0.00 H new ATOM 0 HB2 ALA A 391 6.100 -3.531 8.866 1.00 0.00 H new ATOM 0 HB3 ALA A 391 6.707 -4.582 7.565 1.00 0.00 H new ATOM 384 N VAL A 392 5.990 -4.165 4.853 1.00 0.00 N ATOM 385 CA VAL A 392 6.461 -4.259 3.477 1.00 0.00 C ATOM 386 C VAL A 392 5.464 -3.627 2.510 1.00 0.00 C ATOM 387 O VAL A 392 5.834 -2.800 1.675 1.00 0.00 O ATOM 388 CB VAL A 392 6.700 -5.723 3.063 1.00 0.00 C ATOM 389 CG1 VAL A 392 7.346 -5.794 1.688 1.00 0.00 C ATOM 390 CG2 VAL A 392 7.556 -6.436 4.100 1.00 0.00 C ATOM 0 H VAL A 392 5.768 -5.062 5.285 1.00 0.00 H new ATOM 0 HA VAL A 392 7.405 -3.716 3.429 1.00 0.00 H new ATOM 0 HB VAL A 392 5.735 -6.228 3.010 1.00 0.00 H new ATOM 0 HG11 VAL A 392 7.506 -6.837 1.415 1.00 0.00 H new ATOM 0 HG12 VAL A 392 6.692 -5.323 0.954 1.00 0.00 H new ATOM 0 HG13 VAL A 392 8.303 -5.273 1.708 1.00 0.00 H new ATOM 0 HG21 VAL A 392 7.715 -7.469 3.792 1.00 0.00 H new ATOM 0 HG22 VAL A 392 8.518 -5.931 4.187 1.00 0.00 H new ATOM 0 HG23 VAL A 392 7.049 -6.419 5.065 1.00 0.00 H new ATOM 400 N PHE A 393 4.200 -4.020 2.628 1.00 0.00 N ATOM 401 CA PHE A 393 3.150 -3.492 1.764 1.00 0.00 C ATOM 402 C PHE A 393 3.065 -1.973 1.872 1.00 0.00 C ATOM 403 O PHE A 393 2.708 -1.291 0.913 1.00 0.00 O ATOM 404 CB PHE A 393 1.801 -4.118 2.125 1.00 0.00 C ATOM 405 CG PHE A 393 0.710 -3.803 1.142 1.00 0.00 C ATOM 406 CD1 PHE A 393 0.156 -2.534 1.084 1.00 0.00 C ATOM 407 CD2 PHE A 393 0.240 -4.775 0.276 1.00 0.00 C ATOM 408 CE1 PHE A 393 -0.848 -2.241 0.181 1.00 0.00 C ATOM 409 CE2 PHE A 393 -0.764 -4.489 -0.631 1.00 0.00 C ATOM 410 CZ PHE A 393 -1.307 -3.221 -0.679 1.00 0.00 C ATOM 0 H PHE A 393 3.878 -4.703 3.314 1.00 0.00 H new ATOM 0 HA PHE A 393 3.399 -3.750 0.735 1.00 0.00 H new ATOM 0 HB2 PHE A 393 1.918 -5.200 2.191 1.00 0.00 H new ATOM 0 HB3 PHE A 393 1.501 -3.769 3.113 1.00 0.00 H new ATOM 0 HD1 PHE A 393 0.513 -1.765 1.753 1.00 0.00 H new ATOM 0 HD2 PHE A 393 0.662 -5.768 0.309 1.00 0.00 H new ATOM 0 HE1 PHE A 393 -1.273 -1.249 0.147 1.00 0.00 H new ATOM 0 HE2 PHE A 393 -1.123 -5.257 -1.301 1.00 0.00 H new ATOM 0 HZ PHE A 393 -2.090 -2.995 -1.388 1.00 0.00 H new ATOM 420 N ALA A 394 3.394 -1.449 3.048 1.00 0.00 N ATOM 421 CA ALA A 394 3.355 -0.010 3.282 1.00 0.00 C ATOM 422 C ALA A 394 4.628 0.662 2.779 1.00 0.00 C ATOM 423 O ALA A 394 4.607 1.823 2.367 1.00 0.00 O ATOM 424 CB ALA A 394 3.153 0.278 4.762 1.00 0.00 C ATOM 0 H ALA A 394 3.691 -1.999 3.854 1.00 0.00 H new ATOM 0 HA ALA A 394 2.514 0.402 2.725 1.00 0.00 H new ATOM 0 HB1 ALA A 394 3.126 1.356 4.923 1.00 0.00 H new ATOM 0 HB2 ALA A 394 2.212 -0.162 5.093 1.00 0.00 H new ATOM 0 HB3 ALA A 394 3.976 -0.153 5.332 1.00 0.00 H new ATOM 430 N ARG A 395 5.735 -0.072 2.815 1.00 0.00 N ATOM 431 CA ARG A 395 7.017 0.457 2.365 1.00 0.00 C ATOM 432 C ARG A 395 7.130 0.391 0.844 1.00 0.00 C ATOM 433 O ARG A 395 7.784 1.229 0.223 1.00 0.00 O ATOM 434 CB ARG A 395 8.168 -0.318 3.009 1.00 0.00 C ATOM 435 CG ARG A 395 9.331 0.563 3.434 1.00 0.00 C ATOM 436 CD ARG A 395 9.967 0.066 4.723 1.00 0.00 C ATOM 437 NE ARG A 395 11.408 0.301 4.748 1.00 0.00 N ATOM 438 CZ ARG A 395 12.247 -0.330 5.564 1.00 0.00 C ATOM 439 NH1 ARG A 395 11.796 -1.236 6.424 1.00 0.00 N ATOM 440 NH2 ARG A 395 13.545 -0.057 5.523 1.00 0.00 N ATOM 0 H ARG A 395 5.770 -1.034 3.151 1.00 0.00 H new ATOM 0 HA ARG A 395 7.077 1.502 2.670 1.00 0.00 H new ATOM 0 HB2 ARG A 395 7.792 -0.854 3.880 1.00 0.00 H new ATOM 0 HB3 ARG A 395 8.529 -1.068 2.305 1.00 0.00 H new ATOM 0 HG2 ARG A 395 10.080 0.585 2.643 1.00 0.00 H new ATOM 0 HG3 ARG A 395 8.982 1.587 3.571 1.00 0.00 H new ATOM 0 HD2 ARG A 395 9.503 0.567 5.573 1.00 0.00 H new ATOM 0 HD3 ARG A 395 9.772 -1.000 4.836 1.00 0.00 H new ATOM 0 HE ARG A 395 11.793 0.990 4.102 1.00 0.00 H new ATOM 0 HH11 ARG A 395 10.800 -1.452 6.462 1.00 0.00 H new ATOM 0 HH12 ARG A 395 12.446 -1.716 7.047 1.00 0.00 H new ATOM 0 HH21 ARG A 395 13.900 0.637 4.865 1.00 0.00 H new ATOM 0 HH22 ARG A 395 14.188 -0.541 6.149 1.00 0.00 H new ATOM 454 N VAL A 396 6.491 -0.612 0.250 1.00 0.00 N ATOM 455 CA VAL A 396 6.522 -0.786 -1.198 1.00 0.00 C ATOM 456 C VAL A 396 5.432 0.038 -1.876 1.00 0.00 C ATOM 457 O VAL A 396 5.593 0.478 -3.016 1.00 0.00 O ATOM 458 CB VAL A 396 6.349 -2.265 -1.590 1.00 0.00 C ATOM 459 CG1 VAL A 396 7.575 -3.070 -1.188 1.00 0.00 C ATOM 460 CG2 VAL A 396 5.088 -2.845 -0.963 1.00 0.00 C ATOM 0 H VAL A 396 5.946 -1.316 0.748 1.00 0.00 H new ATOM 0 HA VAL A 396 7.499 -0.439 -1.536 1.00 0.00 H new ATOM 0 HB VAL A 396 6.244 -2.324 -2.673 1.00 0.00 H new ATOM 0 HG11 VAL A 396 7.435 -4.113 -1.473 1.00 0.00 H new ATOM 0 HG12 VAL A 396 8.454 -2.671 -1.694 1.00 0.00 H new ATOM 0 HG13 VAL A 396 7.716 -3.004 -0.109 1.00 0.00 H new ATOM 0 HG21 VAL A 396 4.985 -3.891 -1.253 1.00 0.00 H new ATOM 0 HG22 VAL A 396 5.156 -2.774 0.123 1.00 0.00 H new ATOM 0 HG23 VAL A 396 4.219 -2.285 -1.309 1.00 0.00 H new ATOM 470 N ALA A 397 4.325 0.245 -1.171 1.00 0.00 N ATOM 471 CA ALA A 397 3.210 1.016 -1.708 1.00 0.00 C ATOM 472 C ALA A 397 3.480 2.514 -1.608 1.00 0.00 C ATOM 473 O ALA A 397 3.213 3.267 -2.543 1.00 0.00 O ATOM 474 CB ALA A 397 1.924 0.660 -0.981 1.00 0.00 C ATOM 0 H ALA A 397 4.176 -0.110 -0.227 1.00 0.00 H new ATOM 0 HA ALA A 397 3.100 0.763 -2.762 1.00 0.00 H new ATOM 0 HB1 ALA A 397 1.100 1.243 -1.392 1.00 0.00 H new ATOM 0 HB2 ALA A 397 1.716 -0.402 -1.109 1.00 0.00 H new ATOM 0 HB3 ALA A 397 2.032 0.883 0.080 1.00 0.00 H new ATOM 480 N PHE A 398 4.010 2.937 -0.465 1.00 0.00 N ATOM 481 CA PHE A 398 4.316 4.345 -0.240 1.00 0.00 C ATOM 482 C PHE A 398 5.195 4.516 0.994 1.00 0.00 C ATOM 483 O PHE A 398 4.751 4.290 2.120 1.00 0.00 O ATOM 484 CB PHE A 398 3.025 5.148 -0.077 1.00 0.00 C ATOM 485 CG PHE A 398 2.164 4.675 1.061 1.00 0.00 C ATOM 486 CD1 PHE A 398 1.458 3.487 0.962 1.00 0.00 C ATOM 487 CD2 PHE A 398 2.061 5.418 2.225 1.00 0.00 C ATOM 488 CE1 PHE A 398 0.665 3.049 2.006 1.00 0.00 C ATOM 489 CE2 PHE A 398 1.271 4.985 3.272 1.00 0.00 C ATOM 490 CZ PHE A 398 0.571 3.798 3.162 1.00 0.00 C ATOM 0 H PHE A 398 4.236 2.325 0.319 1.00 0.00 H new ATOM 0 HA PHE A 398 4.860 4.719 -1.107 1.00 0.00 H new ATOM 0 HB2 PHE A 398 3.276 6.197 0.080 1.00 0.00 H new ATOM 0 HB3 PHE A 398 2.452 5.092 -1.003 1.00 0.00 H new ATOM 0 HD1 PHE A 398 1.528 2.897 0.060 1.00 0.00 H new ATOM 0 HD2 PHE A 398 2.605 6.347 2.315 1.00 0.00 H new ATOM 0 HE1 PHE A 398 0.119 2.121 1.917 1.00 0.00 H new ATOM 0 HE2 PHE A 398 1.200 5.573 4.175 1.00 0.00 H new ATOM 0 HZ PHE A 398 -0.048 3.457 3.979 1.00 0.00 H new ATOM 500 N ASN A 399 6.443 4.916 0.775 1.00 0.00 N ATOM 501 CA ASN A 399 7.386 5.116 1.871 1.00 0.00 C ATOM 502 C ASN A 399 6.860 6.149 2.863 1.00 0.00 C ATOM 503 O ASN A 399 6.533 7.275 2.489 1.00 0.00 O ATOM 504 CB ASN A 399 8.744 5.562 1.326 1.00 0.00 C ATOM 505 CG ASN A 399 9.890 5.160 2.235 1.00 0.00 C ATOM 506 OD1 ASN A 399 10.190 3.976 2.388 1.00 0.00 O ATOM 507 ND2 ASN A 399 10.537 6.146 2.844 1.00 0.00 N ATOM 0 H ASN A 399 6.826 5.108 -0.151 1.00 0.00 H new ATOM 0 HA ASN A 399 7.504 4.166 2.393 1.00 0.00 H new ATOM 0 HB2 ASN A 399 8.897 5.127 0.338 1.00 0.00 H new ATOM 0 HB3 ASN A 399 8.745 6.645 1.201 1.00 0.00 H new ATOM 0 HD21 ASN A 399 11.316 5.936 3.467 1.00 0.00 H new ATOM 0 HD22 ASN A 399 10.255 7.114 2.689 1.00 0.00 H new ATOM 514 N ARG A 400 6.780 5.755 4.131 1.00 0.00 N ATOM 515 CA ARG A 400 6.295 6.645 5.180 1.00 0.00 C ATOM 516 C ARG A 400 6.733 6.155 6.557 1.00 0.00 C ATOM 517 O ARG A 400 7.445 5.158 6.675 1.00 0.00 O ATOM 518 CB ARG A 400 4.765 6.766 5.112 1.00 0.00 C ATOM 519 CG ARG A 400 4.015 5.646 5.824 1.00 0.00 C ATOM 520 CD ARG A 400 4.302 4.289 5.202 1.00 0.00 C ATOM 521 NE ARG A 400 5.005 3.401 6.125 1.00 0.00 N ATOM 522 CZ ARG A 400 4.410 2.737 7.113 1.00 0.00 C ATOM 523 NH1 ARG A 400 3.101 2.850 7.303 1.00 0.00 N ATOM 524 NH2 ARG A 400 5.125 1.959 7.913 1.00 0.00 N ATOM 0 H ARG A 400 7.045 4.825 4.456 1.00 0.00 H new ATOM 0 HA ARG A 400 6.730 7.631 5.019 1.00 0.00 H new ATOM 0 HB2 ARG A 400 4.468 7.720 5.547 1.00 0.00 H new ATOM 0 HB3 ARG A 400 4.460 6.784 4.066 1.00 0.00 H new ATOM 0 HG2 ARG A 400 4.299 5.631 6.876 1.00 0.00 H new ATOM 0 HG3 ARG A 400 2.944 5.844 5.785 1.00 0.00 H new ATOM 0 HD2 ARG A 400 3.364 3.825 4.896 1.00 0.00 H new ATOM 0 HD3 ARG A 400 4.901 4.423 4.301 1.00 0.00 H new ATOM 0 HE ARG A 400 6.011 3.283 6.005 1.00 0.00 H new ATOM 0 HH11 ARG A 400 2.546 3.448 6.690 1.00 0.00 H new ATOM 0 HH12 ARG A 400 2.650 2.339 8.062 1.00 0.00 H new ATOM 0 HH21 ARG A 400 6.131 1.869 7.771 1.00 0.00 H new ATOM 0 HH22 ARG A 400 4.669 1.450 8.670 1.00 0.00 H new ATOM 538 N THR A 401 6.301 6.863 7.596 1.00 0.00 N ATOM 539 CA THR A 401 6.647 6.500 8.964 1.00 0.00 C ATOM 540 C THR A 401 5.697 5.435 9.505 1.00 0.00 C ATOM 541 O THR A 401 4.507 5.434 9.190 1.00 0.00 O ATOM 542 CB THR A 401 6.614 7.724 9.898 1.00 0.00 C ATOM 543 OG1 THR A 401 5.576 8.625 9.490 1.00 0.00 O ATOM 544 CG2 THR A 401 7.951 8.447 9.892 1.00 0.00 C ATOM 0 H THR A 401 5.711 7.691 7.516 1.00 0.00 H new ATOM 0 HA THR A 401 7.661 6.102 8.939 1.00 0.00 H new ATOM 0 HB THR A 401 6.414 7.374 10.911 1.00 0.00 H new ATOM 0 HG1 THR A 401 5.561 9.400 10.090 1.00 0.00 H new ATOM 0 HG21 THR A 401 7.902 9.308 10.559 1.00 0.00 H new ATOM 0 HG22 THR A 401 8.733 7.768 10.232 1.00 0.00 H new ATOM 0 HG23 THR A 401 8.178 8.784 8.881 1.00 0.00 H new ATOM 552 N GLN A 402 6.231 4.528 10.318 1.00 0.00 N ATOM 553 CA GLN A 402 5.429 3.458 10.900 1.00 0.00 C ATOM 554 C GLN A 402 4.275 4.027 11.721 1.00 0.00 C ATOM 555 O GLN A 402 4.439 5.009 12.444 1.00 0.00 O ATOM 556 CB GLN A 402 6.301 2.557 11.777 1.00 0.00 C ATOM 557 CG GLN A 402 6.816 1.322 11.056 1.00 0.00 C ATOM 558 CD GLN A 402 6.380 0.031 11.723 1.00 0.00 C ATOM 559 OE1 GLN A 402 7.062 -0.482 12.612 1.00 0.00 O ATOM 560 NE2 GLN A 402 5.241 -0.501 11.297 1.00 0.00 N ATOM 0 H GLN A 402 7.214 4.513 10.588 1.00 0.00 H new ATOM 0 HA GLN A 402 5.013 2.866 10.085 1.00 0.00 H new ATOM 0 HB2 GLN A 402 7.150 3.133 12.145 1.00 0.00 H new ATOM 0 HB3 GLN A 402 5.726 2.245 12.649 1.00 0.00 H new ATOM 0 HG2 GLN A 402 6.460 1.332 10.026 1.00 0.00 H new ATOM 0 HG3 GLN A 402 7.905 1.356 11.017 1.00 0.00 H new ATOM 0 HE21 GLN A 402 4.709 -0.042 10.558 1.00 0.00 H new ATOM 0 HE22 GLN A 402 4.898 -1.369 11.709 1.00 0.00 H new ATOM 569 N GLY A 403 3.108 3.401 11.603 1.00 0.00 N ATOM 570 CA GLY A 403 1.945 3.858 12.339 1.00 0.00 C ATOM 571 C GLY A 403 0.949 4.585 11.457 1.00 0.00 C ATOM 572 O GLY A 403 -0.249 4.597 11.740 1.00 0.00 O ATOM 0 H GLY A 403 2.948 2.586 11.011 1.00 0.00 H new ATOM 0 HA2 GLY A 403 1.456 3.003 12.806 1.00 0.00 H new ATOM 0 HA3 GLY A 403 2.265 4.521 13.143 1.00 0.00 H new ATOM 576 N LEU A 404 1.445 5.196 10.385 1.00 0.00 N ATOM 577 CA LEU A 404 0.590 5.929 9.459 1.00 0.00 C ATOM 578 C LEU A 404 -0.399 4.993 8.770 1.00 0.00 C ATOM 579 O LEU A 404 -1.610 5.203 8.827 1.00 0.00 O ATOM 580 CB LEU A 404 1.439 6.650 8.410 1.00 0.00 C ATOM 581 CG LEU A 404 0.760 7.840 7.734 1.00 0.00 C ATOM 582 CD1 LEU A 404 0.952 9.104 8.559 1.00 0.00 C ATOM 583 CD2 LEU A 404 1.304 8.034 6.325 1.00 0.00 C ATOM 0 H LEU A 404 2.434 5.198 10.137 1.00 0.00 H new ATOM 0 HA LEU A 404 0.027 6.665 10.032 1.00 0.00 H new ATOM 0 HB2 LEU A 404 2.357 6.996 8.884 1.00 0.00 H new ATOM 0 HB3 LEU A 404 1.728 5.932 7.642 1.00 0.00 H new ATOM 0 HG LEU A 404 -0.308 7.634 7.666 1.00 0.00 H new ATOM 0 HD11 LEU A 404 0.462 9.941 8.062 1.00 0.00 H new ATOM 0 HD12 LEU A 404 0.515 8.963 9.548 1.00 0.00 H new ATOM 0 HD13 LEU A 404 2.017 9.315 8.659 1.00 0.00 H new ATOM 0 HD21 LEU A 404 0.809 8.886 5.858 1.00 0.00 H new ATOM 0 HD22 LEU A 404 2.377 8.218 6.372 1.00 0.00 H new ATOM 0 HD23 LEU A 404 1.115 7.137 5.735 1.00 0.00 H new ATOM 595 N LEU A 405 0.127 3.961 8.120 1.00 0.00 N ATOM 596 CA LEU A 405 -0.709 2.993 7.418 1.00 0.00 C ATOM 597 C LEU A 405 -1.692 2.325 8.375 1.00 0.00 C ATOM 598 O LEU A 405 -2.809 1.978 7.991 1.00 0.00 O ATOM 599 CB LEU A 405 0.161 1.933 6.743 1.00 0.00 C ATOM 600 CG LEU A 405 -0.612 0.833 6.007 1.00 0.00 C ATOM 601 CD1 LEU A 405 -0.318 0.877 4.515 1.00 0.00 C ATOM 602 CD2 LEU A 405 -0.271 -0.536 6.578 1.00 0.00 C ATOM 0 H LEU A 405 1.128 3.773 8.064 1.00 0.00 H new ATOM 0 HA LEU A 405 -1.278 3.527 6.657 1.00 0.00 H new ATOM 0 HB2 LEU A 405 0.824 2.427 6.033 1.00 0.00 H new ATOM 0 HB3 LEU A 405 0.793 1.468 7.499 1.00 0.00 H new ATOM 0 HG LEU A 405 -1.678 1.010 6.152 1.00 0.00 H new ATOM 0 HD11 LEU A 405 -0.876 0.088 4.011 1.00 0.00 H new ATOM 0 HD12 LEU A 405 -0.616 1.846 4.114 1.00 0.00 H new ATOM 0 HD13 LEU A 405 0.749 0.729 4.350 1.00 0.00 H new ATOM 0 HD21 LEU A 405 -0.830 -1.303 6.042 1.00 0.00 H new ATOM 0 HD22 LEU A 405 0.797 -0.721 6.467 1.00 0.00 H new ATOM 0 HD23 LEU A 405 -0.536 -0.566 7.635 1.00 0.00 H new ATOM 614 N SER A 406 -1.269 2.149 9.622 1.00 0.00 N ATOM 615 CA SER A 406 -2.113 1.523 10.634 1.00 0.00 C ATOM 616 C SER A 406 -3.283 2.430 11.002 1.00 0.00 C ATOM 617 O SER A 406 -4.361 1.953 11.359 1.00 0.00 O ATOM 618 CB SER A 406 -1.290 1.193 11.883 1.00 0.00 C ATOM 619 OG SER A 406 -1.323 -0.196 12.162 1.00 0.00 O ATOM 0 H SER A 406 -0.347 2.431 9.956 1.00 0.00 H new ATOM 0 HA SER A 406 -2.512 0.598 10.218 1.00 0.00 H new ATOM 0 HB2 SER A 406 -0.258 1.514 11.738 1.00 0.00 H new ATOM 0 HB3 SER A 406 -1.679 1.748 12.736 1.00 0.00 H new ATOM 0 HG SER A 406 -0.789 -0.382 12.963 1.00 0.00 H new ATOM 625 N GLU A 407 -3.066 3.738 10.912 1.00 0.00 N ATOM 626 CA GLU A 407 -4.103 4.710 11.236 1.00 0.00 C ATOM 627 C GLU A 407 -5.037 4.924 10.048 1.00 0.00 C ATOM 628 O GLU A 407 -6.249 5.061 10.216 1.00 0.00 O ATOM 629 CB GLU A 407 -3.473 6.041 11.651 1.00 0.00 C ATOM 630 CG GLU A 407 -4.438 6.973 12.367 1.00 0.00 C ATOM 631 CD GLU A 407 -4.506 8.346 11.727 1.00 0.00 C ATOM 632 OE1 GLU A 407 -4.540 8.420 10.480 1.00 0.00 O ATOM 633 OE2 GLU A 407 -4.525 9.348 12.473 1.00 0.00 O ATOM 0 H GLU A 407 -2.180 4.149 10.617 1.00 0.00 H new ATOM 0 HA GLU A 407 -4.687 4.318 12.069 1.00 0.00 H new ATOM 0 HB2 GLU A 407 -2.621 5.843 12.302 1.00 0.00 H new ATOM 0 HB3 GLU A 407 -3.087 6.543 10.764 1.00 0.00 H new ATOM 0 HG2 GLU A 407 -5.433 6.528 12.369 1.00 0.00 H new ATOM 0 HG3 GLU A 407 -4.132 7.076 13.408 1.00 0.00 H new ATOM 640 N ILE A 408 -4.465 4.953 8.849 1.00 0.00 N ATOM 641 CA ILE A 408 -5.247 5.152 7.634 1.00 0.00 C ATOM 642 C ILE A 408 -6.191 3.978 7.393 1.00 0.00 C ATOM 643 O ILE A 408 -7.301 4.153 6.892 1.00 0.00 O ATOM 644 CB ILE A 408 -4.338 5.328 6.401 1.00 0.00 C ATOM 645 CG1 ILE A 408 -3.300 6.423 6.657 1.00 0.00 C ATOM 646 CG2 ILE A 408 -5.169 5.658 5.170 1.00 0.00 C ATOM 647 CD1 ILE A 408 -1.993 6.196 5.930 1.00 0.00 C ATOM 0 H ILE A 408 -3.463 4.841 8.692 1.00 0.00 H new ATOM 0 HA ILE A 408 -5.830 6.062 7.777 1.00 0.00 H new ATOM 0 HB ILE A 408 -3.814 4.390 6.220 1.00 0.00 H new ATOM 0 HG12 ILE A 408 -3.714 7.384 6.352 1.00 0.00 H new ATOM 0 HG13 ILE A 408 -3.105 6.485 7.728 1.00 0.00 H new ATOM 0 HG21 ILE A 408 -4.512 5.779 4.309 1.00 0.00 H new ATOM 0 HG22 ILE A 408 -5.873 4.848 4.978 1.00 0.00 H new ATOM 0 HG23 ILE A 408 -5.719 6.584 5.340 1.00 0.00 H new ATOM 0 HD11 ILE A 408 -1.304 7.010 6.157 1.00 0.00 H new ATOM 0 HD12 ILE A 408 -1.557 5.251 6.253 1.00 0.00 H new ATOM 0 HD13 ILE A 408 -2.175 6.164 4.856 1.00 0.00 H new ATOM 659 N LEU A 409 -5.742 2.780 7.757 1.00 0.00 N ATOM 660 CA LEU A 409 -6.545 1.576 7.580 1.00 0.00 C ATOM 661 C LEU A 409 -7.600 1.462 8.678 1.00 0.00 C ATOM 662 O LEU A 409 -8.686 0.925 8.455 1.00 0.00 O ATOM 663 CB LEU A 409 -5.648 0.336 7.585 1.00 0.00 C ATOM 664 CG LEU A 409 -5.232 -0.166 6.200 1.00 0.00 C ATOM 665 CD1 LEU A 409 -4.224 -1.297 6.324 1.00 0.00 C ATOM 666 CD2 LEU A 409 -6.451 -0.619 5.411 1.00 0.00 C ATOM 0 H LEU A 409 -4.826 2.618 8.176 1.00 0.00 H new ATOM 0 HA LEU A 409 -7.053 1.643 6.618 1.00 0.00 H new ATOM 0 HB2 LEU A 409 -4.749 0.559 8.160 1.00 0.00 H new ATOM 0 HB3 LEU A 409 -6.168 -0.468 8.106 1.00 0.00 H new ATOM 0 HG LEU A 409 -4.760 0.656 5.662 1.00 0.00 H new ATOM 0 HD11 LEU A 409 -3.940 -1.641 5.330 1.00 0.00 H new ATOM 0 HD12 LEU A 409 -3.339 -0.940 6.851 1.00 0.00 H new ATOM 0 HD13 LEU A 409 -4.669 -2.122 6.880 1.00 0.00 H new ATOM 0 HD21 LEU A 409 -6.138 -0.973 4.429 1.00 0.00 H new ATOM 0 HD22 LEU A 409 -6.951 -1.427 5.945 1.00 0.00 H new ATOM 0 HD23 LEU A 409 -7.139 0.218 5.293 1.00 0.00 H new ATOM 678 N ARG A 410 -7.272 1.968 9.862 1.00 0.00 N ATOM 679 CA ARG A 410 -8.192 1.922 10.993 1.00 0.00 C ATOM 680 C ARG A 410 -9.341 2.906 10.801 1.00 0.00 C ATOM 681 O ARG A 410 -10.502 2.577 11.047 1.00 0.00 O ATOM 682 CB ARG A 410 -7.451 2.234 12.294 1.00 0.00 C ATOM 683 CG ARG A 410 -8.079 1.596 13.521 1.00 0.00 C ATOM 684 CD ARG A 410 -7.775 0.108 13.593 1.00 0.00 C ATOM 685 NE ARG A 410 -8.742 -0.610 14.421 1.00 0.00 N ATOM 686 CZ ARG A 410 -8.804 -0.507 15.747 1.00 0.00 C ATOM 687 NH1 ARG A 410 -7.961 0.285 16.399 1.00 0.00 N ATOM 688 NH2 ARG A 410 -9.714 -1.196 16.423 1.00 0.00 N ATOM 0 H ARG A 410 -6.377 2.414 10.063 1.00 0.00 H new ATOM 0 HA ARG A 410 -8.605 0.915 11.051 1.00 0.00 H new ATOM 0 HB2 ARG A 410 -6.420 1.893 12.205 1.00 0.00 H new ATOM 0 HB3 ARG A 410 -7.418 3.315 12.433 1.00 0.00 H new ATOM 0 HG2 ARG A 410 -7.706 2.088 14.419 1.00 0.00 H new ATOM 0 HG3 ARG A 410 -9.158 1.747 13.499 1.00 0.00 H new ATOM 0 HD2 ARG A 410 -7.777 -0.311 12.587 1.00 0.00 H new ATOM 0 HD3 ARG A 410 -6.773 -0.038 13.997 1.00 0.00 H new ATOM 0 HE ARG A 410 -9.408 -1.226 13.956 1.00 0.00 H new ATOM 0 HH11 ARG A 410 -7.261 0.819 15.884 1.00 0.00 H new ATOM 0 HH12 ARG A 410 -8.014 0.360 17.415 1.00 0.00 H new ATOM 0 HH21 ARG A 410 -10.366 -1.804 15.927 1.00 0.00 H new ATOM 0 HH22 ARG A 410 -9.762 -1.118 17.439 1.00 0.00 H new ATOM 702 N LYS A 411 -9.012 4.115 10.362 1.00 0.00 N ATOM 703 CA LYS A 411 -10.016 5.148 10.137 1.00 0.00 C ATOM 704 C LYS A 411 -11.034 4.698 9.093 1.00 0.00 C ATOM 705 O LYS A 411 -12.242 4.795 9.310 1.00 0.00 O ATOM 706 CB LYS A 411 -9.350 6.449 9.687 1.00 0.00 C ATOM 707 CG LYS A 411 -8.585 7.155 10.794 1.00 0.00 C ATOM 708 CD LYS A 411 -8.215 8.576 10.400 1.00 0.00 C ATOM 709 CE LYS A 411 -8.008 9.456 11.619 1.00 0.00 C ATOM 710 NZ LYS A 411 -8.018 10.903 11.269 1.00 0.00 N ATOM 0 H LYS A 411 -8.056 4.405 10.154 1.00 0.00 H new ATOM 0 HA LYS A 411 -10.538 5.322 11.078 1.00 0.00 H new ATOM 0 HB2 LYS A 411 -8.667 6.233 8.866 1.00 0.00 H new ATOM 0 HB3 LYS A 411 -10.113 7.123 9.298 1.00 0.00 H new ATOM 0 HG2 LYS A 411 -9.190 7.174 11.700 1.00 0.00 H new ATOM 0 HG3 LYS A 411 -7.680 6.594 11.027 1.00 0.00 H new ATOM 0 HD2 LYS A 411 -7.305 8.563 9.801 1.00 0.00 H new ATOM 0 HD3 LYS A 411 -9.002 8.998 9.775 1.00 0.00 H new ATOM 0 HE2 LYS A 411 -8.791 9.254 12.349 1.00 0.00 H new ATOM 0 HE3 LYS A 411 -7.059 9.204 12.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 411 -7.874 11.469 12.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 411 -7.254 11.102 10.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 411 -8.933 11.150 10.841 1.00 0.00 H new ATOM 724 N GLU A 412 -10.538 4.206 7.963 1.00 0.00 N ATOM 725 CA GLU A 412 -11.403 3.741 6.885 1.00 0.00 C ATOM 726 C GLU A 412 -12.288 4.872 6.371 1.00 0.00 C ATOM 727 O GLU A 412 -13.412 4.640 5.925 1.00 0.00 O ATOM 728 CB GLU A 412 -12.272 2.578 7.367 1.00 0.00 C ATOM 729 CG GLU A 412 -12.850 1.743 6.235 1.00 0.00 C ATOM 730 CD GLU A 412 -12.347 0.312 6.249 1.00 0.00 C ATOM 731 OE1 GLU A 412 -11.252 0.061 5.704 1.00 0.00 O ATOM 732 OE2 GLU A 412 -13.050 -0.558 6.805 1.00 0.00 O ATOM 0 H GLU A 412 -9.540 4.119 7.770 1.00 0.00 H new ATOM 0 HA GLU A 412 -10.770 3.399 6.067 1.00 0.00 H new ATOM 0 HB2 GLU A 412 -11.677 1.935 8.015 1.00 0.00 H new ATOM 0 HB3 GLU A 412 -13.089 2.972 7.971 1.00 0.00 H new ATOM 0 HG2 GLU A 412 -13.938 1.742 6.308 1.00 0.00 H new ATOM 0 HG3 GLU A 412 -12.595 2.205 5.281 1.00 0.00 H new ATOM 739 N GLU A 413 -11.774 6.096 6.435 1.00 0.00 N ATOM 740 CA GLU A 413 -12.519 7.262 5.974 1.00 0.00 C ATOM 741 C GLU A 413 -12.341 7.463 4.473 1.00 0.00 C ATOM 742 O GLU A 413 -11.313 7.096 3.905 1.00 0.00 O ATOM 743 CB GLU A 413 -12.065 8.514 6.729 1.00 0.00 C ATOM 744 CG GLU A 413 -12.937 8.849 7.928 1.00 0.00 C ATOM 745 CD GLU A 413 -13.312 10.318 7.984 1.00 0.00 C ATOM 746 OE1 GLU A 413 -12.397 11.160 8.104 1.00 0.00 O ATOM 747 OE2 GLU A 413 -14.519 10.625 7.910 1.00 0.00 O ATOM 0 H GLU A 413 -10.845 6.306 6.801 1.00 0.00 H new ATOM 0 HA GLU A 413 -13.577 7.090 6.174 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -11.038 8.373 7.065 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -12.063 9.361 6.043 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -13.845 8.247 7.892 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -12.411 8.577 8.843 1.00 0.00 H new ATOM 754 N ASP A 414 -13.350 8.049 3.835 1.00 0.00 N ATOM 755 CA ASP A 414 -13.305 8.299 2.400 1.00 0.00 C ATOM 756 C ASP A 414 -12.373 9.467 2.079 1.00 0.00 C ATOM 757 O ASP A 414 -12.295 10.434 2.838 1.00 0.00 O ATOM 758 CB ASP A 414 -14.710 8.591 1.868 1.00 0.00 C ATOM 759 CG ASP A 414 -14.993 7.876 0.562 1.00 0.00 C ATOM 760 OD1 ASP A 414 -14.741 6.655 0.486 1.00 0.00 O ATOM 761 OD2 ASP A 414 -15.465 8.538 -0.387 1.00 0.00 O ATOM 0 H ASP A 414 -14.208 8.359 4.290 1.00 0.00 H new ATOM 0 HA ASP A 414 -12.918 7.404 1.912 1.00 0.00 H new ATOM 0 HB2 ASP A 414 -15.447 8.289 2.612 1.00 0.00 H new ATOM 0 HB3 ASP A 414 -14.825 9.665 1.723 1.00 0.00 H new ATOM 766 N PRO A 415 -11.651 9.393 0.946 1.00 0.00 N ATOM 767 CA PRO A 415 -10.723 10.450 0.532 1.00 0.00 C ATOM 768 C PRO A 415 -11.440 11.680 -0.019 1.00 0.00 C ATOM 769 O PRO A 415 -10.804 12.687 -0.336 1.00 0.00 O ATOM 770 CB PRO A 415 -9.900 9.776 -0.565 1.00 0.00 C ATOM 771 CG PRO A 415 -10.817 8.761 -1.151 1.00 0.00 C ATOM 772 CD PRO A 415 -11.682 8.275 -0.018 1.00 0.00 C ATOM 0 HA PRO A 415 -10.131 10.824 1.368 1.00 0.00 H new ATOM 0 HB2 PRO A 415 -9.574 10.496 -1.315 1.00 0.00 H new ATOM 0 HB3 PRO A 415 -9.002 9.311 -0.158 1.00 0.00 H new ATOM 0 HG2 PRO A 415 -11.424 9.196 -1.945 1.00 0.00 H new ATOM 0 HG3 PRO A 415 -10.256 7.938 -1.593 1.00 0.00 H new ATOM 0 HD2 PRO A 415 -12.697 8.061 -0.352 1.00 0.00 H new ATOM 0 HD3 PRO A 415 -11.291 7.357 0.420 1.00 0.00 H new ATOM 780 N LYS A 416 -12.763 11.599 -0.133 1.00 0.00 N ATOM 781 CA LYS A 416 -13.556 12.710 -0.647 1.00 0.00 C ATOM 782 C LYS A 416 -13.326 13.973 0.177 1.00 0.00 C ATOM 783 O LYS A 416 -13.120 15.056 -0.374 1.00 0.00 O ATOM 784 CB LYS A 416 -15.042 12.348 -0.639 1.00 0.00 C ATOM 785 CG LYS A 416 -15.449 11.420 -1.773 1.00 0.00 C ATOM 786 CD LYS A 416 -15.450 12.143 -3.110 1.00 0.00 C ATOM 787 CE LYS A 416 -16.641 13.079 -3.236 1.00 0.00 C ATOM 788 NZ LYS A 416 -17.835 12.384 -3.794 1.00 0.00 N ATOM 0 H LYS A 416 -13.308 10.776 0.124 1.00 0.00 H new ATOM 0 HA LYS A 416 -13.240 12.905 -1.672 1.00 0.00 H new ATOM 0 HB2 LYS A 416 -15.287 11.875 0.312 1.00 0.00 H new ATOM 0 HB3 LYS A 416 -15.631 13.263 -0.701 1.00 0.00 H new ATOM 0 HG2 LYS A 416 -14.763 10.574 -1.816 1.00 0.00 H new ATOM 0 HG3 LYS A 416 -16.442 11.016 -1.576 1.00 0.00 H new ATOM 0 HD2 LYS A 416 -14.526 12.711 -3.218 1.00 0.00 H new ATOM 0 HD3 LYS A 416 -15.472 11.413 -3.919 1.00 0.00 H new ATOM 0 HE2 LYS A 416 -16.885 13.491 -2.257 1.00 0.00 H new ATOM 0 HE3 LYS A 416 -16.377 13.919 -3.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 416 -18.626 13.055 -3.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 416 -17.610 12.013 -4.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 416 -18.103 11.598 -3.168 1.00 0.00 H new ATOM 802 N THR A 417 -13.361 13.828 1.497 1.00 0.00 N ATOM 803 CA THR A 417 -13.154 14.958 2.395 1.00 0.00 C ATOM 804 C THR A 417 -11.812 14.853 3.112 1.00 0.00 C ATOM 805 O THR A 417 -11.669 15.301 4.249 1.00 0.00 O ATOM 806 CB THR A 417 -14.277 15.053 3.445 1.00 0.00 C ATOM 807 OG1 THR A 417 -14.701 13.739 3.830 1.00 0.00 O ATOM 808 CG2 THR A 417 -15.463 15.833 2.900 1.00 0.00 C ATOM 0 H THR A 417 -13.531 12.940 1.969 1.00 0.00 H new ATOM 0 HA THR A 417 -13.164 15.857 1.779 1.00 0.00 H new ATOM 0 HB THR A 417 -13.886 15.578 4.316 1.00 0.00 H new ATOM 0 HG1 THR A 417 -15.414 13.808 4.499 1.00 0.00 H new ATOM 0 HG21 THR A 417 -16.243 15.887 3.659 1.00 0.00 H new ATOM 0 HG22 THR A 417 -15.145 16.841 2.635 1.00 0.00 H new ATOM 0 HG23 THR A 417 -15.853 15.331 2.014 1.00 0.00 H new ATOM 816 N ALA A 418 -10.832 14.261 2.437 1.00 0.00 N ATOM 817 CA ALA A 418 -9.502 14.099 3.009 1.00 0.00 C ATOM 818 C ALA A 418 -8.546 15.164 2.484 1.00 0.00 C ATOM 819 O ALA A 418 -8.830 15.831 1.488 1.00 0.00 O ATOM 820 CB ALA A 418 -8.963 12.709 2.706 1.00 0.00 C ATOM 0 H ALA A 418 -10.935 13.886 1.494 1.00 0.00 H new ATOM 0 HA ALA A 418 -9.581 14.219 4.090 1.00 0.00 H new ATOM 0 HB1 ALA A 418 -7.969 12.602 3.139 1.00 0.00 H new ATOM 0 HB2 ALA A 418 -9.628 11.959 3.135 1.00 0.00 H new ATOM 0 HB3 ALA A 418 -8.905 12.568 1.627 1.00 0.00 H new ATOM 826 N SER A 419 -7.412 15.319 3.158 1.00 0.00 N ATOM 827 CA SER A 419 -6.415 16.305 2.759 1.00 0.00 C ATOM 828 C SER A 419 -5.583 15.792 1.588 1.00 0.00 C ATOM 829 O SER A 419 -5.721 14.641 1.173 1.00 0.00 O ATOM 830 CB SER A 419 -5.501 16.642 3.939 1.00 0.00 C ATOM 831 OG SER A 419 -5.972 17.781 4.638 1.00 0.00 O ATOM 0 H SER A 419 -7.160 14.775 3.983 1.00 0.00 H new ATOM 0 HA SER A 419 -6.938 17.208 2.443 1.00 0.00 H new ATOM 0 HB2 SER A 419 -5.449 15.791 4.618 1.00 0.00 H new ATOM 0 HB3 SER A 419 -4.489 16.825 3.579 1.00 0.00 H new ATOM 0 HG SER A 419 -5.372 17.975 5.388 1.00 0.00 H new ATOM 837 N GLN A 420 -4.720 16.653 1.059 1.00 0.00 N ATOM 838 CA GLN A 420 -3.865 16.286 -0.065 1.00 0.00 C ATOM 839 C GLN A 420 -2.883 15.190 0.333 1.00 0.00 C ATOM 840 O GLN A 420 -2.611 14.274 -0.443 1.00 0.00 O ATOM 841 CB GLN A 420 -3.105 17.512 -0.576 1.00 0.00 C ATOM 842 CG GLN A 420 -3.091 17.632 -2.091 1.00 0.00 C ATOM 843 CD GLN A 420 -3.644 18.957 -2.578 1.00 0.00 C ATOM 844 OE1 GLN A 420 -4.708 19.397 -2.141 1.00 0.00 O ATOM 845 NE2 GLN A 420 -2.923 19.601 -3.488 1.00 0.00 N ATOM 0 H GLN A 420 -4.594 17.609 1.390 1.00 0.00 H new ATOM 0 HA GLN A 420 -4.500 15.904 -0.864 1.00 0.00 H new ATOM 0 HB2 GLN A 420 -3.555 18.410 -0.153 1.00 0.00 H new ATOM 0 HB3 GLN A 420 -2.078 17.469 -0.214 1.00 0.00 H new ATOM 0 HG2 GLN A 420 -2.069 17.515 -2.451 1.00 0.00 H new ATOM 0 HG3 GLN A 420 -3.676 16.819 -2.521 1.00 0.00 H new ATOM 0 HE21 GLN A 420 -2.047 19.199 -3.822 1.00 0.00 H new ATOM 0 HE22 GLN A 420 -3.245 20.497 -3.853 1.00 0.00 H new ATOM 854 N SER A 421 -2.355 15.289 1.549 1.00 0.00 N ATOM 855 CA SER A 421 -1.401 14.306 2.051 1.00 0.00 C ATOM 856 C SER A 421 -2.010 12.908 2.053 1.00 0.00 C ATOM 857 O SER A 421 -1.347 11.932 1.697 1.00 0.00 O ATOM 858 CB SER A 421 -0.952 14.680 3.466 1.00 0.00 C ATOM 859 OG SER A 421 -2.062 14.990 4.290 1.00 0.00 O ATOM 0 H SER A 421 -2.571 16.040 2.205 1.00 0.00 H new ATOM 0 HA SER A 421 -0.535 14.305 1.389 1.00 0.00 H new ATOM 0 HB2 SER A 421 -0.391 13.854 3.903 1.00 0.00 H new ATOM 0 HB3 SER A 421 -0.278 15.535 3.422 1.00 0.00 H new ATOM 0 HG SER A 421 -1.747 15.224 5.188 1.00 0.00 H new ATOM 865 N LEU A 422 -3.274 12.818 2.450 1.00 0.00 N ATOM 866 CA LEU A 422 -3.972 11.538 2.496 1.00 0.00 C ATOM 867 C LEU A 422 -4.219 11.003 1.090 1.00 0.00 C ATOM 868 O LEU A 422 -4.246 9.792 0.870 1.00 0.00 O ATOM 869 CB LEU A 422 -5.300 11.682 3.240 1.00 0.00 C ATOM 870 CG LEU A 422 -5.955 10.365 3.657 1.00 0.00 C ATOM 871 CD1 LEU A 422 -5.038 9.584 4.585 1.00 0.00 C ATOM 872 CD2 LEU A 422 -7.297 10.626 4.325 1.00 0.00 C ATOM 0 H LEU A 422 -3.837 13.616 2.745 1.00 0.00 H new ATOM 0 HA LEU A 422 -3.341 10.828 3.030 1.00 0.00 H new ATOM 0 HB2 LEU A 422 -5.135 12.287 4.132 1.00 0.00 H new ATOM 0 HB3 LEU A 422 -5.996 12.232 2.606 1.00 0.00 H new ATOM 0 HG LEU A 422 -6.127 9.767 2.762 1.00 0.00 H new ATOM 0 HD11 LEU A 422 -5.521 8.650 4.872 1.00 0.00 H new ATOM 0 HD12 LEU A 422 -4.101 9.366 4.072 1.00 0.00 H new ATOM 0 HD13 LEU A 422 -4.834 10.176 5.477 1.00 0.00 H new ATOM 0 HD21 LEU A 422 -7.749 9.678 4.615 1.00 0.00 H new ATOM 0 HD22 LEU A 422 -7.149 11.244 5.211 1.00 0.00 H new ATOM 0 HD23 LEU A 422 -7.956 11.144 3.628 1.00 0.00 H new ATOM 884 N LEU A 423 -4.398 11.914 0.138 1.00 0.00 N ATOM 885 CA LEU A 423 -4.643 11.537 -1.248 1.00 0.00 C ATOM 886 C LEU A 423 -3.380 10.965 -1.886 1.00 0.00 C ATOM 887 O LEU A 423 -3.430 9.949 -2.579 1.00 0.00 O ATOM 888 CB LEU A 423 -5.133 12.744 -2.049 1.00 0.00 C ATOM 889 CG LEU A 423 -6.496 13.292 -1.624 1.00 0.00 C ATOM 890 CD1 LEU A 423 -6.767 14.629 -2.296 1.00 0.00 C ATOM 891 CD2 LEU A 423 -7.597 12.294 -1.956 1.00 0.00 C ATOM 0 H LEU A 423 -4.378 12.920 0.303 1.00 0.00 H new ATOM 0 HA LEU A 423 -5.415 10.767 -1.259 1.00 0.00 H new ATOM 0 HB2 LEU A 423 -4.395 13.542 -1.964 1.00 0.00 H new ATOM 0 HB3 LEU A 423 -5.182 12.467 -3.102 1.00 0.00 H new ATOM 0 HG LEU A 423 -6.484 13.447 -0.545 1.00 0.00 H new ATOM 0 HD11 LEU A 423 -7.741 15.003 -1.982 1.00 0.00 H new ATOM 0 HD12 LEU A 423 -5.994 15.343 -2.010 1.00 0.00 H new ATOM 0 HD13 LEU A 423 -6.760 14.500 -3.378 1.00 0.00 H new ATOM 0 HD21 LEU A 423 -8.561 12.699 -1.647 1.00 0.00 H new ATOM 0 HD22 LEU A 423 -7.609 12.109 -3.030 1.00 0.00 H new ATOM 0 HD23 LEU A 423 -7.411 11.358 -1.429 1.00 0.00 H new ATOM 903 N VAL A 424 -2.252 11.626 -1.649 1.00 0.00 N ATOM 904 CA VAL A 424 -0.977 11.182 -2.199 1.00 0.00 C ATOM 905 C VAL A 424 -0.634 9.775 -1.723 1.00 0.00 C ATOM 906 O VAL A 424 -0.188 8.936 -2.504 1.00 0.00 O ATOM 907 CB VAL A 424 0.166 12.137 -1.810 1.00 0.00 C ATOM 908 CG1 VAL A 424 1.444 11.767 -2.547 1.00 0.00 C ATOM 909 CG2 VAL A 424 -0.223 13.581 -2.092 1.00 0.00 C ATOM 0 H VAL A 424 -2.195 12.471 -1.080 1.00 0.00 H new ATOM 0 HA VAL A 424 -1.084 11.180 -3.284 1.00 0.00 H new ATOM 0 HB VAL A 424 0.349 12.038 -0.740 1.00 0.00 H new ATOM 0 HG11 VAL A 424 2.241 12.453 -2.260 1.00 0.00 H new ATOM 0 HG12 VAL A 424 1.731 10.748 -2.288 1.00 0.00 H new ATOM 0 HG13 VAL A 424 1.277 11.835 -3.622 1.00 0.00 H new ATOM 0 HG21 VAL A 424 0.598 14.241 -1.810 1.00 0.00 H new ATOM 0 HG22 VAL A 424 -0.436 13.700 -3.154 1.00 0.00 H new ATOM 0 HG23 VAL A 424 -1.110 13.838 -1.513 1.00 0.00 H new ATOM 919 N ASN A 425 -0.844 9.526 -0.434 1.00 0.00 N ATOM 920 CA ASN A 425 -0.558 8.220 0.147 1.00 0.00 C ATOM 921 C ASN A 425 -1.518 7.164 -0.389 1.00 0.00 C ATOM 922 O ASN A 425 -1.106 6.060 -0.746 1.00 0.00 O ATOM 923 CB ASN A 425 -0.656 8.286 1.673 1.00 0.00 C ATOM 924 CG ASN A 425 0.548 8.961 2.301 1.00 0.00 C ATOM 925 OD1 ASN A 425 1.621 8.367 2.411 1.00 0.00 O ATOM 926 ND2 ASN A 425 0.376 10.211 2.718 1.00 0.00 N ATOM 0 H ASN A 425 -1.211 10.211 0.227 1.00 0.00 H new ATOM 0 HA ASN A 425 0.457 7.939 -0.135 1.00 0.00 H new ATOM 0 HB2 ASN A 425 -1.560 8.827 1.953 1.00 0.00 H new ATOM 0 HB3 ASN A 425 -0.752 7.276 2.072 1.00 0.00 H new ATOM 0 HD21 ASN A 425 1.150 10.716 3.149 1.00 0.00 H new ATOM 0 HD22 ASN A 425 -0.530 10.665 2.607 1.00 0.00 H new ATOM 933 N LEU A 426 -2.800 7.509 -0.442 1.00 0.00 N ATOM 934 CA LEU A 426 -3.819 6.590 -0.936 1.00 0.00 C ATOM 935 C LEU A 426 -3.636 6.323 -2.427 1.00 0.00 C ATOM 936 O LEU A 426 -3.803 5.197 -2.890 1.00 0.00 O ATOM 937 CB LEU A 426 -5.217 7.156 -0.672 1.00 0.00 C ATOM 938 CG LEU A 426 -5.889 6.654 0.608 1.00 0.00 C ATOM 939 CD1 LEU A 426 -4.978 6.864 1.808 1.00 0.00 C ATOM 940 CD2 LEU A 426 -7.222 7.355 0.819 1.00 0.00 C ATOM 0 H LEU A 426 -3.158 8.418 -0.149 1.00 0.00 H new ATOM 0 HA LEU A 426 -3.711 5.646 -0.402 1.00 0.00 H new ATOM 0 HB2 LEU A 426 -5.149 8.243 -0.626 1.00 0.00 H new ATOM 0 HB3 LEU A 426 -5.857 6.912 -1.520 1.00 0.00 H new ATOM 0 HG LEU A 426 -6.075 5.585 0.503 1.00 0.00 H new ATOM 0 HD11 LEU A 426 -5.473 6.501 2.709 1.00 0.00 H new ATOM 0 HD12 LEU A 426 -4.048 6.316 1.659 1.00 0.00 H new ATOM 0 HD13 LEU A 426 -4.759 7.926 1.917 1.00 0.00 H new ATOM 0 HD21 LEU A 426 -7.686 6.986 1.734 1.00 0.00 H new ATOM 0 HD22 LEU A 426 -7.059 8.429 0.903 1.00 0.00 H new ATOM 0 HD23 LEU A 426 -7.878 7.153 -0.028 1.00 0.00 H new ATOM 952 N ARG A 427 -3.294 7.369 -3.171 1.00 0.00 N ATOM 953 CA ARG A 427 -3.089 7.248 -4.610 1.00 0.00 C ATOM 954 C ARG A 427 -1.966 6.262 -4.918 1.00 0.00 C ATOM 955 O ARG A 427 -2.068 5.460 -5.846 1.00 0.00 O ATOM 956 CB ARG A 427 -2.765 8.615 -5.218 1.00 0.00 C ATOM 957 CG ARG A 427 -3.975 9.316 -5.817 1.00 0.00 C ATOM 958 CD ARG A 427 -3.561 10.381 -6.820 1.00 0.00 C ATOM 959 NE ARG A 427 -3.516 9.862 -8.184 1.00 0.00 N ATOM 960 CZ ARG A 427 -4.594 9.691 -8.947 1.00 0.00 C ATOM 961 NH1 ARG A 427 -5.800 9.995 -8.484 1.00 0.00 N ATOM 962 NH2 ARG A 427 -4.465 9.214 -10.177 1.00 0.00 N ATOM 0 H ARG A 427 -3.153 8.309 -2.802 1.00 0.00 H new ATOM 0 HA ARG A 427 -4.011 6.871 -5.053 1.00 0.00 H new ATOM 0 HB2 ARG A 427 -2.330 9.252 -4.448 1.00 0.00 H new ATOM 0 HB3 ARG A 427 -2.008 8.489 -5.992 1.00 0.00 H new ATOM 0 HG2 ARG A 427 -4.616 8.583 -6.307 1.00 0.00 H new ATOM 0 HG3 ARG A 427 -4.563 9.773 -5.021 1.00 0.00 H new ATOM 0 HD2 ARG A 427 -4.261 11.215 -6.773 1.00 0.00 H new ATOM 0 HD3 ARG A 427 -2.581 10.772 -6.549 1.00 0.00 H new ATOM 0 HE ARG A 427 -2.607 9.616 -8.575 1.00 0.00 H new ATOM 0 HH11 ARG A 427 -5.906 10.362 -7.538 1.00 0.00 H new ATOM 0 HH12 ARG A 427 -6.621 9.862 -9.074 1.00 0.00 H new ATOM 0 HH21 ARG A 427 -3.541 8.978 -10.538 1.00 0.00 H new ATOM 0 HH22 ARG A 427 -5.290 9.083 -10.762 1.00 0.00 H new ATOM 976 N ALA A 428 -0.896 6.327 -4.131 1.00 0.00 N ATOM 977 CA ALA A 428 0.244 5.439 -4.319 1.00 0.00 C ATOM 978 C ALA A 428 -0.167 3.978 -4.167 1.00 0.00 C ATOM 979 O ALA A 428 0.290 3.113 -4.914 1.00 0.00 O ATOM 980 CB ALA A 428 1.350 5.785 -3.332 1.00 0.00 C ATOM 0 H ALA A 428 -0.796 6.985 -3.358 1.00 0.00 H new ATOM 0 HA ALA A 428 0.620 5.579 -5.333 1.00 0.00 H new ATOM 0 HB1 ALA A 428 2.196 5.114 -3.483 1.00 0.00 H new ATOM 0 HB2 ALA A 428 1.671 6.815 -3.491 1.00 0.00 H new ATOM 0 HB3 ALA A 428 0.977 5.674 -2.314 1.00 0.00 H new ATOM 986 N MET A 429 -1.035 3.711 -3.197 1.00 0.00 N ATOM 987 CA MET A 429 -1.510 2.356 -2.947 1.00 0.00 C ATOM 988 C MET A 429 -2.224 1.796 -4.173 1.00 0.00 C ATOM 989 O MET A 429 -2.108 0.612 -4.486 1.00 0.00 O ATOM 990 CB MET A 429 -2.451 2.338 -1.741 1.00 0.00 C ATOM 991 CG MET A 429 -1.725 2.349 -0.404 1.00 0.00 C ATOM 992 SD MET A 429 -2.309 3.654 0.697 1.00 0.00 S ATOM 993 CE MET A 429 -2.974 2.685 2.049 1.00 0.00 C ATOM 0 H MET A 429 -1.424 4.416 -2.571 1.00 0.00 H new ATOM 0 HA MET A 429 -0.646 1.727 -2.734 1.00 0.00 H new ATOM 0 HB2 MET A 429 -3.112 3.203 -1.793 1.00 0.00 H new ATOM 0 HB3 MET A 429 -3.082 1.451 -1.796 1.00 0.00 H new ATOM 0 HG2 MET A 429 -1.856 1.383 0.083 1.00 0.00 H new ATOM 0 HG3 MET A 429 -0.656 2.477 -0.577 1.00 0.00 H new ATOM 0 HE1 MET A 429 -3.277 3.349 2.858 1.00 0.00 H new ATOM 0 HE2 MET A 429 -3.838 2.120 1.701 1.00 0.00 H new ATOM 0 HE3 MET A 429 -2.212 1.995 2.412 1.00 0.00 H new ATOM 1003 N GLN A 430 -2.964 2.658 -4.863 1.00 0.00 N ATOM 1004 CA GLN A 430 -3.699 2.250 -6.056 1.00 0.00 C ATOM 1005 C GLN A 430 -2.744 1.982 -7.216 1.00 0.00 C ATOM 1006 O GLN A 430 -2.949 1.056 -7.999 1.00 0.00 O ATOM 1007 CB GLN A 430 -4.710 3.326 -6.450 1.00 0.00 C ATOM 1008 CG GLN A 430 -5.820 2.816 -7.355 1.00 0.00 C ATOM 1009 CD GLN A 430 -7.183 3.362 -6.972 1.00 0.00 C ATOM 1010 OE1 GLN A 430 -7.845 2.836 -6.076 1.00 0.00 O ATOM 1011 NE2 GLN A 430 -7.609 4.420 -7.650 1.00 0.00 N ATOM 0 H GLN A 430 -3.071 3.642 -4.617 1.00 0.00 H new ATOM 0 HA GLN A 430 -4.233 1.328 -5.827 1.00 0.00 H new ATOM 0 HB2 GLN A 430 -5.153 3.745 -5.546 1.00 0.00 H new ATOM 0 HB3 GLN A 430 -4.186 4.138 -6.954 1.00 0.00 H new ATOM 0 HG2 GLN A 430 -5.599 3.092 -8.386 1.00 0.00 H new ATOM 0 HG3 GLN A 430 -5.845 1.727 -7.315 1.00 0.00 H new ATOM 0 HE21 GLN A 430 -7.027 4.823 -8.384 1.00 0.00 H new ATOM 0 HE22 GLN A 430 -8.518 4.830 -7.437 1.00 0.00 H new ATOM 1020 N ASN A 431 -1.703 2.800 -7.318 1.00 0.00 N ATOM 1021 CA ASN A 431 -0.716 2.652 -8.381 1.00 0.00 C ATOM 1022 C ASN A 431 0.033 1.330 -8.246 1.00 0.00 C ATOM 1023 O ASN A 431 0.265 0.633 -9.234 1.00 0.00 O ATOM 1024 CB ASN A 431 0.275 3.818 -8.354 1.00 0.00 C ATOM 1025 CG ASN A 431 -0.252 5.041 -9.078 1.00 0.00 C ATOM 1026 OD1 ASN A 431 -0.507 6.078 -8.466 1.00 0.00 O ATOM 1027 ND2 ASN A 431 -0.418 4.925 -10.391 1.00 0.00 N ATOM 0 H ASN A 431 -1.520 3.573 -6.678 1.00 0.00 H new ATOM 0 HA ASN A 431 -1.243 2.656 -9.335 1.00 0.00 H new ATOM 0 HB2 ASN A 431 0.497 4.079 -7.319 1.00 0.00 H new ATOM 0 HB3 ASN A 431 1.213 3.504 -8.812 1.00 0.00 H new ATOM 0 HD21 ASN A 431 -0.770 5.715 -10.932 1.00 0.00 H new ATOM 0 HD22 ASN A 431 -0.194 4.046 -10.858 1.00 0.00 H new ATOM 1034 N PHE A 432 0.408 0.992 -7.017 1.00 0.00 N ATOM 1035 CA PHE A 432 1.130 -0.247 -6.752 1.00 0.00 C ATOM 1036 C PHE A 432 0.286 -1.460 -7.128 1.00 0.00 C ATOM 1037 O PHE A 432 0.767 -2.384 -7.785 1.00 0.00 O ATOM 1038 CB PHE A 432 1.524 -0.325 -5.275 1.00 0.00 C ATOM 1039 CG PHE A 432 2.316 -1.553 -4.928 1.00 0.00 C ATOM 1040 CD1 PHE A 432 3.416 -1.923 -5.687 1.00 0.00 C ATOM 1041 CD2 PHE A 432 1.960 -2.339 -3.845 1.00 0.00 C ATOM 1042 CE1 PHE A 432 4.145 -3.052 -5.369 1.00 0.00 C ATOM 1043 CE2 PHE A 432 2.687 -3.469 -3.522 1.00 0.00 C ATOM 1044 CZ PHE A 432 3.781 -3.827 -4.286 1.00 0.00 C ATOM 0 H PHE A 432 0.224 1.558 -6.189 1.00 0.00 H new ATOM 0 HA PHE A 432 2.032 -0.251 -7.364 1.00 0.00 H new ATOM 0 HB2 PHE A 432 2.107 0.559 -5.016 1.00 0.00 H new ATOM 0 HB3 PHE A 432 0.621 -0.301 -4.665 1.00 0.00 H new ATOM 0 HD1 PHE A 432 3.706 -1.322 -6.536 1.00 0.00 H new ATOM 0 HD2 PHE A 432 1.104 -2.066 -3.246 1.00 0.00 H new ATOM 0 HE1 PHE A 432 5.000 -3.329 -5.968 1.00 0.00 H new ATOM 0 HE2 PHE A 432 2.400 -4.072 -2.673 1.00 0.00 H new ATOM 0 HZ PHE A 432 4.350 -4.711 -4.037 1.00 0.00 H new ATOM 1054 N LEU A 433 -0.976 -1.449 -6.711 1.00 0.00 N ATOM 1055 CA LEU A 433 -1.888 -2.547 -7.006 1.00 0.00 C ATOM 1056 C LEU A 433 -2.157 -2.647 -8.504 1.00 0.00 C ATOM 1057 O LEU A 433 -2.411 -3.731 -9.028 1.00 0.00 O ATOM 1058 CB LEU A 433 -3.207 -2.358 -6.251 1.00 0.00 C ATOM 1059 CG LEU A 433 -3.169 -2.748 -4.773 1.00 0.00 C ATOM 1060 CD1 LEU A 433 -4.398 -2.216 -4.049 1.00 0.00 C ATOM 1061 CD2 LEU A 433 -3.072 -4.257 -4.623 1.00 0.00 C ATOM 0 H LEU A 433 -1.390 -0.691 -6.168 1.00 0.00 H new ATOM 0 HA LEU A 433 -1.417 -3.474 -6.678 1.00 0.00 H new ATOM 0 HB2 LEU A 433 -3.505 -1.312 -6.327 1.00 0.00 H new ATOM 0 HB3 LEU A 433 -3.979 -2.947 -6.747 1.00 0.00 H new ATOM 0 HG LEU A 433 -2.284 -2.300 -4.321 1.00 0.00 H new ATOM 0 HD11 LEU A 433 -4.354 -2.503 -2.998 1.00 0.00 H new ATOM 0 HD12 LEU A 433 -4.424 -1.129 -4.127 1.00 0.00 H new ATOM 0 HD13 LEU A 433 -5.297 -2.634 -4.502 1.00 0.00 H new ATOM 0 HD21 LEU A 433 -3.046 -4.517 -3.565 1.00 0.00 H new ATOM 0 HD22 LEU A 433 -3.938 -4.726 -5.090 1.00 0.00 H new ATOM 0 HD23 LEU A 433 -2.162 -4.613 -5.106 1.00 0.00 H new ATOM 1073 N GLN A 434 -2.097 -1.508 -9.189 1.00 0.00 N ATOM 1074 CA GLN A 434 -2.334 -1.469 -10.628 1.00 0.00 C ATOM 1075 C GLN A 434 -1.191 -2.136 -11.387 1.00 0.00 C ATOM 1076 O GLN A 434 -1.392 -2.689 -12.469 1.00 0.00 O ATOM 1077 CB GLN A 434 -2.497 -0.022 -11.097 1.00 0.00 C ATOM 1078 CG GLN A 434 -3.931 0.479 -11.035 1.00 0.00 C ATOM 1079 CD GLN A 434 -4.148 1.727 -11.869 1.00 0.00 C ATOM 1080 OE1 GLN A 434 -3.363 2.033 -12.767 1.00 0.00 O ATOM 1081 NE2 GLN A 434 -5.220 2.454 -11.576 1.00 0.00 N ATOM 0 H GLN A 434 -1.887 -0.602 -8.771 1.00 0.00 H new ATOM 0 HA GLN A 434 -3.252 -2.019 -10.836 1.00 0.00 H new ATOM 0 HB2 GLN A 434 -1.868 0.623 -10.483 1.00 0.00 H new ATOM 0 HB3 GLN A 434 -2.135 0.062 -12.122 1.00 0.00 H new ATOM 0 HG2 GLN A 434 -4.602 -0.307 -11.382 1.00 0.00 H new ATOM 0 HG3 GLN A 434 -4.194 0.689 -9.998 1.00 0.00 H new ATOM 0 HE21 GLN A 434 -5.844 2.163 -10.823 1.00 0.00 H new ATOM 0 HE22 GLN A 434 -5.420 3.304 -12.104 1.00 0.00 H new ATOM 1090 N LEU A 435 0.008 -2.080 -10.816 1.00 0.00 N ATOM 1091 CA LEU A 435 1.181 -2.679 -11.441 1.00 0.00 C ATOM 1092 C LEU A 435 0.975 -4.175 -11.671 1.00 0.00 C ATOM 1093 O LEU A 435 0.287 -4.840 -10.896 1.00 0.00 O ATOM 1094 CB LEU A 435 2.420 -2.451 -10.572 1.00 0.00 C ATOM 1095 CG LEU A 435 2.854 -0.991 -10.430 1.00 0.00 C ATOM 1096 CD1 LEU A 435 3.756 -0.817 -9.220 1.00 0.00 C ATOM 1097 CD2 LEU A 435 3.558 -0.521 -11.695 1.00 0.00 C ATOM 0 H LEU A 435 0.192 -1.626 -9.922 1.00 0.00 H new ATOM 0 HA LEU A 435 1.330 -2.199 -12.408 1.00 0.00 H new ATOM 0 HB2 LEU A 435 2.227 -2.855 -9.578 1.00 0.00 H new ATOM 0 HB3 LEU A 435 3.249 -3.021 -10.992 1.00 0.00 H new ATOM 0 HG LEU A 435 1.964 -0.379 -10.283 1.00 0.00 H new ATOM 0 HD11 LEU A 435 4.054 0.228 -9.136 1.00 0.00 H new ATOM 0 HD12 LEU A 435 3.218 -1.115 -8.320 1.00 0.00 H new ATOM 0 HD13 LEU A 435 4.643 -1.439 -9.335 1.00 0.00 H new ATOM 0 HD21 LEU A 435 3.860 0.520 -11.578 1.00 0.00 H new ATOM 0 HD22 LEU A 435 4.439 -1.137 -11.871 1.00 0.00 H new ATOM 0 HD23 LEU A 435 2.879 -0.608 -12.543 1.00 0.00 H new ATOM 1109 N PRO A 436 1.571 -4.726 -12.742 1.00 0.00 N ATOM 1110 CA PRO A 436 1.447 -6.150 -13.069 1.00 0.00 C ATOM 1111 C PRO A 436 1.815 -7.046 -11.892 1.00 0.00 C ATOM 1112 O PRO A 436 2.518 -6.625 -10.974 1.00 0.00 O ATOM 1113 CB PRO A 436 2.440 -6.341 -14.217 1.00 0.00 C ATOM 1114 CG PRO A 436 2.566 -4.994 -14.840 1.00 0.00 C ATOM 1115 CD PRO A 436 2.408 -4.005 -13.718 1.00 0.00 C ATOM 0 HA PRO A 436 0.423 -6.421 -13.326 1.00 0.00 H new ATOM 0 HB2 PRO A 436 3.402 -6.699 -13.852 1.00 0.00 H new ATOM 0 HB3 PRO A 436 2.078 -7.077 -14.935 1.00 0.00 H new ATOM 0 HG2 PRO A 436 3.533 -4.879 -15.329 1.00 0.00 H new ATOM 0 HG3 PRO A 436 1.803 -4.844 -15.604 1.00 0.00 H new ATOM 0 HD2 PRO A 436 3.371 -3.724 -13.291 1.00 0.00 H new ATOM 0 HD3 PRO A 436 1.929 -3.086 -14.057 1.00 0.00 H new ATOM 1123 N GLU A 437 1.334 -8.285 -11.925 1.00 0.00 N ATOM 1124 CA GLU A 437 1.612 -9.242 -10.861 1.00 0.00 C ATOM 1125 C GLU A 437 3.100 -9.568 -10.798 1.00 0.00 C ATOM 1126 O GLU A 437 3.640 -9.848 -9.727 1.00 0.00 O ATOM 1127 CB GLU A 437 0.806 -10.525 -11.075 1.00 0.00 C ATOM 1128 CG GLU A 437 0.636 -11.354 -9.812 1.00 0.00 C ATOM 1129 CD GLU A 437 -0.679 -12.109 -9.785 1.00 0.00 C ATOM 1130 OE1 GLU A 437 -1.638 -11.655 -10.444 1.00 0.00 O ATOM 1131 OE2 GLU A 437 -0.751 -13.152 -9.102 1.00 0.00 O ATOM 0 H GLU A 437 0.750 -8.649 -12.678 1.00 0.00 H new ATOM 0 HA GLU A 437 1.317 -8.790 -9.914 1.00 0.00 H new ATOM 0 HB2 GLU A 437 -0.178 -10.265 -11.464 1.00 0.00 H new ATOM 0 HB3 GLU A 437 1.299 -11.132 -11.834 1.00 0.00 H new ATOM 0 HG2 GLU A 437 1.460 -12.063 -9.733 1.00 0.00 H new ATOM 0 HG3 GLU A 437 0.694 -10.700 -8.942 1.00 0.00 H new ATOM 1138 N ALA A 438 3.758 -9.531 -11.952 1.00 0.00 N ATOM 1139 CA ALA A 438 5.185 -9.823 -12.028 1.00 0.00 C ATOM 1140 C ALA A 438 6.004 -8.737 -11.341 1.00 0.00 C ATOM 1141 O ALA A 438 7.036 -9.016 -10.731 1.00 0.00 O ATOM 1142 CB ALA A 438 5.615 -9.973 -13.480 1.00 0.00 C ATOM 0 H ALA A 438 3.326 -9.302 -12.847 1.00 0.00 H new ATOM 0 HA ALA A 438 5.368 -10.763 -11.507 1.00 0.00 H new ATOM 0 HB1 ALA A 438 6.682 -10.191 -13.523 1.00 0.00 H new ATOM 0 HB2 ALA A 438 5.059 -10.789 -13.942 1.00 0.00 H new ATOM 0 HB3 ALA A 438 5.412 -9.047 -14.017 1.00 0.00 H new ATOM 1148 N GLU A 439 5.539 -7.497 -11.443 1.00 0.00 N ATOM 1149 CA GLU A 439 6.229 -6.368 -10.832 1.00 0.00 C ATOM 1150 C GLU A 439 6.008 -6.347 -9.323 1.00 0.00 C ATOM 1151 O GLU A 439 6.923 -6.048 -8.556 1.00 0.00 O ATOM 1152 CB GLU A 439 5.746 -5.053 -11.449 1.00 0.00 C ATOM 1153 CG GLU A 439 6.805 -3.963 -11.467 1.00 0.00 C ATOM 1154 CD GLU A 439 6.773 -3.140 -12.740 1.00 0.00 C ATOM 1155 OE1 GLU A 439 6.999 -3.715 -13.824 1.00 0.00 O ATOM 1156 OE2 GLU A 439 6.520 -1.919 -12.651 1.00 0.00 O ATOM 0 H GLU A 439 4.686 -7.248 -11.944 1.00 0.00 H new ATOM 0 HA GLU A 439 7.296 -6.480 -11.023 1.00 0.00 H new ATOM 0 HB2 GLU A 439 5.413 -5.241 -12.470 1.00 0.00 H new ATOM 0 HB3 GLU A 439 4.880 -4.697 -10.892 1.00 0.00 H new ATOM 0 HG2 GLU A 439 6.659 -3.306 -10.610 1.00 0.00 H new ATOM 0 HG3 GLU A 439 7.790 -4.417 -11.357 1.00 0.00 H new ATOM 1163 N ARG A 440 4.788 -6.666 -8.904 1.00 0.00 N ATOM 1164 CA ARG A 440 4.446 -6.683 -7.486 1.00 0.00 C ATOM 1165 C ARG A 440 5.321 -7.676 -6.726 1.00 0.00 C ATOM 1166 O ARG A 440 5.790 -7.389 -5.625 1.00 0.00 O ATOM 1167 CB ARG A 440 2.970 -7.040 -7.299 1.00 0.00 C ATOM 1168 CG ARG A 440 2.019 -5.944 -7.749 1.00 0.00 C ATOM 1169 CD ARG A 440 0.699 -6.011 -6.996 1.00 0.00 C ATOM 1170 NE ARG A 440 -0.017 -7.257 -7.257 1.00 0.00 N ATOM 1171 CZ ARG A 440 -0.736 -7.484 -8.353 1.00 0.00 C ATOM 1172 NH1 ARG A 440 -0.840 -6.554 -9.294 1.00 0.00 N ATOM 1173 NH2 ARG A 440 -1.357 -8.646 -8.510 1.00 0.00 N ATOM 0 H ARG A 440 4.019 -6.916 -9.526 1.00 0.00 H new ATOM 0 HA ARG A 440 4.625 -5.686 -7.084 1.00 0.00 H new ATOM 0 HB2 ARG A 440 2.751 -7.951 -7.856 1.00 0.00 H new ATOM 0 HB3 ARG A 440 2.788 -7.259 -6.247 1.00 0.00 H new ATOM 0 HG2 ARG A 440 2.482 -4.970 -7.589 1.00 0.00 H new ATOM 0 HG3 ARG A 440 1.834 -6.037 -8.819 1.00 0.00 H new ATOM 0 HD2 ARG A 440 0.887 -5.918 -5.926 1.00 0.00 H new ATOM 0 HD3 ARG A 440 0.074 -5.166 -7.285 1.00 0.00 H new ATOM 0 HE ARG A 440 0.038 -7.997 -6.557 1.00 0.00 H new ATOM 0 HH11 ARG A 440 -0.367 -5.658 -9.180 1.00 0.00 H new ATOM 0 HH12 ARG A 440 -1.393 -6.736 -10.132 1.00 0.00 H new ATOM 0 HH21 ARG A 440 -1.283 -9.365 -7.790 1.00 0.00 H new ATOM 0 HH22 ARG A 440 -1.908 -8.820 -9.350 1.00 0.00 H new ATOM 1187 N ASP A 441 5.536 -8.845 -7.322 1.00 0.00 N ATOM 1188 CA ASP A 441 6.353 -9.881 -6.701 1.00 0.00 C ATOM 1189 C ASP A 441 7.812 -9.446 -6.618 1.00 0.00 C ATOM 1190 O ASP A 441 8.508 -9.751 -5.648 1.00 0.00 O ATOM 1191 CB ASP A 441 6.242 -11.188 -7.488 1.00 0.00 C ATOM 1192 CG ASP A 441 4.989 -11.967 -7.141 1.00 0.00 C ATOM 1193 OD1 ASP A 441 3.881 -11.415 -7.307 1.00 0.00 O ATOM 1194 OD2 ASP A 441 5.115 -13.130 -6.704 1.00 0.00 O ATOM 0 H ASP A 441 5.156 -9.098 -8.234 1.00 0.00 H new ATOM 0 HA ASP A 441 5.983 -10.042 -5.689 1.00 0.00 H new ATOM 0 HB2 ASP A 441 6.245 -10.968 -8.555 1.00 0.00 H new ATOM 0 HB3 ASP A 441 7.118 -11.805 -7.287 1.00 0.00 H new ATOM 1199 N ARG A 442 8.270 -8.732 -7.641 1.00 0.00 N ATOM 1200 CA ARG A 442 9.648 -8.256 -7.686 1.00 0.00 C ATOM 1201 C ARG A 442 9.906 -7.234 -6.584 1.00 0.00 C ATOM 1202 O ARG A 442 10.952 -7.258 -5.934 1.00 0.00 O ATOM 1203 CB ARG A 442 9.951 -7.638 -9.052 1.00 0.00 C ATOM 1204 CG ARG A 442 11.359 -7.926 -9.549 1.00 0.00 C ATOM 1205 CD ARG A 442 11.608 -9.420 -9.694 1.00 0.00 C ATOM 1206 NE ARG A 442 11.792 -9.812 -11.088 1.00 0.00 N ATOM 1207 CZ ARG A 442 11.672 -11.062 -11.529 1.00 0.00 C ATOM 1208 NH1 ARG A 442 11.367 -12.042 -10.689 1.00 0.00 N ATOM 1209 NH2 ARG A 442 11.856 -11.331 -12.814 1.00 0.00 N ATOM 0 H ARG A 442 7.707 -8.470 -8.450 1.00 0.00 H new ATOM 0 HA ARG A 442 10.307 -9.109 -7.527 1.00 0.00 H new ATOM 0 HB2 ARG A 442 9.233 -8.015 -9.780 1.00 0.00 H new ATOM 0 HB3 ARG A 442 9.808 -6.559 -8.993 1.00 0.00 H new ATOM 0 HG2 ARG A 442 11.513 -7.436 -10.510 1.00 0.00 H new ATOM 0 HG3 ARG A 442 12.084 -7.502 -8.855 1.00 0.00 H new ATOM 0 HD2 ARG A 442 12.492 -9.697 -9.120 1.00 0.00 H new ATOM 0 HD3 ARG A 442 10.768 -9.970 -9.271 1.00 0.00 H new ATOM 0 HE ARG A 442 12.026 -9.085 -11.764 1.00 0.00 H new ATOM 0 HH11 ARG A 442 11.223 -11.839 -9.700 1.00 0.00 H new ATOM 0 HH12 ARG A 442 11.276 -12.998 -11.032 1.00 0.00 H new ATOM 0 HH21 ARG A 442 12.089 -10.580 -13.464 1.00 0.00 H new ATOM 0 HH22 ARG A 442 11.764 -12.289 -13.153 1.00 0.00 H new ATOM 1223 N ILE A 443 8.949 -6.335 -6.379 1.00 0.00 N ATOM 1224 CA ILE A 443 9.075 -5.305 -5.356 1.00 0.00 C ATOM 1225 C ILE A 443 8.869 -5.886 -3.959 1.00 0.00 C ATOM 1226 O ILE A 443 9.430 -5.390 -2.983 1.00 0.00 O ATOM 1227 CB ILE A 443 8.064 -4.164 -5.581 1.00 0.00 C ATOM 1228 CG1 ILE A 443 8.161 -3.641 -7.015 1.00 0.00 C ATOM 1229 CG2 ILE A 443 8.301 -3.038 -4.585 1.00 0.00 C ATOM 1230 CD1 ILE A 443 6.955 -2.838 -7.450 1.00 0.00 C ATOM 0 H ILE A 443 8.078 -6.299 -6.908 1.00 0.00 H new ATOM 0 HA ILE A 443 10.086 -4.905 -5.433 1.00 0.00 H new ATOM 0 HB ILE A 443 7.059 -4.556 -5.424 1.00 0.00 H new ATOM 0 HG12 ILE A 443 9.052 -3.021 -7.107 1.00 0.00 H new ATOM 0 HG13 ILE A 443 8.289 -4.485 -7.693 1.00 0.00 H new ATOM 0 HG21 ILE A 443 7.578 -2.241 -4.758 1.00 0.00 H new ATOM 0 HG22 ILE A 443 8.184 -3.419 -3.570 1.00 0.00 H new ATOM 0 HG23 ILE A 443 9.310 -2.647 -4.712 1.00 0.00 H new ATOM 0 HD11 ILE A 443 7.094 -2.500 -8.477 1.00 0.00 H new ATOM 0 HD12 ILE A 443 6.063 -3.461 -7.391 1.00 0.00 H new ATOM 0 HD13 ILE A 443 6.838 -1.974 -6.796 1.00 0.00 H new ATOM 1242 N TYR A 444 8.061 -6.938 -3.873 1.00 0.00 N ATOM 1243 CA TYR A 444 7.784 -7.583 -2.594 1.00 0.00 C ATOM 1244 C TYR A 444 9.019 -8.310 -2.073 1.00 0.00 C ATOM 1245 O TYR A 444 9.375 -8.186 -0.900 1.00 0.00 O ATOM 1246 CB TYR A 444 6.620 -8.566 -2.736 1.00 0.00 C ATOM 1247 CG TYR A 444 5.259 -7.916 -2.640 1.00 0.00 C ATOM 1248 CD1 TYR A 444 4.990 -6.965 -1.663 1.00 0.00 C ATOM 1249 CD2 TYR A 444 4.242 -8.252 -3.525 1.00 0.00 C ATOM 1250 CE1 TYR A 444 3.746 -6.368 -1.572 1.00 0.00 C ATOM 1251 CE2 TYR A 444 2.998 -7.660 -3.441 1.00 0.00 C ATOM 1252 CZ TYR A 444 2.754 -6.719 -2.463 1.00 0.00 C ATOM 1253 OH TYR A 444 1.516 -6.127 -2.376 1.00 0.00 O ATOM 0 H TYR A 444 7.588 -7.361 -4.671 1.00 0.00 H new ATOM 0 HA TYR A 444 7.511 -6.809 -1.877 1.00 0.00 H new ATOM 0 HB2 TYR A 444 6.702 -9.076 -3.696 1.00 0.00 H new ATOM 0 HB3 TYR A 444 6.704 -9.329 -1.962 1.00 0.00 H new ATOM 0 HD1 TYR A 444 5.765 -6.688 -0.964 1.00 0.00 H new ATOM 0 HD2 TYR A 444 4.428 -8.989 -4.292 1.00 0.00 H new ATOM 0 HE1 TYR A 444 3.552 -5.631 -0.807 1.00 0.00 H new ATOM 0 HE2 TYR A 444 2.219 -7.933 -4.138 1.00 0.00 H new ATOM 0 HH TYR A 444 1.378 -5.789 -1.467 1.00 0.00 H new ATOM 1263 N GLN A 445 9.668 -9.070 -2.949 1.00 0.00 N ATOM 1264 CA GLN A 445 10.863 -9.817 -2.576 1.00 0.00 C ATOM 1265 C GLN A 445 12.072 -8.893 -2.466 1.00 0.00 C ATOM 1266 O GLN A 445 12.871 -9.005 -1.536 1.00 0.00 O ATOM 1267 CB GLN A 445 11.139 -10.921 -3.598 1.00 0.00 C ATOM 1268 CG GLN A 445 10.698 -12.301 -3.138 1.00 0.00 C ATOM 1269 CD GLN A 445 9.219 -12.359 -2.810 1.00 0.00 C ATOM 1270 OE1 GLN A 445 8.371 -12.089 -3.659 1.00 0.00 O ATOM 1271 NE2 GLN A 445 8.902 -12.714 -1.570 1.00 0.00 N ATOM 0 H GLN A 445 9.386 -9.185 -3.923 1.00 0.00 H new ATOM 0 HA GLN A 445 10.688 -10.271 -1.601 1.00 0.00 H new ATOM 0 HB2 GLN A 445 10.629 -10.678 -4.530 1.00 0.00 H new ATOM 0 HB3 GLN A 445 12.207 -10.944 -3.816 1.00 0.00 H new ATOM 0 HG2 GLN A 445 10.923 -13.029 -3.917 1.00 0.00 H new ATOM 0 HG3 GLN A 445 11.273 -12.588 -2.258 1.00 0.00 H new ATOM 0 HE21 GLN A 445 9.638 -12.930 -0.897 1.00 0.00 H new ATOM 0 HE22 GLN A 445 7.923 -12.771 -1.290 1.00 0.00 H new ATOM 1280 N ASP A 446 12.200 -7.977 -3.422 1.00 0.00 N ATOM 1281 CA ASP A 446 13.311 -7.034 -3.434 1.00 0.00 C ATOM 1282 C ASP A 446 13.004 -5.821 -2.560 1.00 0.00 C ATOM 1283 O ASP A 446 11.969 -5.177 -2.718 1.00 0.00 O ATOM 1284 CB ASP A 446 13.612 -6.585 -4.865 1.00 0.00 C ATOM 1285 CG ASP A 446 15.099 -6.483 -5.139 1.00 0.00 C ATOM 1286 OD1 ASP A 446 15.767 -7.538 -5.192 1.00 0.00 O ATOM 1287 OD2 ASP A 446 15.597 -5.349 -5.301 1.00 0.00 O ATOM 0 H ASP A 446 11.547 -7.869 -4.198 1.00 0.00 H new ATOM 0 HA ASP A 446 14.188 -7.539 -3.028 1.00 0.00 H new ATOM 0 HB2 ASP A 446 13.164 -7.290 -5.566 1.00 0.00 H new ATOM 0 HB3 ASP A 446 13.145 -5.617 -5.045 1.00 0.00 H new ATOM 1292 N GLU A 447 13.915 -5.517 -1.640 1.00 0.00 N ATOM 1293 CA GLU A 447 13.741 -4.383 -0.741 1.00 0.00 C ATOM 1294 C GLU A 447 15.092 -3.831 -0.294 1.00 0.00 C ATOM 1295 O GLU A 447 15.319 -2.621 -0.318 1.00 0.00 O ATOM 1296 CB GLU A 447 12.916 -4.793 0.480 1.00 0.00 C ATOM 1297 CG GLU A 447 11.415 -4.701 0.258 1.00 0.00 C ATOM 1298 CD GLU A 447 10.688 -4.074 1.431 1.00 0.00 C ATOM 1299 OE1 GLU A 447 10.822 -2.848 1.626 1.00 0.00 O ATOM 1300 OE2 GLU A 447 9.986 -4.809 2.157 1.00 0.00 O ATOM 0 H GLU A 447 14.779 -6.040 -1.498 1.00 0.00 H new ATOM 0 HA GLU A 447 13.209 -3.601 -1.283 1.00 0.00 H new ATOM 0 HB2 GLU A 447 13.172 -5.816 0.755 1.00 0.00 H new ATOM 0 HB3 GLU A 447 13.190 -4.159 1.323 1.00 0.00 H new ATOM 0 HG2 GLU A 447 11.220 -4.115 -0.640 1.00 0.00 H new ATOM 0 HG3 GLU A 447 11.016 -5.700 0.080 1.00 0.00 H new ATOM 1307 N ARG A 448 15.985 -4.727 0.112 1.00 0.00 N ATOM 1308 CA ARG A 448 17.314 -4.331 0.565 1.00 0.00 C ATOM 1309 C ARG A 448 18.338 -4.467 -0.558 1.00 0.00 C ATOM 1310 O ARG A 448 19.334 -3.746 -0.592 1.00 0.00 O ATOM 1311 CB ARG A 448 17.740 -5.182 1.763 1.00 0.00 C ATOM 1312 CG ARG A 448 18.806 -4.527 2.625 1.00 0.00 C ATOM 1313 CD ARG A 448 18.253 -3.330 3.381 1.00 0.00 C ATOM 1314 NE ARG A 448 17.835 -3.682 4.736 1.00 0.00 N ATOM 1315 CZ ARG A 448 17.587 -2.789 5.691 1.00 0.00 C ATOM 1316 NH1 ARG A 448 17.713 -1.491 5.445 1.00 0.00 N ATOM 1317 NH2 ARG A 448 17.212 -3.195 6.897 1.00 0.00 N ATOM 0 H ARG A 448 15.813 -5.732 0.137 1.00 0.00 H new ATOM 0 HA ARG A 448 17.270 -3.284 0.866 1.00 0.00 H new ATOM 0 HB2 ARG A 448 16.865 -5.392 2.378 1.00 0.00 H new ATOM 0 HB3 ARG A 448 18.114 -6.140 1.403 1.00 0.00 H new ATOM 0 HG2 ARG A 448 19.201 -5.255 3.333 1.00 0.00 H new ATOM 0 HG3 ARG A 448 19.639 -4.209 1.997 1.00 0.00 H new ATOM 0 HD2 ARG A 448 19.012 -2.549 3.427 1.00 0.00 H new ATOM 0 HD3 ARG A 448 17.404 -2.918 2.836 1.00 0.00 H new ATOM 0 HE ARG A 448 17.727 -4.670 4.963 1.00 0.00 H new ATOM 0 HH11 ARG A 448 18.001 -1.173 4.520 1.00 0.00 H new ATOM 0 HH12 ARG A 448 17.521 -0.811 6.181 1.00 0.00 H new ATOM 0 HH21 ARG A 448 17.114 -4.191 7.092 1.00 0.00 H new ATOM 0 HH22 ARG A 448 17.022 -2.511 7.629 1.00 0.00 H new ATOM 1331 N GLU A 449 18.087 -5.397 -1.475 1.00 0.00 N ATOM 1332 CA GLU A 449 18.987 -5.627 -2.598 1.00 0.00 C ATOM 1333 C GLU A 449 18.759 -4.611 -3.718 1.00 0.00 C ATOM 1334 O GLU A 449 19.437 -4.649 -4.745 1.00 0.00 O ATOM 1335 CB GLU A 449 18.805 -7.046 -3.139 1.00 0.00 C ATOM 1336 CG GLU A 449 20.101 -7.692 -3.603 1.00 0.00 C ATOM 1337 CD GLU A 449 19.906 -8.581 -4.815 1.00 0.00 C ATOM 1338 OE1 GLU A 449 19.199 -8.160 -5.753 1.00 0.00 O ATOM 1339 OE2 GLU A 449 20.462 -9.700 -4.826 1.00 0.00 O ATOM 0 H GLU A 449 17.267 -6.003 -1.461 1.00 0.00 H new ATOM 0 HA GLU A 449 20.007 -5.505 -2.234 1.00 0.00 H new ATOM 0 HB2 GLU A 449 18.357 -7.667 -2.363 1.00 0.00 H new ATOM 0 HB3 GLU A 449 18.103 -7.021 -3.972 1.00 0.00 H new ATOM 0 HG2 GLU A 449 20.826 -6.914 -3.840 1.00 0.00 H new ATOM 0 HG3 GLU A 449 20.521 -8.281 -2.788 1.00 0.00 H new ATOM 1346 N ARG A 450 17.805 -3.703 -3.518 1.00 0.00 N ATOM 1347 CA ARG A 450 17.500 -2.686 -4.519 1.00 0.00 C ATOM 1348 C ARG A 450 18.729 -1.832 -4.820 1.00 0.00 C ATOM 1349 O ARG A 450 18.882 -1.317 -5.928 1.00 0.00 O ATOM 1350 CB ARG A 450 16.351 -1.796 -4.040 1.00 0.00 C ATOM 1351 CG ARG A 450 16.686 -0.978 -2.803 1.00 0.00 C ATOM 1352 CD ARG A 450 15.853 0.294 -2.732 1.00 0.00 C ATOM 1353 NE ARG A 450 16.684 1.486 -2.576 1.00 0.00 N ATOM 1354 CZ ARG A 450 17.321 2.083 -3.582 1.00 0.00 C ATOM 1355 NH1 ARG A 450 17.229 1.601 -4.816 1.00 0.00 N ATOM 1356 NH2 ARG A 450 18.052 3.165 -3.353 1.00 0.00 N ATOM 0 H ARG A 450 17.233 -3.652 -2.675 1.00 0.00 H new ATOM 0 HA ARG A 450 17.199 -3.194 -5.435 1.00 0.00 H new ATOM 0 HB2 ARG A 450 16.067 -1.120 -4.846 1.00 0.00 H new ATOM 0 HB3 ARG A 450 15.483 -2.421 -3.828 1.00 0.00 H new ATOM 0 HG2 ARG A 450 16.511 -1.579 -1.910 1.00 0.00 H new ATOM 0 HG3 ARG A 450 17.745 -0.720 -2.812 1.00 0.00 H new ATOM 0 HD2 ARG A 450 15.254 0.386 -3.638 1.00 0.00 H new ATOM 0 HD3 ARG A 450 15.157 0.225 -1.896 1.00 0.00 H new ATOM 0 HE ARG A 450 16.782 1.884 -1.642 1.00 0.00 H new ATOM 0 HH11 ARG A 450 16.668 0.769 -4.998 1.00 0.00 H new ATOM 0 HH12 ARG A 450 17.719 2.063 -5.582 1.00 0.00 H new ATOM 0 HH21 ARG A 450 18.126 3.540 -2.407 1.00 0.00 H new ATOM 0 HH22 ARG A 450 18.540 3.623 -4.123 1.00 0.00 H new ATOM 1370 N SER A 451 19.601 -1.686 -3.828 1.00 0.00 N ATOM 1371 CA SER A 451 20.816 -0.894 -3.988 1.00 0.00 C ATOM 1372 C SER A 451 21.678 -1.443 -5.120 1.00 0.00 C ATOM 1373 O SER A 451 22.195 -2.558 -5.036 1.00 0.00 O ATOM 1374 CB SER A 451 21.616 -0.879 -2.685 1.00 0.00 C ATOM 1375 OG SER A 451 22.007 -2.189 -2.310 1.00 0.00 O ATOM 0 H SER A 451 19.489 -2.105 -2.905 1.00 0.00 H new ATOM 0 HA SER A 451 20.524 0.126 -4.239 1.00 0.00 H new ATOM 0 HB2 SER A 451 22.500 -0.253 -2.805 1.00 0.00 H new ATOM 0 HB3 SER A 451 21.016 -0.434 -1.891 1.00 0.00 H new ATOM 0 HG SER A 451 22.297 -2.684 -3.105 1.00 0.00 H new ATOM 1381 N LEU A 452 21.829 -0.653 -6.178 1.00 0.00 N ATOM 1382 CA LEU A 452 22.628 -1.059 -7.328 1.00 0.00 C ATOM 1383 C LEU A 452 23.856 -0.167 -7.478 1.00 0.00 C ATOM 1384 O LEU A 452 24.990 -0.624 -7.331 1.00 0.00 O ATOM 1385 CB LEU A 452 21.784 -1.010 -8.604 1.00 0.00 C ATOM 1386 CG LEU A 452 22.005 -2.174 -9.572 1.00 0.00 C ATOM 1387 CD1 LEU A 452 23.393 -2.101 -10.188 1.00 0.00 C ATOM 1388 CD2 LEU A 452 21.803 -3.502 -8.858 1.00 0.00 C ATOM 0 H LEU A 452 21.408 0.272 -6.263 1.00 0.00 H new ATOM 0 HA LEU A 452 22.964 -2.083 -7.164 1.00 0.00 H new ATOM 0 HB2 LEU A 452 20.731 -0.985 -8.324 1.00 0.00 H new ATOM 0 HB3 LEU A 452 21.997 -0.077 -9.127 1.00 0.00 H new ATOM 0 HG LEU A 452 21.272 -2.100 -10.375 1.00 0.00 H new ATOM 0 HD11 LEU A 452 23.531 -2.937 -10.873 1.00 0.00 H new ATOM 0 HD12 LEU A 452 23.500 -1.163 -10.733 1.00 0.00 H new ATOM 0 HD13 LEU A 452 24.144 -2.150 -9.400 1.00 0.00 H new ATOM 0 HD21 LEU A 452 21.964 -4.320 -9.560 1.00 0.00 H new ATOM 0 HD22 LEU A 452 22.513 -3.585 -8.035 1.00 0.00 H new ATOM 0 HD23 LEU A 452 20.787 -3.554 -8.467 1.00 0.00 H new ATOM 1400 N ASN A 453 23.622 1.108 -7.772 1.00 0.00 N ATOM 1401 CA ASN A 453 24.709 2.065 -7.941 1.00 0.00 C ATOM 1402 C ASN A 453 24.589 3.208 -6.938 1.00 0.00 C ATOM 1403 O ASN A 453 23.492 3.533 -6.482 1.00 0.00 O ATOM 1404 CB ASN A 453 24.712 2.621 -9.366 1.00 0.00 C ATOM 1405 CG ASN A 453 23.412 3.317 -9.718 1.00 0.00 C ATOM 1406 OD1 ASN A 453 22.699 3.804 -8.841 1.00 0.00 O ATOM 1407 ND2 ASN A 453 23.098 3.369 -11.007 1.00 0.00 N ATOM 0 H ASN A 453 22.690 1.502 -7.898 1.00 0.00 H new ATOM 0 HA ASN A 453 25.649 1.543 -7.760 1.00 0.00 H new ATOM 0 HB2 ASN A 453 25.538 3.323 -9.477 1.00 0.00 H new ATOM 0 HB3 ASN A 453 24.888 1.808 -10.070 1.00 0.00 H new ATOM 0 HD21 ASN A 453 22.236 3.826 -11.304 1.00 0.00 H new ATOM 0 HD22 ASN A 453 23.719 2.952 -11.700 1.00 0.00 H new ATOM 1414 N ALA A 454 25.720 3.814 -6.600 1.00 0.00 N ATOM 1415 CA ALA A 454 25.741 4.922 -5.652 1.00 0.00 C ATOM 1416 C ALA A 454 25.811 6.263 -6.374 1.00 0.00 C ATOM 1417 O ALA A 454 25.223 7.249 -5.932 1.00 0.00 O ATOM 1418 CB ALA A 454 26.915 4.775 -4.695 1.00 0.00 C ATOM 0 H ALA A 454 26.636 3.557 -6.968 1.00 0.00 H new ATOM 0 HA ALA A 454 24.813 4.895 -5.080 1.00 0.00 H new ATOM 0 HB1 ALA A 454 26.919 5.609 -3.993 1.00 0.00 H new ATOM 0 HB2 ALA A 454 26.821 3.838 -4.146 1.00 0.00 H new ATOM 0 HB3 ALA A 454 27.847 4.773 -5.260 1.00 0.00 H new ATOM 1424 N ALA A 455 26.533 6.290 -7.489 1.00 0.00 N ATOM 1425 CA ALA A 455 26.680 7.510 -8.274 1.00 0.00 C ATOM 1426 C ALA A 455 25.563 7.637 -9.305 1.00 0.00 C ATOM 1427 O ALA A 455 24.501 8.198 -8.961 1.00 0.00 O ATOM 1428 CB ALA A 455 28.038 7.538 -8.959 1.00 0.00 C ATOM 0 H ALA A 455 27.025 5.482 -7.869 1.00 0.00 H new ATOM 0 HA ALA A 455 26.611 8.360 -7.595 1.00 0.00 H new ATOM 0 HB1 ALA A 455 28.133 8.455 -9.541 1.00 0.00 H new ATOM 0 HB2 ALA A 455 28.826 7.503 -8.207 1.00 0.00 H new ATOM 0 HB3 ALA A 455 28.130 6.677 -9.621 1.00 0.00 H new TER 1434 ALA A 455