USER MOD reduce.3.24.130724 H: found=0, std=0, add=950, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 956 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 589 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 644 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.1: A 592 HIS : no HE2:sc= 0.72 K(o=1.3,f=-5.2!) USER MOD Set 2.2: A 640 TYR OH : rot -95:sc= 0.622 USER MOD Set 3.1: A 601 SER OG : rot -23:sc= 0.734 USER MOD Set 3.2: A 602 HIS : no HD1:sc= 0 X(o=0.73,f=0.7) USER MOD Single : A 594 HIS : no HD1:sc= -0.426 K(o=-0.43,f=-1.1) USER MOD Single : A 596 THR OG1 : rot -170:sc= 0.283 USER MOD Single : A 597 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 605 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 606 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 609 GLN : amide:sc= -0.463 K(o=-0.46,f=-3.8!) USER MOD Single : A 614 THR OG1 : rot 180:sc= 0 USER MOD Single : A 621 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 625 MET CE :methyl 170:sc= 0 (180deg=-0.0105) USER MOD Single : A 627 ASN : amide:sc=-0.000216 K(o=-0.00022,f=-1.4!) USER MOD Single : A 631 TYR OH : rot 180:sc= 0 USER MOD Single : A 633 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 634 LYS NZ :NH3+ 172:sc= 0.115 (180deg=0.0521) USER MOD Single : A 639 MET CE :methyl -174:sc= -1.59 (180deg=-1.99) USER MOD Single : A 642 SER OG : rot 90:sc= 0.496 USER MOD Single : A 645 SER OG : rot 180:sc= -0.183 USER MOD Single : A 649 TYR OH : rot 165:sc= 0 USER MOD Single : A 650 TYR OH : rot 180:sc= -0.646 USER MOD Single : A 651 HIS : no HD1:sc= 0 X(o=0,f=-0.0048) USER MOD Single : A 656 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 658 TYR OH : rot 180:sc= 0 USER MOD Single : A 659 LYS NZ :NH3+ -110:sc= 0.332 (180deg=0.0438) USER MOD Single : A 661 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 662 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 667 LYS NZ :NH3+ -137:sc= -0.711 (180deg=-1.64) USER MOD Single : A 670 SER OG : rot -68:sc= 0.175 USER MOD Single : B 520 SER OG : rot 180:sc= 0 USER MOD Single : B 523 TYR OH : rot 180:sc= 0 USER MOD Single : B 525 ASN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : B 529 SER OG : rot 180:sc= 0 USER MOD Single : B 535 SER OG : rot 148:sc= -1.64! USER MOD Single : B 536 SER OG : rot 80:sc= 0.518 USER MOD Single : B 540 MET CE :methyl 177:sc= 0 (180deg=-0.0262) USER MOD Single : B 543 SER OG : rot 180:sc= 0 USER MOD Single : B 547 SER OG : rot -34:sc= 0.416 USER MOD Single : B 548 GLN : amide:sc= -0.0499 X(o=-0.05,f=-0.2) USER MOD Single : B 550 SER OG : rot 180:sc= 0 USER MOD Single : B 551 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 586 26.652 -4.199 -6.736 1.00 25.00 N ATOM 2 CA GLY A 586 27.148 -2.818 -6.482 1.00 25.00 C ATOM 3 C GLY A 586 27.759 -2.666 -5.104 1.00 25.00 C ATOM 4 O GLY A 586 28.876 -3.132 -4.861 1.00 25.00 O ATOM 0 HA2 GLY A 586 27.891 -2.558 -7.236 1.00 25.00 H new ATOM 0 HA3 GLY A 586 26.323 -2.113 -6.590 1.00 25.00 H new ATOM 10 N VAL A 587 27.019 -2.008 -4.203 1.00 25.00 N ATOM 11 CA VAL A 587 27.472 -1.788 -2.821 1.00 25.00 C ATOM 12 C VAL A 587 27.007 -2.951 -1.927 1.00 25.00 C ATOM 13 O VAL A 587 25.866 -3.412 -2.041 1.00 25.00 O ATOM 14 CB VAL A 587 26.959 -0.426 -2.248 1.00 25.00 C ATOM 15 CG1 VAL A 587 27.307 -0.273 -0.767 1.00 25.00 C ATOM 16 CG2 VAL A 587 27.522 0.757 -3.033 1.00 25.00 C ATOM 0 H VAL A 587 26.099 -1.616 -4.406 1.00 25.00 H new ATOM 0 HA VAL A 587 28.561 -1.748 -2.830 1.00 25.00 H new ATOM 0 HB VAL A 587 25.874 -0.431 -2.352 1.00 25.00 H new ATOM 0 HG11 VAL A 587 26.935 0.685 -0.403 1.00 25.00 H new ATOM 0 HG12 VAL A 587 26.845 -1.081 -0.199 1.00 25.00 H new ATOM 0 HG13 VAL A 587 28.389 -0.314 -0.641 1.00 25.00 H new ATOM 0 HG21 VAL A 587 27.145 1.688 -2.608 1.00 25.00 H new ATOM 0 HG22 VAL A 587 28.610 0.746 -2.976 1.00 25.00 H new ATOM 0 HG23 VAL A 587 27.212 0.682 -4.075 1.00 25.00 H new ATOM 26 N ARG A 588 27.902 -3.407 -1.043 1.00 25.00 N ATOM 27 CA ARG A 588 27.640 -4.574 -0.189 1.00 25.00 C ATOM 28 C ARG A 588 27.039 -4.153 1.151 1.00 25.00 C ATOM 29 O ARG A 588 27.635 -3.366 1.894 1.00 25.00 O ATOM 30 CB ARG A 588 28.926 -5.382 0.038 1.00 25.00 C ATOM 31 CG ARG A 588 28.698 -6.735 0.708 1.00 25.00 C ATOM 32 CD ARG A 588 30.002 -7.494 0.926 1.00 25.00 C ATOM 33 NE ARG A 588 29.789 -8.823 1.519 1.00 25.00 N ATOM 34 CZ ARG A 588 30.751 -9.579 2.069 1.00 25.00 C ATOM 35 NH1 ARG A 588 32.014 -9.161 2.119 1.00 25.00 N ATOM 36 NH2 ARG A 588 30.440 -10.766 2.572 1.00 25.00 N ATOM 0 H ARG A 588 28.819 -2.984 -0.899 1.00 25.00 H new ATOM 0 HA ARG A 588 26.917 -5.206 -0.705 1.00 25.00 H new ATOM 0 HB2 ARG A 588 29.417 -5.541 -0.922 1.00 25.00 H new ATOM 0 HB3 ARG A 588 29.609 -4.794 0.652 1.00 25.00 H new ATOM 0 HG2 ARG A 588 28.202 -6.585 1.667 1.00 25.00 H new ATOM 0 HG3 ARG A 588 28.028 -7.335 0.093 1.00 25.00 H new ATOM 0 HD2 ARG A 588 30.518 -7.604 -0.028 1.00 25.00 H new ATOM 0 HD3 ARG A 588 30.654 -6.910 1.576 1.00 25.00 H new ATOM 0 HE ARG A 588 28.840 -9.197 1.511 1.00 25.00 H new ATOM 0 HH11 ARG A 588 32.265 -8.250 1.735 1.00 25.00 H new ATOM 0 HH12 ARG A 588 32.730 -9.751 2.542 1.00 25.00 H new ATOM 0 HH21 ARG A 588 29.476 -11.097 2.539 1.00 25.00 H new ATOM 0 HH22 ARG A 588 31.165 -11.348 2.992 1.00 25.00 H new ATOM 50 N LYS A 589 25.855 -4.700 1.447 1.00 25.00 N ATOM 51 CA LYS A 589 25.103 -4.361 2.658 1.00 25.00 C ATOM 52 C LYS A 589 24.466 -5.607 3.276 1.00 25.00 C ATOM 53 O LYS A 589 24.239 -6.610 2.591 1.00 25.00 O ATOM 54 CB LYS A 589 24.016 -3.322 2.333 1.00 25.00 C ATOM 55 CG LYS A 589 24.508 -2.090 1.568 1.00 25.00 C ATOM 56 CD LYS A 589 23.397 -1.080 1.286 1.00 25.00 C ATOM 57 CE LYS A 589 23.869 0.038 0.362 1.00 25.00 C ATOM 58 NZ LYS A 589 22.757 0.947 -0.039 1.00 25.00 N ATOM 0 H LYS A 589 25.392 -5.389 0.854 1.00 25.00 H new ATOM 0 HA LYS A 589 25.799 -3.938 3.382 1.00 25.00 H new ATOM 0 HB2 LYS A 589 23.234 -3.807 1.748 1.00 25.00 H new ATOM 0 HB3 LYS A 589 23.558 -2.993 3.266 1.00 25.00 H new ATOM 0 HG2 LYS A 589 25.297 -1.604 2.142 1.00 25.00 H new ATOM 0 HG3 LYS A 589 24.951 -2.408 0.624 1.00 25.00 H new ATOM 0 HD2 LYS A 589 22.547 -1.591 0.833 1.00 25.00 H new ATOM 0 HD3 LYS A 589 23.048 -0.652 2.226 1.00 25.00 H new ATOM 0 HE2 LYS A 589 24.646 0.616 0.862 1.00 25.00 H new ATOM 0 HE3 LYS A 589 24.320 -0.397 -0.530 1.00 25.00 H new ATOM 0 HZ1 LYS A 589 23.125 1.690 -0.666 1.00 25.00 H new ATOM 0 HZ2 LYS A 589 22.027 0.402 -0.540 1.00 25.00 H new ATOM 0 HZ3 LYS A 589 22.343 1.384 0.809 1.00 25.00 H new ATOM 72 N GLY A 590 24.181 -5.520 4.586 1.00 25.00 N ATOM 73 CA GLY A 590 23.635 -6.646 5.341 1.00 25.00 C ATOM 74 C GLY A 590 22.136 -6.854 5.155 1.00 25.00 C ATOM 75 O GLY A 590 21.627 -7.935 5.459 1.00 25.00 O ATOM 0 H GLY A 590 24.323 -4.676 5.140 1.00 25.00 H new ATOM 0 HA2 GLY A 590 24.157 -7.556 5.043 1.00 25.00 H new ATOM 0 HA3 GLY A 590 23.841 -6.493 6.400 1.00 25.00 H new ATOM 79 N TRP A 591 21.432 -5.817 4.672 1.00 25.00 N ATOM 80 CA TRP A 591 19.982 -5.897 4.422 1.00 25.00 C ATOM 81 C TRP A 591 19.681 -6.511 3.044 1.00 25.00 C ATOM 82 O TRP A 591 18.684 -7.212 2.874 1.00 25.00 O ATOM 83 CB TRP A 591 19.332 -4.501 4.552 1.00 25.00 C ATOM 84 CG TRP A 591 19.578 -3.553 3.400 1.00 25.00 C ATOM 85 CD1 TRP A 591 20.748 -2.916 3.091 1.00 25.00 C ATOM 86 CD2 TRP A 591 18.617 -3.121 2.420 1.00 25.00 C ATOM 87 NE1 TRP A 591 20.579 -2.134 1.972 1.00 25.00 N ATOM 88 CE2 TRP A 591 19.280 -2.237 1.547 1.00 25.00 C ATOM 89 CE3 TRP A 591 17.263 -3.398 2.194 1.00 25.00 C ATOM 90 CZ2 TRP A 591 18.638 -1.633 0.468 1.00 25.00 C ATOM 91 CZ3 TRP A 591 16.628 -2.795 1.125 1.00 25.00 C ATOM 92 CH2 TRP A 591 17.315 -1.922 0.274 1.00 25.00 C ATOM 0 H TRP A 591 21.844 -4.912 4.446 1.00 25.00 H new ATOM 0 HA TRP A 591 19.550 -6.554 5.177 1.00 25.00 H new ATOM 0 HB2 TRP A 591 18.256 -4.631 4.668 1.00 25.00 H new ATOM 0 HB3 TRP A 591 19.697 -4.034 5.467 1.00 25.00 H new ATOM 0 HD1 TRP A 591 21.670 -3.013 3.645 1.00 25.00 H new ATOM 0 HE1 TRP A 591 21.304 -1.569 1.530 1.00 25.00 H new ATOM 0 HE3 TRP A 591 16.724 -4.071 2.844 1.00 25.00 H new ATOM 0 HZ2 TRP A 591 19.166 -0.961 -0.192 1.00 25.00 H new ATOM 0 HZ3 TRP A 591 15.584 -3.001 0.943 1.00 25.00 H new ATOM 0 HH2 TRP A 591 16.790 -1.467 -0.553 1.00 25.00 H new ATOM 103 N HIS A 592 20.569 -6.240 2.078 1.00 25.00 N ATOM 104 CA HIS A 592 20.432 -6.717 0.689 1.00 25.00 C ATOM 105 C HIS A 592 20.494 -8.257 0.598 1.00 25.00 C ATOM 106 O HIS A 592 19.727 -8.864 -0.155 1.00 25.00 O ATOM 107 CB HIS A 592 21.537 -6.072 -0.176 1.00 25.00 C ATOM 108 CG HIS A 592 22.039 -6.917 -1.321 1.00 25.00 C ATOM 109 ND1 HIS A 592 21.266 -7.229 -2.420 1.00 25.00 N ATOM 110 CD2 HIS A 592 23.249 -7.490 -1.543 1.00 25.00 C ATOM 111 CE1 HIS A 592 21.978 -7.956 -3.266 1.00 25.00 C ATOM 112 NE2 HIS A 592 23.183 -8.126 -2.756 1.00 25.00 N ATOM 0 H HIS A 592 21.408 -5.681 2.236 1.00 25.00 H new ATOM 0 HA HIS A 592 19.452 -6.421 0.316 1.00 25.00 H new ATOM 0 HB2 HIS A 592 21.158 -5.133 -0.579 1.00 25.00 H new ATOM 0 HB3 HIS A 592 22.381 -5.825 0.468 1.00 25.00 H new ATOM 0 HD1 HIS A 592 20.297 -6.944 -2.559 1.00 25.00 H new ATOM 0 HD2 HIS A 592 24.105 -7.452 -0.886 1.00 25.00 H new ATOM 0 HE1 HIS A 592 21.632 -8.344 -4.213 1.00 25.00 H new ATOM 121 N GLU A 593 21.409 -8.871 1.366 1.00 25.00 N ATOM 122 CA GLU A 593 21.552 -10.337 1.397 1.00 25.00 C ATOM 123 C GLU A 593 20.568 -10.983 2.384 1.00 25.00 C ATOM 124 O GLU A 593 20.399 -12.206 2.397 1.00 25.00 O ATOM 125 CB GLU A 593 22.988 -10.728 1.761 1.00 25.00 C ATOM 126 CG GLU A 593 24.015 -10.307 0.722 1.00 25.00 C ATOM 127 CD GLU A 593 25.436 -10.641 1.134 1.00 25.00 C ATOM 128 OE1 GLU A 593 25.619 -11.181 2.246 1.00 25.00 O ATOM 129 OE2 GLU A 593 26.364 -10.366 0.346 1.00 25.00 O ATOM 0 H GLU A 593 22.061 -8.375 1.974 1.00 25.00 H new ATOM 0 HA GLU A 593 21.320 -10.708 0.399 1.00 25.00 H new ATOM 0 HB2 GLU A 593 23.247 -10.277 2.719 1.00 25.00 H new ATOM 0 HB3 GLU A 593 23.039 -11.809 1.893 1.00 25.00 H new ATOM 0 HG2 GLU A 593 23.791 -10.799 -0.225 1.00 25.00 H new ATOM 0 HG3 GLU A 593 23.934 -9.234 0.551 1.00 25.00 H new ATOM 136 N HIS A 594 19.920 -10.138 3.194 1.00 25.00 N ATOM 137 CA HIS A 594 18.949 -10.581 4.196 1.00 25.00 C ATOM 138 C HIS A 594 17.507 -10.512 3.653 1.00 25.00 C ATOM 139 O HIS A 594 16.640 -11.259 4.114 1.00 25.00 O ATOM 140 CB HIS A 594 19.132 -9.722 5.471 1.00 25.00 C ATOM 141 CG HIS A 594 20.094 -10.255 6.499 1.00 25.00 C ATOM 142 ND1 HIS A 594 21.394 -10.620 6.215 1.00 25.00 N ATOM 143 CD2 HIS A 594 19.924 -10.468 7.824 1.00 25.00 C ATOM 144 CE1 HIS A 594 21.982 -11.036 7.325 1.00 25.00 C ATOM 145 NE2 HIS A 594 21.110 -10.953 8.315 1.00 25.00 N ATOM 0 H HIS A 594 20.056 -9.127 3.172 1.00 25.00 H new ATOM 0 HA HIS A 594 19.127 -11.628 4.443 1.00 25.00 H new ATOM 0 HB2 HIS A 594 19.467 -8.729 5.170 1.00 25.00 H new ATOM 0 HB3 HIS A 594 18.158 -9.600 5.944 1.00 25.00 H new ATOM 0 HD2 HIS A 594 19.022 -10.289 8.390 1.00 25.00 H new ATOM 0 HE1 HIS A 594 23.001 -11.384 7.408 1.00 25.00 H new ATOM 0 HE2 HIS A 594 21.290 -11.208 9.286 1.00 25.00 H new ATOM 154 N VAL A 595 17.261 -9.623 2.678 1.00 25.00 N ATOM 155 CA VAL A 595 15.920 -9.462 2.101 1.00 25.00 C ATOM 156 C VAL A 595 15.669 -10.530 1.025 1.00 25.00 C ATOM 157 O VAL A 595 16.507 -10.752 0.145 1.00 25.00 O ATOM 158 CB VAL A 595 15.693 -8.015 1.529 1.00 25.00 C ATOM 159 CG1 VAL A 595 14.480 -7.916 0.594 1.00 25.00 C ATOM 160 CG2 VAL A 595 15.506 -7.025 2.667 1.00 25.00 C ATOM 0 H VAL A 595 17.969 -9.009 2.276 1.00 25.00 H new ATOM 0 HA VAL A 595 15.196 -9.600 2.904 1.00 25.00 H new ATOM 0 HB VAL A 595 16.583 -7.778 0.946 1.00 25.00 H new ATOM 0 HG11 VAL A 595 14.380 -6.892 0.235 1.00 25.00 H new ATOM 0 HG12 VAL A 595 14.619 -8.586 -0.254 1.00 25.00 H new ATOM 0 HG13 VAL A 595 13.578 -8.200 1.137 1.00 25.00 H new ATOM 0 HG21 VAL A 595 15.350 -6.027 2.259 1.00 25.00 H new ATOM 0 HG22 VAL A 595 14.639 -7.314 3.262 1.00 25.00 H new ATOM 0 HG23 VAL A 595 16.395 -7.024 3.298 1.00 25.00 H new ATOM 170 N THR A 596 14.506 -11.177 1.121 1.00 25.00 N ATOM 171 CA THR A 596 14.115 -12.239 0.192 1.00 25.00 C ATOM 172 C THR A 596 13.072 -11.751 -0.812 1.00 25.00 C ATOM 173 O THR A 596 12.615 -10.606 -0.746 1.00 25.00 O ATOM 174 CB THR A 596 13.534 -13.465 0.942 1.00 25.00 C ATOM 175 OG1 THR A 596 12.361 -13.092 1.678 1.00 25.00 O ATOM 176 CG2 THR A 596 14.553 -14.079 1.886 1.00 25.00 C ATOM 0 H THR A 596 13.811 -10.981 1.842 1.00 25.00 H new ATOM 0 HA THR A 596 15.022 -12.530 -0.337 1.00 25.00 H new ATOM 0 HB THR A 596 13.271 -14.211 0.191 1.00 25.00 H new ATOM 0 HG1 THR A 596 12.097 -13.829 2.268 1.00 25.00 H new ATOM 0 HG21 THR A 596 14.109 -14.935 2.393 1.00 25.00 H new ATOM 0 HG22 THR A 596 15.425 -14.405 1.318 1.00 25.00 H new ATOM 0 HG23 THR A 596 14.858 -13.338 2.625 1.00 25.00 H new ATOM 184 N GLN A 597 12.710 -12.640 -1.746 1.00 25.00 N ATOM 185 CA GLN A 597 11.579 -12.420 -2.652 1.00 25.00 C ATOM 186 C GLN A 597 10.259 -12.701 -1.922 1.00 25.00 C ATOM 187 O GLN A 597 9.187 -12.285 -2.371 1.00 25.00 O ATOM 188 CB GLN A 597 11.688 -13.314 -3.904 1.00 25.00 C ATOM 189 CG GLN A 597 12.867 -12.994 -4.831 1.00 25.00 C ATOM 190 CD GLN A 597 12.940 -13.845 -6.103 1.00 25.00 C ATOM 191 OE1 GLN A 597 11.998 -14.570 -6.425 1.00 25.00 O ATOM 192 NE2 GLN A 597 14.066 -13.791 -6.818 1.00 25.00 N ATOM 0 H GLN A 597 13.191 -13.527 -1.893 1.00 25.00 H new ATOM 0 HA GLN A 597 11.600 -11.379 -2.974 1.00 25.00 H new ATOM 0 HB2 GLN A 597 11.769 -14.353 -3.584 1.00 25.00 H new ATOM 0 HB3 GLN A 597 10.763 -13.228 -4.475 1.00 25.00 H new ATOM 0 HG2 GLN A 597 12.810 -11.944 -5.117 1.00 25.00 H new ATOM 0 HG3 GLN A 597 13.794 -13.122 -4.272 1.00 25.00 H new ATOM 0 HE21 GLN A 597 14.828 -13.180 -6.524 1.00 25.00 H new ATOM 0 HE22 GLN A 597 14.164 -14.361 -7.658 1.00 25.00 H new ATOM 201 N ASP A 598 10.360 -13.422 -0.790 1.00 25.00 N ATOM 202 CA ASP A 598 9.202 -13.738 0.052 1.00 25.00 C ATOM 203 C ASP A 598 8.857 -12.557 0.978 1.00 25.00 C ATOM 204 O ASP A 598 7.710 -12.435 1.420 1.00 25.00 O ATOM 205 CB ASP A 598 9.484 -15.009 0.873 1.00 25.00 C ATOM 206 CG ASP A 598 9.437 -16.283 0.044 1.00 25.00 C ATOM 207 OD1 ASP A 598 8.901 -16.237 -1.084 1.00 25.00 O ATOM 208 OD2 ASP A 598 9.937 -17.322 0.523 1.00 25.00 O ATOM 0 H ASP A 598 11.241 -13.797 -0.439 1.00 25.00 H new ATOM 0 HA ASP A 598 8.341 -13.918 -0.592 1.00 25.00 H new ATOM 0 HB2 ASP A 598 10.466 -14.922 1.338 1.00 25.00 H new ATOM 0 HB3 ASP A 598 8.755 -15.081 1.680 1.00 25.00 H new ATOM 213 N LEU A 599 9.854 -11.693 1.268 1.00 25.00 N ATOM 214 CA LEU A 599 9.614 -10.453 2.024 1.00 25.00 C ATOM 215 C LEU A 599 8.763 -9.470 1.221 1.00 25.00 C ATOM 216 O LEU A 599 7.750 -8.985 1.718 1.00 25.00 O ATOM 217 CB LEU A 599 10.937 -9.765 2.442 1.00 25.00 C ATOM 218 CG LEU A 599 10.834 -8.418 3.190 1.00 25.00 C ATOM 219 CD1 LEU A 599 10.498 -8.686 4.639 1.00 25.00 C ATOM 220 CD2 LEU A 599 12.129 -7.614 3.146 1.00 25.00 C ATOM 0 H LEU A 599 10.825 -11.834 0.990 1.00 25.00 H new ATOM 0 HA LEU A 599 9.074 -10.740 2.926 1.00 25.00 H new ATOM 0 HB2 LEU A 599 11.492 -10.459 3.073 1.00 25.00 H new ATOM 0 HB3 LEU A 599 11.532 -9.606 1.543 1.00 25.00 H new ATOM 0 HG LEU A 599 10.059 -7.835 2.692 1.00 25.00 H new ATOM 0 HD11 LEU A 599 10.423 -7.740 5.176 1.00 25.00 H new ATOM 0 HD12 LEU A 599 9.547 -9.214 4.700 1.00 25.00 H new ATOM 0 HD13 LEU A 599 11.282 -9.297 5.087 1.00 25.00 H new ATOM 0 HD21 LEU A 599 11.995 -6.678 3.688 1.00 25.00 H new ATOM 0 HD22 LEU A 599 12.931 -8.190 3.609 1.00 25.00 H new ATOM 0 HD23 LEU A 599 12.389 -7.399 2.109 1.00 25.00 H new ATOM 232 N ARG A 600 9.152 -9.220 -0.041 1.00 25.00 N ATOM 233 CA ARG A 600 8.483 -8.218 -0.892 1.00 25.00 C ATOM 234 C ARG A 600 6.986 -8.530 -1.110 1.00 25.00 C ATOM 235 O ARG A 600 6.200 -7.633 -1.426 1.00 25.00 O ATOM 236 CB ARG A 600 9.228 -8.071 -2.242 1.00 25.00 C ATOM 237 CG ARG A 600 10.645 -7.501 -2.154 1.00 25.00 C ATOM 238 CD ARG A 600 11.344 -7.538 -3.505 1.00 25.00 C ATOM 239 NE ARG A 600 10.668 -6.700 -4.502 1.00 25.00 N ATOM 240 CZ ARG A 600 10.948 -6.695 -5.814 1.00 25.00 C ATOM 241 NH1 ARG A 600 11.899 -7.480 -6.322 1.00 25.00 N ATOM 242 NH2 ARG A 600 10.271 -5.893 -6.625 1.00 25.00 N ATOM 0 H ARG A 600 9.929 -9.699 -0.496 1.00 25.00 H new ATOM 0 HA ARG A 600 8.525 -7.265 -0.364 1.00 25.00 H new ATOM 0 HB2 ARG A 600 9.278 -9.050 -2.718 1.00 25.00 H new ATOM 0 HB3 ARG A 600 8.637 -7.429 -2.895 1.00 25.00 H new ATOM 0 HG2 ARG A 600 10.604 -6.474 -1.792 1.00 25.00 H new ATOM 0 HG3 ARG A 600 11.224 -8.072 -1.428 1.00 25.00 H new ATOM 0 HD2 ARG A 600 12.374 -7.202 -3.388 1.00 25.00 H new ATOM 0 HD3 ARG A 600 11.383 -8.566 -3.864 1.00 25.00 H new ATOM 0 HE ARG A 600 9.931 -6.076 -4.173 1.00 25.00 H new ATOM 0 HH11 ARG A 600 12.430 -8.100 -5.710 1.00 25.00 H new ATOM 0 HH12 ARG A 600 12.096 -7.461 -7.323 1.00 25.00 H new ATOM 0 HH21 ARG A 600 9.543 -5.285 -6.250 1.00 25.00 H new ATOM 0 HH22 ARG A 600 10.479 -5.884 -7.624 1.00 25.00 H new ATOM 256 N SER A 601 6.616 -9.806 -0.931 1.00 25.00 N ATOM 257 CA SER A 601 5.220 -10.247 -1.020 1.00 25.00 C ATOM 258 C SER A 601 4.484 -10.032 0.313 1.00 25.00 C ATOM 259 O SER A 601 3.267 -9.830 0.332 1.00 25.00 O ATOM 260 CB SER A 601 5.167 -11.730 -1.414 1.00 25.00 C ATOM 261 OG SER A 601 5.733 -12.554 -0.407 1.00 25.00 O ATOM 0 H SER A 601 7.274 -10.557 -0.722 1.00 25.00 H new ATOM 0 HA SER A 601 4.721 -9.649 -1.783 1.00 25.00 H new ATOM 0 HB2 SER A 601 4.132 -12.025 -1.588 1.00 25.00 H new ATOM 0 HB3 SER A 601 5.703 -11.878 -2.351 1.00 25.00 H new ATOM 0 HG SER A 601 6.358 -12.027 0.133 1.00 25.00 H new ATOM 267 N HIS A 602 5.244 -10.078 1.422 1.00 25.00 N ATOM 268 CA HIS A 602 4.704 -9.857 2.772 1.00 25.00 C ATOM 269 C HIS A 602 4.639 -8.355 3.096 1.00 25.00 C ATOM 270 O HIS A 602 3.893 -7.936 3.985 1.00 25.00 O ATOM 271 CB HIS A 602 5.571 -10.602 3.805 1.00 25.00 C ATOM 272 CG HIS A 602 5.556 -12.101 3.672 1.00 25.00 C ATOM 273 ND1 HIS A 602 6.421 -12.927 4.360 1.00 25.00 N ATOM 274 CD2 HIS A 602 4.769 -12.919 2.930 1.00 25.00 C ATOM 275 CE1 HIS A 602 6.167 -14.185 4.049 1.00 25.00 C ATOM 276 NE2 HIS A 602 5.169 -14.207 3.184 1.00 25.00 N ATOM 0 H HIS A 602 6.246 -10.269 1.406 1.00 25.00 H new ATOM 0 HA HIS A 602 3.688 -10.249 2.814 1.00 25.00 H new ATOM 0 HB2 HIS A 602 6.600 -10.253 3.716 1.00 25.00 H new ATOM 0 HB3 HIS A 602 5.230 -10.336 4.805 1.00 25.00 H new ATOM 0 HD2 HIS A 602 3.976 -12.614 2.264 1.00 25.00 H new ATOM 0 HE1 HIS A 602 6.687 -15.049 4.436 1.00 25.00 H new ATOM 0 HE2 HIS A 602 4.761 -15.046 2.771 1.00 25.00 H new ATOM 285 N LEU A 603 5.431 -7.562 2.360 1.00 25.00 N ATOM 286 CA LEU A 603 5.430 -6.094 2.463 1.00 25.00 C ATOM 287 C LEU A 603 4.200 -5.521 1.743 1.00 25.00 C ATOM 288 O LEU A 603 3.614 -4.525 2.174 1.00 25.00 O ATOM 289 CB LEU A 603 6.724 -5.523 1.838 1.00 25.00 C ATOM 290 CG LEU A 603 8.085 -5.714 2.583 1.00 25.00 C ATOM 291 CD1 LEU A 603 9.209 -5.030 1.843 1.00 25.00 C ATOM 292 CD2 LEU A 603 8.089 -5.209 4.012 1.00 25.00 C ATOM 0 H LEU A 603 6.094 -7.922 1.673 1.00 25.00 H new ATOM 0 HA LEU A 603 5.389 -5.809 3.514 1.00 25.00 H new ATOM 0 HB2 LEU A 603 6.830 -5.962 0.846 1.00 25.00 H new ATOM 0 HB3 LEU A 603 6.575 -4.452 1.698 1.00 25.00 H new ATOM 0 HG LEU A 603 8.232 -6.794 2.611 1.00 25.00 H new ATOM 0 HD11 LEU A 603 10.144 -5.179 2.383 1.00 25.00 H new ATOM 0 HD12 LEU A 603 9.297 -5.453 0.842 1.00 25.00 H new ATOM 0 HD13 LEU A 603 8.999 -3.963 1.768 1.00 25.00 H new ATOM 0 HD21 LEU A 603 9.070 -5.380 4.456 1.00 25.00 H new ATOM 0 HD22 LEU A 603 7.867 -4.142 4.021 1.00 25.00 H new ATOM 0 HD23 LEU A 603 7.333 -5.742 4.588 1.00 25.00 H new ATOM 304 N VAL A 604 3.838 -6.184 0.633 1.00 25.00 N ATOM 305 CA VAL A 604 2.605 -5.923 -0.120 1.00 25.00 C ATOM 306 C VAL A 604 1.372 -6.428 0.660 1.00 25.00 C ATOM 307 O VAL A 604 0.329 -5.772 0.664 1.00 25.00 O ATOM 308 CB VAL A 604 2.709 -6.604 -1.525 1.00 25.00 C ATOM 309 CG1 VAL A 604 1.398 -6.598 -2.302 1.00 25.00 C ATOM 310 CG2 VAL A 604 3.786 -5.931 -2.358 1.00 25.00 C ATOM 0 H VAL A 604 4.405 -6.929 0.228 1.00 25.00 H new ATOM 0 HA VAL A 604 2.482 -4.849 -0.257 1.00 25.00 H new ATOM 0 HB VAL A 604 2.966 -7.646 -1.335 1.00 25.00 H new ATOM 0 HG11 VAL A 604 1.544 -7.086 -3.266 1.00 25.00 H new ATOM 0 HG12 VAL A 604 0.637 -7.134 -1.735 1.00 25.00 H new ATOM 0 HG13 VAL A 604 1.074 -5.569 -2.461 1.00 25.00 H new ATOM 0 HG21 VAL A 604 3.847 -6.415 -3.333 1.00 25.00 H new ATOM 0 HG22 VAL A 604 3.538 -4.878 -2.491 1.00 25.00 H new ATOM 0 HG23 VAL A 604 4.746 -6.017 -1.849 1.00 25.00 H new ATOM 320 N HIS A 605 1.514 -7.595 1.313 1.00 25.00 N ATOM 321 CA HIS A 605 0.448 -8.163 2.157 1.00 25.00 C ATOM 322 C HIS A 605 0.298 -7.355 3.457 1.00 25.00 C ATOM 323 O HIS A 605 -0.722 -7.450 4.143 1.00 25.00 O ATOM 324 CB HIS A 605 0.742 -9.641 2.465 1.00 25.00 C ATOM 325 CG HIS A 605 -0.409 -10.384 3.088 1.00 25.00 C ATOM 326 ND1 HIS A 605 -1.596 -10.623 2.428 1.00 25.00 N ATOM 327 CD2 HIS A 605 -0.554 -10.929 4.323 1.00 25.00 C ATOM 328 CE1 HIS A 605 -2.419 -11.281 3.226 1.00 25.00 C ATOM 329 NE2 HIS A 605 -1.810 -11.478 4.380 1.00 25.00 N ATOM 0 H HIS A 605 2.359 -8.165 1.272 1.00 25.00 H new ATOM 0 HA HIS A 605 -0.494 -8.105 1.612 1.00 25.00 H new ATOM 0 HB2 HIS A 605 1.026 -10.143 1.540 1.00 25.00 H new ATOM 0 HB3 HIS A 605 1.600 -9.697 3.134 1.00 25.00 H new ATOM 0 HD2 HIS A 605 0.182 -10.930 5.113 1.00 25.00 H new ATOM 0 HE1 HIS A 605 -3.419 -11.603 2.976 1.00 25.00 H new ATOM 0 HE2 HIS A 605 -2.209 -11.961 5.185 1.00 25.00 H new ATOM 338 N LYS A 606 1.336 -6.564 3.769 1.00 25.00 N ATOM 339 CA LYS A 606 1.338 -5.647 4.914 1.00 25.00 C ATOM 340 C LYS A 606 0.683 -4.321 4.501 1.00 25.00 C ATOM 341 O LYS A 606 0.192 -3.557 5.337 1.00 25.00 O ATOM 342 CB LYS A 606 2.791 -5.412 5.353 1.00 25.00 C ATOM 343 CG LYS A 606 3.199 -6.088 6.655 1.00 25.00 C ATOM 344 CD LYS A 606 4.604 -5.697 7.046 1.00 25.00 C ATOM 345 CE LYS A 606 4.999 -6.335 8.368 1.00 25.00 C ATOM 346 NZ LYS A 606 6.376 -5.951 8.794 1.00 25.00 N ATOM 0 H LYS A 606 2.201 -6.544 3.230 1.00 25.00 H new ATOM 0 HA LYS A 606 0.775 -6.073 5.744 1.00 25.00 H new ATOM 0 HB2 LYS A 606 3.453 -5.760 4.560 1.00 25.00 H new ATOM 0 HB3 LYS A 606 2.953 -4.339 5.455 1.00 25.00 H new ATOM 0 HG2 LYS A 606 2.505 -5.809 7.448 1.00 25.00 H new ATOM 0 HG3 LYS A 606 3.136 -7.170 6.543 1.00 25.00 H new ATOM 0 HD2 LYS A 606 5.301 -6.005 6.267 1.00 25.00 H new ATOM 0 HD3 LYS A 606 4.674 -4.612 7.126 1.00 25.00 H new ATOM 0 HE2 LYS A 606 4.287 -6.039 9.139 1.00 25.00 H new ATOM 0 HE3 LYS A 606 4.938 -7.420 8.278 1.00 25.00 H new ATOM 0 HZ1 LYS A 606 6.600 -6.410 9.700 1.00 25.00 H new ATOM 0 HZ2 LYS A 606 7.060 -6.256 8.073 1.00 25.00 H new ATOM 0 HZ3 LYS A 606 6.429 -4.919 8.907 1.00 25.00 H new ATOM 360 N LEU A 607 0.695 -4.089 3.187 1.00 25.00 N ATOM 361 CA LEU A 607 0.169 -2.881 2.566 1.00 25.00 C ATOM 362 C LEU A 607 -1.332 -3.003 2.274 1.00 25.00 C ATOM 363 O LEU A 607 -2.090 -2.057 2.494 1.00 25.00 O ATOM 364 CB LEU A 607 0.958 -2.644 1.279 1.00 25.00 C ATOM 365 CG LEU A 607 2.238 -1.804 1.418 1.00 25.00 C ATOM 366 CD1 LEU A 607 3.020 -1.849 0.127 1.00 25.00 C ATOM 367 CD2 LEU A 607 1.926 -0.351 1.761 1.00 25.00 C ATOM 0 H LEU A 607 1.080 -4.752 2.514 1.00 25.00 H new ATOM 0 HA LEU A 607 0.282 -2.036 3.245 1.00 25.00 H new ATOM 0 HB2 LEU A 607 1.227 -3.613 0.858 1.00 25.00 H new ATOM 0 HB3 LEU A 607 0.302 -2.154 0.559 1.00 25.00 H new ATOM 0 HG LEU A 607 2.825 -2.229 2.232 1.00 25.00 H new ATOM 0 HD11 LEU A 607 3.926 -1.252 0.230 1.00 25.00 H new ATOM 0 HD12 LEU A 607 3.288 -2.881 -0.100 1.00 25.00 H new ATOM 0 HD13 LEU A 607 2.410 -1.446 -0.682 1.00 25.00 H new ATOM 0 HD21 LEU A 607 2.857 0.210 1.851 1.00 25.00 H new ATOM 0 HD22 LEU A 607 1.314 0.086 0.972 1.00 25.00 H new ATOM 0 HD23 LEU A 607 1.384 -0.308 2.706 1.00 25.00 H new ATOM 379 N VAL A 608 -1.746 -4.190 1.802 1.00 25.00 N ATOM 380 CA VAL A 608 -3.149 -4.476 1.442 1.00 25.00 C ATOM 381 C VAL A 608 -4.046 -4.589 2.699 1.00 25.00 C ATOM 382 O VAL A 608 -5.251 -4.338 2.620 1.00 25.00 O ATOM 383 CB VAL A 608 -3.236 -5.782 0.576 1.00 25.00 C ATOM 384 CG1 VAL A 608 -4.677 -6.248 0.371 1.00 25.00 C ATOM 385 CG2 VAL A 608 -2.570 -5.580 -0.785 1.00 25.00 C ATOM 0 H VAL A 608 -1.118 -4.981 1.658 1.00 25.00 H new ATOM 0 HA VAL A 608 -3.520 -3.640 0.850 1.00 25.00 H new ATOM 0 HB VAL A 608 -2.706 -6.556 1.131 1.00 25.00 H new ATOM 0 HG11 VAL A 608 -4.684 -7.155 -0.234 1.00 25.00 H new ATOM 0 HG12 VAL A 608 -5.134 -6.454 1.339 1.00 25.00 H new ATOM 0 HG13 VAL A 608 -5.243 -5.468 -0.138 1.00 25.00 H new ATOM 0 HG21 VAL A 608 -2.644 -6.499 -1.366 1.00 25.00 H new ATOM 0 HG22 VAL A 608 -3.071 -4.772 -1.319 1.00 25.00 H new ATOM 0 HG23 VAL A 608 -1.520 -5.324 -0.642 1.00 25.00 H new ATOM 395 N GLN A 609 -3.449 -4.947 3.849 1.00 25.00 N ATOM 396 CA GLN A 609 -4.195 -5.102 5.098 1.00 25.00 C ATOM 397 C GLN A 609 -4.442 -3.751 5.781 1.00 25.00 C ATOM 398 O GLN A 609 -5.412 -3.592 6.527 1.00 25.00 O ATOM 399 CB GLN A 609 -3.483 -6.073 6.049 1.00 25.00 C ATOM 400 CG GLN A 609 -3.550 -7.526 5.623 1.00 25.00 C ATOM 401 CD GLN A 609 -4.971 -8.044 5.440 1.00 25.00 C ATOM 402 OE1 GLN A 609 -5.860 -7.785 6.256 1.00 25.00 O ATOM 403 NE2 GLN A 609 -5.190 -8.784 4.360 1.00 25.00 N ATOM 0 H GLN A 609 -2.450 -5.134 3.934 1.00 25.00 H new ATOM 0 HA GLN A 609 -5.167 -5.525 4.845 1.00 25.00 H new ATOM 0 HB2 GLN A 609 -2.437 -5.779 6.133 1.00 25.00 H new ATOM 0 HB3 GLN A 609 -3.922 -5.977 7.042 1.00 25.00 H new ATOM 0 HG2 GLN A 609 -3.005 -7.647 4.687 1.00 25.00 H new ATOM 0 HG3 GLN A 609 -3.042 -8.138 6.369 1.00 25.00 H new ATOM 0 HE21 GLN A 609 -4.428 -8.975 3.710 1.00 25.00 H new ATOM 0 HE22 GLN A 609 -6.120 -9.161 4.180 1.00 25.00 H new ATOM 412 N ALA A 610 -3.548 -2.789 5.514 1.00 25.00 N ATOM 413 CA ALA A 610 -3.686 -1.423 6.018 1.00 25.00 C ATOM 414 C ALA A 610 -4.702 -0.621 5.201 1.00 25.00 C ATOM 415 O ALA A 610 -5.439 0.201 5.752 1.00 25.00 O ATOM 416 CB ALA A 610 -2.336 -0.737 5.994 1.00 25.00 C ATOM 0 H ALA A 610 -2.714 -2.938 4.945 1.00 25.00 H new ATOM 0 HA ALA A 610 -4.055 -1.472 7.042 1.00 25.00 H new ATOM 0 HB1 ALA A 610 -2.439 0.281 6.370 1.00 25.00 H new ATOM 0 HB2 ALA A 610 -1.637 -1.287 6.624 1.00 25.00 H new ATOM 0 HB3 ALA A 610 -1.960 -0.710 4.971 1.00 25.00 H new ATOM 422 N ILE A 611 -4.743 -0.881 3.884 1.00 25.00 N ATOM 423 CA ILE A 611 -5.670 -0.195 2.973 1.00 25.00 C ATOM 424 C ILE A 611 -7.082 -0.796 3.114 1.00 25.00 C ATOM 425 O ILE A 611 -8.059 -0.058 3.270 1.00 25.00 O ATOM 426 CB ILE A 611 -5.171 -0.259 1.487 1.00 25.00 C ATOM 427 CG1 ILE A 611 -3.805 0.444 1.353 1.00 25.00 C ATOM 428 CG2 ILE A 611 -6.182 0.402 0.545 1.00 25.00 C ATOM 429 CD1 ILE A 611 -3.098 0.251 0.016 1.00 25.00 C ATOM 0 H ILE A 611 -4.141 -1.565 3.426 1.00 25.00 H new ATOM 0 HA ILE A 611 -5.708 0.859 3.250 1.00 25.00 H new ATOM 0 HB ILE A 611 -5.067 -1.308 1.210 1.00 25.00 H new ATOM 0 HG12 ILE A 611 -3.947 1.512 1.519 1.00 25.00 H new ATOM 0 HG13 ILE A 611 -3.150 0.083 2.146 1.00 25.00 H new ATOM 0 HG21 ILE A 611 -5.815 0.346 -0.480 1.00 25.00 H new ATOM 0 HG22 ILE A 611 -7.139 -0.116 0.617 1.00 25.00 H new ATOM 0 HG23 ILE A 611 -6.313 1.447 0.827 1.00 25.00 H new ATOM 0 HD11 ILE A 611 -2.148 0.785 0.026 1.00 25.00 H new ATOM 0 HD12 ILE A 611 -2.915 -0.811 -0.149 1.00 25.00 H new ATOM 0 HD13 ILE A 611 -3.725 0.640 -0.786 1.00 25.00 H new ATOM 441 N PHE A 612 -7.173 -2.135 3.053 1.00 25.00 N ATOM 442 CA PHE A 612 -8.418 -2.847 3.322 1.00 25.00 C ATOM 443 C PHE A 612 -8.134 -4.141 4.128 1.00 25.00 C ATOM 444 O PHE A 612 -7.659 -5.128 3.554 1.00 25.00 O ATOM 445 CB PHE A 612 -9.149 -3.158 1.995 1.00 25.00 C ATOM 446 CG PHE A 612 -10.536 -3.728 2.164 1.00 25.00 C ATOM 447 CD1 PHE A 612 -11.622 -2.882 2.289 1.00 25.00 C ATOM 448 CD2 PHE A 612 -10.748 -5.098 2.184 1.00 25.00 C ATOM 449 CE1 PHE A 612 -12.901 -3.387 2.431 1.00 25.00 C ATOM 450 CE2 PHE A 612 -12.024 -5.612 2.327 1.00 25.00 C ATOM 451 CZ PHE A 612 -13.102 -4.754 2.450 1.00 25.00 C ATOM 0 H PHE A 612 -6.389 -2.743 2.817 1.00 25.00 H new ATOM 0 HA PHE A 612 -9.069 -2.215 3.926 1.00 25.00 H new ATOM 0 HB2 PHE A 612 -9.215 -2.242 1.408 1.00 25.00 H new ATOM 0 HB3 PHE A 612 -8.548 -3.862 1.420 1.00 25.00 H new ATOM 0 HD1 PHE A 612 -11.469 -1.813 2.276 1.00 25.00 H new ATOM 0 HD2 PHE A 612 -9.908 -5.770 2.087 1.00 25.00 H new ATOM 0 HE1 PHE A 612 -13.741 -2.715 2.527 1.00 25.00 H new ATOM 0 HE2 PHE A 612 -12.178 -6.681 2.343 1.00 25.00 H new ATOM 0 HZ PHE A 612 -14.100 -5.152 2.561 1.00 25.00 H new ATOM 461 N PRO A 613 -8.406 -4.164 5.478 1.00 25.00 N ATOM 462 CA PRO A 613 -8.274 -5.388 6.291 1.00 25.00 C ATOM 463 C PRO A 613 -9.431 -6.370 6.066 1.00 25.00 C ATOM 464 O PRO A 613 -10.597 -5.961 6.014 1.00 25.00 O ATOM 465 CB PRO A 613 -8.287 -4.882 7.748 1.00 25.00 C ATOM 466 CG PRO A 613 -9.081 -3.616 7.743 1.00 25.00 C ATOM 467 CD PRO A 613 -8.822 -3.024 6.324 1.00 25.00 C ATOM 0 HA PRO A 613 -7.370 -5.937 6.029 1.00 25.00 H new ATOM 0 HB2 PRO A 613 -8.736 -5.620 8.412 1.00 25.00 H new ATOM 0 HB3 PRO A 613 -7.273 -4.704 8.107 1.00 25.00 H new ATOM 0 HG2 PRO A 613 -10.141 -3.807 7.910 1.00 25.00 H new ATOM 0 HG3 PRO A 613 -8.753 -2.934 8.528 1.00 25.00 H new ATOM 0 HD2 PRO A 613 -9.721 -2.552 5.928 1.00 25.00 H new ATOM 0 HD3 PRO A 613 -8.047 -2.258 6.356 1.00 25.00 H new ATOM 475 N THR A 614 -9.099 -7.662 5.930 1.00 25.00 N ATOM 476 CA THR A 614 -10.107 -8.701 5.699 1.00 25.00 C ATOM 477 C THR A 614 -9.694 -10.058 6.310 1.00 25.00 C ATOM 478 O THR A 614 -8.598 -10.559 6.039 1.00 25.00 O ATOM 479 CB THR A 614 -10.466 -8.876 4.195 1.00 25.00 C ATOM 480 OG1 THR A 614 -11.406 -9.948 4.022 1.00 25.00 O ATOM 481 CG2 THR A 614 -9.236 -9.133 3.332 1.00 25.00 C ATOM 0 H THR A 614 -8.141 -8.010 5.976 1.00 25.00 H new ATOM 0 HA THR A 614 -11.004 -8.351 6.211 1.00 25.00 H new ATOM 0 HB THR A 614 -10.914 -7.938 3.868 1.00 25.00 H new ATOM 0 HG1 THR A 614 -11.622 -10.043 3.071 1.00 25.00 H new ATOM 0 HG21 THR A 614 -9.539 -9.248 2.291 1.00 25.00 H new ATOM 0 HG22 THR A 614 -8.548 -8.292 3.419 1.00 25.00 H new ATOM 0 HG23 THR A 614 -8.740 -10.043 3.668 1.00 25.00 H new ATOM 489 N PRO A 615 -10.584 -10.658 7.164 1.00 25.00 N ATOM 490 CA PRO A 615 -10.423 -12.032 7.704 1.00 25.00 C ATOM 491 C PRO A 615 -10.121 -13.099 6.642 1.00 25.00 C ATOM 492 O PRO A 615 -9.147 -13.845 6.758 1.00 25.00 O ATOM 493 CB PRO A 615 -11.793 -12.313 8.316 1.00 25.00 C ATOM 494 CG PRO A 615 -12.290 -10.982 8.744 1.00 25.00 C ATOM 495 CD PRO A 615 -11.805 -10.013 7.719 1.00 25.00 C ATOM 0 HA PRO A 615 -9.576 -12.080 8.389 1.00 25.00 H new ATOM 0 HB2 PRO A 615 -12.465 -12.773 7.591 1.00 25.00 H new ATOM 0 HB3 PRO A 615 -11.717 -12.998 9.160 1.00 25.00 H new ATOM 0 HG2 PRO A 615 -13.378 -10.973 8.805 1.00 25.00 H new ATOM 0 HG3 PRO A 615 -11.913 -10.724 9.734 1.00 25.00 H new ATOM 0 HD2 PRO A 615 -12.553 -9.843 6.945 1.00 25.00 H new ATOM 0 HD3 PRO A 615 -11.578 -9.043 8.162 1.00 25.00 H new ATOM 503 N ASP A 616 -10.985 -13.157 5.622 1.00 25.00 N ATOM 504 CA ASP A 616 -10.895 -14.162 4.552 1.00 25.00 C ATOM 505 C ASP A 616 -9.846 -13.790 3.486 1.00 25.00 C ATOM 506 O ASP A 616 -9.981 -12.757 2.821 1.00 25.00 O ATOM 507 CB ASP A 616 -12.264 -14.358 3.886 1.00 25.00 C ATOM 508 CG ASP A 616 -12.315 -15.581 2.987 1.00 25.00 C ATOM 509 OD1 ASP A 616 -11.289 -16.286 2.883 1.00 25.00 O ATOM 510 OD2 ASP A 616 -13.382 -15.834 2.387 1.00 25.00 O ATOM 0 H ASP A 616 -11.766 -12.510 5.513 1.00 25.00 H new ATOM 0 HA ASP A 616 -10.576 -15.095 5.018 1.00 25.00 H new ATOM 0 HB2 ASP A 616 -13.028 -14.449 4.658 1.00 25.00 H new ATOM 0 HB3 ASP A 616 -12.507 -13.472 3.300 1.00 25.00 H new ATOM 515 N PRO A 617 -8.767 -14.626 3.315 1.00 25.00 N ATOM 516 CA PRO A 617 -7.781 -14.454 2.214 1.00 25.00 C ATOM 517 C PRO A 617 -8.371 -14.675 0.804 1.00 25.00 C ATOM 518 O PRO A 617 -7.719 -14.375 -0.199 1.00 25.00 O ATOM 519 CB PRO A 617 -6.724 -15.530 2.515 1.00 25.00 C ATOM 520 CG PRO A 617 -7.457 -16.586 3.268 1.00 25.00 C ATOM 521 CD PRO A 617 -8.377 -15.759 4.202 1.00 25.00 C ATOM 0 HA PRO A 617 -7.400 -13.433 2.190 1.00 25.00 H new ATOM 0 HB2 PRO A 617 -6.292 -15.927 1.597 1.00 25.00 H new ATOM 0 HB3 PRO A 617 -5.902 -15.123 3.104 1.00 25.00 H new ATOM 0 HG2 PRO A 617 -8.030 -17.233 2.604 1.00 25.00 H new ATOM 0 HG3 PRO A 617 -6.779 -17.227 3.831 1.00 25.00 H new ATOM 0 HD2 PRO A 617 -9.241 -16.332 4.538 1.00 25.00 H new ATOM 0 HD3 PRO A 617 -7.854 -15.418 5.095 1.00 25.00 H new ATOM 529 N ALA A 618 -9.609 -15.195 0.747 1.00 25.00 N ATOM 530 CA ALA A 618 -10.285 -15.513 -0.521 1.00 25.00 C ATOM 531 C ALA A 618 -10.789 -14.259 -1.257 1.00 25.00 C ATOM 532 O ALA A 618 -11.234 -14.346 -2.407 1.00 25.00 O ATOM 533 CB ALA A 618 -11.441 -16.471 -0.262 1.00 25.00 C ATOM 0 H ALA A 618 -10.166 -15.406 1.575 1.00 25.00 H new ATOM 0 HA ALA A 618 -9.549 -15.985 -1.171 1.00 25.00 H new ATOM 0 HB1 ALA A 618 -11.939 -16.704 -1.203 1.00 25.00 H new ATOM 0 HB2 ALA A 618 -11.059 -17.390 0.183 1.00 25.00 H new ATOM 0 HB3 ALA A 618 -12.153 -16.006 0.420 1.00 25.00 H new ATOM 539 N ALA A 619 -10.706 -13.099 -0.589 1.00 25.00 N ATOM 540 CA ALA A 619 -11.125 -11.817 -1.173 1.00 25.00 C ATOM 541 C ALA A 619 -10.046 -11.217 -2.083 1.00 25.00 C ATOM 542 O ALA A 619 -10.313 -10.273 -2.834 1.00 25.00 O ATOM 543 CB ALA A 619 -11.465 -10.831 -0.065 1.00 25.00 C ATOM 0 H ALA A 619 -10.349 -13.023 0.364 1.00 25.00 H new ATOM 0 HA ALA A 619 -12.006 -12.009 -1.786 1.00 25.00 H new ATOM 0 HB1 ALA A 619 -11.775 -9.883 -0.504 1.00 25.00 H new ATOM 0 HB2 ALA A 619 -12.276 -11.232 0.542 1.00 25.00 H new ATOM 0 HB3 ALA A 619 -10.588 -10.671 0.562 1.00 25.00 H new ATOM 549 N LEU A 620 -8.834 -11.784 -2.015 1.00 25.00 N ATOM 550 CA LEU A 620 -7.682 -11.276 -2.760 1.00 25.00 C ATOM 551 C LEU A 620 -7.622 -11.829 -4.197 1.00 25.00 C ATOM 552 O LEU A 620 -6.686 -11.526 -4.946 1.00 25.00 O ATOM 553 CB LEU A 620 -6.389 -11.635 -2.007 1.00 25.00 C ATOM 554 CG LEU A 620 -6.224 -11.031 -0.600 1.00 25.00 C ATOM 555 CD1 LEU A 620 -4.905 -11.478 0.011 1.00 25.00 C ATOM 556 CD2 LEU A 620 -6.283 -9.505 -0.638 1.00 25.00 C ATOM 0 H LEU A 620 -8.628 -12.604 -1.444 1.00 25.00 H new ATOM 0 HA LEU A 620 -7.788 -10.194 -2.836 1.00 25.00 H new ATOM 0 HB2 LEU A 620 -6.334 -12.720 -1.921 1.00 25.00 H new ATOM 0 HB3 LEU A 620 -5.541 -11.320 -2.615 1.00 25.00 H new ATOM 0 HG LEU A 620 -7.050 -11.389 0.014 1.00 25.00 H new ATOM 0 HD11 LEU A 620 -4.799 -11.045 1.006 1.00 25.00 H new ATOM 0 HD12 LEU A 620 -4.888 -12.565 0.085 1.00 25.00 H new ATOM 0 HD13 LEU A 620 -4.081 -11.145 -0.619 1.00 25.00 H new ATOM 0 HD21 LEU A 620 -6.163 -9.111 0.371 1.00 25.00 H new ATOM 0 HD22 LEU A 620 -5.482 -9.126 -1.273 1.00 25.00 H new ATOM 0 HD23 LEU A 620 -7.246 -9.188 -1.039 1.00 25.00 H new ATOM 568 N LYS A 621 -8.632 -12.625 -4.576 1.00 25.00 N ATOM 569 CA LYS A 621 -8.681 -13.257 -5.900 1.00 25.00 C ATOM 570 C LYS A 621 -9.677 -12.520 -6.818 1.00 25.00 C ATOM 571 O LYS A 621 -10.056 -13.023 -7.884 1.00 25.00 O ATOM 572 CB LYS A 621 -9.059 -14.748 -5.744 1.00 25.00 C ATOM 573 CG LYS A 621 -8.136 -15.573 -4.835 1.00 25.00 C ATOM 574 CD LYS A 621 -8.549 -17.035 -4.750 1.00 25.00 C ATOM 575 CE LYS A 621 -7.658 -17.786 -3.793 1.00 25.00 C ATOM 576 NZ LYS A 621 -8.122 -19.183 -3.572 1.00 25.00 N ATOM 0 H LYS A 621 -9.429 -12.847 -3.980 1.00 25.00 H new ATOM 0 HA LYS A 621 -7.698 -13.193 -6.367 1.00 25.00 H new ATOM 0 HB2 LYS A 621 -10.074 -14.808 -5.352 1.00 25.00 H new ATOM 0 HB3 LYS A 621 -9.071 -15.207 -6.733 1.00 25.00 H new ATOM 0 HG2 LYS A 621 -7.114 -15.510 -5.208 1.00 25.00 H new ATOM 0 HG3 LYS A 621 -8.137 -15.141 -3.834 1.00 25.00 H new ATOM 0 HD2 LYS A 621 -9.586 -17.107 -4.422 1.00 25.00 H new ATOM 0 HD3 LYS A 621 -8.496 -17.491 -5.739 1.00 25.00 H new ATOM 0 HE2 LYS A 621 -6.640 -17.800 -4.182 1.00 25.00 H new ATOM 0 HE3 LYS A 621 -7.627 -17.260 -2.839 1.00 25.00 H new ATOM 0 HZ1 LYS A 621 -7.480 -19.661 -2.908 1.00 25.00 H new ATOM 0 HZ2 LYS A 621 -9.084 -19.171 -3.176 1.00 25.00 H new ATOM 0 HZ3 LYS A 621 -8.127 -19.695 -4.478 1.00 25.00 H new ATOM 590 N ASP A 622 -10.077 -11.314 -6.396 1.00 25.00 N ATOM 591 CA ASP A 622 -11.053 -10.499 -7.122 1.00 25.00 C ATOM 592 C ASP A 622 -10.355 -9.622 -8.175 1.00 25.00 C ATOM 593 O ASP A 622 -9.179 -9.276 -8.033 1.00 25.00 O ATOM 594 CB ASP A 622 -11.829 -9.634 -6.117 1.00 25.00 C ATOM 595 CG ASP A 622 -13.128 -9.083 -6.682 1.00 25.00 C ATOM 596 OD1 ASP A 622 -13.065 -8.230 -7.593 1.00 25.00 O ATOM 597 OD2 ASP A 622 -14.206 -9.507 -6.216 1.00 25.00 O ATOM 0 H ASP A 622 -9.732 -10.878 -5.541 1.00 25.00 H new ATOM 0 HA ASP A 622 -11.749 -11.152 -7.649 1.00 25.00 H new ATOM 0 HB2 ASP A 622 -12.049 -10.228 -5.230 1.00 25.00 H new ATOM 0 HB3 ASP A 622 -11.198 -8.805 -5.798 1.00 25.00 H new ATOM 602 N ARG A 623 -11.111 -9.274 -9.228 1.00 25.00 N ATOM 603 CA ARG A 623 -10.588 -8.518 -10.385 1.00 25.00 C ATOM 604 C ARG A 623 -10.486 -7.033 -10.062 1.00 25.00 C ATOM 605 O ARG A 623 -9.560 -6.348 -10.502 1.00 25.00 O ATOM 606 CB ARG A 623 -11.508 -8.689 -11.610 1.00 25.00 C ATOM 607 CG ARG A 623 -11.546 -10.099 -12.165 1.00 25.00 C ATOM 608 CD ARG A 623 -10.366 -10.385 -13.083 1.00 25.00 C ATOM 609 NE ARG A 623 -9.132 -10.647 -12.333 1.00 25.00 N ATOM 610 CZ ARG A 623 -8.808 -11.825 -11.776 1.00 25.00 C ATOM 611 NH1 ARG A 623 -9.618 -12.878 -11.866 1.00 25.00 N ATOM 612 NH2 ARG A 623 -7.660 -11.945 -11.123 1.00 25.00 N ATOM 0 H ARG A 623 -12.101 -9.507 -9.305 1.00 25.00 H new ATOM 0 HA ARG A 623 -9.597 -8.913 -10.610 1.00 25.00 H new ATOM 0 HB2 ARG A 623 -12.520 -8.391 -11.335 1.00 25.00 H new ATOM 0 HB3 ARG A 623 -11.178 -8.010 -12.396 1.00 25.00 H new ATOM 0 HG2 ARG A 623 -11.545 -10.813 -11.341 1.00 25.00 H new ATOM 0 HG3 ARG A 623 -12.476 -10.247 -12.714 1.00 25.00 H new ATOM 0 HD2 ARG A 623 -10.597 -11.245 -13.712 1.00 25.00 H new ATOM 0 HD3 ARG A 623 -10.211 -9.536 -13.749 1.00 25.00 H new ATOM 0 HE ARG A 623 -8.471 -9.877 -12.227 1.00 25.00 H new ATOM 0 HH11 ARG A 623 -10.504 -12.799 -12.365 1.00 25.00 H new ATOM 0 HH12 ARG A 623 -9.353 -13.764 -11.436 1.00 25.00 H new ATOM 0 HH21 ARG A 623 -7.031 -11.146 -11.047 1.00 25.00 H new ATOM 0 HH22 ARG A 623 -7.406 -12.836 -10.697 1.00 25.00 H new ATOM 626 N ARG A 624 -11.473 -6.557 -9.297 1.00 25.00 N ATOM 627 CA ARG A 624 -11.549 -5.149 -8.867 1.00 25.00 C ATOM 628 C ARG A 624 -10.509 -4.810 -7.786 1.00 25.00 C ATOM 629 O ARG A 624 -10.154 -3.642 -7.608 1.00 25.00 O ATOM 630 CB ARG A 624 -12.959 -4.825 -8.351 1.00 25.00 C ATOM 631 CG ARG A 624 -14.033 -4.836 -9.436 1.00 25.00 C ATOM 632 CD ARG A 624 -15.419 -4.538 -8.873 1.00 25.00 C ATOM 633 NE ARG A 624 -15.531 -3.166 -8.356 1.00 25.00 N ATOM 634 CZ ARG A 624 -16.637 -2.409 -8.423 1.00 25.00 C ATOM 635 NH1 ARG A 624 -17.756 -2.866 -8.983 1.00 25.00 N ATOM 636 NH2 ARG A 624 -16.621 -1.183 -7.918 1.00 25.00 N ATOM 0 H ARG A 624 -12.243 -7.133 -8.956 1.00 25.00 H new ATOM 0 HA ARG A 624 -11.327 -4.536 -9.741 1.00 25.00 H new ATOM 0 HB2 ARG A 624 -13.228 -5.547 -7.580 1.00 25.00 H new ATOM 0 HB3 ARG A 624 -12.945 -3.843 -7.877 1.00 25.00 H new ATOM 0 HG2 ARG A 624 -13.785 -4.098 -10.198 1.00 25.00 H new ATOM 0 HG3 ARG A 624 -14.043 -5.809 -9.926 1.00 25.00 H new ATOM 0 HD2 ARG A 624 -16.165 -4.692 -9.652 1.00 25.00 H new ATOM 0 HD3 ARG A 624 -15.643 -5.244 -8.073 1.00 25.00 H new ATOM 0 HE ARG A 624 -14.707 -2.759 -7.914 1.00 25.00 H new ATOM 0 HH11 ARG A 624 -17.784 -3.809 -9.372 1.00 25.00 H new ATOM 0 HH12 ARG A 624 -18.585 -2.273 -9.023 1.00 25.00 H new ATOM 0 HH21 ARG A 624 -15.772 -0.822 -7.483 1.00 25.00 H new ATOM 0 HH22 ARG A 624 -17.457 -0.601 -7.965 1.00 25.00 H new ATOM 650 N MET A 625 -10.019 -5.842 -7.082 1.00 25.00 N ATOM 651 CA MET A 625 -9.019 -5.669 -6.019 1.00 25.00 C ATOM 652 C MET A 625 -7.594 -5.679 -6.590 1.00 25.00 C ATOM 653 O MET A 625 -6.727 -4.941 -6.113 1.00 25.00 O ATOM 654 CB MET A 625 -9.175 -6.782 -4.970 1.00 25.00 C ATOM 655 CG MET A 625 -8.117 -6.760 -3.865 1.00 25.00 C ATOM 656 SD MET A 625 -8.191 -5.262 -2.862 1.00 25.00 S ATOM 657 CE MET A 625 -8.262 -5.949 -1.213 1.00 25.00 C ATOM 0 H MET A 625 -10.302 -6.810 -7.232 1.00 25.00 H new ATOM 0 HA MET A 625 -9.186 -4.701 -5.548 1.00 25.00 H new ATOM 0 HB2 MET A 625 -10.161 -6.699 -4.514 1.00 25.00 H new ATOM 0 HB3 MET A 625 -9.137 -7.748 -5.474 1.00 25.00 H new ATOM 0 HG2 MET A 625 -8.251 -7.630 -3.222 1.00 25.00 H new ATOM 0 HG3 MET A 625 -7.127 -6.844 -4.313 1.00 25.00 H new ATOM 0 HE1 MET A 625 -8.133 -5.152 -0.481 1.00 25.00 H new ATOM 0 HE2 MET A 625 -9.229 -6.429 -1.060 1.00 25.00 H new ATOM 0 HE3 MET A 625 -7.468 -6.686 -1.091 1.00 25.00 H new ATOM 667 N GLU A 626 -7.370 -6.528 -7.606 1.00 25.00 N ATOM 668 CA GLU A 626 -6.058 -6.664 -8.272 1.00 25.00 C ATOM 669 C GLU A 626 -5.484 -5.329 -8.784 1.00 25.00 C ATOM 670 O GLU A 626 -4.275 -5.219 -9.014 1.00 25.00 O ATOM 671 CB GLU A 626 -6.136 -7.675 -9.421 1.00 25.00 C ATOM 672 CG GLU A 626 -4.771 -8.087 -9.954 1.00 25.00 C ATOM 673 CD GLU A 626 -4.858 -9.157 -11.026 1.00 25.00 C ATOM 674 OE1 GLU A 626 -5.990 -9.562 -11.371 1.00 25.00 O ATOM 675 OE2 GLU A 626 -3.796 -9.590 -11.522 1.00 25.00 O ATOM 0 H GLU A 626 -8.090 -7.140 -7.991 1.00 25.00 H new ATOM 0 HA GLU A 626 -5.372 -7.026 -7.507 1.00 25.00 H new ATOM 0 HB2 GLU A 626 -6.668 -8.563 -9.079 1.00 25.00 H new ATOM 0 HB3 GLU A 626 -6.722 -7.246 -10.234 1.00 25.00 H new ATOM 0 HG2 GLU A 626 -4.265 -7.211 -10.361 1.00 25.00 H new ATOM 0 HG3 GLU A 626 -4.159 -8.454 -9.130 1.00 25.00 H new ATOM 682 N ASN A 627 -6.357 -4.321 -8.951 1.00 25.00 N ATOM 683 CA ASN A 627 -5.953 -2.988 -9.424 1.00 25.00 C ATOM 684 C ASN A 627 -5.100 -2.244 -8.375 1.00 25.00 C ATOM 685 O ASN A 627 -4.129 -1.572 -8.736 1.00 25.00 O ATOM 686 CB ASN A 627 -7.201 -2.163 -9.785 1.00 25.00 C ATOM 687 CG ASN A 627 -7.844 -2.592 -11.094 1.00 25.00 C ATOM 688 OD1 ASN A 627 -7.226 -3.281 -11.907 1.00 25.00 O ATOM 689 ND2 ASN A 627 -9.089 -2.184 -11.303 1.00 25.00 N ATOM 0 H ASN A 627 -7.356 -4.407 -8.763 1.00 25.00 H new ATOM 0 HA ASN A 627 -5.335 -3.118 -10.313 1.00 25.00 H new ATOM 0 HB2 ASN A 627 -7.933 -2.252 -8.982 1.00 25.00 H new ATOM 0 HB3 ASN A 627 -6.926 -1.110 -9.850 1.00 25.00 H new ATOM 0 HD21 ASN A 627 -9.572 -2.440 -12.164 1.00 25.00 H new ATOM 0 HD22 ASN A 627 -9.563 -1.614 -10.602 1.00 25.00 H new ATOM 696 N LEU A 628 -5.465 -2.370 -7.086 1.00 25.00 N ATOM 697 CA LEU A 628 -4.712 -1.725 -6.001 1.00 25.00 C ATOM 698 C LEU A 628 -3.548 -2.621 -5.539 1.00 25.00 C ATOM 699 O LEU A 628 -2.512 -2.122 -5.096 1.00 25.00 O ATOM 700 CB LEU A 628 -5.663 -1.281 -4.841 1.00 25.00 C ATOM 701 CG LEU A 628 -6.637 -0.098 -5.065 1.00 25.00 C ATOM 702 CD1 LEU A 628 -7.543 0.124 -3.863 1.00 25.00 C ATOM 703 CD2 LEU A 628 -5.858 1.172 -5.324 1.00 25.00 C ATOM 0 H LEU A 628 -6.272 -2.910 -6.774 1.00 25.00 H new ATOM 0 HA LEU A 628 -4.259 -0.808 -6.378 1.00 25.00 H new ATOM 0 HB2 LEU A 628 -6.261 -2.148 -4.559 1.00 25.00 H new ATOM 0 HB3 LEU A 628 -5.038 -1.032 -3.983 1.00 25.00 H new ATOM 0 HG LEU A 628 -7.256 -0.348 -5.926 1.00 25.00 H new ATOM 0 HD11 LEU A 628 -8.211 0.963 -4.061 1.00 25.00 H new ATOM 0 HD12 LEU A 628 -8.133 -0.774 -3.681 1.00 25.00 H new ATOM 0 HD13 LEU A 628 -6.935 0.343 -2.985 1.00 25.00 H new ATOM 0 HD21 LEU A 628 -6.551 1.999 -5.480 1.00 25.00 H new ATOM 0 HD22 LEU A 628 -5.221 1.390 -4.466 1.00 25.00 H new ATOM 0 HD23 LEU A 628 -5.239 1.045 -6.212 1.00 25.00 H new ATOM 715 N VAL A 629 -3.743 -3.949 -5.640 1.00 25.00 N ATOM 716 CA VAL A 629 -2.668 -4.945 -5.428 1.00 25.00 C ATOM 717 C VAL A 629 -1.471 -4.632 -6.344 1.00 25.00 C ATOM 718 O VAL A 629 -0.312 -4.830 -5.971 1.00 25.00 O ATOM 719 CB VAL A 629 -3.206 -6.384 -5.719 1.00 25.00 C ATOM 720 CG1 VAL A 629 -2.108 -7.451 -5.722 1.00 25.00 C ATOM 721 CG2 VAL A 629 -4.298 -6.763 -4.724 1.00 25.00 C ATOM 0 H VAL A 629 -4.646 -4.364 -5.870 1.00 25.00 H new ATOM 0 HA VAL A 629 -2.339 -4.895 -4.390 1.00 25.00 H new ATOM 0 HB VAL A 629 -3.622 -6.354 -6.726 1.00 25.00 H new ATOM 0 HG11 VAL A 629 -2.549 -8.426 -5.930 1.00 25.00 H new ATOM 0 HG12 VAL A 629 -1.372 -7.214 -6.491 1.00 25.00 H new ATOM 0 HG13 VAL A 629 -1.620 -7.474 -4.748 1.00 25.00 H new ATOM 0 HG21 VAL A 629 -4.658 -7.768 -4.945 1.00 25.00 H new ATOM 0 HG22 VAL A 629 -3.893 -6.736 -3.712 1.00 25.00 H new ATOM 0 HG23 VAL A 629 -5.124 -6.056 -4.803 1.00 25.00 H new ATOM 731 N ALA A 630 -1.797 -4.134 -7.540 1.00 25.00 N ATOM 732 CA ALA A 630 -0.812 -3.741 -8.537 1.00 25.00 C ATOM 733 C ALA A 630 -0.229 -2.352 -8.237 1.00 25.00 C ATOM 734 O ALA A 630 0.832 -1.993 -8.753 1.00 25.00 O ATOM 735 CB ALA A 630 -1.461 -3.786 -9.908 1.00 25.00 C ATOM 0 H ALA A 630 -2.761 -3.993 -7.841 1.00 25.00 H new ATOM 0 HA ALA A 630 0.025 -4.439 -8.510 1.00 25.00 H new ATOM 0 HB1 ALA A 630 -0.733 -3.493 -10.665 1.00 25.00 H new ATOM 0 HB2 ALA A 630 -1.810 -4.798 -10.112 1.00 25.00 H new ATOM 0 HB3 ALA A 630 -2.307 -3.099 -9.933 1.00 25.00 H new ATOM 741 N TYR A 631 -0.944 -1.580 -7.399 1.00 25.00 N ATOM 742 CA TYR A 631 -0.454 -0.298 -6.875 1.00 25.00 C ATOM 743 C TYR A 631 0.629 -0.525 -5.802 1.00 25.00 C ATOM 744 O TYR A 631 1.618 0.208 -5.751 1.00 25.00 O ATOM 745 CB TYR A 631 -1.651 0.533 -6.316 1.00 25.00 C ATOM 746 CG TYR A 631 -1.368 2.010 -6.036 1.00 25.00 C ATOM 747 CD1 TYR A 631 -1.807 2.994 -6.922 1.00 25.00 C ATOM 748 CD2 TYR A 631 -0.706 2.414 -4.879 1.00 25.00 C ATOM 749 CE1 TYR A 631 -1.594 4.333 -6.657 1.00 25.00 C ATOM 750 CE2 TYR A 631 -0.486 3.751 -4.616 1.00 25.00 C ATOM 751 CZ TYR A 631 -0.773 4.684 -5.556 1.00 25.00 C ATOM 752 OH TYR A 631 -0.725 6.038 -5.240 1.00 25.00 O ATOM 0 H TYR A 631 -1.876 -1.829 -7.068 1.00 25.00 H new ATOM 0 HA TYR A 631 0.008 0.268 -7.684 1.00 25.00 H new ATOM 0 HB2 TYR A 631 -2.475 0.470 -7.027 1.00 25.00 H new ATOM 0 HB3 TYR A 631 -1.991 0.067 -5.391 1.00 25.00 H new ATOM 0 HD1 TYR A 631 -2.320 2.705 -7.827 1.00 25.00 H new ATOM 0 HD2 TYR A 631 -0.360 1.670 -4.177 1.00 25.00 H new ATOM 0 HE1 TYR A 631 -2.043 5.096 -7.275 1.00 25.00 H new ATOM 0 HE2 TYR A 631 -0.085 4.054 -3.660 1.00 25.00 H new ATOM 0 HH TYR A 631 -0.135 6.173 -4.469 1.00 25.00 H new ATOM 762 N ALA A 632 0.419 -1.534 -4.947 1.00 25.00 N ATOM 763 CA ALA A 632 1.340 -1.826 -3.847 1.00 25.00 C ATOM 764 C ALA A 632 2.509 -2.707 -4.299 1.00 25.00 C ATOM 765 O ALA A 632 3.599 -2.644 -3.722 1.00 25.00 O ATOM 766 CB ALA A 632 0.594 -2.479 -2.697 1.00 25.00 C ATOM 0 H ALA A 632 -0.383 -2.162 -4.998 1.00 25.00 H new ATOM 0 HA ALA A 632 1.760 -0.879 -3.507 1.00 25.00 H new ATOM 0 HB1 ALA A 632 1.290 -2.691 -1.885 1.00 25.00 H new ATOM 0 HB2 ALA A 632 -0.185 -1.806 -2.340 1.00 25.00 H new ATOM 0 HB3 ALA A 632 0.141 -3.410 -3.039 1.00 25.00 H new ATOM 772 N LYS A 633 2.267 -3.530 -5.335 1.00 25.00 N ATOM 773 CA LYS A 633 3.286 -4.410 -5.921 1.00 25.00 C ATOM 774 C LYS A 633 4.472 -3.621 -6.504 1.00 25.00 C ATOM 775 O LYS A 633 5.608 -4.104 -6.506 1.00 25.00 O ATOM 776 CB LYS A 633 2.636 -5.255 -7.032 1.00 25.00 C ATOM 777 CG LYS A 633 2.095 -6.615 -6.587 1.00 25.00 C ATOM 778 CD LYS A 633 1.598 -7.439 -7.764 1.00 25.00 C ATOM 779 CE LYS A 633 1.605 -8.936 -7.467 1.00 25.00 C ATOM 780 NZ LYS A 633 0.490 -9.656 -8.149 1.00 25.00 N ATOM 0 H LYS A 633 1.356 -3.601 -5.788 1.00 25.00 H new ATOM 0 HA LYS A 633 3.677 -5.047 -5.128 1.00 25.00 H new ATOM 0 HB2 LYS A 633 1.818 -4.683 -7.470 1.00 25.00 H new ATOM 0 HB3 LYS A 633 3.371 -5.415 -7.821 1.00 25.00 H new ATOM 0 HG2 LYS A 633 2.878 -7.164 -6.064 1.00 25.00 H new ATOM 0 HG3 LYS A 633 1.281 -6.468 -5.877 1.00 25.00 H new ATOM 0 HD2 LYS A 633 0.586 -7.127 -8.022 1.00 25.00 H new ATOM 0 HD3 LYS A 633 2.224 -7.240 -8.634 1.00 25.00 H new ATOM 0 HE2 LYS A 633 2.557 -9.362 -7.784 1.00 25.00 H new ATOM 0 HE3 LYS A 633 1.529 -9.091 -6.391 1.00 25.00 H new ATOM 0 HZ1 LYS A 633 0.537 -10.669 -7.917 1.00 25.00 H new ATOM 0 HZ2 LYS A 633 -0.421 -9.269 -7.828 1.00 25.00 H new ATOM 0 HZ3 LYS A 633 0.575 -9.533 -9.178 1.00 25.00 H new ATOM 794 N LYS A 634 4.183 -2.416 -7.007 1.00 25.00 N ATOM 795 CA LYS A 634 5.167 -1.560 -7.654 1.00 25.00 C ATOM 796 C LYS A 634 5.944 -0.651 -6.684 1.00 25.00 C ATOM 797 O LYS A 634 7.089 -0.289 -6.976 1.00 25.00 O ATOM 798 CB LYS A 634 4.489 -0.717 -8.741 1.00 25.00 C ATOM 799 CG LYS A 634 5.439 0.202 -9.487 1.00 25.00 C ATOM 800 CD LYS A 634 6.547 -0.553 -10.218 1.00 25.00 C ATOM 801 CE LYS A 634 7.560 0.393 -10.859 1.00 25.00 C ATOM 802 NZ LYS A 634 8.397 1.081 -9.838 1.00 25.00 N ATOM 0 H LYS A 634 3.248 -2.009 -6.973 1.00 25.00 H new ATOM 0 HA LYS A 634 5.908 -2.227 -8.095 1.00 25.00 H new ATOM 0 HB2 LYS A 634 4.007 -1.383 -9.456 1.00 25.00 H new ATOM 0 HB3 LYS A 634 3.702 -0.117 -8.284 1.00 25.00 H new ATOM 0 HG2 LYS A 634 4.873 0.793 -10.207 1.00 25.00 H new ATOM 0 HG3 LYS A 634 5.888 0.902 -8.782 1.00 25.00 H new ATOM 0 HD2 LYS A 634 7.060 -1.212 -9.517 1.00 25.00 H new ATOM 0 HD3 LYS A 634 6.106 -1.187 -10.987 1.00 25.00 H new ATOM 0 HE2 LYS A 634 8.202 -0.168 -11.538 1.00 25.00 H new ATOM 0 HE3 LYS A 634 7.034 1.136 -11.459 1.00 25.00 H new ATOM 0 HZ1 LYS A 634 9.158 1.608 -10.311 1.00 25.00 H new ATOM 0 HZ2 LYS A 634 7.807 1.741 -9.292 1.00 25.00 H new ATOM 0 HZ3 LYS A 634 8.812 0.375 -9.196 1.00 25.00 H new ATOM 816 N VAL A 635 5.338 -0.286 -5.535 1.00 25.00 N ATOM 817 CA VAL A 635 5.931 0.738 -4.647 1.00 25.00 C ATOM 818 C VAL A 635 7.230 0.261 -3.963 1.00 25.00 C ATOM 819 O VAL A 635 8.266 0.912 -4.111 1.00 25.00 O ATOM 820 CB VAL A 635 4.931 1.325 -3.587 1.00 25.00 C ATOM 821 CG1 VAL A 635 5.668 2.106 -2.511 1.00 25.00 C ATOM 822 CG2 VAL A 635 3.824 2.192 -4.193 1.00 25.00 C ATOM 0 H VAL A 635 4.455 -0.676 -5.204 1.00 25.00 H new ATOM 0 HA VAL A 635 6.186 1.556 -5.321 1.00 25.00 H new ATOM 0 HB VAL A 635 4.442 0.458 -3.142 1.00 25.00 H new ATOM 0 HG11 VAL A 635 4.950 2.500 -1.792 1.00 25.00 H new ATOM 0 HG12 VAL A 635 6.370 1.447 -2.000 1.00 25.00 H new ATOM 0 HG13 VAL A 635 6.213 2.931 -2.969 1.00 25.00 H new ATOM 0 HG21 VAL A 635 3.175 2.560 -3.399 1.00 25.00 H new ATOM 0 HG22 VAL A 635 4.270 3.037 -4.718 1.00 25.00 H new ATOM 0 HG23 VAL A 635 3.238 1.597 -4.894 1.00 25.00 H new ATOM 832 N GLU A 636 7.179 -0.887 -3.256 1.00 25.00 N ATOM 833 CA GLU A 636 8.335 -1.410 -2.481 1.00 25.00 C ATOM 834 C GLU A 636 9.587 -1.661 -3.342 1.00 25.00 C ATOM 835 O GLU A 636 10.703 -1.720 -2.814 1.00 25.00 O ATOM 836 CB GLU A 636 7.968 -2.683 -1.677 1.00 25.00 C ATOM 837 CG GLU A 636 7.449 -3.858 -2.497 1.00 25.00 C ATOM 838 CD GLU A 636 8.543 -4.663 -3.180 1.00 25.00 C ATOM 839 OE1 GLU A 636 9.677 -4.681 -2.662 1.00 25.00 O ATOM 840 OE2 GLU A 636 8.264 -5.272 -4.231 1.00 25.00 O ATOM 0 H GLU A 636 6.348 -1.475 -3.203 1.00 25.00 H new ATOM 0 HA GLU A 636 8.587 -0.617 -1.777 1.00 25.00 H new ATOM 0 HB2 GLU A 636 8.851 -3.010 -1.127 1.00 25.00 H new ATOM 0 HB3 GLU A 636 7.212 -2.418 -0.938 1.00 25.00 H new ATOM 0 HG2 GLU A 636 6.878 -4.519 -1.845 1.00 25.00 H new ATOM 0 HG3 GLU A 636 6.760 -3.484 -3.254 1.00 25.00 H new ATOM 847 N GLY A 637 9.394 -1.804 -4.665 1.00 25.00 N ATOM 848 CA GLY A 637 10.515 -1.942 -5.595 1.00 25.00 C ATOM 849 C GLY A 637 11.298 -0.642 -5.777 1.00 25.00 C ATOM 850 O GLY A 637 12.471 -0.668 -6.156 1.00 25.00 O ATOM 0 H GLY A 637 8.475 -1.826 -5.107 1.00 25.00 H new ATOM 0 HA2 GLY A 637 11.188 -2.718 -5.232 1.00 25.00 H new ATOM 0 HA3 GLY A 637 10.139 -2.273 -6.563 1.00 25.00 H new ATOM 854 N ASP A 638 10.631 0.490 -5.503 1.00 25.00 N ATOM 855 CA ASP A 638 11.262 1.817 -5.541 1.00 25.00 C ATOM 856 C ASP A 638 11.911 2.165 -4.194 1.00 25.00 C ATOM 857 O ASP A 638 12.778 3.041 -4.125 1.00 25.00 O ATOM 858 CB ASP A 638 10.233 2.892 -5.917 1.00 25.00 C ATOM 859 CG ASP A 638 9.762 2.782 -7.357 1.00 25.00 C ATOM 860 OD1 ASP A 638 10.608 2.527 -8.240 1.00 25.00 O ATOM 861 OD2 ASP A 638 8.549 2.948 -7.600 1.00 25.00 O ATOM 0 H ASP A 638 9.643 0.511 -5.250 1.00 25.00 H new ATOM 0 HA ASP A 638 12.043 1.789 -6.301 1.00 25.00 H new ATOM 0 HB2 ASP A 638 9.373 2.813 -5.252 1.00 25.00 H new ATOM 0 HB3 ASP A 638 10.670 3.878 -5.757 1.00 25.00 H new ATOM 866 N MET A 639 11.481 1.464 -3.128 1.00 25.00 N ATOM 867 CA MET A 639 12.036 1.644 -1.775 1.00 25.00 C ATOM 868 C MET A 639 13.451 1.059 -1.650 1.00 25.00 C ATOM 869 O MET A 639 14.212 1.438 -0.753 1.00 25.00 O ATOM 870 CB MET A 639 11.128 0.994 -0.729 1.00 25.00 C ATOM 871 CG MET A 639 9.701 1.490 -0.779 1.00 25.00 C ATOM 872 SD MET A 639 8.680 0.818 0.535 1.00 25.00 S ATOM 873 CE MET A 639 9.591 -0.667 0.910 1.00 25.00 C ATOM 0 H MET A 639 10.744 0.761 -3.180 1.00 25.00 H new ATOM 0 HA MET A 639 12.093 2.718 -1.598 1.00 25.00 H new ATOM 0 HB2 MET A 639 11.134 -0.086 -0.875 1.00 25.00 H new ATOM 0 HB3 MET A 639 11.536 1.184 0.264 1.00 25.00 H new ATOM 0 HG2 MET A 639 9.698 2.578 -0.714 1.00 25.00 H new ATOM 0 HG3 MET A 639 9.264 1.227 -1.742 1.00 25.00 H new ATOM 0 HE1 MET A 639 9.035 -1.261 1.636 1.00 25.00 H new ATOM 0 HE2 MET A 639 9.732 -1.247 -0.002 1.00 25.00 H new ATOM 0 HE3 MET A 639 10.563 -0.402 1.326 1.00 25.00 H new ATOM 883 N TYR A 640 13.788 0.137 -2.564 1.00 25.00 N ATOM 884 CA TYR A 640 15.078 -0.566 -2.556 1.00 25.00 C ATOM 885 C TYR A 640 16.214 0.342 -3.055 1.00 25.00 C ATOM 886 O TYR A 640 17.349 0.244 -2.579 1.00 25.00 O ATOM 887 CB TYR A 640 14.971 -1.819 -3.438 1.00 25.00 C ATOM 888 CG TYR A 640 16.157 -2.761 -3.355 1.00 25.00 C ATOM 889 CD1 TYR A 640 16.111 -3.890 -2.543 1.00 25.00 C ATOM 890 CD2 TYR A 640 17.314 -2.533 -4.092 1.00 25.00 C ATOM 891 CE1 TYR A 640 17.180 -4.762 -2.469 1.00 25.00 C ATOM 892 CE2 TYR A 640 18.388 -3.400 -4.021 1.00 25.00 C ATOM 893 CZ TYR A 640 18.314 -4.513 -3.207 1.00 25.00 C ATOM 894 OH TYR A 640 19.378 -5.381 -3.136 1.00 25.00 O ATOM 0 H TYR A 640 13.174 -0.142 -3.329 1.00 25.00 H new ATOM 0 HA TYR A 640 15.315 -0.853 -1.531 1.00 25.00 H new ATOM 0 HB2 TYR A 640 14.071 -2.366 -3.159 1.00 25.00 H new ATOM 0 HB3 TYR A 640 14.846 -1.506 -4.475 1.00 25.00 H new ATOM 0 HD1 TYR A 640 15.224 -4.088 -1.960 1.00 25.00 H new ATOM 0 HD2 TYR A 640 17.374 -1.664 -4.730 1.00 25.00 H new ATOM 0 HE1 TYR A 640 17.126 -5.635 -1.835 1.00 25.00 H new ATOM 0 HE2 TYR A 640 19.280 -3.208 -4.599 1.00 25.00 H new ATOM 0 HH TYR A 640 20.021 -5.056 -2.472 1.00 25.00 H new ATOM 904 N GLU A 641 15.891 1.220 -4.017 1.00 25.00 N ATOM 905 CA GLU A 641 16.867 2.153 -4.601 1.00 25.00 C ATOM 906 C GLU A 641 16.942 3.475 -3.821 1.00 25.00 C ATOM 907 O GLU A 641 17.973 4.153 -3.845 1.00 25.00 O ATOM 908 CB GLU A 641 16.524 2.445 -6.069 1.00 25.00 C ATOM 909 CG GLU A 641 16.661 1.246 -6.990 1.00 25.00 C ATOM 910 CD GLU A 641 18.105 0.843 -7.218 1.00 25.00 C ATOM 911 OE1 GLU A 641 18.919 1.726 -7.563 1.00 25.00 O ATOM 912 OE2 GLU A 641 18.420 -0.354 -7.052 1.00 25.00 O ATOM 0 H GLU A 641 14.953 1.303 -4.410 1.00 25.00 H new ATOM 0 HA GLU A 641 17.842 1.669 -4.541 1.00 25.00 H new ATOM 0 HB2 GLU A 641 15.501 2.817 -6.124 1.00 25.00 H new ATOM 0 HB3 GLU A 641 17.173 3.243 -6.430 1.00 25.00 H new ATOM 0 HG2 GLU A 641 16.116 0.403 -6.565 1.00 25.00 H new ATOM 0 HG3 GLU A 641 16.197 1.475 -7.949 1.00 25.00 H new ATOM 919 N SER A 642 15.849 3.826 -3.125 1.00 25.00 N ATOM 920 CA SER A 642 15.747 5.105 -2.408 1.00 25.00 C ATOM 921 C SER A 642 16.330 5.015 -0.990 1.00 25.00 C ATOM 922 O SER A 642 17.083 5.899 -0.573 1.00 25.00 O ATOM 923 CB SER A 642 14.283 5.565 -2.357 1.00 25.00 C ATOM 924 OG SER A 642 13.764 5.795 -3.657 1.00 25.00 O ATOM 0 H SER A 642 15.020 3.238 -3.044 1.00 25.00 H new ATOM 0 HA SER A 642 16.337 5.840 -2.956 1.00 25.00 H new ATOM 0 HB2 SER A 642 13.681 4.810 -1.852 1.00 25.00 H new ATOM 0 HB3 SER A 642 14.208 6.479 -1.767 1.00 25.00 H new ATOM 0 HG SER A 642 13.361 4.970 -3.999 1.00 25.00 H new ATOM 930 N ALA A 643 15.975 3.946 -0.261 1.00 25.00 N ATOM 931 CA ALA A 643 16.452 3.737 1.110 1.00 25.00 C ATOM 932 C ALA A 643 17.824 3.056 1.140 1.00 25.00 C ATOM 933 O ALA A 643 18.142 2.238 0.271 1.00 25.00 O ATOM 934 CB ALA A 643 15.441 2.914 1.888 1.00 25.00 C ATOM 0 H ALA A 643 15.356 3.211 -0.603 1.00 25.00 H new ATOM 0 HA ALA A 643 16.563 4.716 1.577 1.00 25.00 H new ATOM 0 HB1 ALA A 643 15.801 2.762 2.906 1.00 25.00 H new ATOM 0 HB2 ALA A 643 14.487 3.441 1.915 1.00 25.00 H new ATOM 0 HB3 ALA A 643 15.308 1.947 1.402 1.00 25.00 H new ATOM 940 N ASN A 644 18.625 3.407 2.154 1.00 25.00 N ATOM 941 CA ASN A 644 19.973 2.851 2.325 1.00 25.00 C ATOM 942 C ASN A 644 20.024 1.868 3.510 1.00 25.00 C ATOM 943 O ASN A 644 20.988 1.111 3.652 1.00 25.00 O ATOM 944 CB ASN A 644 20.980 3.997 2.538 1.00 25.00 C ATOM 945 CG ASN A 644 21.199 4.850 1.296 1.00 25.00 C ATOM 946 OD1 ASN A 644 21.780 4.396 0.311 1.00 25.00 O ATOM 947 ND2 ASN A 644 20.745 6.098 1.348 1.00 25.00 N ATOM 0 H ASN A 644 18.360 4.079 2.874 1.00 25.00 H new ATOM 0 HA ASN A 644 20.237 2.299 1.423 1.00 25.00 H new ATOM 0 HB2 ASN A 644 20.628 4.634 3.349 1.00 25.00 H new ATOM 0 HB3 ASN A 644 21.935 3.577 2.854 1.00 25.00 H new ATOM 0 HD21 ASN A 644 20.873 6.721 0.550 1.00 25.00 H new ATOM 0 HD22 ASN A 644 20.269 6.433 2.185 1.00 25.00 H new ATOM 954 N SER A 645 18.973 1.877 4.339 1.00 25.00 N ATOM 955 CA SER A 645 18.922 1.051 5.550 1.00 25.00 C ATOM 956 C SER A 645 17.590 0.301 5.637 1.00 25.00 C ATOM 957 O SER A 645 16.604 0.697 5.011 1.00 25.00 O ATOM 958 CB SER A 645 19.108 1.932 6.793 1.00 25.00 C ATOM 959 OG SER A 645 17.999 2.795 6.980 1.00 25.00 O ATOM 0 H SER A 645 18.143 2.451 4.191 1.00 25.00 H new ATOM 0 HA SER A 645 19.729 0.320 5.504 1.00 25.00 H new ATOM 0 HB2 SER A 645 19.234 1.302 7.673 1.00 25.00 H new ATOM 0 HB3 SER A 645 20.018 2.522 6.691 1.00 25.00 H new ATOM 0 HG SER A 645 18.143 3.344 7.779 1.00 25.00 H new ATOM 965 N ARG A 646 17.579 -0.787 6.428 1.00 25.00 N ATOM 966 CA ARG A 646 16.413 -1.678 6.546 1.00 25.00 C ATOM 967 C ARG A 646 15.300 -1.054 7.409 1.00 25.00 C ATOM 968 O ARG A 646 14.128 -1.409 7.260 1.00 25.00 O ATOM 969 CB ARG A 646 16.851 -3.031 7.129 1.00 25.00 C ATOM 970 CG ARG A 646 15.731 -4.070 7.223 1.00 25.00 C ATOM 971 CD ARG A 646 16.238 -5.406 7.755 1.00 25.00 C ATOM 972 NE ARG A 646 16.615 -5.338 9.175 1.00 25.00 N ATOM 973 CZ ARG A 646 15.747 -5.258 10.196 1.00 25.00 C ATOM 974 NH1 ARG A 646 14.432 -5.249 9.985 1.00 25.00 N ATOM 975 NH2 ARG A 646 16.205 -5.193 11.439 1.00 25.00 N ATOM 0 H ARG A 646 18.374 -1.071 7.000 1.00 25.00 H new ATOM 0 HA ARG A 646 16.001 -1.829 5.548 1.00 25.00 H new ATOM 0 HB2 ARG A 646 17.655 -3.435 6.514 1.00 25.00 H new ATOM 0 HB3 ARG A 646 17.263 -2.868 8.125 1.00 25.00 H new ATOM 0 HG2 ARG A 646 14.942 -3.695 7.875 1.00 25.00 H new ATOM 0 HG3 ARG A 646 15.288 -4.216 6.238 1.00 25.00 H new ATOM 0 HD2 ARG A 646 15.465 -6.163 7.623 1.00 25.00 H new ATOM 0 HD3 ARG A 646 17.100 -5.724 7.168 1.00 25.00 H new ATOM 0 HE ARG A 646 17.610 -5.353 9.401 1.00 25.00 H new ATOM 0 HH11 ARG A 646 14.068 -5.304 9.034 1.00 25.00 H new ATOM 0 HH12 ARG A 646 13.789 -5.188 10.775 1.00 25.00 H new ATOM 0 HH21 ARG A 646 17.210 -5.204 11.613 1.00 25.00 H new ATOM 0 HH22 ARG A 646 15.552 -5.132 12.220 1.00 25.00 H new ATOM 989 N ASP A 647 15.683 -0.139 8.312 1.00 25.00 N ATOM 990 CA ASP A 647 14.720 0.601 9.143 1.00 25.00 C ATOM 991 C ASP A 647 14.114 1.783 8.376 1.00 25.00 C ATOM 992 O ASP A 647 13.020 2.249 8.708 1.00 25.00 O ATOM 993 CB ASP A 647 15.389 1.099 10.433 1.00 25.00 C ATOM 994 CG ASP A 647 15.729 -0.028 11.392 1.00 25.00 C ATOM 995 OD1 ASP A 647 15.223 -1.152 11.191 1.00 25.00 O ATOM 996 OD2 ASP A 647 16.501 0.216 12.344 1.00 25.00 O ATOM 0 H ASP A 647 16.657 0.107 8.486 1.00 25.00 H new ATOM 0 HA ASP A 647 13.914 -0.085 9.404 1.00 25.00 H new ATOM 0 HB2 ASP A 647 16.300 1.641 10.179 1.00 25.00 H new ATOM 0 HB3 ASP A 647 14.726 1.806 10.931 1.00 25.00 H new ATOM 1001 N GLU A 648 14.838 2.257 7.348 1.00 25.00 N ATOM 1002 CA GLU A 648 14.359 3.330 6.474 1.00 25.00 C ATOM 1003 C GLU A 648 13.507 2.742 5.339 1.00 25.00 C ATOM 1004 O GLU A 648 12.436 3.263 5.031 1.00 25.00 O ATOM 1005 CB GLU A 648 15.552 4.128 5.912 1.00 25.00 C ATOM 1006 CG GLU A 648 15.168 5.299 5.009 1.00 25.00 C ATOM 1007 CD GLU A 648 16.370 6.088 4.528 1.00 25.00 C ATOM 1008 OE1 GLU A 648 17.258 5.485 3.888 1.00 25.00 O ATOM 1009 OE2 GLU A 648 16.424 7.308 4.791 1.00 25.00 O ATOM 0 H GLU A 648 15.765 1.907 7.104 1.00 25.00 H new ATOM 0 HA GLU A 648 13.736 4.012 7.052 1.00 25.00 H new ATOM 0 HB2 GLU A 648 16.142 4.508 6.746 1.00 25.00 H new ATOM 0 HB3 GLU A 648 16.194 3.449 5.350 1.00 25.00 H new ATOM 0 HG2 GLU A 648 14.618 4.922 4.147 1.00 25.00 H new ATOM 0 HG3 GLU A 648 14.495 5.964 5.550 1.00 25.00 H new ATOM 1016 N TYR A 649 13.997 1.638 4.748 1.00 25.00 N ATOM 1017 CA TYR A 649 13.305 0.913 3.667 1.00 25.00 C ATOM 1018 C TYR A 649 11.866 0.532 4.073 1.00 25.00 C ATOM 1019 O TYR A 649 10.914 0.798 3.334 1.00 25.00 O ATOM 1020 CB TYR A 649 14.155 -0.329 3.296 1.00 25.00 C ATOM 1021 CG TYR A 649 13.516 -1.321 2.337 1.00 25.00 C ATOM 1022 CD1 TYR A 649 13.510 -1.107 0.964 1.00 25.00 C ATOM 1023 CD2 TYR A 649 12.930 -2.481 2.824 1.00 25.00 C ATOM 1024 CE1 TYR A 649 12.931 -2.025 0.107 1.00 25.00 C ATOM 1025 CE2 TYR A 649 12.351 -3.397 1.979 1.00 25.00 C ATOM 1026 CZ TYR A 649 12.327 -3.154 0.620 1.00 25.00 C ATOM 1027 OH TYR A 649 11.743 -4.161 -0.124 1.00 25.00 O ATOM 0 H TYR A 649 14.890 1.221 5.009 1.00 25.00 H new ATOM 0 HA TYR A 649 13.207 1.556 2.792 1.00 25.00 H new ATOM 0 HB2 TYR A 649 15.091 0.016 2.858 1.00 25.00 H new ATOM 0 HB3 TYR A 649 14.409 -0.857 4.215 1.00 25.00 H new ATOM 0 HD1 TYR A 649 13.963 -0.213 0.561 1.00 25.00 H new ATOM 0 HD2 TYR A 649 12.929 -2.667 3.888 1.00 25.00 H new ATOM 0 HE1 TYR A 649 12.952 -1.859 -0.960 1.00 25.00 H new ATOM 0 HE2 TYR A 649 11.917 -4.303 2.376 1.00 25.00 H new ATOM 0 HH TYR A 649 11.604 -4.948 0.443 1.00 25.00 H new ATOM 1037 N TYR A 650 11.739 -0.091 5.249 1.00 25.00 N ATOM 1038 CA TYR A 650 10.439 -0.417 5.848 1.00 25.00 C ATOM 1039 C TYR A 650 9.627 0.830 6.253 1.00 25.00 C ATOM 1040 O TYR A 650 8.416 0.736 6.475 1.00 25.00 O ATOM 1041 CB TYR A 650 10.652 -1.311 7.078 1.00 25.00 C ATOM 1042 CG TYR A 650 11.177 -2.701 6.760 1.00 25.00 C ATOM 1043 CD1 TYR A 650 11.193 -3.189 5.455 1.00 25.00 C ATOM 1044 CD2 TYR A 650 11.651 -3.531 7.772 1.00 25.00 C ATOM 1045 CE1 TYR A 650 11.663 -4.453 5.170 1.00 25.00 C ATOM 1046 CE2 TYR A 650 12.124 -4.800 7.492 1.00 25.00 C ATOM 1047 CZ TYR A 650 12.153 -5.240 6.167 1.00 25.00 C ATOM 1048 OH TYR A 650 12.590 -6.521 5.913 1.00 25.00 O ATOM 0 H TYR A 650 12.536 -0.384 5.814 1.00 25.00 H new ATOM 0 HA TYR A 650 9.860 -0.938 5.086 1.00 25.00 H new ATOM 0 HB2 TYR A 650 11.351 -0.818 7.754 1.00 25.00 H new ATOM 0 HB3 TYR A 650 9.706 -1.406 7.611 1.00 25.00 H new ATOM 0 HD1 TYR A 650 10.830 -2.565 4.652 1.00 25.00 H new ATOM 0 HD2 TYR A 650 11.649 -3.178 8.793 1.00 25.00 H new ATOM 0 HE1 TYR A 650 11.643 -4.820 4.154 1.00 25.00 H new ATOM 0 HE2 TYR A 650 12.467 -5.443 8.289 1.00 25.00 H new ATOM 0 HH TYR A 650 12.906 -6.930 6.746 1.00 25.00 H new ATOM 1058 N HIS A 651 10.298 1.992 6.339 1.00 25.00 N ATOM 1059 CA HIS A 651 9.660 3.233 6.802 1.00 25.00 C ATOM 1060 C HIS A 651 8.930 3.974 5.670 1.00 25.00 C ATOM 1061 O HIS A 651 7.946 4.671 5.934 1.00 25.00 O ATOM 1062 CB HIS A 651 10.700 4.149 7.473 1.00 25.00 C ATOM 1063 CG HIS A 651 10.133 5.421 8.045 1.00 25.00 C ATOM 1064 ND1 HIS A 651 10.394 6.667 7.515 1.00 25.00 N ATOM 1065 CD2 HIS A 651 9.326 5.633 9.116 1.00 25.00 C ATOM 1066 CE1 HIS A 651 9.776 7.589 8.234 1.00 25.00 C ATOM 1067 NE2 HIS A 651 9.122 6.987 9.209 1.00 25.00 N ATOM 0 H HIS A 651 11.283 2.096 6.093 1.00 25.00 H new ATOM 0 HA HIS A 651 8.903 2.955 7.536 1.00 25.00 H new ATOM 0 HB2 HIS A 651 11.193 3.594 8.271 1.00 25.00 H new ATOM 0 HB3 HIS A 651 11.467 4.404 6.742 1.00 25.00 H new ATOM 0 HD2 HIS A 651 8.920 4.877 9.772 1.00 25.00 H new ATOM 0 HE1 HIS A 651 9.802 8.654 8.054 1.00 25.00 H new ATOM 0 HE2 HIS A 651 8.556 7.453 9.918 1.00 25.00 H new ATOM 1076 N LEU A 652 9.406 3.830 4.416 1.00 25.00 N ATOM 1077 CA LEU A 652 8.728 4.421 3.259 1.00 25.00 C ATOM 1078 C LEU A 652 7.364 3.760 2.990 1.00 25.00 C ATOM 1079 O LEU A 652 6.461 4.403 2.453 1.00 25.00 O ATOM 1080 CB LEU A 652 9.598 4.307 1.995 1.00 25.00 C ATOM 1081 CG LEU A 652 10.958 5.052 1.939 1.00 25.00 C ATOM 1082 CD1 LEU A 652 11.810 4.647 0.741 1.00 25.00 C ATOM 1083 CD2 LEU A 652 10.773 6.561 1.991 1.00 25.00 C ATOM 0 H LEU A 652 10.253 3.311 4.186 1.00 25.00 H new ATOM 0 HA LEU A 652 8.563 5.472 3.498 1.00 25.00 H new ATOM 0 HB2 LEU A 652 9.797 3.248 1.829 1.00 25.00 H new ATOM 0 HB3 LEU A 652 8.999 4.654 1.153 1.00 25.00 H new ATOM 0 HG LEU A 652 11.505 4.745 2.830 1.00 25.00 H new ATOM 0 HD11 LEU A 652 12.748 5.202 0.757 1.00 25.00 H new ATOM 0 HD12 LEU A 652 12.020 3.578 0.788 1.00 25.00 H new ATOM 0 HD13 LEU A 652 11.272 4.871 -0.180 1.00 25.00 H new ATOM 0 HD21 LEU A 652 11.747 7.049 1.950 1.00 25.00 H new ATOM 0 HD22 LEU A 652 10.170 6.883 1.142 1.00 25.00 H new ATOM 0 HD23 LEU A 652 10.270 6.834 2.918 1.00 25.00 H new ATOM 1095 N LEU A 653 7.231 2.476 3.365 1.00 25.00 N ATOM 1096 CA LEU A 653 5.983 1.724 3.175 1.00 25.00 C ATOM 1097 C LEU A 653 5.029 1.900 4.359 1.00 25.00 C ATOM 1098 O LEU A 653 3.807 1.846 4.188 1.00 25.00 O ATOM 1099 CB LEU A 653 6.284 0.230 2.971 1.00 25.00 C ATOM 1100 CG LEU A 653 6.306 -0.636 4.243 1.00 25.00 C ATOM 1101 CD1 LEU A 653 5.124 -1.576 4.261 1.00 25.00 C ATOM 1102 CD2 LEU A 653 7.586 -1.453 4.348 1.00 25.00 C ATOM 0 H LEU A 653 7.978 1.937 3.803 1.00 25.00 H new ATOM 0 HA LEU A 653 5.496 2.122 2.285 1.00 25.00 H new ATOM 0 HB2 LEU A 653 5.539 -0.180 2.290 1.00 25.00 H new ATOM 0 HB3 LEU A 653 7.252 0.139 2.477 1.00 25.00 H new ATOM 0 HG LEU A 653 6.256 0.044 5.093 1.00 25.00 H new ATOM 0 HD11 LEU A 653 5.154 -2.181 5.167 1.00 25.00 H new ATOM 0 HD12 LEU A 653 4.200 -0.999 4.241 1.00 25.00 H new ATOM 0 HD13 LEU A 653 5.164 -2.227 3.388 1.00 25.00 H new ATOM 0 HD21 LEU A 653 7.563 -2.051 5.259 1.00 25.00 H new ATOM 0 HD22 LEU A 653 7.669 -2.112 3.484 1.00 25.00 H new ATOM 0 HD23 LEU A 653 8.445 -0.782 4.376 1.00 25.00 H new ATOM 1114 N ALA A 654 5.596 2.115 5.557 1.00 25.00 N ATOM 1115 CA ALA A 654 4.808 2.321 6.778 1.00 25.00 C ATOM 1116 C ALA A 654 4.204 3.729 6.832 1.00 25.00 C ATOM 1117 O ALA A 654 3.181 3.942 7.491 1.00 25.00 O ATOM 1118 CB ALA A 654 5.664 2.071 8.008 1.00 25.00 C ATOM 0 H ALA A 654 6.605 2.150 5.704 1.00 25.00 H new ATOM 0 HA ALA A 654 3.985 1.606 6.763 1.00 25.00 H new ATOM 0 HB1 ALA A 654 5.066 2.228 8.906 1.00 25.00 H new ATOM 0 HB2 ALA A 654 6.033 1.045 7.992 1.00 25.00 H new ATOM 0 HB3 ALA A 654 6.508 2.760 8.010 1.00 25.00 H new ATOM 1124 N GLU A 655 4.841 4.683 6.130 1.00 25.00 N ATOM 1125 CA GLU A 655 4.339 6.063 6.057 1.00 25.00 C ATOM 1126 C GLU A 655 3.183 6.205 5.055 1.00 25.00 C ATOM 1127 O GLU A 655 2.297 7.030 5.261 1.00 25.00 O ATOM 1128 CB GLU A 655 5.475 7.064 5.748 1.00 25.00 C ATOM 1129 CG GLU A 655 5.054 8.531 5.686 1.00 25.00 C ATOM 1130 CD GLU A 655 6.211 9.458 5.368 1.00 25.00 C ATOM 1131 OE1 GLU A 655 6.864 9.255 4.322 1.00 25.00 O ATOM 1132 OE2 GLU A 655 6.464 10.386 6.163 1.00 25.00 O ATOM 0 H GLU A 655 5.702 4.522 5.607 1.00 25.00 H new ATOM 0 HA GLU A 655 3.941 6.307 7.042 1.00 25.00 H new ATOM 0 HB2 GLU A 655 6.248 6.957 6.509 1.00 25.00 H new ATOM 0 HB3 GLU A 655 5.927 6.792 4.794 1.00 25.00 H new ATOM 0 HG2 GLU A 655 4.279 8.651 4.929 1.00 25.00 H new ATOM 0 HG3 GLU A 655 4.614 8.819 6.641 1.00 25.00 H new ATOM 1139 N LYS A 656 3.197 5.392 3.977 1.00 25.00 N ATOM 1140 CA LYS A 656 2.045 5.291 3.051 1.00 25.00 C ATOM 1141 C LYS A 656 0.880 4.607 3.774 1.00 25.00 C ATOM 1142 O LYS A 656 -0.284 4.898 3.514 1.00 25.00 O ATOM 1143 CB LYS A 656 2.381 4.459 1.791 1.00 25.00 C ATOM 1144 CG LYS A 656 3.244 5.156 0.726 1.00 25.00 C ATOM 1145 CD LYS A 656 3.510 4.279 -0.505 1.00 25.00 C ATOM 1146 CE LYS A 656 4.101 5.071 -1.673 1.00 25.00 C ATOM 1147 NZ LYS A 656 5.485 5.550 -1.396 1.00 25.00 N ATOM 0 H LYS A 656 3.988 4.799 3.726 1.00 25.00 H new ATOM 0 HA LYS A 656 1.786 6.303 2.739 1.00 25.00 H new ATOM 0 HB2 LYS A 656 2.894 3.551 2.107 1.00 25.00 H new ATOM 0 HB3 LYS A 656 1.445 4.150 1.325 1.00 25.00 H new ATOM 0 HG2 LYS A 656 2.749 6.074 0.410 1.00 25.00 H new ATOM 0 HG3 LYS A 656 4.196 5.445 1.171 1.00 25.00 H new ATOM 0 HD2 LYS A 656 4.194 3.475 -0.233 1.00 25.00 H new ATOM 0 HD3 LYS A 656 2.578 3.812 -0.822 1.00 25.00 H new ATOM 0 HE2 LYS A 656 4.108 4.445 -2.565 1.00 25.00 H new ATOM 0 HE3 LYS A 656 3.460 5.926 -1.889 1.00 25.00 H new ATOM 0 HZ1 LYS A 656 5.840 6.080 -2.217 1.00 25.00 H new ATOM 0 HZ2 LYS A 656 5.477 6.170 -0.561 1.00 25.00 H new ATOM 0 HZ3 LYS A 656 6.105 4.735 -1.216 1.00 25.00 H new ATOM 1161 N ILE A 657 1.230 3.727 4.727 1.00 25.00 N ATOM 1162 CA ILE A 657 0.261 2.924 5.480 1.00 25.00 C ATOM 1163 C ILE A 657 -0.562 3.803 6.444 1.00 25.00 C ATOM 1164 O ILE A 657 -1.763 3.589 6.607 1.00 25.00 O ATOM 1165 CB ILE A 657 1.007 1.747 6.214 1.00 25.00 C ATOM 1166 CG1 ILE A 657 1.057 0.519 5.268 1.00 25.00 C ATOM 1167 CG2 ILE A 657 0.394 1.388 7.582 1.00 25.00 C ATOM 1168 CD1 ILE A 657 1.967 -0.626 5.707 1.00 25.00 C ATOM 0 H ILE A 657 2.199 3.554 4.995 1.00 25.00 H new ATOM 0 HA ILE A 657 -0.457 2.482 4.790 1.00 25.00 H new ATOM 0 HB ILE A 657 2.019 2.082 6.441 1.00 25.00 H new ATOM 0 HG12 ILE A 657 0.045 0.130 5.156 1.00 25.00 H new ATOM 0 HG13 ILE A 657 1.380 0.857 4.283 1.00 25.00 H new ATOM 0 HG21 ILE A 657 0.958 0.570 8.030 1.00 25.00 H new ATOM 0 HG22 ILE A 657 0.433 2.258 8.238 1.00 25.00 H new ATOM 0 HG23 ILE A 657 -0.643 1.082 7.447 1.00 25.00 H new ATOM 0 HD11 ILE A 657 1.923 -1.429 4.971 1.00 25.00 H new ATOM 0 HD12 ILE A 657 2.992 -0.265 5.789 1.00 25.00 H new ATOM 0 HD13 ILE A 657 1.637 -1.003 6.675 1.00 25.00 H new ATOM 1180 N TYR A 658 0.099 4.781 7.069 1.00 25.00 N ATOM 1181 CA TYR A 658 -0.571 5.725 7.968 1.00 25.00 C ATOM 1182 C TYR A 658 -1.218 6.862 7.163 1.00 25.00 C ATOM 1183 O TYR A 658 -2.230 7.431 7.573 1.00 25.00 O ATOM 1184 CB TYR A 658 0.445 6.297 8.971 1.00 25.00 C ATOM 1185 CG TYR A 658 0.948 5.304 10.009 1.00 25.00 C ATOM 1186 CD1 TYR A 658 2.276 4.882 10.014 1.00 25.00 C ATOM 1187 CD2 TYR A 658 0.096 4.791 10.981 1.00 25.00 C ATOM 1188 CE1 TYR A 658 2.736 3.979 10.954 1.00 25.00 C ATOM 1189 CE2 TYR A 658 0.550 3.888 11.925 1.00 25.00 C ATOM 1190 CZ TYR A 658 1.869 3.488 11.909 1.00 25.00 C ATOM 1191 OH TYR A 658 2.323 2.587 12.846 1.00 25.00 O ATOM 0 H TYR A 658 1.101 4.940 6.968 1.00 25.00 H new ATOM 0 HA TYR A 658 -1.354 5.199 8.514 1.00 25.00 H new ATOM 0 HB2 TYR A 658 1.300 6.687 8.418 1.00 25.00 H new ATOM 0 HB3 TYR A 658 -0.012 7.141 9.488 1.00 25.00 H new ATOM 0 HD1 TYR A 658 2.958 5.267 9.270 1.00 25.00 H new ATOM 0 HD2 TYR A 658 -0.938 5.103 10.999 1.00 25.00 H new ATOM 0 HE1 TYR A 658 3.768 3.660 10.941 1.00 25.00 H new ATOM 0 HE2 TYR A 658 -0.126 3.498 12.672 1.00 25.00 H new ATOM 0 HH TYR A 658 1.588 2.341 13.446 1.00 25.00 H new ATOM 1201 N LYS A 659 -0.612 7.159 6.008 1.00 25.00 N ATOM 1202 CA LYS A 659 -1.037 8.251 5.130 1.00 25.00 C ATOM 1203 C LYS A 659 -2.308 7.897 4.321 1.00 25.00 C ATOM 1204 O LYS A 659 -3.139 8.776 4.067 1.00 25.00 O ATOM 1205 CB LYS A 659 0.169 8.645 4.237 1.00 25.00 C ATOM 1206 CG LYS A 659 0.027 9.895 3.355 1.00 25.00 C ATOM 1207 CD LYS A 659 -0.551 9.607 1.960 1.00 25.00 C ATOM 1208 CE LYS A 659 -0.681 10.859 1.106 1.00 25.00 C ATOM 1209 NZ LYS A 659 -1.589 10.661 -0.060 1.00 25.00 N ATOM 0 H LYS A 659 0.194 6.643 5.655 1.00 25.00 H new ATOM 0 HA LYS A 659 -1.332 9.114 5.727 1.00 25.00 H new ATOM 0 HB2 LYS A 659 1.033 8.789 4.885 1.00 25.00 H new ATOM 0 HB3 LYS A 659 0.395 7.800 3.587 1.00 25.00 H new ATOM 0 HG2 LYS A 659 -0.615 10.615 3.862 1.00 25.00 H new ATOM 0 HG3 LYS A 659 1.005 10.363 3.243 1.00 25.00 H new ATOM 0 HD2 LYS A 659 0.089 8.888 1.448 1.00 25.00 H new ATOM 0 HD3 LYS A 659 -1.531 9.142 2.067 1.00 25.00 H new ATOM 0 HE2 LYS A 659 -1.057 11.677 1.721 1.00 25.00 H new ATOM 0 HE3 LYS A 659 0.305 11.156 0.749 1.00 25.00 H new ATOM 0 HZ1 LYS A 659 -1.031 10.658 -0.938 1.00 25.00 H new ATOM 0 HZ2 LYS A 659 -2.086 9.753 0.038 1.00 25.00 H new ATOM 0 HZ3 LYS A 659 -2.284 11.434 -0.094 1.00 25.00 H new ATOM 1223 N ILE A 660 -2.461 6.621 3.932 1.00 25.00 N ATOM 1224 CA ILE A 660 -3.673 6.160 3.223 1.00 25.00 C ATOM 1225 C ILE A 660 -4.848 6.040 4.215 1.00 25.00 C ATOM 1226 O ILE A 660 -6.011 6.229 3.847 1.00 25.00 O ATOM 1227 CB ILE A 660 -3.429 4.800 2.487 1.00 25.00 C ATOM 1228 CG1 ILE A 660 -2.420 4.988 1.337 1.00 25.00 C ATOM 1229 CG2 ILE A 660 -4.744 4.223 1.945 1.00 25.00 C ATOM 1230 CD1 ILE A 660 -1.888 3.690 0.750 1.00 25.00 C ATOM 0 H ILE A 660 -1.767 5.891 4.094 1.00 25.00 H new ATOM 0 HA ILE A 660 -3.923 6.900 2.462 1.00 25.00 H new ATOM 0 HB ILE A 660 -3.018 4.094 3.209 1.00 25.00 H new ATOM 0 HG12 ILE A 660 -2.896 5.564 0.543 1.00 25.00 H new ATOM 0 HG13 ILE A 660 -1.580 5.580 1.700 1.00 25.00 H new ATOM 0 HG21 ILE A 660 -4.545 3.278 1.439 1.00 25.00 H new ATOM 0 HG22 ILE A 660 -5.435 4.054 2.771 1.00 25.00 H new ATOM 0 HG23 ILE A 660 -5.187 4.927 1.240 1.00 25.00 H new ATOM 0 HD11 ILE A 660 -1.185 3.915 -0.052 1.00 25.00 H new ATOM 0 HD12 ILE A 660 -1.380 3.120 1.528 1.00 25.00 H new ATOM 0 HD13 ILE A 660 -2.717 3.104 0.353 1.00 25.00 H new ATOM 1242 N GLN A 661 -4.507 5.735 5.472 1.00 25.00 N ATOM 1243 CA GLN A 661 -5.467 5.672 6.585 1.00 25.00 C ATOM 1244 C GLN A 661 -6.130 7.033 6.875 1.00 25.00 C ATOM 1245 O GLN A 661 -7.194 7.087 7.497 1.00 25.00 O ATOM 1246 CB GLN A 661 -4.755 5.152 7.841 1.00 25.00 C ATOM 1247 CG GLN A 661 -4.585 3.628 7.888 1.00 25.00 C ATOM 1248 CD GLN A 661 -3.680 3.107 9.011 1.00 25.00 C ATOM 1249 OE1 GLN A 661 -3.217 3.885 9.844 1.00 25.00 O ATOM 1250 NE2 GLN A 661 -3.440 1.796 9.063 1.00 25.00 N ATOM 0 H GLN A 661 -3.549 5.523 5.750 1.00 25.00 H new ATOM 0 HA GLN A 661 -6.265 4.989 6.294 1.00 25.00 H new ATOM 0 HB2 GLN A 661 -3.771 5.617 7.905 1.00 25.00 H new ATOM 0 HB3 GLN A 661 -5.316 5.470 8.720 1.00 25.00 H new ATOM 0 HG2 GLN A 661 -5.569 3.172 7.995 1.00 25.00 H new ATOM 0 HG3 GLN A 661 -4.181 3.294 6.933 1.00 25.00 H new ATOM 0 HE21 GLN A 661 -3.838 1.176 8.358 1.00 25.00 H new ATOM 0 HE22 GLN A 661 -2.858 1.413 9.808 1.00 25.00 H new ATOM 1259 N LYS A 662 -5.493 8.123 6.410 1.00 25.00 N ATOM 1260 CA LYS A 662 -6.004 9.494 6.609 1.00 25.00 C ATOM 1261 C LYS A 662 -7.148 9.813 5.638 1.00 25.00 C ATOM 1262 O LYS A 662 -8.158 10.406 6.026 1.00 25.00 O ATOM 1263 CB LYS A 662 -4.884 10.540 6.400 1.00 25.00 C ATOM 1264 CG LYS A 662 -5.249 12.018 6.647 1.00 25.00 C ATOM 1265 CD LYS A 662 -4.076 12.977 6.543 1.00 25.00 C ATOM 1266 CE LYS A 662 -4.488 14.414 6.798 1.00 25.00 C ATOM 1267 NZ LYS A 662 -3.360 15.367 6.606 1.00 25.00 N ATOM 0 H LYS A 662 -4.617 8.081 5.890 1.00 25.00 H new ATOM 0 HA LYS A 662 -6.372 9.544 7.634 1.00 25.00 H new ATOM 0 HB2 LYS A 662 -4.053 10.282 7.057 1.00 25.00 H new ATOM 0 HB3 LYS A 662 -4.521 10.448 5.376 1.00 25.00 H new ATOM 0 HG2 LYS A 662 -6.012 12.317 5.928 1.00 25.00 H new ATOM 0 HG3 LYS A 662 -5.692 12.110 7.639 1.00 25.00 H new ATOM 0 HD2 LYS A 662 -3.308 12.688 7.260 1.00 25.00 H new ATOM 0 HD3 LYS A 662 -3.631 12.899 5.551 1.00 25.00 H new ATOM 0 HE2 LYS A 662 -5.304 14.680 6.127 1.00 25.00 H new ATOM 0 HE3 LYS A 662 -4.869 14.506 7.815 1.00 25.00 H new ATOM 0 HZ1 LYS A 662 -3.689 16.336 6.791 1.00 25.00 H new ATOM 0 HZ2 LYS A 662 -2.590 15.131 7.264 1.00 25.00 H new ATOM 0 HZ3 LYS A 662 -3.012 15.300 5.628 1.00 25.00 H new ATOM 1281 N GLU A 663 -6.961 9.408 4.376 1.00 25.00 N ATOM 1282 CA GLU A 663 -7.898 9.692 3.274 1.00 25.00 C ATOM 1283 C GLU A 663 -9.265 9.037 3.498 1.00 25.00 C ATOM 1284 O GLU A 663 -10.303 9.657 3.256 1.00 25.00 O ATOM 1285 CB GLU A 663 -7.305 9.193 1.948 1.00 25.00 C ATOM 1286 CG GLU A 663 -6.153 10.041 1.434 1.00 25.00 C ATOM 1287 CD GLU A 663 -5.208 9.280 0.529 1.00 25.00 C ATOM 1288 OE1 GLU A 663 -5.010 8.069 0.763 1.00 25.00 O ATOM 1289 OE2 GLU A 663 -4.662 9.895 -0.412 1.00 25.00 O ATOM 0 H GLU A 663 -6.147 8.867 4.084 1.00 25.00 H new ATOM 0 HA GLU A 663 -8.046 10.771 3.239 1.00 25.00 H new ATOM 0 HB2 GLU A 663 -6.959 8.168 2.078 1.00 25.00 H new ATOM 0 HB3 GLU A 663 -8.092 9.171 1.194 1.00 25.00 H new ATOM 0 HG2 GLU A 663 -6.555 10.897 0.891 1.00 25.00 H new ATOM 0 HG3 GLU A 663 -5.594 10.435 2.283 1.00 25.00 H new ATOM 1296 N LEU A 664 -9.245 7.778 3.961 1.00 25.00 N ATOM 1297 CA LEU A 664 -10.474 7.037 4.304 1.00 25.00 C ATOM 1298 C LEU A 664 -11.208 7.644 5.516 1.00 25.00 C ATOM 1299 O LEU A 664 -12.390 7.364 5.733 1.00 25.00 O ATOM 1300 CB LEU A 664 -10.169 5.543 4.578 1.00 25.00 C ATOM 1301 CG LEU A 664 -9.674 4.673 3.392 1.00 25.00 C ATOM 1302 CD1 LEU A 664 -9.301 3.260 3.836 1.00 25.00 C ATOM 1303 CD2 LEU A 664 -10.695 4.624 2.263 1.00 25.00 C ATOM 0 H LEU A 664 -8.387 7.247 4.108 1.00 25.00 H new ATOM 0 HA LEU A 664 -11.130 7.118 3.438 1.00 25.00 H new ATOM 0 HB2 LEU A 664 -9.417 5.494 5.365 1.00 25.00 H new ATOM 0 HB3 LEU A 664 -11.075 5.084 4.974 1.00 25.00 H new ATOM 0 HG LEU A 664 -8.772 5.153 3.012 1.00 25.00 H new ATOM 0 HD11 LEU A 664 -8.960 2.686 2.974 1.00 25.00 H new ATOM 0 HD12 LEU A 664 -8.503 3.310 4.577 1.00 25.00 H new ATOM 0 HD13 LEU A 664 -10.173 2.774 4.274 1.00 25.00 H new ATOM 0 HD21 LEU A 664 -10.311 4.005 1.452 1.00 25.00 H new ATOM 0 HD22 LEU A 664 -11.627 4.198 2.634 1.00 25.00 H new ATOM 0 HD23 LEU A 664 -10.878 5.633 1.894 1.00 25.00 H new ATOM 1315 N GLU A 665 -10.493 8.456 6.310 1.00 25.00 N ATOM 1316 CA GLU A 665 -11.096 9.178 7.442 1.00 25.00 C ATOM 1317 C GLU A 665 -11.702 10.516 6.995 1.00 25.00 C ATOM 1318 O GLU A 665 -12.523 11.100 7.709 1.00 25.00 O ATOM 1319 CB GLU A 665 -10.063 9.414 8.552 1.00 25.00 C ATOM 1320 CG GLU A 665 -9.679 8.157 9.322 1.00 25.00 C ATOM 1321 CD GLU A 665 -9.822 8.323 10.823 1.00 25.00 C ATOM 1322 OE1 GLU A 665 -9.527 9.426 11.328 1.00 25.00 O ATOM 1323 OE2 GLU A 665 -10.230 7.349 11.491 1.00 25.00 O ATOM 0 H GLU A 665 -9.495 8.629 6.189 1.00 25.00 H new ATOM 0 HA GLU A 665 -11.899 8.554 7.835 1.00 25.00 H new ATOM 0 HB2 GLU A 665 -9.164 9.846 8.111 1.00 25.00 H new ATOM 0 HB3 GLU A 665 -10.460 10.149 9.252 1.00 25.00 H new ATOM 0 HG2 GLU A 665 -10.305 7.328 8.991 1.00 25.00 H new ATOM 0 HG3 GLU A 665 -8.648 7.892 9.086 1.00 25.00 H new ATOM 1330 N GLU A 666 -11.291 10.991 5.804 1.00 25.00 N ATOM 1331 CA GLU A 666 -11.827 12.229 5.212 1.00 25.00 C ATOM 1332 C GLU A 666 -13.245 12.019 4.661 1.00 25.00 C ATOM 1333 O GLU A 666 -14.019 12.973 4.540 1.00 25.00 O ATOM 1334 CB GLU A 666 -10.906 12.735 4.091 1.00 25.00 C ATOM 1335 CG GLU A 666 -9.619 13.384 4.587 1.00 25.00 C ATOM 1336 CD GLU A 666 -9.875 14.591 5.469 1.00 25.00 C ATOM 1337 OE1 GLU A 666 -10.577 15.520 5.017 1.00 25.00 O ATOM 1338 OE2 GLU A 666 -9.372 14.608 6.614 1.00 25.00 O ATOM 0 H GLU A 666 -10.584 10.531 5.230 1.00 25.00 H new ATOM 0 HA GLU A 666 -11.873 12.976 6.004 1.00 25.00 H new ATOM 0 HB2 GLU A 666 -10.651 11.899 3.440 1.00 25.00 H new ATOM 0 HB3 GLU A 666 -11.453 13.456 3.484 1.00 25.00 H new ATOM 0 HG2 GLU A 666 -9.037 12.649 5.144 1.00 25.00 H new ATOM 0 HG3 GLU A 666 -9.016 13.686 3.731 1.00 25.00 H new ATOM 1345 N LYS A 667 -13.570 10.758 4.331 1.00 25.00 N ATOM 1346 CA LYS A 667 -14.912 10.377 3.873 1.00 25.00 C ATOM 1347 C LYS A 667 -15.852 10.097 5.063 1.00 25.00 C ATOM 1348 O LYS A 667 -17.076 10.073 4.908 1.00 25.00 O ATOM 1349 CB LYS A 667 -14.842 9.168 2.921 1.00 25.00 C ATOM 1350 CG LYS A 667 -14.085 9.438 1.624 1.00 25.00 C ATOM 1351 CD LYS A 667 -14.646 10.615 0.816 1.00 25.00 C ATOM 1352 CE LYS A 667 -13.707 11.094 -0.291 1.00 25.00 C ATOM 1353 NZ LYS A 667 -12.442 11.672 0.247 1.00 25.00 N ATOM 0 H LYS A 667 -12.912 9.980 4.375 1.00 25.00 H new ATOM 0 HA LYS A 667 -15.328 11.218 3.319 1.00 25.00 H new ATOM 0 HB2 LYS A 667 -14.365 8.337 3.441 1.00 25.00 H new ATOM 0 HB3 LYS A 667 -15.856 8.852 2.678 1.00 25.00 H new ATOM 0 HG2 LYS A 667 -13.039 9.636 1.859 1.00 25.00 H new ATOM 0 HG3 LYS A 667 -14.109 8.540 1.006 1.00 25.00 H new ATOM 0 HD2 LYS A 667 -15.598 10.321 0.373 1.00 25.00 H new ATOM 0 HD3 LYS A 667 -14.852 11.445 1.492 1.00 25.00 H new ATOM 0 HE2 LYS A 667 -13.470 10.258 -0.950 1.00 25.00 H new ATOM 0 HE3 LYS A 667 -14.217 11.843 -0.897 1.00 25.00 H new ATOM 0 HZ1 LYS A 667 -12.207 12.540 -0.276 1.00 25.00 H new ATOM 0 HZ2 LYS A 667 -12.564 11.898 1.255 1.00 25.00 H new ATOM 0 HZ3 LYS A 667 -11.671 10.982 0.138 1.00 25.00 H new ATOM 1367 N ARG A 668 -15.254 9.883 6.245 1.00 25.00 N ATOM 1368 CA ARG A 668 -15.999 9.563 7.468 1.00 25.00 C ATOM 1369 C ARG A 668 -16.587 10.831 8.119 1.00 25.00 C ATOM 1370 O ARG A 668 -17.580 10.753 8.850 1.00 25.00 O ATOM 1371 CB ARG A 668 -15.071 8.839 8.459 1.00 25.00 C ATOM 1372 CG ARG A 668 -14.671 7.435 8.036 1.00 25.00 C ATOM 1373 CD ARG A 668 -13.773 6.810 9.081 1.00 25.00 C ATOM 1374 NE ARG A 668 -13.279 5.490 8.672 1.00 25.00 N ATOM 1375 CZ ARG A 668 -12.301 4.811 9.293 1.00 25.00 C ATOM 1376 NH1 ARG A 668 -11.692 5.307 10.370 1.00 25.00 N ATOM 1377 NH2 ARG A 668 -11.931 3.625 8.829 1.00 25.00 N ATOM 0 H ARG A 668 -14.244 9.927 6.378 1.00 25.00 H new ATOM 0 HA ARG A 668 -16.832 8.912 7.202 1.00 25.00 H new ATOM 0 HB2 ARG A 668 -14.169 9.435 8.594 1.00 25.00 H new ATOM 0 HB3 ARG A 668 -15.566 8.786 9.429 1.00 25.00 H new ATOM 0 HG2 ARG A 668 -15.561 6.822 7.897 1.00 25.00 H new ATOM 0 HG3 ARG A 668 -14.155 7.470 7.076 1.00 25.00 H new ATOM 0 HD2 ARG A 668 -12.926 7.470 9.271 1.00 25.00 H new ATOM 0 HD3 ARG A 668 -14.321 6.716 10.019 1.00 25.00 H new ATOM 0 HE ARG A 668 -13.710 5.056 7.856 1.00 25.00 H new ATOM 0 HH11 ARG A 668 -11.967 6.218 10.737 1.00 25.00 H new ATOM 0 HH12 ARG A 668 -10.951 4.775 10.827 1.00 25.00 H new ATOM 0 HH21 ARG A 668 -12.389 3.234 8.005 1.00 25.00 H new ATOM 0 HH22 ARG A 668 -11.189 3.104 9.296 1.00 25.00 H new ATOM 1391 N ARG A 669 -15.966 11.988 7.842 1.00 25.00 N ATOM 1392 CA ARG A 669 -16.378 13.265 8.437 1.00 25.00 C ATOM 1393 C ARG A 669 -17.403 13.998 7.551 1.00 25.00 C ATOM 1394 O ARG A 669 -18.421 14.484 8.055 1.00 25.00 O ATOM 1395 CB ARG A 669 -15.137 14.146 8.682 1.00 25.00 C ATOM 1396 CG ARG A 669 -14.123 13.560 9.657 1.00 25.00 C ATOM 1397 CD ARG A 669 -12.889 14.434 9.743 1.00 25.00 C ATOM 1398 NE ARG A 669 -11.780 13.760 10.427 1.00 25.00 N ATOM 1399 CZ ARG A 669 -10.553 14.277 10.588 1.00 25.00 C ATOM 1400 NH1 ARG A 669 -10.245 15.484 10.116 1.00 25.00 N ATOM 1401 NH2 ARG A 669 -9.626 13.576 11.229 1.00 25.00 N ATOM 0 H ARG A 669 -15.172 12.063 7.206 1.00 25.00 H new ATOM 0 HA ARG A 669 -16.866 13.059 9.390 1.00 25.00 H new ATOM 0 HB2 ARG A 669 -14.642 14.326 7.728 1.00 25.00 H new ATOM 0 HB3 ARG A 669 -15.465 15.115 9.058 1.00 25.00 H new ATOM 0 HG2 ARG A 669 -14.575 13.464 10.644 1.00 25.00 H new ATOM 0 HG3 ARG A 669 -13.842 12.557 9.336 1.00 25.00 H new ATOM 0 HD2 ARG A 669 -12.576 14.717 8.738 1.00 25.00 H new ATOM 0 HD3 ARG A 669 -13.134 15.355 10.272 1.00 25.00 H new ATOM 0 HE ARG A 669 -11.955 12.830 10.808 1.00 25.00 H new ATOM 0 HH11 ARG A 669 -10.948 16.033 9.622 1.00 25.00 H new ATOM 0 HH12 ARG A 669 -9.306 15.859 10.249 1.00 25.00 H new ATOM 0 HH21 ARG A 669 -9.849 12.651 11.595 1.00 25.00 H new ATOM 0 HH22 ARG A 669 -8.691 13.963 11.355 1.00 25.00 H new ATOM 1415 N SER A 670 -17.126 14.071 6.241 1.00 25.00 N ATOM 1416 CA SER A 670 -17.981 14.807 5.302 1.00 25.00 C ATOM 1417 C SER A 670 -18.916 13.878 4.517 1.00 25.00 C ATOM 1418 O SER A 670 -20.067 14.231 4.254 1.00 25.00 O ATOM 1419 CB SER A 670 -17.127 15.638 4.338 1.00 25.00 C ATOM 1420 OG SER A 670 -16.270 14.816 3.560 1.00 25.00 O ATOM 0 H SER A 670 -16.315 13.628 5.809 1.00 25.00 H new ATOM 0 HA SER A 670 -18.607 15.474 5.894 1.00 25.00 H new ATOM 0 HB2 SER A 670 -17.777 16.214 3.679 1.00 25.00 H new ATOM 0 HB3 SER A 670 -16.531 16.354 4.904 1.00 25.00 H new ATOM 0 HG SER A 670 -15.587 14.416 4.138 1.00 25.00 H new ATOM 1426 N ARG A 671 -18.398 12.683 4.148 1.00 25.00 N ATOM 1427 CA ARG A 671 -19.151 11.629 3.414 1.00 25.00 C ATOM 1428 C ARG A 671 -19.467 12.025 1.956 1.00 25.00 C ATOM 1429 O ARG A 671 -19.988 11.211 1.184 1.00 25.00 O ATOM 1430 CB ARG A 671 -20.431 11.223 4.170 1.00 25.00 C ATOM 1431 CG ARG A 671 -20.175 10.726 5.585 1.00 25.00 C ATOM 1432 CD ARG A 671 -21.471 10.367 6.259 1.00 25.00 C ATOM 1433 NE ARG A 671 -21.287 10.000 7.668 1.00 25.00 N ATOM 1434 CZ ARG A 671 -20.911 8.786 8.098 1.00 25.00 C ATOM 1435 NH1 ARG A 671 -20.659 7.796 7.243 1.00 25.00 N ATOM 1436 NH2 ARG A 671 -20.784 8.564 9.400 1.00 25.00 N ATOM 0 H ARG A 671 -17.435 12.417 4.352 1.00 25.00 H new ATOM 0 HA ARG A 671 -18.495 10.760 3.366 1.00 25.00 H new ATOM 0 HB2 ARG A 671 -21.105 12.079 4.212 1.00 25.00 H new ATOM 0 HB3 ARG A 671 -20.942 10.442 3.607 1.00 25.00 H new ATOM 0 HG2 ARG A 671 -19.519 9.856 5.558 1.00 25.00 H new ATOM 0 HG3 ARG A 671 -19.660 11.496 6.160 1.00 25.00 H new ATOM 0 HD2 ARG A 671 -22.157 11.211 6.193 1.00 25.00 H new ATOM 0 HD3 ARG A 671 -21.935 9.536 5.728 1.00 25.00 H new ATOM 0 HE ARG A 671 -21.457 10.719 8.371 1.00 25.00 H new ATOM 0 HH11 ARG A 671 -20.751 7.953 6.239 1.00 25.00 H new ATOM 0 HH12 ARG A 671 -20.374 6.881 7.592 1.00 25.00 H new ATOM 0 HH21 ARG A 671 -20.972 9.314 10.066 1.00 25.00 H new ATOM 0 HH22 ARG A 671 -20.499 7.644 9.735 1.00 25.00 H new ATOM 1450 N LEU A 672 -19.132 13.265 1.590 1.00 25.00 N ATOM 1451 CA LEU A 672 -19.337 13.769 0.228 1.00 25.00 C ATOM 1452 C LEU A 672 -17.994 14.041 -0.454 1.00 25.00 C ATOM 1453 O LEU A 672 -17.592 13.219 -1.305 1.00 25.00 O ATOM 1454 CB LEU A 672 -20.213 15.053 0.226 1.00 25.00 C ATOM 1455 CG LEU A 672 -21.668 14.954 0.771 1.00 25.00 C ATOM 1456 CD1 LEU A 672 -22.338 16.323 0.868 1.00 25.00 C ATOM 1457 CD2 LEU A 672 -22.523 13.998 -0.055 1.00 25.00 C ATOM 1458 OXT LEU A 672 -17.346 15.060 -0.123 1.00 25.00 O ATOM 0 H LEU A 672 -18.713 13.945 2.225 1.00 25.00 H new ATOM 0 HA LEU A 672 -19.866 12.999 -0.334 1.00 25.00 H new ATOM 0 HB2 LEU A 672 -19.691 15.813 0.808 1.00 25.00 H new ATOM 0 HB3 LEU A 672 -20.266 15.418 -0.800 1.00 25.00 H new ATOM 0 HG LEU A 672 -21.589 14.548 1.780 1.00 25.00 H new ATOM 0 HD11 LEU A 672 -23.351 16.206 1.253 1.00 25.00 H new ATOM 0 HD12 LEU A 672 -21.766 16.961 1.541 1.00 25.00 H new ATOM 0 HD13 LEU A 672 -22.376 16.780 -0.121 1.00 25.00 H new ATOM 0 HD21 LEU A 672 -23.530 13.959 0.360 1.00 25.00 H new ATOM 0 HD22 LEU A 672 -22.569 14.349 -1.086 1.00 25.00 H new ATOM 0 HD23 LEU A 672 -22.082 13.002 -0.030 1.00 25.00 H new TER 1470 LEU A 672 ATOM 1471 N GLY B 519 -29.445 16.196 -3.426 1.00 25.00 N ATOM 1472 CA GLY B 519 -28.069 16.746 -3.576 1.00 25.00 C ATOM 1473 C GLY B 519 -27.121 15.767 -4.239 1.00 25.00 C ATOM 1474 O GLY B 519 -26.662 14.814 -3.602 1.00 25.00 O ATOM 0 HA2 GLY B 519 -28.110 17.662 -4.165 1.00 25.00 H new ATOM 0 HA3 GLY B 519 -27.680 17.015 -2.594 1.00 25.00 H new ATOM 1480 N SER B 520 -26.832 16.008 -5.522 1.00 25.00 N ATOM 1481 CA SER B 520 -25.934 15.149 -6.298 1.00 25.00 C ATOM 1482 C SER B 520 -24.556 15.815 -6.487 1.00 25.00 C ATOM 1483 O SER B 520 -24.494 16.986 -6.877 1.00 25.00 O ATOM 1484 CB SER B 520 -26.558 14.818 -7.661 1.00 25.00 C ATOM 1485 OG SER B 520 -25.620 14.195 -8.524 1.00 25.00 O ATOM 0 H SER B 520 -27.210 16.796 -6.047 1.00 25.00 H new ATOM 0 HA SER B 520 -25.789 14.222 -5.743 1.00 25.00 H new ATOM 0 HB2 SER B 520 -27.416 14.161 -7.520 1.00 25.00 H new ATOM 0 HB3 SER B 520 -26.929 15.732 -8.124 1.00 25.00 H new ATOM 0 HG SER B 520 -26.048 13.995 -9.383 1.00 25.00 H new ATOM 1491 N PRO B 521 -23.423 15.087 -6.213 1.00 25.00 N ATOM 1492 CA PRO B 521 -22.062 15.655 -6.349 1.00 25.00 C ATOM 1493 C PRO B 521 -21.628 15.858 -7.810 1.00 25.00 C ATOM 1494 O PRO B 521 -21.831 14.978 -8.654 1.00 25.00 O ATOM 1495 CB PRO B 521 -21.179 14.609 -5.654 1.00 25.00 C ATOM 1496 CG PRO B 521 -21.939 13.341 -5.756 1.00 25.00 C ATOM 1497 CD PRO B 521 -23.368 13.674 -5.733 1.00 25.00 C ATOM 0 HA PRO B 521 -21.996 16.653 -5.915 1.00 25.00 H new ATOM 0 HB2 PRO B 521 -20.207 14.527 -6.140 1.00 25.00 H new ATOM 0 HB3 PRO B 521 -20.994 14.876 -4.614 1.00 25.00 H new ATOM 0 HG2 PRO B 521 -21.684 12.815 -6.676 1.00 25.00 H new ATOM 0 HG3 PRO B 521 -21.688 12.677 -4.929 1.00 25.00 H new ATOM 0 HD2 PRO B 521 -23.942 13.011 -6.380 1.00 25.00 H new ATOM 0 HD3 PRO B 521 -23.783 13.578 -4.730 1.00 25.00 H new ATOM 1505 N GLY B 522 -21.035 17.025 -8.084 1.00 25.00 N ATOM 1506 CA GLY B 522 -20.568 17.342 -9.427 1.00 25.00 C ATOM 1507 C GLY B 522 -19.062 17.533 -9.493 1.00 25.00 C ATOM 1508 O GLY B 522 -18.586 18.505 -10.084 1.00 25.00 O ATOM 0 H GLY B 522 -20.870 17.758 -7.394 1.00 25.00 H new ATOM 0 HA2 GLY B 522 -20.859 16.541 -10.107 1.00 25.00 H new ATOM 0 HA3 GLY B 522 -21.061 18.250 -9.774 1.00 25.00 H new ATOM 1512 N TYR B 523 -18.315 16.587 -8.882 1.00 25.00 N ATOM 1513 CA TYR B 523 -16.831 16.603 -8.827 1.00 25.00 C ATOM 1514 C TYR B 523 -16.286 17.863 -8.111 1.00 25.00 C ATOM 1515 O TYR B 523 -16.529 18.983 -8.573 1.00 25.00 O ATOM 1516 CB TYR B 523 -16.200 16.476 -10.233 1.00 25.00 C ATOM 1517 CG TYR B 523 -16.487 15.156 -10.928 1.00 25.00 C ATOM 1518 CD1 TYR B 523 -17.606 15.004 -11.742 1.00 25.00 C ATOM 1519 CD2 TYR B 523 -15.639 14.066 -10.771 1.00 25.00 C ATOM 1520 CE1 TYR B 523 -17.868 13.804 -12.377 1.00 25.00 C ATOM 1521 CE2 TYR B 523 -15.895 12.865 -11.403 1.00 25.00 C ATOM 1522 CZ TYR B 523 -17.009 12.738 -12.204 1.00 25.00 C ATOM 1523 OH TYR B 523 -17.267 11.543 -12.834 1.00 25.00 O ATOM 0 H TYR B 523 -18.726 15.783 -8.408 1.00 25.00 H new ATOM 0 HA TYR B 523 -16.541 15.730 -8.241 1.00 25.00 H new ATOM 0 HB2 TYR B 523 -16.567 17.290 -10.858 1.00 25.00 H new ATOM 0 HB3 TYR B 523 -15.121 16.601 -10.147 1.00 25.00 H new ATOM 0 HD1 TYR B 523 -18.280 15.836 -11.880 1.00 25.00 H new ATOM 0 HD2 TYR B 523 -14.765 14.160 -10.144 1.00 25.00 H new ATOM 0 HE1 TYR B 523 -18.741 13.702 -13.005 1.00 25.00 H new ATOM 0 HE2 TYR B 523 -15.225 12.029 -11.270 1.00 25.00 H new ATOM 0 HH TYR B 523 -16.566 10.896 -12.609 1.00 25.00 H new ATOM 1533 N PRO B 524 -15.538 17.709 -6.967 1.00 25.00 N ATOM 1534 CA PRO B 524 -14.991 18.865 -6.222 1.00 25.00 C ATOM 1535 C PRO B 524 -13.790 19.522 -6.922 1.00 25.00 C ATOM 1536 O PRO B 524 -12.953 18.832 -7.513 1.00 25.00 O ATOM 1537 CB PRO B 524 -14.575 18.254 -4.878 1.00 25.00 C ATOM 1538 CG PRO B 524 -14.320 16.806 -5.173 1.00 25.00 C ATOM 1539 CD PRO B 524 -15.186 16.420 -6.303 1.00 25.00 C ATOM 0 HA PRO B 524 -15.721 19.669 -6.134 1.00 25.00 H new ATOM 0 HB2 PRO B 524 -13.683 18.740 -4.483 1.00 25.00 H new ATOM 0 HB3 PRO B 524 -15.360 18.372 -4.131 1.00 25.00 H new ATOM 0 HG2 PRO B 524 -13.271 16.645 -5.423 1.00 25.00 H new ATOM 0 HG3 PRO B 524 -14.537 16.193 -4.298 1.00 25.00 H new ATOM 0 HD2 PRO B 524 -14.667 15.750 -6.989 1.00 25.00 H new ATOM 0 HD3 PRO B 524 -16.077 15.896 -5.958 1.00 25.00 H new ATOM 1547 N ASN B 525 -13.726 20.857 -6.848 1.00 25.00 N ATOM 1548 CA ASN B 525 -12.646 21.625 -7.476 1.00 25.00 C ATOM 1549 C ASN B 525 -11.830 22.401 -6.435 1.00 25.00 C ATOM 1550 O ASN B 525 -12.389 22.949 -5.480 1.00 25.00 O ATOM 1551 CB ASN B 525 -13.207 22.579 -8.558 1.00 25.00 C ATOM 1552 CG ASN B 525 -13.885 21.877 -9.736 1.00 25.00 C ATOM 1553 OD1 ASN B 525 -13.244 21.179 -10.525 1.00 25.00 O ATOM 1554 ND2 ASN B 525 -15.194 22.065 -9.855 1.00 25.00 N ATOM 0 H ASN B 525 -14.413 21.429 -6.357 1.00 25.00 H new ATOM 0 HA ASN B 525 -11.974 20.916 -7.959 1.00 25.00 H new ATOM 0 HB2 ASN B 525 -13.925 23.254 -8.092 1.00 25.00 H new ATOM 0 HB3 ASN B 525 -12.392 23.195 -8.939 1.00 25.00 H new ATOM 0 HD21 ASN B 525 -15.705 21.624 -10.620 1.00 25.00 H new ATOM 0 HD22 ASN B 525 -15.689 22.650 -9.181 1.00 25.00 H new ATOM 1561 N GLY B 526 -10.506 22.432 -6.632 1.00 25.00 N ATOM 1562 CA GLY B 526 -9.620 23.158 -5.729 1.00 25.00 C ATOM 1563 C GLY B 526 -8.525 22.286 -5.142 1.00 25.00 C ATOM 1564 O GLY B 526 -7.352 22.669 -5.147 1.00 25.00 O ATOM 0 H GLY B 526 -10.032 21.964 -7.405 1.00 25.00 H new ATOM 0 HA2 GLY B 526 -9.165 23.990 -6.267 1.00 25.00 H new ATOM 0 HA3 GLY B 526 -10.209 23.587 -4.918 1.00 25.00 H new ATOM 1568 N LEU B 527 -8.915 21.111 -4.636 1.00 25.00 N ATOM 1569 CA LEU B 527 -7.978 20.176 -4.001 1.00 25.00 C ATOM 1570 C LEU B 527 -7.879 18.854 -4.782 1.00 25.00 C ATOM 1571 O LEU B 527 -7.730 17.773 -4.195 1.00 25.00 O ATOM 1572 CB LEU B 527 -8.353 19.931 -2.500 1.00 25.00 C ATOM 1573 CG LEU B 527 -8.444 21.143 -1.525 1.00 25.00 C ATOM 1574 CD1 LEU B 527 -9.038 20.734 -0.188 1.00 25.00 C ATOM 1575 CD2 LEU B 527 -7.094 21.830 -1.320 1.00 25.00 C ATOM 0 H LEU B 527 -9.881 20.783 -4.654 1.00 25.00 H new ATOM 0 HA LEU B 527 -6.990 20.636 -4.023 1.00 25.00 H new ATOM 0 HB2 LEU B 527 -9.318 19.425 -2.483 1.00 25.00 H new ATOM 0 HB3 LEU B 527 -7.621 19.236 -2.090 1.00 25.00 H new ATOM 0 HG LEU B 527 -9.110 21.866 -1.995 1.00 25.00 H new ATOM 0 HD11 LEU B 527 -9.088 21.602 0.469 1.00 25.00 H new ATOM 0 HD12 LEU B 527 -10.042 20.338 -0.342 1.00 25.00 H new ATOM 0 HD13 LEU B 527 -8.412 19.968 0.269 1.00 25.00 H new ATOM 0 HD21 LEU B 527 -7.213 22.667 -0.632 1.00 25.00 H new ATOM 0 HD22 LEU B 527 -6.382 21.117 -0.904 1.00 25.00 H new ATOM 0 HD23 LEU B 527 -6.723 22.196 -2.277 1.00 25.00 H new ATOM 1587 N LEU B 528 -7.932 18.954 -6.117 1.00 25.00 N ATOM 1588 CA LEU B 528 -7.920 17.777 -6.994 1.00 25.00 C ATOM 1589 C LEU B 528 -6.490 17.229 -7.198 1.00 25.00 C ATOM 1590 O LEU B 528 -6.287 16.253 -7.930 1.00 25.00 O ATOM 1591 CB LEU B 528 -8.564 18.142 -8.350 1.00 25.00 C ATOM 1592 CG LEU B 528 -10.106 18.183 -8.401 1.00 25.00 C ATOM 1593 CD1 LEU B 528 -10.608 19.360 -9.234 1.00 25.00 C ATOM 1594 CD2 LEU B 528 -10.652 16.873 -8.954 1.00 25.00 C ATOM 0 H LEU B 528 -7.984 19.843 -6.615 1.00 25.00 H new ATOM 0 HA LEU B 528 -8.499 16.986 -6.517 1.00 25.00 H new ATOM 0 HB2 LEU B 528 -8.188 19.120 -8.652 1.00 25.00 H new ATOM 0 HB3 LEU B 528 -8.219 17.424 -9.094 1.00 25.00 H new ATOM 0 HG LEU B 528 -10.469 18.318 -7.382 1.00 25.00 H new ATOM 0 HD11 LEU B 528 -11.698 19.357 -9.248 1.00 25.00 H new ATOM 0 HD12 LEU B 528 -10.253 20.293 -8.796 1.00 25.00 H new ATOM 0 HD13 LEU B 528 -10.232 19.271 -10.253 1.00 25.00 H new ATOM 0 HD21 LEU B 528 -11.741 16.916 -8.984 1.00 25.00 H new ATOM 0 HD22 LEU B 528 -10.267 16.715 -9.961 1.00 25.00 H new ATOM 0 HD23 LEU B 528 -10.339 16.049 -8.313 1.00 25.00 H new ATOM 1606 N SER B 529 -5.513 17.857 -6.530 1.00 25.00 N ATOM 1607 CA SER B 529 -4.104 17.461 -6.641 1.00 25.00 C ATOM 1608 C SER B 529 -3.464 17.253 -5.255 1.00 25.00 C ATOM 1609 O SER B 529 -2.233 17.223 -5.126 1.00 25.00 O ATOM 1610 CB SER B 529 -3.323 18.514 -7.446 1.00 25.00 C ATOM 1611 OG SER B 529 -3.367 19.786 -6.819 1.00 25.00 O ATOM 0 H SER B 529 -5.675 18.646 -5.904 1.00 25.00 H new ATOM 0 HA SER B 529 -4.061 16.507 -7.167 1.00 25.00 H new ATOM 0 HB2 SER B 529 -2.286 18.196 -7.553 1.00 25.00 H new ATOM 0 HB3 SER B 529 -3.739 18.588 -8.451 1.00 25.00 H new ATOM 0 HG SER B 529 -2.860 20.432 -7.354 1.00 25.00 H new ATOM 1617 N GLY B 530 -4.312 17.091 -4.229 1.00 25.00 N ATOM 1618 CA GLY B 530 -3.830 16.906 -2.866 1.00 25.00 C ATOM 1619 C GLY B 530 -3.923 15.464 -2.396 1.00 25.00 C ATOM 1620 O GLY B 530 -2.915 14.751 -2.370 1.00 25.00 O ATOM 0 H GLY B 530 -5.328 17.085 -4.323 1.00 25.00 H new ATOM 0 HA2 GLY B 530 -2.793 17.237 -2.805 1.00 25.00 H new ATOM 0 HA3 GLY B 530 -4.407 17.540 -2.193 1.00 25.00 H new ATOM 1624 N ASP B 531 -5.139 15.040 -2.030 1.00 25.00 N ATOM 1625 CA ASP B 531 -5.388 13.683 -1.527 1.00 25.00 C ATOM 1626 C ASP B 531 -6.654 13.104 -2.172 1.00 25.00 C ATOM 1627 O ASP B 531 -7.397 12.328 -1.557 1.00 25.00 O ATOM 1628 CB ASP B 531 -5.521 13.694 0.008 1.00 25.00 C ATOM 1629 CG ASP B 531 -4.203 13.954 0.716 1.00 25.00 C ATOM 1630 OD1 ASP B 531 -3.234 13.209 0.460 1.00 25.00 O ATOM 1631 OD2 ASP B 531 -4.141 14.902 1.527 1.00 25.00 O ATOM 0 H ASP B 531 -5.974 15.624 -2.074 1.00 25.00 H new ATOM 0 HA ASP B 531 -4.541 13.051 -1.793 1.00 25.00 H new ATOM 0 HB2 ASP B 531 -6.241 14.459 0.299 1.00 25.00 H new ATOM 0 HB3 ASP B 531 -5.922 12.736 0.339 1.00 25.00 H new ATOM 1636 N GLU B 532 -6.872 13.481 -3.436 1.00 25.00 N ATOM 1637 CA GLU B 532 -8.077 13.123 -4.172 1.00 25.00 C ATOM 1638 C GLU B 532 -7.884 11.909 -5.082 1.00 25.00 C ATOM 1639 O GLU B 532 -8.832 11.437 -5.720 1.00 25.00 O ATOM 1640 CB GLU B 532 -8.554 14.327 -4.967 1.00 25.00 C ATOM 1641 CG GLU B 532 -9.252 15.376 -4.113 1.00 25.00 C ATOM 1642 CD GLU B 532 -10.511 14.862 -3.431 1.00 25.00 C ATOM 1643 OE1 GLU B 532 -11.332 14.214 -4.111 1.00 25.00 O ATOM 1644 OE2 GLU B 532 -10.671 15.109 -2.217 1.00 25.00 O ATOM 0 H GLU B 532 -6.213 14.044 -3.974 1.00 25.00 H new ATOM 0 HA GLU B 532 -8.836 12.833 -3.445 1.00 25.00 H new ATOM 0 HB2 GLU B 532 -7.700 14.785 -5.466 1.00 25.00 H new ATOM 0 HB3 GLU B 532 -9.237 13.991 -5.747 1.00 25.00 H new ATOM 0 HG2 GLU B 532 -8.558 15.736 -3.354 1.00 25.00 H new ATOM 0 HG3 GLU B 532 -9.510 16.230 -4.739 1.00 25.00 H new ATOM 1651 N ASP B 533 -6.652 11.410 -5.119 1.00 25.00 N ATOM 1652 CA ASP B 533 -6.270 10.288 -5.989 1.00 25.00 C ATOM 1653 C ASP B 533 -6.782 8.944 -5.434 1.00 25.00 C ATOM 1654 O ASP B 533 -7.273 8.106 -6.195 1.00 25.00 O ATOM 1655 CB ASP B 533 -4.742 10.258 -6.162 1.00 25.00 C ATOM 1656 CG ASP B 533 -4.215 11.385 -7.038 1.00 25.00 C ATOM 1657 OD1 ASP B 533 -5.019 11.977 -7.790 1.00 25.00 O ATOM 1658 OD2 ASP B 533 -3.002 11.672 -6.972 1.00 25.00 O ATOM 0 H ASP B 533 -5.886 11.768 -4.549 1.00 25.00 H new ATOM 0 HA ASP B 533 -6.736 10.437 -6.963 1.00 25.00 H new ATOM 0 HB2 ASP B 533 -4.271 10.318 -5.181 1.00 25.00 H new ATOM 0 HB3 ASP B 533 -4.451 9.302 -6.597 1.00 25.00 H new ATOM 1663 N PHE B 534 -6.658 8.753 -4.111 1.00 25.00 N ATOM 1664 CA PHE B 534 -7.140 7.530 -3.447 1.00 25.00 C ATOM 1665 C PHE B 534 -8.601 7.668 -3.010 1.00 25.00 C ATOM 1666 O PHE B 534 -9.251 6.679 -2.663 1.00 25.00 O ATOM 1667 CB PHE B 534 -6.261 7.180 -2.234 1.00 25.00 C ATOM 1668 CG PHE B 534 -5.456 5.912 -2.390 1.00 25.00 C ATOM 1669 CD1 PHE B 534 -4.303 5.902 -3.166 1.00 25.00 C ATOM 1670 CD2 PHE B 534 -5.847 4.734 -1.762 1.00 25.00 C ATOM 1671 CE1 PHE B 534 -3.560 4.747 -3.315 1.00 25.00 C ATOM 1672 CE2 PHE B 534 -5.103 3.582 -1.911 1.00 25.00 C ATOM 1673 CZ PHE B 534 -3.961 3.587 -2.688 1.00 25.00 C ATOM 0 H PHE B 534 -6.228 9.429 -3.480 1.00 25.00 H new ATOM 0 HA PHE B 534 -7.075 6.721 -4.174 1.00 25.00 H new ATOM 0 HB2 PHE B 534 -5.578 8.008 -2.045 1.00 25.00 H new ATOM 0 HB3 PHE B 534 -6.898 7.085 -1.355 1.00 25.00 H new ATOM 0 HD1 PHE B 534 -3.984 6.809 -3.659 1.00 25.00 H new ATOM 0 HD2 PHE B 534 -6.739 4.721 -1.154 1.00 25.00 H new ATOM 0 HE1 PHE B 534 -2.667 4.753 -3.922 1.00 25.00 H new ATOM 0 HE2 PHE B 534 -5.415 2.673 -1.418 1.00 25.00 H new ATOM 0 HZ PHE B 534 -3.383 2.682 -2.804 1.00 25.00 H new ATOM 1683 N SER B 535 -9.108 8.902 -3.042 1.00 25.00 N ATOM 1684 CA SER B 535 -10.504 9.193 -2.699 1.00 25.00 C ATOM 1685 C SER B 535 -11.440 8.869 -3.869 1.00 25.00 C ATOM 1686 O SER B 535 -12.659 8.784 -3.695 1.00 25.00 O ATOM 1687 CB SER B 535 -10.658 10.662 -2.300 1.00 25.00 C ATOM 1688 OG SER B 535 -10.460 11.520 -3.411 1.00 25.00 O ATOM 0 H SER B 535 -8.566 9.725 -3.305 1.00 25.00 H new ATOM 0 HA SER B 535 -10.780 8.562 -1.854 1.00 25.00 H new ATOM 0 HB2 SER B 535 -11.652 10.826 -1.884 1.00 25.00 H new ATOM 0 HB3 SER B 535 -9.940 10.906 -1.517 1.00 25.00 H new ATOM 0 HG SER B 535 -11.021 12.317 -3.313 1.00 25.00 H new ATOM 1694 N SER B 536 -10.854 8.712 -5.064 1.00 25.00 N ATOM 1695 CA SER B 536 -11.598 8.317 -6.258 1.00 25.00 C ATOM 1696 C SER B 536 -11.622 6.792 -6.425 1.00 25.00 C ATOM 1697 O SER B 536 -12.688 6.210 -6.612 1.00 25.00 O ATOM 1698 CB SER B 536 -11.007 8.991 -7.507 1.00 25.00 C ATOM 1699 OG SER B 536 -11.065 10.406 -7.412 1.00 25.00 O ATOM 0 H SER B 536 -9.857 8.855 -5.225 1.00 25.00 H new ATOM 0 HA SER B 536 -12.628 8.652 -6.136 1.00 25.00 H new ATOM 0 HB2 SER B 536 -9.971 8.676 -7.636 1.00 25.00 H new ATOM 0 HB3 SER B 536 -11.552 8.662 -8.392 1.00 25.00 H new ATOM 0 HG SER B 536 -10.327 10.727 -6.853 1.00 25.00 H new ATOM 1705 N ILE B 537 -10.440 6.155 -6.336 1.00 25.00 N ATOM 1706 CA ILE B 537 -10.308 4.710 -6.586 1.00 25.00 C ATOM 1707 C ILE B 537 -10.575 3.885 -5.319 1.00 25.00 C ATOM 1708 O ILE B 537 -11.360 2.934 -5.359 1.00 25.00 O ATOM 1709 CB ILE B 537 -8.900 4.347 -7.186 1.00 25.00 C ATOM 1710 CG1 ILE B 537 -8.686 4.983 -8.591 1.00 25.00 C ATOM 1711 CG2 ILE B 537 -8.683 2.823 -7.247 1.00 25.00 C ATOM 1712 CD1 ILE B 537 -7.264 4.907 -9.149 1.00 25.00 C ATOM 0 H ILE B 537 -9.564 6.618 -6.093 1.00 25.00 H new ATOM 0 HA ILE B 537 -11.068 4.453 -7.324 1.00 25.00 H new ATOM 0 HB ILE B 537 -8.156 4.769 -6.510 1.00 25.00 H new ATOM 0 HG12 ILE B 537 -9.359 4.495 -9.296 1.00 25.00 H new ATOM 0 HG13 ILE B 537 -8.981 6.031 -8.543 1.00 25.00 H new ATOM 0 HG21 ILE B 537 -7.700 2.612 -7.667 1.00 25.00 H new ATOM 0 HG22 ILE B 537 -8.745 2.406 -6.242 1.00 25.00 H new ATOM 0 HG23 ILE B 537 -9.450 2.371 -7.875 1.00 25.00 H new ATOM 0 HD11 ILE B 537 -7.232 5.380 -10.130 1.00 25.00 H new ATOM 0 HD12 ILE B 537 -6.581 5.423 -8.475 1.00 25.00 H new ATOM 0 HD13 ILE B 537 -6.964 3.863 -9.240 1.00 25.00 H new ATOM 1724 N ALA B 538 -9.930 4.252 -4.205 1.00 25.00 N ATOM 1725 CA ALA B 538 -10.041 3.481 -2.960 1.00 25.00 C ATOM 1726 C ALA B 538 -11.384 3.687 -2.259 1.00 25.00 C ATOM 1727 O ALA B 538 -11.717 2.978 -1.306 1.00 25.00 O ATOM 1728 CB ALA B 538 -8.877 3.788 -2.027 1.00 25.00 C ATOM 0 H ALA B 538 -9.329 5.073 -4.140 1.00 25.00 H new ATOM 0 HA ALA B 538 -9.994 2.427 -3.233 1.00 25.00 H new ATOM 0 HB1 ALA B 538 -8.981 3.205 -1.112 1.00 25.00 H new ATOM 0 HB2 ALA B 538 -7.939 3.528 -2.518 1.00 25.00 H new ATOM 0 HB3 ALA B 538 -8.877 4.850 -1.783 1.00 25.00 H new ATOM 1734 N ASP B 539 -12.135 4.665 -2.749 1.00 25.00 N ATOM 1735 CA ASP B 539 -13.502 4.926 -2.289 1.00 25.00 C ATOM 1736 C ASP B 539 -14.518 4.267 -3.243 1.00 25.00 C ATOM 1737 O ASP B 539 -15.698 4.133 -2.907 1.00 25.00 O ATOM 1738 CB ASP B 539 -13.731 6.445 -2.162 1.00 25.00 C ATOM 1739 CG ASP B 539 -12.965 7.088 -1.014 1.00 25.00 C ATOM 1740 OD1 ASP B 539 -12.496 6.348 -0.126 1.00 25.00 O ATOM 1741 OD2 ASP B 539 -12.833 8.330 -1.008 1.00 25.00 O ATOM 0 H ASP B 539 -11.817 5.303 -3.478 1.00 25.00 H new ATOM 0 HA ASP B 539 -13.647 4.485 -1.303 1.00 25.00 H new ATOM 0 HB2 ASP B 539 -13.440 6.926 -3.096 1.00 25.00 H new ATOM 0 HB3 ASP B 539 -14.796 6.632 -2.026 1.00 25.00 H new ATOM 1746 N MET B 540 -14.036 3.856 -4.427 1.00 25.00 N ATOM 1747 CA MET B 540 -14.835 3.064 -5.370 1.00 25.00 C ATOM 1748 C MET B 540 -14.684 1.568 -5.104 1.00 25.00 C ATOM 1749 O MET B 540 -15.597 0.785 -5.382 1.00 25.00 O ATOM 1750 CB MET B 540 -14.446 3.360 -6.815 1.00 25.00 C ATOM 1751 CG MET B 540 -15.079 4.637 -7.364 1.00 25.00 C ATOM 1752 SD MET B 540 -14.414 5.137 -8.968 1.00 25.00 S ATOM 1753 CE MET B 540 -15.083 3.868 -10.034 1.00 25.00 C ATOM 0 H MET B 540 -13.092 4.062 -4.753 1.00 25.00 H new ATOM 0 HA MET B 540 -15.876 3.349 -5.219 1.00 25.00 H new ATOM 0 HB2 MET B 540 -13.361 3.443 -6.882 1.00 25.00 H new ATOM 0 HB3 MET B 540 -14.740 2.519 -7.442 1.00 25.00 H new ATOM 0 HG2 MET B 540 -16.155 4.490 -7.455 1.00 25.00 H new ATOM 0 HG3 MET B 540 -14.927 5.445 -6.648 1.00 25.00 H new ATOM 0 HE1 MET B 540 -14.801 4.074 -11.067 1.00 25.00 H new ATOM 0 HE2 MET B 540 -14.687 2.897 -9.737 1.00 25.00 H new ATOM 0 HE3 MET B 540 -16.170 3.858 -9.950 1.00 25.00 H new ATOM 1763 N ASP B 541 -13.521 1.187 -4.563 1.00 25.00 N ATOM 1764 CA ASP B 541 -13.197 -0.202 -4.297 1.00 25.00 C ATOM 1765 C ASP B 541 -13.560 -0.630 -2.868 1.00 25.00 C ATOM 1766 O ASP B 541 -13.752 -1.820 -2.614 1.00 25.00 O ATOM 1767 CB ASP B 541 -11.711 -0.427 -4.549 1.00 25.00 C ATOM 1768 CG ASP B 541 -11.365 -0.472 -6.026 1.00 25.00 C ATOM 1769 OD1 ASP B 541 -12.202 -0.949 -6.820 1.00 25.00 O ATOM 1770 OD2 ASP B 541 -10.252 -0.032 -6.388 1.00 25.00 O ATOM 0 H ASP B 541 -12.783 1.841 -4.300 1.00 25.00 H new ATOM 0 HA ASP B 541 -13.794 -0.817 -4.971 1.00 25.00 H new ATOM 0 HB2 ASP B 541 -11.141 0.370 -4.071 1.00 25.00 H new ATOM 0 HB3 ASP B 541 -11.405 -1.362 -4.080 1.00 25.00 H new ATOM 1775 N PHE B 542 -13.669 0.343 -1.942 1.00 25.00 N ATOM 1776 CA PHE B 542 -13.945 0.049 -0.523 1.00 25.00 C ATOM 1777 C PHE B 542 -15.400 -0.405 -0.314 1.00 25.00 C ATOM 1778 O PHE B 542 -15.686 -1.185 0.599 1.00 25.00 O ATOM 1779 CB PHE B 542 -13.643 1.288 0.335 1.00 25.00 C ATOM 1780 CG PHE B 542 -13.597 1.036 1.824 1.00 25.00 C ATOM 1781 CD1 PHE B 542 -12.462 0.514 2.430 1.00 25.00 C ATOM 1782 CD2 PHE B 542 -14.704 1.315 2.612 1.00 25.00 C ATOM 1783 CE1 PHE B 542 -12.436 0.275 3.791 1.00 25.00 C ATOM 1784 CE2 PHE B 542 -14.682 1.078 3.972 1.00 25.00 C ATOM 1785 CZ PHE B 542 -13.547 0.558 4.563 1.00 25.00 C ATOM 0 H PHE B 542 -13.570 1.336 -2.151 1.00 25.00 H new ATOM 0 HA PHE B 542 -13.296 -0.771 -0.214 1.00 25.00 H new ATOM 0 HB2 PHE B 542 -12.685 1.704 0.022 1.00 25.00 H new ATOM 0 HB3 PHE B 542 -14.401 2.045 0.133 1.00 25.00 H new ATOM 0 HD1 PHE B 542 -11.591 0.292 1.832 1.00 25.00 H new ATOM 0 HD2 PHE B 542 -15.594 1.723 2.156 1.00 25.00 H new ATOM 0 HE1 PHE B 542 -11.548 -0.133 4.251 1.00 25.00 H new ATOM 0 HE2 PHE B 542 -15.552 1.299 4.573 1.00 25.00 H new ATOM 0 HZ PHE B 542 -13.528 0.373 5.627 1.00 25.00 H new ATOM 1795 N SER B 543 -16.306 0.097 -1.167 1.00 25.00 N ATOM 1796 CA SER B 543 -17.722 -0.301 -1.150 1.00 25.00 C ATOM 1797 C SER B 543 -17.932 -1.619 -1.905 1.00 25.00 C ATOM 1798 O SER B 543 -18.849 -2.385 -1.592 1.00 25.00 O ATOM 1799 CB SER B 543 -18.579 0.798 -1.776 1.00 25.00 C ATOM 1800 OG SER B 543 -18.314 0.939 -3.163 1.00 25.00 O ATOM 0 H SER B 543 -16.080 0.786 -1.884 1.00 25.00 H new ATOM 0 HA SER B 543 -18.023 -0.449 -0.113 1.00 25.00 H new ATOM 0 HB2 SER B 543 -19.634 0.567 -1.628 1.00 25.00 H new ATOM 0 HB3 SER B 543 -18.386 1.744 -1.270 1.00 25.00 H new ATOM 0 HG SER B 543 -18.879 1.649 -3.534 1.00 25.00 H new ATOM 1806 N ALA B 544 -17.065 -1.867 -2.900 1.00 25.00 N ATOM 1807 CA ALA B 544 -17.107 -3.091 -3.707 1.00 25.00 C ATOM 1808 C ALA B 544 -16.474 -4.274 -2.964 1.00 25.00 C ATOM 1809 O ALA B 544 -16.843 -5.428 -3.193 1.00 25.00 O ATOM 1810 CB ALA B 544 -16.408 -2.854 -5.036 1.00 25.00 C ATOM 0 H ALA B 544 -16.318 -1.225 -3.165 1.00 25.00 H new ATOM 0 HA ALA B 544 -18.151 -3.345 -3.893 1.00 25.00 H new ATOM 0 HB1 ALA B 544 -16.441 -3.766 -5.632 1.00 25.00 H new ATOM 0 HB2 ALA B 544 -16.911 -2.050 -5.573 1.00 25.00 H new ATOM 0 HB3 ALA B 544 -15.369 -2.576 -4.856 1.00 25.00 H new ATOM 1816 N LEU B 545 -15.518 -3.964 -2.075 1.00 25.00 N ATOM 1817 CA LEU B 545 -14.902 -4.948 -1.183 1.00 25.00 C ATOM 1818 C LEU B 545 -15.763 -5.169 0.067 1.00 25.00 C ATOM 1819 O LEU B 545 -15.638 -6.192 0.747 1.00 25.00 O ATOM 1820 CB LEU B 545 -13.510 -4.464 -0.774 1.00 25.00 C ATOM 1821 CG LEU B 545 -12.430 -4.526 -1.865 1.00 25.00 C ATOM 1822 CD1 LEU B 545 -11.170 -3.800 -1.421 1.00 25.00 C ATOM 1823 CD2 LEU B 545 -12.090 -5.975 -2.210 1.00 25.00 C ATOM 0 H LEU B 545 -15.152 -3.019 -1.957 1.00 25.00 H new ATOM 0 HA LEU B 545 -14.821 -5.896 -1.714 1.00 25.00 H new ATOM 0 HB2 LEU B 545 -13.592 -3.433 -0.429 1.00 25.00 H new ATOM 0 HB3 LEU B 545 -13.175 -5.059 0.076 1.00 25.00 H new ATOM 0 HG LEU B 545 -12.828 -4.034 -2.752 1.00 25.00 H new ATOM 0 HD11 LEU B 545 -10.420 -3.857 -2.210 1.00 25.00 H new ATOM 0 HD12 LEU B 545 -11.404 -2.755 -1.219 1.00 25.00 H new ATOM 0 HD13 LEU B 545 -10.781 -4.266 -0.516 1.00 25.00 H new ATOM 0 HD21 LEU B 545 -11.323 -5.994 -2.985 1.00 25.00 H new ATOM 0 HD22 LEU B 545 -11.720 -6.484 -1.320 1.00 25.00 H new ATOM 0 HD23 LEU B 545 -12.984 -6.482 -2.572 1.00 25.00 H new ATOM 1835 N LEU B 546 -16.640 -4.191 0.348 1.00 25.00 N ATOM 1836 CA LEU B 546 -17.580 -4.254 1.473 1.00 25.00 C ATOM 1837 C LEU B 546 -18.756 -5.189 1.148 1.00 25.00 C ATOM 1838 O LEU B 546 -19.323 -5.821 2.043 1.00 25.00 O ATOM 1839 CB LEU B 546 -18.075 -2.826 1.803 1.00 25.00 C ATOM 1840 CG LEU B 546 -17.369 -2.078 2.946 1.00 25.00 C ATOM 1841 CD1 LEU B 546 -18.055 -0.754 3.243 1.00 25.00 C ATOM 1842 CD2 LEU B 546 -17.324 -2.944 4.196 1.00 25.00 C ATOM 0 H LEU B 546 -16.715 -3.335 -0.201 1.00 25.00 H new ATOM 0 HA LEU B 546 -17.072 -4.663 2.347 1.00 25.00 H new ATOM 0 HB2 LEU B 546 -17.986 -2.222 0.900 1.00 25.00 H new ATOM 0 HB3 LEU B 546 -19.136 -2.885 2.044 1.00 25.00 H new ATOM 0 HG LEU B 546 -16.348 -1.864 2.629 1.00 25.00 H new ATOM 0 HD11 LEU B 546 -17.533 -0.248 4.055 1.00 25.00 H new ATOM 0 HD12 LEU B 546 -18.035 -0.126 2.352 1.00 25.00 H new ATOM 0 HD13 LEU B 546 -19.089 -0.937 3.534 1.00 25.00 H new ATOM 0 HD21 LEU B 546 -16.821 -2.401 4.997 1.00 25.00 H new ATOM 0 HD22 LEU B 546 -18.340 -3.189 4.506 1.00 25.00 H new ATOM 0 HD23 LEU B 546 -16.778 -3.863 3.982 1.00 25.00 H new ATOM 1854 N SER B 547 -19.107 -5.254 -0.142 1.00 25.00 N ATOM 1855 CA SER B 547 -20.147 -6.163 -0.642 1.00 25.00 C ATOM 1856 C SER B 547 -19.643 -7.614 -0.752 1.00 25.00 C ATOM 1857 O SER B 547 -20.445 -8.546 -0.859 1.00 25.00 O ATOM 1858 CB SER B 547 -20.666 -5.679 -2.003 1.00 25.00 C ATOM 1859 OG SER B 547 -19.665 -5.765 -3.003 1.00 25.00 O ATOM 0 H SER B 547 -18.679 -4.679 -0.868 1.00 25.00 H new ATOM 0 HA SER B 547 -20.963 -6.154 0.081 1.00 25.00 H new ATOM 0 HB2 SER B 547 -21.528 -6.277 -2.298 1.00 25.00 H new ATOM 0 HB3 SER B 547 -21.008 -4.648 -1.917 1.00 25.00 H new ATOM 0 HG SER B 547 -18.789 -5.575 -2.606 1.00 25.00 H new ATOM 1865 N GLN B 548 -18.309 -7.790 -0.721 1.00 25.00 N ATOM 1866 CA GLN B 548 -17.680 -9.115 -0.877 1.00 25.00 C ATOM 1867 C GLN B 548 -17.792 -9.970 0.390 1.00 25.00 C ATOM 1868 O GLN B 548 -17.602 -11.191 0.341 1.00 25.00 O ATOM 1869 CB GLN B 548 -16.200 -8.974 -1.272 1.00 25.00 C ATOM 1870 CG GLN B 548 -15.969 -8.354 -2.644 1.00 25.00 C ATOM 1871 CD GLN B 548 -16.791 -9.003 -3.749 1.00 25.00 C ATOM 1872 OE1 GLN B 548 -16.824 -10.229 -3.893 1.00 25.00 O ATOM 1873 NE2 GLN B 548 -17.466 -8.175 -4.539 1.00 25.00 N ATOM 0 H GLN B 548 -17.644 -7.028 -0.589 1.00 25.00 H new ATOM 0 HA GLN B 548 -18.225 -9.624 -1.672 1.00 25.00 H new ATOM 0 HB2 GLN B 548 -15.693 -8.366 -0.523 1.00 25.00 H new ATOM 0 HB3 GLN B 548 -15.736 -9.960 -1.250 1.00 25.00 H new ATOM 0 HG2 GLN B 548 -16.209 -7.292 -2.599 1.00 25.00 H new ATOM 0 HG3 GLN B 548 -14.911 -8.431 -2.896 1.00 25.00 H new ATOM 0 HE21 GLN B 548 -17.412 -7.168 -4.387 1.00 25.00 H new ATOM 0 HE22 GLN B 548 -18.038 -8.547 -5.298 1.00 25.00 H new ATOM 1882 N ILE B 549 -18.107 -9.322 1.510 1.00 25.00 N ATOM 1883 CA ILE B 549 -18.244 -10.005 2.806 1.00 25.00 C ATOM 1884 C ILE B 549 -19.716 -10.171 3.220 1.00 25.00 C ATOM 1885 O ILE B 549 -20.031 -10.986 4.093 1.00 25.00 O ATOM 1886 CB ILE B 549 -17.432 -9.298 3.946 1.00 25.00 C ATOM 1887 CG1 ILE B 549 -17.914 -7.856 4.230 1.00 25.00 C ATOM 1888 CG2 ILE B 549 -15.944 -9.292 3.614 1.00 25.00 C ATOM 1889 CD1 ILE B 549 -17.194 -7.166 5.373 1.00 25.00 C ATOM 0 H ILE B 549 -18.274 -8.317 1.551 1.00 25.00 H new ATOM 0 HA ILE B 549 -17.818 -10.998 2.664 1.00 25.00 H new ATOM 0 HB ILE B 549 -17.607 -9.876 4.853 1.00 25.00 H new ATOM 0 HG12 ILE B 549 -17.789 -7.260 3.326 1.00 25.00 H new ATOM 0 HG13 ILE B 549 -18.981 -7.880 4.451 1.00 25.00 H new ATOM 0 HG21 ILE B 549 -15.394 -8.798 4.415 1.00 25.00 H new ATOM 0 HG22 ILE B 549 -15.590 -10.318 3.510 1.00 25.00 H new ATOM 0 HG23 ILE B 549 -15.782 -8.756 2.679 1.00 25.00 H new ATOM 0 HD11 ILE B 549 -17.595 -6.161 5.502 1.00 25.00 H new ATOM 0 HD12 ILE B 549 -17.339 -7.735 6.291 1.00 25.00 H new ATOM 0 HD13 ILE B 549 -16.129 -7.106 5.149 1.00 25.00 H new ATOM 1901 N SER B 550 -20.606 -9.394 2.585 1.00 25.00 N ATOM 1902 CA SER B 550 -22.043 -9.440 2.877 1.00 25.00 C ATOM 1903 C SER B 550 -22.803 -10.260 1.824 1.00 25.00 C ATOM 1904 O SER B 550 -23.830 -10.869 2.133 1.00 25.00 O ATOM 1905 CB SER B 550 -22.610 -8.015 2.952 1.00 25.00 C ATOM 1906 OG SER B 550 -22.587 -7.379 1.682 1.00 25.00 O ATOM 0 H SER B 550 -20.351 -8.722 1.861 1.00 25.00 H new ATOM 0 HA SER B 550 -22.176 -9.931 3.841 1.00 25.00 H new ATOM 0 HB2 SER B 550 -23.634 -8.049 3.325 1.00 25.00 H new ATOM 0 HB3 SER B 550 -22.030 -7.428 3.665 1.00 25.00 H new ATOM 0 HG SER B 550 -22.956 -6.475 1.762 1.00 25.00 H new ATOM 1912 N SER B 551 -22.281 -10.266 0.576 1.00 25.00 N ATOM 1913 CA SER B 551 -22.883 -10.989 -0.573 1.00 25.00 C ATOM 1914 C SER B 551 -24.297 -10.481 -0.897 1.00 25.00 C ATOM 1915 O SER B 551 -24.430 -9.686 -1.851 1.00 25.00 O ATOM 1916 CB SER B 551 -22.892 -12.515 -0.348 1.00 25.00 C ATOM 1917 OG SER B 551 -21.572 -13.029 -0.275 1.00 25.00 O ATOM 1918 OXT SER B 551 -25.254 -10.871 -0.190 1.00 25.00 O ATOM 0 H SER B 551 -21.425 -9.767 0.334 1.00 25.00 H new ATOM 0 HA SER B 551 -22.250 -10.780 -1.435 1.00 25.00 H new ATOM 0 HB2 SER B 551 -23.427 -12.747 0.573 1.00 25.00 H new ATOM 0 HB3 SER B 551 -23.431 -13.002 -1.161 1.00 25.00 H new ATOM 0 HG SER B 551 -21.606 -13.998 -0.130 1.00 25.00 H new TER 1924 SER B 551