USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 834 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 125 THR OG1 : rot 180:sc= 0.127 USER MOD Set 1.2: A 128 GLN : amide:sc= 0.13 X(o=0.26,f=0) USER MOD Set 2.1: A 108 ASN : amide:sc= 0.252 K(o=0.51,f=-0.37) USER MOD Set 2.2: A 112 ASN : amide:sc= 0.258 K(o=0.51,f=0) USER MOD Set 3.1: A 34 LYS NZ :NH3+ -138:sc= 0.829 (180deg=-1.93!) USER MOD Set 3.2: A 59 GLN : amide:sc= 0.625 K(o=1.5,f=-11!) USER MOD Single : A 35 HIS : no HE2:sc= -0.0439 X(o=-0.044,f=-0.3) USER MOD Single : A 37 GLN : amide:sc= 0.89 K(o=0.89,f=0) USER MOD Single : A 40 TYR OH : rot 63:sc= 1.23 USER MOD Single : A 50 SER OG : rot -62:sc= 1.23 USER MOD Single : A 51 HIS : no HD1:sc= -0.0285 X(o=-0.029,f=-0.0074) USER MOD Single : A 54 GLN : amide:sc= -0.761 K(o=-0.76,f=-2.8!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -0.897! C(o=-0.9!,f=-2.5!) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl -178:sc= -3.07! (180deg=-3.09!) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 GLN :FLIP amide:sc= -0.805 F(o=-3.2!,f=-0.81) USER MOD Single : A 94 LYS NZ :NH3+ 168:sc= 1.1 (180deg=0.894) USER MOD Single : A 97 ASN :FLIP amide:sc= 0 F(o=-0.82,f=0) USER MOD Single : A 100 GLN : amide:sc= -0.137 X(o=-0.14,f=-0.26) USER MOD Single : A 105 SER OG : rot -94:sc= 0.325 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ -155:sc= 1.3 (180deg=0.828) USER MOD Single : A 122 SER OG : rot -100:sc= 0.181 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 137 THR OG1 : rot 38:sc= 0.169 USER MOD Single : A 139 MET CE :methyl 171:sc= 0 (180deg=-0.0685) USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 142 CYS SG : rot 117:sc= -2.78! USER MOD Single : A 145 TYR OH : rot 30:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 540 N LYS A 34 -10.338 0.657 -7.775 1.00 0.00 N ATOM 541 CA LYS A 34 -9.885 -0.350 -6.825 1.00 0.00 C ATOM 542 C LYS A 34 -8.659 -1.076 -7.378 1.00 0.00 C ATOM 543 O LYS A 34 -8.148 -0.718 -8.438 1.00 0.00 O ATOM 544 CB LYS A 34 -11.008 -1.352 -6.524 1.00 0.00 C ATOM 545 CG LYS A 34 -11.444 -2.164 -7.736 1.00 0.00 C ATOM 546 CD LYS A 34 -12.532 -3.181 -7.404 1.00 0.00 C ATOM 547 CE LYS A 34 -13.872 -2.520 -7.105 1.00 0.00 C ATOM 548 NZ LYS A 34 -14.004 -2.106 -5.683 1.00 0.00 N ATOM 0 HA LYS A 34 -9.611 0.147 -5.894 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -10.675 -2.034 -5.742 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -11.869 -0.812 -6.131 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -11.809 -1.488 -8.509 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -10.580 -2.684 -8.149 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -12.648 -3.871 -8.240 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -12.222 -3.773 -6.543 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -13.992 -1.647 -7.746 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -14.677 -3.212 -7.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -14.959 -2.338 -5.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -13.299 -2.609 -5.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -13.847 -1.081 -5.604 1.00 0.00 H new ATOM 562 N HIS A 35 -8.191 -2.091 -6.661 1.00 0.00 N ATOM 563 CA HIS A 35 -6.999 -2.838 -7.068 1.00 0.00 C ATOM 564 C HIS A 35 -7.156 -4.318 -6.728 1.00 0.00 C ATOM 565 O HIS A 35 -8.243 -4.758 -6.351 1.00 0.00 O ATOM 566 CB HIS A 35 -5.743 -2.278 -6.385 1.00 0.00 C ATOM 567 CG HIS A 35 -5.408 -0.870 -6.776 1.00 0.00 C ATOM 568 ND1 HIS A 35 -5.395 0.173 -5.877 1.00 0.00 N ATOM 569 CD2 HIS A 35 -5.079 -0.333 -7.976 1.00 0.00 C ATOM 570 CE1 HIS A 35 -5.075 1.289 -6.506 1.00 0.00 C ATOM 571 NE2 HIS A 35 -4.878 1.012 -7.779 1.00 0.00 N ATOM 0 H HIS A 35 -8.617 -2.418 -5.794 1.00 0.00 H new ATOM 0 HA HIS A 35 -6.886 -2.730 -8.147 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -5.881 -2.320 -5.305 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -4.896 -2.921 -6.624 1.00 0.00 H new ATOM 0 HD1 HIS A 35 -5.600 0.096 -4.881 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -4.991 -0.863 -8.913 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -4.989 2.266 -6.053 1.00 0.00 H new ATOM 580 N GLY A 36 -6.069 -5.075 -6.862 1.00 0.00 N ATOM 581 CA GLY A 36 -6.093 -6.494 -6.549 1.00 0.00 C ATOM 582 C GLY A 36 -6.036 -6.766 -5.055 1.00 0.00 C ATOM 583 O GLY A 36 -6.305 -5.878 -4.244 1.00 0.00 O ATOM 0 H GLY A 36 -5.166 -4.727 -7.184 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.000 -6.937 -6.961 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -5.250 -6.984 -7.036 1.00 0.00 H new ATOM 587 N GLN A 37 -5.680 -7.994 -4.692 1.00 0.00 N ATOM 588 CA GLN A 37 -5.592 -8.373 -3.288 1.00 0.00 C ATOM 589 C GLN A 37 -4.307 -7.863 -2.664 1.00 0.00 C ATOM 590 O GLN A 37 -4.315 -6.886 -1.929 1.00 0.00 O ATOM 591 CB GLN A 37 -5.666 -9.890 -3.112 1.00 0.00 C ATOM 592 CG GLN A 37 -7.069 -10.460 -3.196 1.00 0.00 C ATOM 593 CD GLN A 37 -7.112 -11.926 -2.812 1.00 0.00 C ATOM 594 OE1 GLN A 37 -6.997 -12.805 -3.663 1.00 0.00 O ATOM 595 NE2 GLN A 37 -7.261 -12.196 -1.521 1.00 0.00 N ATOM 0 H GLN A 37 -5.449 -8.740 -5.348 1.00 0.00 H new ATOM 0 HA GLN A 37 -6.444 -7.916 -2.784 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -5.048 -10.363 -3.875 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -5.237 -10.153 -2.145 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -7.730 -9.894 -2.539 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -7.449 -10.340 -4.211 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -7.353 -11.435 -0.848 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -7.283 -13.165 -1.202 1.00 0.00 H new ATOM 604 N PHE A 38 -3.204 -8.529 -2.968 1.00 0.00 N ATOM 605 CA PHE A 38 -1.921 -8.190 -2.373 1.00 0.00 C ATOM 606 C PHE A 38 -1.070 -7.429 -3.372 1.00 0.00 C ATOM 607 O PHE A 38 -0.434 -8.028 -4.239 1.00 0.00 O ATOM 608 CB PHE A 38 -1.192 -9.457 -1.924 1.00 0.00 C ATOM 609 CG PHE A 38 -2.010 -10.339 -1.023 1.00 0.00 C ATOM 610 CD1 PHE A 38 -2.157 -10.034 0.319 1.00 0.00 C ATOM 611 CD2 PHE A 38 -2.631 -11.473 -1.521 1.00 0.00 C ATOM 612 CE1 PHE A 38 -2.907 -10.843 1.149 1.00 0.00 C ATOM 613 CE2 PHE A 38 -3.384 -12.287 -0.696 1.00 0.00 C ATOM 614 CZ PHE A 38 -3.523 -11.971 0.640 1.00 0.00 C ATOM 0 H PHE A 38 -3.172 -9.309 -3.625 1.00 0.00 H new ATOM 0 HA PHE A 38 -2.096 -7.559 -1.501 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -0.897 -10.027 -2.805 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -0.276 -9.174 -1.406 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -1.679 -9.153 0.722 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -2.525 -11.724 -2.566 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -3.012 -10.595 2.195 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -3.863 -13.169 -1.096 1.00 0.00 H new ATOM 0 HZ PHE A 38 -4.112 -12.604 1.287 1.00 0.00 H new ATOM 624 N ILE A 39 -1.071 -6.111 -3.263 1.00 0.00 N ATOM 625 CA ILE A 39 -0.355 -5.276 -4.215 1.00 0.00 C ATOM 626 C ILE A 39 0.732 -4.465 -3.522 1.00 0.00 C ATOM 627 O ILE A 39 0.466 -3.730 -2.571 1.00 0.00 O ATOM 628 CB ILE A 39 -1.312 -4.314 -4.958 1.00 0.00 C ATOM 629 CG1 ILE A 39 -2.448 -5.096 -5.631 1.00 0.00 C ATOM 630 CG2 ILE A 39 -0.552 -3.486 -5.988 1.00 0.00 C ATOM 631 CD1 ILE A 39 -1.980 -6.084 -6.682 1.00 0.00 C ATOM 0 H ILE A 39 -1.557 -5.597 -2.528 1.00 0.00 H new ATOM 0 HA ILE A 39 0.104 -5.946 -4.942 1.00 0.00 H new ATOM 0 HB ILE A 39 -1.747 -3.634 -4.226 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -3.008 -5.634 -4.866 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.137 -4.389 -6.093 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.244 -2.816 -6.499 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.218 -2.899 -5.487 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -0.085 -4.150 -6.716 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -2.842 -6.596 -7.110 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -1.446 -5.552 -7.469 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -1.315 -6.815 -6.223 1.00 0.00 H new ATOM 643 N TYR A 40 1.956 -4.622 -3.995 1.00 0.00 N ATOM 644 CA TYR A 40 3.067 -3.814 -3.526 1.00 0.00 C ATOM 645 C TYR A 40 3.502 -2.876 -4.642 1.00 0.00 C ATOM 646 O TYR A 40 4.050 -3.317 -5.656 1.00 0.00 O ATOM 647 CB TYR A 40 4.237 -4.711 -3.098 1.00 0.00 C ATOM 648 CG TYR A 40 5.342 -3.990 -2.348 1.00 0.00 C ATOM 649 CD1 TYR A 40 6.312 -3.258 -3.024 1.00 0.00 C ATOM 650 CD2 TYR A 40 5.413 -4.048 -0.963 1.00 0.00 C ATOM 651 CE1 TYR A 40 7.319 -2.607 -2.339 1.00 0.00 C ATOM 652 CE2 TYR A 40 6.418 -3.399 -0.272 1.00 0.00 C ATOM 653 CZ TYR A 40 7.368 -2.679 -0.964 1.00 0.00 C ATOM 654 OH TYR A 40 8.367 -2.031 -0.279 1.00 0.00 O ATOM 0 H TYR A 40 2.206 -5.307 -4.708 1.00 0.00 H new ATOM 0 HA TYR A 40 2.752 -3.231 -2.661 1.00 0.00 H new ATOM 0 HB2 TYR A 40 3.852 -5.513 -2.469 1.00 0.00 H new ATOM 0 HB3 TYR A 40 4.663 -5.179 -3.986 1.00 0.00 H new ATOM 0 HD1 TYR A 40 6.277 -3.198 -4.102 1.00 0.00 H new ATOM 0 HD2 TYR A 40 4.670 -4.610 -0.416 1.00 0.00 H new ATOM 0 HE1 TYR A 40 8.065 -2.044 -2.879 1.00 0.00 H new ATOM 0 HE2 TYR A 40 6.459 -3.456 0.806 1.00 0.00 H new ATOM 0 HH TYR A 40 8.292 -1.065 -0.427 1.00 0.00 H new ATOM 664 N VAL A 41 3.227 -1.592 -4.473 1.00 0.00 N ATOM 665 CA VAL A 41 3.619 -0.602 -5.461 1.00 0.00 C ATOM 666 C VAL A 41 5.015 -0.075 -5.154 1.00 0.00 C ATOM 667 O VAL A 41 5.272 0.445 -4.068 1.00 0.00 O ATOM 668 CB VAL A 41 2.609 0.566 -5.553 1.00 0.00 C ATOM 669 CG1 VAL A 41 1.313 0.098 -6.198 1.00 0.00 C ATOM 670 CG2 VAL A 41 2.329 1.168 -4.183 1.00 0.00 C ATOM 0 H VAL A 41 2.736 -1.213 -3.664 1.00 0.00 H new ATOM 0 HA VAL A 41 3.627 -1.097 -6.432 1.00 0.00 H new ATOM 0 HB VAL A 41 3.054 1.342 -6.176 1.00 0.00 H new ATOM 0 HG11 VAL A 41 0.613 0.932 -6.255 1.00 0.00 H new ATOM 0 HG12 VAL A 41 1.519 -0.272 -7.202 1.00 0.00 H new ATOM 0 HG13 VAL A 41 0.877 -0.702 -5.599 1.00 0.00 H new ATOM 0 HG21 VAL A 41 1.616 1.986 -4.284 1.00 0.00 H new ATOM 0 HG22 VAL A 41 1.913 0.403 -3.527 1.00 0.00 H new ATOM 0 HG23 VAL A 41 3.257 1.547 -3.755 1.00 0.00 H new ATOM 680 N TRP A 42 5.918 -0.223 -6.110 1.00 0.00 N ATOM 681 CA TRP A 42 7.314 0.099 -5.879 1.00 0.00 C ATOM 682 C TRP A 42 7.803 1.177 -6.835 1.00 0.00 C ATOM 683 O TRP A 42 7.219 1.393 -7.903 1.00 0.00 O ATOM 684 CB TRP A 42 8.172 -1.160 -6.025 1.00 0.00 C ATOM 685 CG TRP A 42 8.492 -1.531 -7.444 1.00 0.00 C ATOM 686 CD1 TRP A 42 7.638 -2.043 -8.379 1.00 0.00 C ATOM 687 CD2 TRP A 42 9.770 -1.426 -8.079 1.00 0.00 C ATOM 688 NE1 TRP A 42 8.309 -2.262 -9.558 1.00 0.00 N ATOM 689 CE2 TRP A 42 9.621 -1.894 -9.397 1.00 0.00 C ATOM 690 CE3 TRP A 42 11.028 -0.987 -7.655 1.00 0.00 C ATOM 691 CZ2 TRP A 42 10.683 -1.924 -10.297 1.00 0.00 C ATOM 692 CZ3 TRP A 42 12.079 -1.017 -8.550 1.00 0.00 C ATOM 693 CH2 TRP A 42 11.902 -1.487 -9.856 1.00 0.00 C ATOM 0 H TRP A 42 5.709 -0.563 -7.049 1.00 0.00 H new ATOM 0 HA TRP A 42 7.406 0.485 -4.864 1.00 0.00 H new ATOM 0 HB2 TRP A 42 9.105 -1.014 -5.481 1.00 0.00 H new ATOM 0 HB3 TRP A 42 7.655 -1.995 -5.552 1.00 0.00 H new ATOM 0 HD1 TRP A 42 6.590 -2.246 -8.216 1.00 0.00 H new ATOM 0 HE1 TRP A 42 7.899 -2.637 -10.413 1.00 0.00 H new ATOM 0 HE3 TRP A 42 11.175 -0.631 -6.646 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 10.549 -2.280 -11.308 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 13.053 -0.672 -8.237 1.00 0.00 H new ATOM 0 HH2 TRP A 42 12.746 -1.505 -10.530 1.00 0.00 H new ATOM 787 N SER A 50 1.259 7.953 -1.877 1.00 0.00 N ATOM 788 CA SER A 50 0.340 7.233 -1.004 1.00 0.00 C ATOM 789 C SER A 50 -1.122 7.629 -1.223 1.00 0.00 C ATOM 790 O SER A 50 -2.024 7.029 -0.637 1.00 0.00 O ATOM 791 CB SER A 50 0.735 7.482 0.448 1.00 0.00 C ATOM 792 OG SER A 50 2.124 7.272 0.626 1.00 0.00 O ATOM 0 HA SER A 50 0.416 6.173 -1.247 1.00 0.00 H new ATOM 0 HB2 SER A 50 0.476 8.502 0.732 1.00 0.00 H new ATOM 0 HB3 SER A 50 0.173 6.816 1.103 1.00 0.00 H new ATOM 0 HG SER A 50 2.342 6.338 0.426 1.00 0.00 H new ATOM 798 N HIS A 51 -1.360 8.628 -2.068 1.00 0.00 N ATOM 799 CA HIS A 51 -2.721 9.074 -2.366 1.00 0.00 C ATOM 800 C HIS A 51 -3.572 7.919 -2.899 1.00 0.00 C ATOM 801 O HIS A 51 -4.771 7.857 -2.646 1.00 0.00 O ATOM 802 CB HIS A 51 -2.730 10.257 -3.357 1.00 0.00 C ATOM 803 CG HIS A 51 -2.235 9.940 -4.740 1.00 0.00 C ATOM 804 ND1 HIS A 51 -0.947 10.203 -5.159 1.00 0.00 N ATOM 805 CD2 HIS A 51 -2.867 9.393 -5.807 1.00 0.00 C ATOM 806 CE1 HIS A 51 -0.812 9.833 -6.419 1.00 0.00 C ATOM 807 NE2 HIS A 51 -1.961 9.339 -6.833 1.00 0.00 N ATOM 0 H HIS A 51 -0.630 9.145 -2.559 1.00 0.00 H new ATOM 0 HA HIS A 51 -3.159 9.422 -1.431 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -3.748 10.639 -3.432 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -2.118 11.059 -2.945 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -3.894 9.061 -5.842 1.00 0.00 H new ATOM 0 HE1 HIS A 51 0.088 9.920 -7.010 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -2.146 8.975 -7.768 1.00 0.00 H new ATOM 816 N LEU A 52 -2.944 6.999 -3.630 1.00 0.00 N ATOM 817 CA LEU A 52 -3.672 5.884 -4.224 1.00 0.00 C ATOM 818 C LEU A 52 -4.091 4.869 -3.157 1.00 0.00 C ATOM 819 O LEU A 52 -5.070 4.150 -3.332 1.00 0.00 O ATOM 820 CB LEU A 52 -2.851 5.225 -5.347 1.00 0.00 C ATOM 821 CG LEU A 52 -1.507 4.608 -4.944 1.00 0.00 C ATOM 822 CD1 LEU A 52 -1.680 3.150 -4.545 1.00 0.00 C ATOM 823 CD2 LEU A 52 -0.512 4.731 -6.086 1.00 0.00 C ATOM 0 H LEU A 52 -1.942 7.005 -3.823 1.00 0.00 H new ATOM 0 HA LEU A 52 -4.584 6.276 -4.674 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -3.461 4.445 -5.802 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -2.665 5.974 -6.117 1.00 0.00 H new ATOM 0 HG LEU A 52 -1.122 5.152 -4.082 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -0.713 2.733 -4.263 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -2.365 3.083 -3.700 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -2.086 2.588 -5.386 1.00 0.00 H new ATOM 0 HD21 LEU A 52 0.439 4.290 -5.789 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -0.897 4.208 -6.962 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -0.364 5.783 -6.328 1.00 0.00 H new ATOM 835 N LEU A 53 -3.349 4.818 -2.052 1.00 0.00 N ATOM 836 CA LEU A 53 -3.733 3.976 -0.922 1.00 0.00 C ATOM 837 C LEU A 53 -4.964 4.562 -0.245 1.00 0.00 C ATOM 838 O LEU A 53 -5.910 3.845 0.079 1.00 0.00 O ATOM 839 CB LEU A 53 -2.598 3.838 0.106 1.00 0.00 C ATOM 840 CG LEU A 53 -1.416 2.951 -0.307 1.00 0.00 C ATOM 841 CD1 LEU A 53 -0.498 3.675 -1.277 1.00 0.00 C ATOM 842 CD2 LEU A 53 -0.644 2.494 0.920 1.00 0.00 C ATOM 0 H LEU A 53 -2.486 5.345 -1.916 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.953 2.981 -1.310 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.217 4.834 0.332 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -3.019 3.441 1.030 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.814 2.073 -0.817 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.330 3.021 -1.551 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.057 3.948 -2.172 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.107 4.576 -0.804 1.00 0.00 H new ATOM 0 HD21 LEU A 53 0.191 1.866 0.611 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.265 3.364 1.456 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -1.304 1.924 1.574 1.00 0.00 H new ATOM 854 N GLN A 54 -4.944 5.878 -0.060 1.00 0.00 N ATOM 855 CA GLN A 54 -6.064 6.600 0.534 1.00 0.00 C ATOM 856 C GLN A 54 -7.314 6.428 -0.324 1.00 0.00 C ATOM 857 O GLN A 54 -8.405 6.142 0.180 1.00 0.00 O ATOM 858 CB GLN A 54 -5.714 8.087 0.650 1.00 0.00 C ATOM 859 CG GLN A 54 -4.401 8.353 1.375 1.00 0.00 C ATOM 860 CD GLN A 54 -3.956 9.800 1.267 1.00 0.00 C ATOM 861 OE1 GLN A 54 -4.240 10.476 0.280 1.00 0.00 O ATOM 862 NE2 GLN A 54 -3.234 10.278 2.268 1.00 0.00 N ATOM 0 H GLN A 54 -4.155 6.472 -0.316 1.00 0.00 H new ATOM 0 HA GLN A 54 -6.261 6.197 1.527 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -5.660 8.517 -0.350 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -6.519 8.601 1.175 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -4.511 8.088 2.427 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -3.626 7.707 0.963 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -3.019 9.686 3.070 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -2.892 11.239 2.237 1.00 0.00 H new ATOM 871 N ALA A 55 -7.134 6.592 -1.629 1.00 0.00 N ATOM 872 CA ALA A 55 -8.217 6.456 -2.594 1.00 0.00 C ATOM 873 C ALA A 55 -8.790 5.045 -2.602 1.00 0.00 C ATOM 874 O ALA A 55 -10.006 4.861 -2.640 1.00 0.00 O ATOM 875 CB ALA A 55 -7.716 6.817 -3.980 1.00 0.00 C ATOM 0 H ALA A 55 -6.233 6.823 -2.048 1.00 0.00 H new ATOM 0 HA ALA A 55 -9.015 7.138 -2.300 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -8.529 6.714 -4.699 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.359 7.847 -3.981 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -6.900 6.150 -4.257 1.00 0.00 H new ATOM 881 N TRP A 56 -7.904 4.059 -2.562 1.00 0.00 N ATOM 882 CA TRP A 56 -8.297 2.657 -2.592 1.00 0.00 C ATOM 883 C TRP A 56 -9.175 2.319 -1.392 1.00 0.00 C ATOM 884 O TRP A 56 -10.174 1.610 -1.520 1.00 0.00 O ATOM 885 CB TRP A 56 -7.038 1.786 -2.607 1.00 0.00 C ATOM 886 CG TRP A 56 -7.287 0.309 -2.589 1.00 0.00 C ATOM 887 CD1 TRP A 56 -7.839 -0.448 -3.582 1.00 0.00 C ATOM 888 CD2 TRP A 56 -6.966 -0.595 -1.526 1.00 0.00 C ATOM 889 NE1 TRP A 56 -7.878 -1.769 -3.198 1.00 0.00 N ATOM 890 CE2 TRP A 56 -7.353 -1.881 -1.938 1.00 0.00 C ATOM 891 CE3 TRP A 56 -6.390 -0.436 -0.263 1.00 0.00 C ATOM 892 CZ2 TRP A 56 -7.179 -3.004 -1.133 1.00 0.00 C ATOM 893 CZ3 TRP A 56 -6.220 -1.550 0.535 1.00 0.00 C ATOM 894 CH2 TRP A 56 -6.613 -2.819 0.098 1.00 0.00 C ATOM 0 H TRP A 56 -6.896 4.208 -2.508 1.00 0.00 H new ATOM 0 HA TRP A 56 -8.880 2.463 -3.492 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -6.457 2.030 -3.496 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -6.425 2.046 -1.744 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -8.193 -0.067 -4.529 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -8.239 -2.539 -3.760 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -6.083 0.540 0.083 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -7.480 -3.985 -1.469 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -5.776 -1.439 1.513 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -6.466 -3.670 0.746 1.00 0.00 H new ATOM 905 N VAL A 57 -8.803 2.847 -0.234 1.00 0.00 N ATOM 906 CA VAL A 57 -9.576 2.641 0.985 1.00 0.00 C ATOM 907 C VAL A 57 -10.960 3.273 0.875 1.00 0.00 C ATOM 908 O VAL A 57 -11.968 2.630 1.159 1.00 0.00 O ATOM 909 CB VAL A 57 -8.843 3.210 2.219 1.00 0.00 C ATOM 910 CG1 VAL A 57 -9.720 3.141 3.462 1.00 0.00 C ATOM 911 CG2 VAL A 57 -7.549 2.458 2.459 1.00 0.00 C ATOM 0 H VAL A 57 -7.970 3.422 -0.112 1.00 0.00 H new ATOM 0 HA VAL A 57 -9.690 1.564 1.112 1.00 0.00 H new ATOM 0 HB VAL A 57 -8.616 4.257 2.017 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.176 3.549 4.314 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -10.628 3.722 3.299 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -9.984 2.103 3.664 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.045 2.871 3.332 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -7.767 1.404 2.631 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -6.903 2.557 1.586 1.00 0.00 H new ATOM 921 N ALA A 58 -11.003 4.531 0.448 1.00 0.00 N ATOM 922 CA ALA A 58 -12.260 5.268 0.337 1.00 0.00 C ATOM 923 C ALA A 58 -13.205 4.610 -0.664 1.00 0.00 C ATOM 924 O ALA A 58 -14.418 4.573 -0.454 1.00 0.00 O ATOM 925 CB ALA A 58 -11.979 6.706 -0.058 1.00 0.00 C ATOM 0 H ALA A 58 -10.179 5.065 0.172 1.00 0.00 H new ATOM 0 HA ALA A 58 -12.753 5.254 1.309 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -12.919 7.251 -0.139 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -11.352 7.176 0.700 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -11.464 6.725 -1.018 1.00 0.00 H new ATOM 931 N GLN A 59 -12.642 4.073 -1.740 1.00 0.00 N ATOM 932 CA GLN A 59 -13.436 3.410 -2.764 1.00 0.00 C ATOM 933 C GLN A 59 -14.132 2.189 -2.166 1.00 0.00 C ATOM 934 O GLN A 59 -15.324 1.968 -2.394 1.00 0.00 O ATOM 935 CB GLN A 59 -12.541 3.016 -3.947 1.00 0.00 C ATOM 936 CG GLN A 59 -13.294 2.765 -5.249 1.00 0.00 C ATOM 937 CD GLN A 59 -14.030 1.439 -5.285 1.00 0.00 C ATOM 938 OE1 GLN A 59 -13.586 0.445 -4.704 1.00 0.00 O ATOM 939 NE2 GLN A 59 -15.163 1.415 -5.966 1.00 0.00 N ATOM 0 H GLN A 59 -11.639 4.084 -1.925 1.00 0.00 H new ATOM 0 HA GLN A 59 -14.201 4.093 -3.133 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -11.808 3.806 -4.112 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -11.986 2.116 -3.683 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -14.010 3.572 -5.405 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -12.588 2.801 -6.079 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -15.496 2.259 -6.432 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -15.704 0.553 -6.025 1.00 0.00 H new ATOM 948 N ALA A 60 -13.390 1.423 -1.369 1.00 0.00 N ATOM 949 CA ALA A 60 -13.927 0.230 -0.729 1.00 0.00 C ATOM 950 C ALA A 60 -14.936 0.595 0.354 1.00 0.00 C ATOM 951 O ALA A 60 -15.883 -0.153 0.608 1.00 0.00 O ATOM 952 CB ALA A 60 -12.800 -0.604 -0.143 1.00 0.00 C ATOM 0 H ALA A 60 -12.411 1.611 -1.152 1.00 0.00 H new ATOM 0 HA ALA A 60 -14.445 -0.358 -1.487 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -13.214 -1.493 0.333 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -12.117 -0.903 -0.938 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -12.259 -0.015 0.598 1.00 0.00 H new ATOM 958 N LEU A 61 -14.730 1.747 0.984 1.00 0.00 N ATOM 959 CA LEU A 61 -15.647 2.241 2.005 1.00 0.00 C ATOM 960 C LEU A 61 -17.037 2.484 1.419 1.00 0.00 C ATOM 961 O LEU A 61 -18.040 2.034 1.974 1.00 0.00 O ATOM 962 CB LEU A 61 -15.110 3.529 2.637 1.00 0.00 C ATOM 963 CG LEU A 61 -13.857 3.357 3.501 1.00 0.00 C ATOM 964 CD1 LEU A 61 -13.397 4.700 4.042 1.00 0.00 C ATOM 965 CD2 LEU A 61 -14.122 2.385 4.642 1.00 0.00 C ATOM 0 H LEU A 61 -13.933 2.358 0.804 1.00 0.00 H new ATOM 0 HA LEU A 61 -15.727 1.478 2.779 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -14.889 4.241 1.841 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -15.897 3.970 3.249 1.00 0.00 H new ATOM 0 HG LEU A 61 -13.063 2.945 2.877 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -12.506 4.560 4.654 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -13.166 5.367 3.211 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -14.189 5.138 4.650 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -13.220 2.276 5.244 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -14.930 2.767 5.265 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -14.406 1.415 4.235 1.00 0.00 H new ATOM 977 N GLU A 62 -17.089 3.167 0.278 1.00 0.00 N ATOM 978 CA GLU A 62 -18.362 3.474 -0.371 1.00 0.00 C ATOM 979 C GLU A 62 -19.033 2.209 -0.895 1.00 0.00 C ATOM 980 O GLU A 62 -20.246 2.176 -1.104 1.00 0.00 O ATOM 981 CB GLU A 62 -18.169 4.466 -1.515 1.00 0.00 C ATOM 982 CG GLU A 62 -17.622 5.807 -1.065 1.00 0.00 C ATOM 983 CD GLU A 62 -17.593 6.827 -2.186 1.00 0.00 C ATOM 984 OE1 GLU A 62 -17.293 6.448 -3.338 1.00 0.00 O ATOM 985 OE2 GLU A 62 -17.896 8.010 -1.924 1.00 0.00 O ATOM 0 H GLU A 62 -16.268 3.518 -0.215 1.00 0.00 H new ATOM 0 HA GLU A 62 -19.008 3.926 0.381 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -17.490 4.034 -2.250 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -19.124 4.622 -2.016 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -18.232 6.189 -0.246 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -16.613 5.672 -0.675 1.00 0.00 H new ATOM 992 N ALA A 63 -18.240 1.168 -1.098 1.00 0.00 N ATOM 993 CA ALA A 63 -18.758 -0.108 -1.567 1.00 0.00 C ATOM 994 C ALA A 63 -19.503 -0.842 -0.457 1.00 0.00 C ATOM 995 O ALA A 63 -20.245 -1.792 -0.713 1.00 0.00 O ATOM 996 CB ALA A 63 -17.628 -0.969 -2.108 1.00 0.00 C ATOM 0 H ALA A 63 -17.232 1.182 -0.945 1.00 0.00 H new ATOM 0 HA ALA A 63 -19.466 0.090 -2.372 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -18.030 -1.921 -2.455 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -17.144 -0.455 -2.938 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -16.898 -1.150 -1.319 1.00 0.00 H new ATOM 1002 N GLY A 64 -19.308 -0.392 0.776 1.00 0.00 N ATOM 1003 CA GLY A 64 -19.961 -1.018 1.906 1.00 0.00 C ATOM 1004 C GLY A 64 -19.101 -2.092 2.537 1.00 0.00 C ATOM 1005 O GLY A 64 -19.602 -2.976 3.237 1.00 0.00 O ATOM 0 H GLY A 64 -18.707 0.398 1.013 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -20.199 -0.260 2.652 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -20.906 -1.454 1.582 1.00 0.00 H new ATOM 1009 N LYS A 65 -17.803 -2.021 2.288 1.00 0.00 N ATOM 1010 CA LYS A 65 -16.867 -2.974 2.849 1.00 0.00 C ATOM 1011 C LYS A 65 -16.135 -2.338 4.020 1.00 0.00 C ATOM 1012 O LYS A 65 -16.456 -1.221 4.433 1.00 0.00 O ATOM 1013 CB LYS A 65 -15.862 -3.424 1.784 1.00 0.00 C ATOM 1014 CG LYS A 65 -16.504 -4.013 0.537 1.00 0.00 C ATOM 1015 CD LYS A 65 -17.342 -5.240 0.858 1.00 0.00 C ATOM 1016 CE LYS A 65 -17.935 -5.852 -0.400 1.00 0.00 C ATOM 1017 NZ LYS A 65 -18.813 -7.009 -0.091 1.00 0.00 N ATOM 0 H LYS A 65 -17.375 -1.308 1.697 1.00 0.00 H new ATOM 0 HA LYS A 65 -17.416 -3.848 3.198 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -15.248 -2.571 1.496 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -15.193 -4.166 2.221 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -17.131 -3.259 0.061 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -15.727 -4.281 -0.180 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -16.726 -5.980 1.368 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -18.144 -4.966 1.544 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -18.507 -5.095 -0.937 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -17.131 -6.173 -1.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -19.198 -7.399 -0.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -18.262 -7.742 0.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -19.595 -6.698 0.520 1.00 0.00 H new ATOM 1031 N ASN A 66 -15.166 -3.047 4.565 1.00 0.00 N ATOM 1032 CA ASN A 66 -14.335 -2.488 5.615 1.00 0.00 C ATOM 1033 C ASN A 66 -12.940 -2.237 5.080 1.00 0.00 C ATOM 1034 O ASN A 66 -12.341 -3.107 4.445 1.00 0.00 O ATOM 1035 CB ASN A 66 -14.267 -3.419 6.824 1.00 0.00 C ATOM 1036 CG ASN A 66 -13.861 -2.683 8.084 1.00 0.00 C ATOM 1037 OD1 ASN A 66 -14.071 -1.476 8.208 1.00 0.00 O ATOM 1038 ND2 ASN A 66 -13.300 -3.405 9.035 1.00 0.00 N ATOM 0 H ASN A 66 -14.935 -4.005 4.301 1.00 0.00 H new ATOM 0 HA ASN A 66 -14.780 -1.547 5.939 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -15.239 -3.888 6.975 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -13.554 -4.219 6.626 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -13.023 -2.965 9.913 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -13.143 -4.403 8.893 1.00 0.00 H new ATOM 1045 N ALA A 67 -12.415 -1.062 5.359 1.00 0.00 N ATOM 1046 CA ALA A 67 -11.126 -0.659 4.829 1.00 0.00 C ATOM 1047 C ALA A 67 -10.464 0.349 5.753 1.00 0.00 C ATOM 1048 O ALA A 67 -11.135 1.211 6.324 1.00 0.00 O ATOM 1049 CB ALA A 67 -11.284 -0.075 3.432 1.00 0.00 C ATOM 0 H ALA A 67 -12.863 -0.365 5.953 1.00 0.00 H new ATOM 0 HA ALA A 67 -10.488 -1.541 4.765 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -10.308 0.222 3.049 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -11.720 -0.825 2.771 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -11.938 0.796 3.474 1.00 0.00 H new ATOM 1055 N ALA A 68 -9.154 0.232 5.903 1.00 0.00 N ATOM 1056 CA ALA A 68 -8.400 1.138 6.752 1.00 0.00 C ATOM 1057 C ALA A 68 -7.010 1.399 6.188 1.00 0.00 C ATOM 1058 O ALA A 68 -6.369 0.500 5.641 1.00 0.00 O ATOM 1059 CB ALA A 68 -8.298 0.579 8.162 1.00 0.00 C ATOM 0 H ALA A 68 -8.590 -0.484 5.446 1.00 0.00 H new ATOM 0 HA ALA A 68 -8.934 2.088 6.784 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.730 1.269 8.787 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -9.298 0.453 8.577 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -7.792 -0.386 8.135 1.00 0.00 H new ATOM 1065 N TYR A 69 -6.554 2.633 6.322 1.00 0.00 N ATOM 1066 CA TYR A 69 -5.214 3.003 5.909 1.00 0.00 C ATOM 1067 C TYR A 69 -4.369 3.323 7.134 1.00 0.00 C ATOM 1068 O TYR A 69 -4.833 3.975 8.071 1.00 0.00 O ATOM 1069 CB TYR A 69 -5.240 4.195 4.934 1.00 0.00 C ATOM 1070 CG TYR A 69 -6.105 5.360 5.384 1.00 0.00 C ATOM 1071 CD1 TYR A 69 -5.617 6.327 6.258 1.00 0.00 C ATOM 1072 CD2 TYR A 69 -7.414 5.488 4.937 1.00 0.00 C ATOM 1073 CE1 TYR A 69 -6.409 7.382 6.672 1.00 0.00 C ATOM 1074 CE2 TYR A 69 -8.210 6.543 5.344 1.00 0.00 C ATOM 1075 CZ TYR A 69 -7.703 7.485 6.213 1.00 0.00 C ATOM 1076 OH TYR A 69 -8.497 8.531 6.627 1.00 0.00 O ATOM 0 H TYR A 69 -7.098 3.400 6.717 1.00 0.00 H new ATOM 0 HA TYR A 69 -4.768 2.160 5.381 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -4.220 4.551 4.789 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -5.597 3.847 3.965 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -4.602 6.252 6.619 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -7.817 4.750 4.259 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -6.014 8.122 7.352 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -9.224 6.628 4.983 1.00 0.00 H new ATOM 0 HH TYR A 69 -9.380 8.456 6.210 1.00 0.00 H new ATOM 1086 N ILE A 70 -3.148 2.821 7.138 1.00 0.00 N ATOM 1087 CA ILE A 70 -2.224 3.039 8.239 1.00 0.00 C ATOM 1088 C ILE A 70 -0.854 3.452 7.710 1.00 0.00 C ATOM 1089 O ILE A 70 -0.294 2.799 6.828 1.00 0.00 O ATOM 1090 CB ILE A 70 -2.081 1.768 9.114 1.00 0.00 C ATOM 1091 CG1 ILE A 70 -3.442 1.348 9.677 1.00 0.00 C ATOM 1092 CG2 ILE A 70 -1.086 2.003 10.246 1.00 0.00 C ATOM 1093 CD1 ILE A 70 -3.402 0.066 10.478 1.00 0.00 C ATOM 0 H ILE A 70 -2.768 2.252 6.381 1.00 0.00 H new ATOM 0 HA ILE A 70 -2.630 3.840 8.857 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.702 0.962 8.486 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.826 2.149 10.309 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.145 1.228 8.852 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.000 1.099 10.849 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -0.111 2.254 9.827 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -1.435 2.824 10.872 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -4.402 -0.166 10.843 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.049 -0.748 9.845 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.726 0.187 11.324 1.00 0.00 H new ATOM 1105 N ASP A 71 -0.334 4.552 8.233 1.00 0.00 N ATOM 1106 CA ASP A 71 0.995 5.010 7.881 1.00 0.00 C ATOM 1107 C ASP A 71 1.842 5.087 9.142 1.00 0.00 C ATOM 1108 O ASP A 71 1.451 5.699 10.135 1.00 0.00 O ATOM 1109 CB ASP A 71 0.944 6.365 7.156 1.00 0.00 C ATOM 1110 CG ASP A 71 0.629 7.541 8.065 1.00 0.00 C ATOM 1111 OD1 ASP A 71 -0.567 7.800 8.330 1.00 0.00 O ATOM 1112 OD2 ASP A 71 1.581 8.224 8.495 1.00 0.00 O ATOM 0 H ASP A 71 -0.818 5.145 8.907 1.00 0.00 H new ATOM 0 HA ASP A 71 1.448 4.300 7.189 1.00 0.00 H new ATOM 0 HB2 ASP A 71 1.903 6.542 6.670 1.00 0.00 H new ATOM 0 HB3 ASP A 71 0.192 6.316 6.369 1.00 0.00 H new ATOM 1117 N ALA A 72 2.993 4.437 9.101 1.00 0.00 N ATOM 1118 CA ALA A 72 3.858 4.310 10.273 1.00 0.00 C ATOM 1119 C ALA A 72 4.606 5.603 10.596 1.00 0.00 C ATOM 1120 O ALA A 72 5.529 5.604 11.411 1.00 0.00 O ATOM 1121 CB ALA A 72 4.846 3.168 10.069 1.00 0.00 C ATOM 0 H ALA A 72 3.357 3.984 8.263 1.00 0.00 H new ATOM 0 HA ALA A 72 3.215 4.094 11.126 1.00 0.00 H new ATOM 0 HB1 ALA A 72 5.487 3.080 10.946 1.00 0.00 H new ATOM 0 HB2 ALA A 72 4.300 2.236 9.924 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.459 3.370 9.191 1.00 0.00 H new ATOM 1127 N ALA A 73 4.203 6.704 9.981 1.00 0.00 N ATOM 1128 CA ALA A 73 4.842 7.981 10.248 1.00 0.00 C ATOM 1129 C ALA A 73 3.869 8.935 10.920 1.00 0.00 C ATOM 1130 O ALA A 73 4.068 10.150 10.927 1.00 0.00 O ATOM 1131 CB ALA A 73 5.393 8.587 8.967 1.00 0.00 C ATOM 0 H ALA A 73 3.444 6.739 9.300 1.00 0.00 H new ATOM 0 HA ALA A 73 5.677 7.810 10.927 1.00 0.00 H new ATOM 0 HB1 ALA A 73 5.867 9.543 9.191 1.00 0.00 H new ATOM 0 HB2 ALA A 73 6.128 7.911 8.531 1.00 0.00 H new ATOM 0 HB3 ALA A 73 4.579 8.743 8.259 1.00 0.00 H new ATOM 1137 N SER A 74 2.833 8.365 11.504 1.00 0.00 N ATOM 1138 CA SER A 74 1.792 9.141 12.157 1.00 0.00 C ATOM 1139 C SER A 74 0.913 8.224 13.004 1.00 0.00 C ATOM 1140 O SER A 74 0.419 8.617 14.064 1.00 0.00 O ATOM 1141 CB SER A 74 0.948 9.868 11.102 1.00 0.00 C ATOM 1142 OG SER A 74 -0.083 10.645 11.688 1.00 0.00 O ATOM 0 H SER A 74 2.688 7.356 11.540 1.00 0.00 H new ATOM 0 HA SER A 74 2.252 9.883 12.810 1.00 0.00 H new ATOM 0 HB2 SER A 74 1.592 10.513 10.504 1.00 0.00 H new ATOM 0 HB3 SER A 74 0.509 9.137 10.423 1.00 0.00 H new ATOM 0 HG SER A 74 -0.596 11.093 10.983 1.00 0.00 H new ATOM 1148 N MET A 75 0.737 6.992 12.540 1.00 0.00 N ATOM 1149 CA MET A 75 -0.104 6.025 13.232 1.00 0.00 C ATOM 1150 C MET A 75 0.639 4.714 13.460 1.00 0.00 C ATOM 1151 O MET A 75 1.459 4.304 12.640 1.00 0.00 O ATOM 1152 CB MET A 75 -1.380 5.751 12.430 1.00 0.00 C ATOM 1153 CG MET A 75 -2.304 6.949 12.312 1.00 0.00 C ATOM 1154 SD MET A 75 -3.822 6.569 11.416 1.00 0.00 S ATOM 1155 CE MET A 75 -3.182 6.255 9.772 1.00 0.00 C ATOM 0 H MET A 75 1.167 6.639 11.685 1.00 0.00 H new ATOM 0 HA MET A 75 -0.368 6.452 14.199 1.00 0.00 H new ATOM 0 HB2 MET A 75 -1.104 5.418 11.429 1.00 0.00 H new ATOM 0 HB3 MET A 75 -1.923 4.931 12.900 1.00 0.00 H new ATOM 0 HG2 MET A 75 -2.556 7.309 13.310 1.00 0.00 H new ATOM 0 HG3 MET A 75 -1.780 7.759 11.804 1.00 0.00 H new ATOM 0 HE1 MET A 75 -4.009 6.041 9.095 1.00 0.00 H new ATOM 0 HE2 MET A 75 -2.641 7.133 9.418 1.00 0.00 H new ATOM 0 HE3 MET A 75 -2.506 5.400 9.802 1.00 0.00 H new ATOM 1165 N PRO A 76 0.383 4.055 14.596 1.00 0.00 N ATOM 1166 CA PRO A 76 0.904 2.724 14.875 1.00 0.00 C ATOM 1167 C PRO A 76 0.008 1.641 14.273 1.00 0.00 C ATOM 1168 O PRO A 76 -1.094 1.930 13.803 1.00 0.00 O ATOM 1169 CB PRO A 76 0.887 2.641 16.412 1.00 0.00 C ATOM 1170 CG PRO A 76 0.265 3.919 16.899 1.00 0.00 C ATOM 1171 CD PRO A 76 -0.411 4.556 15.718 1.00 0.00 C ATOM 0 HA PRO A 76 1.894 2.567 14.447 1.00 0.00 H new ATOM 0 HB2 PRO A 76 0.313 1.777 16.748 1.00 0.00 H new ATOM 0 HB3 PRO A 76 1.897 2.526 16.806 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -0.454 3.720 17.694 1.00 0.00 H new ATOM 0 HG3 PRO A 76 1.023 4.583 17.314 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -1.457 4.260 15.640 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -0.391 5.644 15.776 1.00 0.00 H new ATOM 1179 N LEU A 77 0.478 0.402 14.283 1.00 0.00 N ATOM 1180 CA LEU A 77 -0.306 -0.707 13.761 1.00 0.00 C ATOM 1181 C LEU A 77 -1.219 -1.255 14.853 1.00 0.00 C ATOM 1182 O LEU A 77 -0.849 -1.279 16.027 1.00 0.00 O ATOM 1183 CB LEU A 77 0.617 -1.805 13.226 1.00 0.00 C ATOM 1184 CG LEU A 77 -0.088 -2.959 12.512 1.00 0.00 C ATOM 1185 CD1 LEU A 77 -0.882 -2.448 11.321 1.00 0.00 C ATOM 1186 CD2 LEU A 77 0.921 -3.999 12.065 1.00 0.00 C ATOM 0 H LEU A 77 1.395 0.140 14.645 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.923 -0.350 12.937 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.330 -1.354 12.536 1.00 0.00 H new ATOM 0 HB3 LEU A 77 1.192 -2.211 14.058 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.781 -3.424 13.214 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.376 -3.285 10.827 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.632 -1.735 11.663 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -0.209 -1.958 10.618 1.00 0.00 H new ATOM 0 HD21 LEU A 77 0.404 -4.814 11.559 1.00 0.00 H new ATOM 0 HD22 LEU A 77 1.636 -3.542 11.381 1.00 0.00 H new ATOM 0 HD23 LEU A 77 1.450 -4.390 12.934 1.00 0.00 H new ATOM 1198 N THR A 78 -2.408 -1.687 14.465 1.00 0.00 N ATOM 1199 CA THR A 78 -3.406 -2.130 15.414 1.00 0.00 C ATOM 1200 C THR A 78 -3.887 -3.539 15.089 1.00 0.00 C ATOM 1201 O THR A 78 -3.688 -4.039 13.981 1.00 0.00 O ATOM 1202 CB THR A 78 -4.614 -1.174 15.407 1.00 0.00 C ATOM 1203 OG1 THR A 78 -5.075 -0.998 14.062 1.00 0.00 O ATOM 1204 CG2 THR A 78 -4.256 0.179 16.004 1.00 0.00 C ATOM 0 H THR A 78 -2.703 -1.739 13.490 1.00 0.00 H new ATOM 0 HA THR A 78 -2.943 -2.132 16.401 1.00 0.00 H new ATOM 0 HB THR A 78 -5.401 -1.616 16.018 1.00 0.00 H new ATOM 0 HG1 THR A 78 -5.845 -0.391 14.057 1.00 0.00 H new ATOM 0 HG21 THR A 78 -5.131 0.829 15.983 1.00 0.00 H new ATOM 0 HG22 THR A 78 -3.927 0.046 17.035 1.00 0.00 H new ATOM 0 HG23 THR A 78 -3.454 0.633 15.422 1.00 0.00 H new ATOM 1212 N ASP A 79 -4.525 -4.172 16.063 1.00 0.00 N ATOM 1213 CA ASP A 79 -5.120 -5.489 15.873 1.00 0.00 C ATOM 1214 C ASP A 79 -6.467 -5.343 15.173 1.00 0.00 C ATOM 1215 O ASP A 79 -7.044 -6.316 14.688 1.00 0.00 O ATOM 1216 CB ASP A 79 -5.293 -6.210 17.214 1.00 0.00 C ATOM 1217 CG ASP A 79 -6.327 -5.559 18.115 1.00 0.00 C ATOM 1218 OD1 ASP A 79 -6.111 -4.404 18.537 1.00 0.00 O ATOM 1219 OD2 ASP A 79 -7.348 -6.211 18.426 1.00 0.00 O ATOM 0 H ASP A 79 -4.645 -3.791 17.002 1.00 0.00 H new ATOM 0 HA ASP A 79 -4.453 -6.089 15.253 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -5.582 -7.244 17.028 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -4.334 -6.235 17.732 1.00 0.00 H new ATOM 1224 N ALA A 80 -6.951 -4.104 15.122 1.00 0.00 N ATOM 1225 CA ALA A 80 -8.167 -3.765 14.390 1.00 0.00 C ATOM 1226 C ALA A 80 -8.012 -4.081 12.908 1.00 0.00 C ATOM 1227 O ALA A 80 -8.993 -4.313 12.204 1.00 0.00 O ATOM 1228 CB ALA A 80 -8.507 -2.294 14.584 1.00 0.00 C ATOM 0 H ALA A 80 -6.512 -3.309 15.586 1.00 0.00 H new ATOM 0 HA ALA A 80 -8.984 -4.369 14.785 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -9.416 -2.055 14.032 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -8.662 -2.093 15.644 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -7.686 -1.679 14.215 1.00 0.00 H new ATOM 1234 N ALA A 81 -6.767 -4.093 12.445 1.00 0.00 N ATOM 1235 CA ALA A 81 -6.457 -4.369 11.048 1.00 0.00 C ATOM 1236 C ALA A 81 -6.952 -5.746 10.609 1.00 0.00 C ATOM 1237 O ALA A 81 -7.131 -5.990 9.421 1.00 0.00 O ATOM 1238 CB ALA A 81 -4.962 -4.252 10.820 1.00 0.00 C ATOM 0 H ALA A 81 -5.948 -3.912 13.025 1.00 0.00 H new ATOM 0 HA ALA A 81 -6.980 -3.630 10.441 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -4.736 -4.459 9.774 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -4.634 -3.243 11.069 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.440 -4.970 11.453 1.00 0.00 H new ATOM 1244 N PHE A 82 -7.178 -6.641 11.567 1.00 0.00 N ATOM 1245 CA PHE A 82 -7.695 -7.971 11.260 1.00 0.00 C ATOM 1246 C PHE A 82 -9.177 -7.913 10.912 1.00 0.00 C ATOM 1247 O PHE A 82 -9.723 -8.838 10.314 1.00 0.00 O ATOM 1248 CB PHE A 82 -7.477 -8.915 12.442 1.00 0.00 C ATOM 1249 CG PHE A 82 -6.041 -9.305 12.638 1.00 0.00 C ATOM 1250 CD1 PHE A 82 -5.441 -10.212 11.780 1.00 0.00 C ATOM 1251 CD2 PHE A 82 -5.290 -8.767 13.671 1.00 0.00 C ATOM 1252 CE1 PHE A 82 -4.122 -10.576 11.951 1.00 0.00 C ATOM 1253 CE2 PHE A 82 -3.969 -9.127 13.845 1.00 0.00 C ATOM 1254 CZ PHE A 82 -3.385 -10.033 12.983 1.00 0.00 C ATOM 0 H PHE A 82 -7.012 -6.470 12.559 1.00 0.00 H new ATOM 0 HA PHE A 82 -7.150 -8.351 10.396 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -7.843 -8.437 13.351 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -8.073 -9.815 12.293 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -6.012 -10.639 10.969 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -5.744 -8.058 14.348 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -3.666 -11.286 11.277 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -3.394 -8.701 14.654 1.00 0.00 H new ATOM 0 HZ PHE A 82 -2.351 -10.317 13.116 1.00 0.00 H new ATOM 1264 N GLU A 83 -9.824 -6.822 11.296 1.00 0.00 N ATOM 1265 CA GLU A 83 -11.239 -6.639 11.036 1.00 0.00 C ATOM 1266 C GLU A 83 -11.457 -5.960 9.693 1.00 0.00 C ATOM 1267 O GLU A 83 -12.519 -6.081 9.081 1.00 0.00 O ATOM 1268 CB GLU A 83 -11.851 -5.797 12.144 1.00 0.00 C ATOM 1269 CG GLU A 83 -11.655 -6.392 13.524 1.00 0.00 C ATOM 1270 CD GLU A 83 -12.306 -5.570 14.613 1.00 0.00 C ATOM 1271 OE1 GLU A 83 -13.333 -4.912 14.336 1.00 0.00 O ATOM 1272 OE2 GLU A 83 -11.806 -5.584 15.756 1.00 0.00 O ATOM 0 H GLU A 83 -9.385 -6.047 11.792 1.00 0.00 H new ATOM 0 HA GLU A 83 -11.720 -7.617 11.008 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.411 -4.800 12.119 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -12.918 -5.679 11.955 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -12.066 -7.401 13.542 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -10.588 -6.479 13.729 1.00 0.00 H new ATOM 1279 N ALA A 84 -10.452 -5.232 9.250 1.00 0.00 N ATOM 1280 CA ALA A 84 -10.516 -4.526 7.984 1.00 0.00 C ATOM 1281 C ALA A 84 -10.089 -5.434 6.846 1.00 0.00 C ATOM 1282 O ALA A 84 -8.933 -5.851 6.773 1.00 0.00 O ATOM 1283 CB ALA A 84 -9.644 -3.281 8.032 1.00 0.00 C ATOM 0 H ALA A 84 -9.573 -5.113 9.753 1.00 0.00 H new ATOM 0 HA ALA A 84 -11.547 -4.220 7.807 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.701 -2.760 7.076 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.995 -2.622 8.826 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -8.611 -3.568 8.228 1.00 0.00 H new ATOM 1289 N GLU A 85 -11.034 -5.745 5.970 1.00 0.00 N ATOM 1290 CA GLU A 85 -10.755 -6.599 4.822 1.00 0.00 C ATOM 1291 C GLU A 85 -9.746 -5.932 3.895 1.00 0.00 C ATOM 1292 O GLU A 85 -8.829 -6.574 3.387 1.00 0.00 O ATOM 1293 CB GLU A 85 -12.043 -6.902 4.053 1.00 0.00 C ATOM 1294 CG GLU A 85 -11.860 -7.881 2.896 1.00 0.00 C ATOM 1295 CD GLU A 85 -11.581 -9.309 3.342 1.00 0.00 C ATOM 1296 OE1 GLU A 85 -11.048 -9.513 4.452 1.00 0.00 O ATOM 1297 OE2 GLU A 85 -11.896 -10.241 2.572 1.00 0.00 O ATOM 0 H GLU A 85 -11.999 -5.420 6.031 1.00 0.00 H new ATOM 0 HA GLU A 85 -10.334 -7.535 5.189 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -12.780 -7.308 4.746 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -12.450 -5.969 3.665 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -12.758 -7.872 2.278 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -11.037 -7.538 2.268 1.00 0.00 H new ATOM 1304 N TYR A 86 -9.935 -4.637 3.676 1.00 0.00 N ATOM 1305 CA TYR A 86 -9.041 -3.862 2.828 1.00 0.00 C ATOM 1306 C TYR A 86 -8.090 -3.042 3.688 1.00 0.00 C ATOM 1307 O TYR A 86 -8.494 -2.061 4.314 1.00 0.00 O ATOM 1308 CB TYR A 86 -9.838 -2.933 1.903 1.00 0.00 C ATOM 1309 CG TYR A 86 -10.785 -3.651 0.964 1.00 0.00 C ATOM 1310 CD1 TYR A 86 -11.984 -4.181 1.423 1.00 0.00 C ATOM 1311 CD2 TYR A 86 -10.479 -3.793 -0.382 1.00 0.00 C ATOM 1312 CE1 TYR A 86 -12.846 -4.837 0.570 1.00 0.00 C ATOM 1313 CE2 TYR A 86 -11.339 -4.446 -1.245 1.00 0.00 C ATOM 1314 CZ TYR A 86 -12.522 -4.968 -0.762 1.00 0.00 C ATOM 1315 OH TYR A 86 -13.383 -5.629 -1.612 1.00 0.00 O ATOM 0 H TYR A 86 -10.704 -4.100 4.077 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.466 -4.554 2.212 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -10.410 -2.235 2.514 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -9.139 -2.341 1.312 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -12.246 -4.078 2.466 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -9.553 -3.386 -0.762 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -13.772 -5.247 0.945 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -11.087 -4.547 -2.290 1.00 0.00 H new ATOM 0 HH TYR A 86 -13.009 -5.634 -2.518 1.00 0.00 H new ATOM 1325 N LEU A 87 -6.835 -3.446 3.734 1.00 0.00 N ATOM 1326 CA LEU A 87 -5.854 -2.756 4.552 1.00 0.00 C ATOM 1327 C LEU A 87 -4.763 -2.140 3.690 1.00 0.00 C ATOM 1328 O LEU A 87 -4.183 -2.797 2.823 1.00 0.00 O ATOM 1329 CB LEU A 87 -5.237 -3.716 5.567 1.00 0.00 C ATOM 1330 CG LEU A 87 -4.317 -3.072 6.607 1.00 0.00 C ATOM 1331 CD1 LEU A 87 -5.097 -2.112 7.493 1.00 0.00 C ATOM 1332 CD2 LEU A 87 -3.635 -4.141 7.446 1.00 0.00 C ATOM 0 H LEU A 87 -6.471 -4.246 3.217 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.365 -1.955 5.086 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -6.043 -4.232 6.090 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -4.671 -4.474 5.026 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.549 -2.503 6.082 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -4.425 -1.665 8.225 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.538 -1.327 6.879 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -5.888 -2.655 8.010 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -2.984 -3.667 8.181 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.390 -4.736 7.960 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.042 -4.787 6.799 1.00 0.00 H new ATOM 1344 N ALA A 88 -4.491 -0.875 3.937 1.00 0.00 N ATOM 1345 CA ALA A 88 -3.439 -0.165 3.231 1.00 0.00 C ATOM 1346 C ALA A 88 -2.377 0.310 4.213 1.00 0.00 C ATOM 1347 O ALA A 88 -2.659 1.111 5.104 1.00 0.00 O ATOM 1348 CB ALA A 88 -4.017 1.008 2.455 1.00 0.00 C ATOM 0 H ALA A 88 -4.988 -0.312 4.627 1.00 0.00 H new ATOM 0 HA ALA A 88 -2.973 -0.846 2.519 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.215 1.529 1.932 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -4.745 0.642 1.731 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.506 1.695 3.145 1.00 0.00 H new ATOM 1354 N VAL A 89 -1.162 -0.186 4.054 1.00 0.00 N ATOM 1355 CA VAL A 89 -0.084 0.153 4.968 1.00 0.00 C ATOM 1356 C VAL A 89 1.062 0.820 4.221 1.00 0.00 C ATOM 1357 O VAL A 89 1.669 0.224 3.329 1.00 0.00 O ATOM 1358 CB VAL A 89 0.445 -1.091 5.718 1.00 0.00 C ATOM 1359 CG1 VAL A 89 1.548 -0.705 6.697 1.00 0.00 C ATOM 1360 CG2 VAL A 89 -0.687 -1.808 6.446 1.00 0.00 C ATOM 0 H VAL A 89 -0.897 -0.823 3.303 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.493 0.847 5.702 1.00 0.00 H new ATOM 0 HB VAL A 89 0.865 -1.775 4.980 1.00 0.00 H new ATOM 0 HG11 VAL A 89 1.905 -1.596 7.213 1.00 0.00 H new ATOM 0 HG12 VAL A 89 2.373 -0.246 6.153 1.00 0.00 H new ATOM 0 HG13 VAL A 89 1.156 0.004 7.426 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -0.290 -2.680 6.966 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -1.142 -1.130 7.168 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -1.439 -2.127 5.724 1.00 0.00 H new ATOM 1370 N ASP A 90 1.349 2.058 4.584 1.00 0.00 N ATOM 1371 CA ASP A 90 2.452 2.785 3.981 1.00 0.00 C ATOM 1372 C ASP A 90 3.512 3.037 5.047 1.00 0.00 C ATOM 1373 O ASP A 90 3.299 2.726 6.222 1.00 0.00 O ATOM 1374 CB ASP A 90 1.968 4.110 3.376 1.00 0.00 C ATOM 1375 CG ASP A 90 2.845 4.599 2.229 1.00 0.00 C ATOM 1376 OD1 ASP A 90 4.027 4.923 2.462 1.00 0.00 O ATOM 1377 OD2 ASP A 90 2.344 4.682 1.090 1.00 0.00 O ATOM 0 H ASP A 90 0.834 2.580 5.293 1.00 0.00 H new ATOM 0 HA ASP A 90 2.878 2.192 3.172 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.946 3.987 3.017 1.00 0.00 H new ATOM 0 HB3 ASP A 90 1.943 4.871 4.156 1.00 0.00 H new ATOM 1382 N GLN A 91 4.636 3.614 4.643 1.00 0.00 N ATOM 1383 CA GLN A 91 5.775 3.825 5.526 1.00 0.00 C ATOM 1384 C GLN A 91 6.329 2.497 6.031 1.00 0.00 C ATOM 1385 O GLN A 91 6.780 2.388 7.172 1.00 0.00 O ATOM 1386 CB GLN A 91 5.413 4.739 6.697 1.00 0.00 C ATOM 1387 CG GLN A 91 5.713 6.208 6.440 1.00 0.00 C ATOM 1388 CD GLN A 91 4.872 6.836 5.342 1.00 0.00 C ATOM 1389 OE1 GLN A 91 3.638 6.392 5.207 1.00 0.00 O flip ATOM 1390 NE2 GLN A 91 5.326 7.737 4.638 1.00 0.00 N flip ATOM 0 H GLN A 91 4.784 3.950 3.691 1.00 0.00 H new ATOM 0 HA GLN A 91 6.552 4.320 4.944 1.00 0.00 H new ATOM 0 HB2 GLN A 91 4.352 4.627 6.919 1.00 0.00 H new ATOM 0 HB3 GLN A 91 5.960 4.415 7.582 1.00 0.00 H new ATOM 0 HG2 GLN A 91 5.558 6.765 7.364 1.00 0.00 H new ATOM 0 HG3 GLN A 91 6.766 6.311 6.179 1.00 0.00 H new ATOM 0 HE21 GLN A 91 6.286 8.054 4.772 1.00 0.00 H new ATOM 0 HE22 GLN A 91 4.742 8.167 3.920 1.00 0.00 H new ATOM 1399 N VAL A 92 6.321 1.500 5.159 1.00 0.00 N ATOM 1400 CA VAL A 92 6.913 0.209 5.466 1.00 0.00 C ATOM 1401 C VAL A 92 8.413 0.386 5.710 1.00 0.00 C ATOM 1402 O VAL A 92 8.995 1.391 5.290 1.00 0.00 O ATOM 1403 CB VAL A 92 6.666 -0.800 4.315 1.00 0.00 C ATOM 1404 CG1 VAL A 92 7.139 -2.202 4.690 1.00 0.00 C ATOM 1405 CG2 VAL A 92 5.190 -0.820 3.929 1.00 0.00 C ATOM 0 H VAL A 92 5.908 1.562 4.228 1.00 0.00 H new ATOM 0 HA VAL A 92 6.445 -0.191 6.365 1.00 0.00 H new ATOM 0 HB VAL A 92 7.249 -0.471 3.455 1.00 0.00 H new ATOM 0 HG11 VAL A 92 6.951 -2.884 3.860 1.00 0.00 H new ATOM 0 HG12 VAL A 92 8.207 -2.180 4.906 1.00 0.00 H new ATOM 0 HG13 VAL A 92 6.597 -2.545 5.572 1.00 0.00 H new ATOM 0 HG21 VAL A 92 5.035 -1.534 3.120 1.00 0.00 H new ATOM 0 HG22 VAL A 92 4.592 -1.114 4.792 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.887 0.174 3.599 1.00 0.00 H new ATOM 1415 N GLU A 93 9.009 -0.568 6.428 1.00 0.00 N ATOM 1416 CA GLU A 93 10.430 -0.535 6.797 1.00 0.00 C ATOM 1417 C GLU A 93 10.685 0.463 7.937 1.00 0.00 C ATOM 1418 O GLU A 93 11.736 0.435 8.574 1.00 0.00 O ATOM 1419 CB GLU A 93 11.311 -0.212 5.578 1.00 0.00 C ATOM 1420 CG GLU A 93 12.805 -0.372 5.822 1.00 0.00 C ATOM 1421 CD GLU A 93 13.230 -1.823 5.979 1.00 0.00 C ATOM 1422 OE1 GLU A 93 13.026 -2.391 7.070 1.00 0.00 O ATOM 1423 OE2 GLU A 93 13.794 -2.390 5.016 1.00 0.00 O ATOM 0 H GLU A 93 8.517 -1.392 6.773 1.00 0.00 H new ATOM 0 HA GLU A 93 10.702 -1.528 7.155 1.00 0.00 H new ATOM 0 HB2 GLU A 93 11.019 -0.860 4.752 1.00 0.00 H new ATOM 0 HB3 GLU A 93 11.114 0.813 5.264 1.00 0.00 H new ATOM 0 HG2 GLU A 93 13.353 0.073 4.991 1.00 0.00 H new ATOM 0 HG3 GLU A 93 13.082 0.181 6.720 1.00 0.00 H new ATOM 1430 N LYS A 94 9.714 1.335 8.210 1.00 0.00 N ATOM 1431 CA LYS A 94 9.833 2.280 9.319 1.00 0.00 C ATOM 1432 C LYS A 94 9.231 1.713 10.602 1.00 0.00 C ATOM 1433 O LYS A 94 9.159 2.401 11.622 1.00 0.00 O ATOM 1434 CB LYS A 94 9.177 3.621 8.982 1.00 0.00 C ATOM 1435 CG LYS A 94 10.138 4.608 8.343 1.00 0.00 C ATOM 1436 CD LYS A 94 10.547 4.185 6.946 1.00 0.00 C ATOM 1437 CE LYS A 94 9.448 4.485 5.943 1.00 0.00 C ATOM 1438 NZ LYS A 94 9.870 4.220 4.545 1.00 0.00 N ATOM 0 H LYS A 94 8.844 1.406 7.683 1.00 0.00 H new ATOM 0 HA LYS A 94 10.898 2.447 9.482 1.00 0.00 H new ATOM 0 HB2 LYS A 94 8.339 3.450 8.307 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.768 4.058 9.893 1.00 0.00 H new ATOM 0 HG2 LYS A 94 9.671 5.592 8.301 1.00 0.00 H new ATOM 0 HG3 LYS A 94 11.027 4.703 8.967 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.460 4.706 6.657 1.00 0.00 H new ATOM 0 HD3 LYS A 94 10.772 3.118 6.936 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.572 3.880 6.176 1.00 0.00 H new ATOM 0 HE3 LYS A 94 9.149 5.529 6.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 9.038 4.242 3.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 10.548 4.948 4.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 10.320 3.284 4.490 1.00 0.00 H new ATOM 1452 N LEU A 95 8.802 0.457 10.543 1.00 0.00 N ATOM 1453 CA LEU A 95 8.244 -0.219 11.709 1.00 0.00 C ATOM 1454 C LEU A 95 9.353 -0.600 12.688 1.00 0.00 C ATOM 1455 O LEU A 95 10.490 -0.843 12.283 1.00 0.00 O ATOM 1456 CB LEU A 95 7.471 -1.469 11.280 1.00 0.00 C ATOM 1457 CG LEU A 95 6.256 -1.218 10.381 1.00 0.00 C ATOM 1458 CD1 LEU A 95 5.632 -2.537 9.952 1.00 0.00 C ATOM 1459 CD2 LEU A 95 5.232 -0.346 11.094 1.00 0.00 C ATOM 0 H LEU A 95 8.830 -0.115 9.699 1.00 0.00 H new ATOM 0 HA LEU A 95 7.558 0.466 12.208 1.00 0.00 H new ATOM 0 HB2 LEU A 95 8.156 -2.137 10.757 1.00 0.00 H new ATOM 0 HB3 LEU A 95 7.136 -1.993 12.175 1.00 0.00 H new ATOM 0 HG LEU A 95 6.591 -0.689 9.489 1.00 0.00 H new ATOM 0 HD11 LEU A 95 4.770 -2.341 9.314 1.00 0.00 H new ATOM 0 HD12 LEU A 95 6.366 -3.124 9.400 1.00 0.00 H new ATOM 0 HD13 LEU A 95 5.312 -3.092 10.834 1.00 0.00 H new ATOM 0 HD21 LEU A 95 4.377 -0.179 10.439 1.00 0.00 H new ATOM 0 HD22 LEU A 95 4.900 -0.845 12.004 1.00 0.00 H new ATOM 0 HD23 LEU A 95 5.685 0.612 11.350 1.00 0.00 H new ATOM 1471 N GLY A 96 9.014 -0.651 13.970 1.00 0.00 N ATOM 1472 CA GLY A 96 9.995 -0.954 14.992 1.00 0.00 C ATOM 1473 C GLY A 96 10.190 -2.441 15.209 1.00 0.00 C ATOM 1474 O GLY A 96 11.154 -3.029 14.711 1.00 0.00 O ATOM 0 H GLY A 96 8.070 -0.487 14.321 1.00 0.00 H new ATOM 0 HA2 GLY A 96 10.949 -0.505 14.715 1.00 0.00 H new ATOM 0 HA3 GLY A 96 9.687 -0.494 15.931 1.00 0.00 H new ATOM 1478 N ASN A 97 9.276 -3.059 15.941 1.00 0.00 N ATOM 1479 CA ASN A 97 9.432 -4.460 16.307 1.00 0.00 C ATOM 1480 C ASN A 97 8.083 -5.152 16.435 1.00 0.00 C ATOM 1481 O ASN A 97 7.746 -6.026 15.635 1.00 0.00 O ATOM 1482 CB ASN A 97 10.196 -4.580 17.628 1.00 0.00 C ATOM 1483 CG ASN A 97 10.529 -6.017 17.982 1.00 0.00 C ATOM 1484 OD1 ASN A 97 10.895 -6.808 16.984 1.00 0.00 O flip ATOM 1485 ND2 ASN A 97 10.489 -6.405 19.149 1.00 0.00 N flip ATOM 0 H ASN A 97 8.425 -2.618 16.291 1.00 0.00 H new ATOM 0 HA ASN A 97 9.996 -4.949 15.513 1.00 0.00 H new ATOM 0 HB2 ASN A 97 11.118 -4.003 17.564 1.00 0.00 H new ATOM 0 HB3 ASN A 97 9.601 -4.141 18.429 1.00 0.00 H new ATOM 0 HD21 ASN A 97 10.202 -5.765 19.890 1.00 0.00 H new ATOM 0 HD22 ASN A 97 10.743 -7.366 19.376 1.00 0.00 H new ATOM 1492 N GLU A 98 7.311 -4.740 17.433 1.00 0.00 N ATOM 1493 CA GLU A 98 6.024 -5.360 17.729 1.00 0.00 C ATOM 1494 C GLU A 98 5.087 -5.266 16.533 1.00 0.00 C ATOM 1495 O GLU A 98 4.320 -6.188 16.254 1.00 0.00 O ATOM 1496 CB GLU A 98 5.386 -4.684 18.943 1.00 0.00 C ATOM 1497 CG GLU A 98 6.270 -4.689 20.180 1.00 0.00 C ATOM 1498 CD GLU A 98 5.627 -3.982 21.355 1.00 0.00 C ATOM 1499 OE1 GLU A 98 5.662 -2.731 21.396 1.00 0.00 O ATOM 1500 OE2 GLU A 98 5.071 -4.668 22.237 1.00 0.00 O ATOM 0 H GLU A 98 7.557 -3.971 18.057 1.00 0.00 H new ATOM 0 HA GLU A 98 6.195 -6.414 17.950 1.00 0.00 H new ATOM 0 HB2 GLU A 98 5.141 -3.653 18.687 1.00 0.00 H new ATOM 0 HB3 GLU A 98 4.447 -5.187 19.176 1.00 0.00 H new ATOM 0 HG2 GLU A 98 6.494 -5.719 20.458 1.00 0.00 H new ATOM 0 HG3 GLU A 98 7.220 -4.208 19.946 1.00 0.00 H new ATOM 1507 N GLU A 99 5.177 -4.154 15.817 1.00 0.00 N ATOM 1508 CA GLU A 99 4.333 -3.911 14.658 1.00 0.00 C ATOM 1509 C GLU A 99 4.627 -4.924 13.558 1.00 0.00 C ATOM 1510 O GLU A 99 3.735 -5.316 12.816 1.00 0.00 O ATOM 1511 CB GLU A 99 4.543 -2.494 14.111 1.00 0.00 C ATOM 1512 CG GLU A 99 4.672 -1.426 15.183 1.00 0.00 C ATOM 1513 CD GLU A 99 6.114 -1.185 15.588 1.00 0.00 C ATOM 1514 OE1 GLU A 99 6.698 -2.038 16.287 1.00 0.00 O ATOM 1515 OE2 GLU A 99 6.676 -0.145 15.190 1.00 0.00 O ATOM 0 H GLU A 99 5.833 -3.400 16.022 1.00 0.00 H new ATOM 0 HA GLU A 99 3.297 -4.016 14.979 1.00 0.00 H new ATOM 0 HB2 GLU A 99 5.442 -2.484 13.494 1.00 0.00 H new ATOM 0 HB3 GLU A 99 3.707 -2.240 13.460 1.00 0.00 H new ATOM 0 HG2 GLU A 99 4.239 -0.494 14.818 1.00 0.00 H new ATOM 0 HG3 GLU A 99 4.096 -1.723 16.059 1.00 0.00 H new ATOM 1522 N GLN A 100 5.879 -5.356 13.467 1.00 0.00 N ATOM 1523 CA GLN A 100 6.279 -6.300 12.433 1.00 0.00 C ATOM 1524 C GLN A 100 5.757 -7.695 12.748 1.00 0.00 C ATOM 1525 O GLN A 100 5.430 -8.463 11.844 1.00 0.00 O ATOM 1526 CB GLN A 100 7.801 -6.321 12.267 1.00 0.00 C ATOM 1527 CG GLN A 100 8.380 -4.975 11.867 1.00 0.00 C ATOM 1528 CD GLN A 100 9.833 -5.058 11.451 1.00 0.00 C ATOM 1529 OE1 GLN A 100 10.587 -5.909 11.927 1.00 0.00 O ATOM 1530 NE2 GLN A 100 10.237 -4.171 10.558 1.00 0.00 N ATOM 0 H GLN A 100 6.631 -5.069 14.094 1.00 0.00 H new ATOM 0 HA GLN A 100 5.840 -5.972 11.491 1.00 0.00 H new ATOM 0 HB2 GLN A 100 8.257 -6.641 13.204 1.00 0.00 H new ATOM 0 HB3 GLN A 100 8.067 -7.062 11.513 1.00 0.00 H new ATOM 0 HG2 GLN A 100 7.795 -4.564 11.044 1.00 0.00 H new ATOM 0 HG3 GLN A 100 8.286 -4.282 12.703 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.580 -3.483 10.189 1.00 0.00 H new ATOM 0 HE22 GLN A 100 11.205 -4.174 10.238 1.00 0.00 H new ATOM 1539 N ALA A 101 5.663 -8.011 14.033 1.00 0.00 N ATOM 1540 CA ALA A 101 5.095 -9.281 14.463 1.00 0.00 C ATOM 1541 C ALA A 101 3.597 -9.309 14.177 1.00 0.00 C ATOM 1542 O ALA A 101 3.051 -10.324 13.737 1.00 0.00 O ATOM 1543 CB ALA A 101 5.365 -9.507 15.942 1.00 0.00 C ATOM 0 H ALA A 101 5.972 -7.406 14.794 1.00 0.00 H new ATOM 0 HA ALA A 101 5.569 -10.087 13.903 1.00 0.00 H new ATOM 0 HB1 ALA A 101 4.934 -10.460 16.249 1.00 0.00 H new ATOM 0 HB2 ALA A 101 6.441 -9.521 16.117 1.00 0.00 H new ATOM 0 HB3 ALA A 101 4.914 -8.702 16.521 1.00 0.00 H new ATOM 1549 N LEU A 102 2.945 -8.176 14.417 1.00 0.00 N ATOM 1550 CA LEU A 102 1.527 -8.019 14.122 1.00 0.00 C ATOM 1551 C LEU A 102 1.319 -8.081 12.609 1.00 0.00 C ATOM 1552 O LEU A 102 0.424 -8.764 12.119 1.00 0.00 O ATOM 1553 CB LEU A 102 1.033 -6.674 14.682 1.00 0.00 C ATOM 1554 CG LEU A 102 -0.472 -6.554 14.962 1.00 0.00 C ATOM 1555 CD1 LEU A 102 -1.291 -6.589 13.682 1.00 0.00 C ATOM 1556 CD2 LEU A 102 -0.924 -7.648 15.915 1.00 0.00 C ATOM 0 H LEU A 102 3.382 -7.346 14.819 1.00 0.00 H new ATOM 0 HA LEU A 102 0.957 -8.821 14.590 1.00 0.00 H new ATOM 0 HB2 LEU A 102 1.569 -6.475 15.610 1.00 0.00 H new ATOM 0 HB3 LEU A 102 1.312 -5.890 13.978 1.00 0.00 H new ATOM 0 HG LEU A 102 -0.642 -5.585 15.431 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -2.350 -6.501 13.925 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -0.996 -5.760 13.039 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -1.115 -7.531 13.163 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -1.993 -7.548 16.103 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -0.723 -8.623 15.471 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -0.381 -7.559 16.856 1.00 0.00 H new ATOM 1568 N LEU A 103 2.170 -7.361 11.888 1.00 0.00 N ATOM 1569 CA LEU A 103 2.160 -7.358 10.426 1.00 0.00 C ATOM 1570 C LEU A 103 2.273 -8.785 9.884 1.00 0.00 C ATOM 1571 O LEU A 103 1.554 -9.170 8.961 1.00 0.00 O ATOM 1572 CB LEU A 103 3.310 -6.471 9.917 1.00 0.00 C ATOM 1573 CG LEU A 103 3.379 -6.207 8.405 1.00 0.00 C ATOM 1574 CD1 LEU A 103 4.045 -7.362 7.673 1.00 0.00 C ATOM 1575 CD2 LEU A 103 1.992 -5.933 7.839 1.00 0.00 C ATOM 0 H LEU A 103 2.887 -6.762 12.298 1.00 0.00 H new ATOM 0 HA LEU A 103 1.215 -6.950 10.067 1.00 0.00 H new ATOM 0 HB2 LEU A 103 3.244 -5.509 10.425 1.00 0.00 H new ATOM 0 HB3 LEU A 103 4.250 -6.929 10.223 1.00 0.00 H new ATOM 0 HG LEU A 103 3.991 -5.319 8.250 1.00 0.00 H new ATOM 0 HD11 LEU A 103 4.079 -7.145 6.605 1.00 0.00 H new ATOM 0 HD12 LEU A 103 5.060 -7.494 8.049 1.00 0.00 H new ATOM 0 HD13 LEU A 103 3.475 -8.276 7.840 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.066 -5.749 6.767 1.00 0.00 H new ATOM 0 HD22 LEU A 103 1.350 -6.796 8.015 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.566 -5.058 8.329 1.00 0.00 H new ATOM 1587 N PHE A 104 3.180 -9.560 10.462 1.00 0.00 N ATOM 1588 CA PHE A 104 3.315 -10.973 10.122 1.00 0.00 C ATOM 1589 C PHE A 104 1.996 -11.714 10.328 1.00 0.00 C ATOM 1590 O PHE A 104 1.556 -12.485 9.473 1.00 0.00 O ATOM 1591 CB PHE A 104 4.407 -11.618 10.975 1.00 0.00 C ATOM 1592 CG PHE A 104 4.451 -13.116 10.861 1.00 0.00 C ATOM 1593 CD1 PHE A 104 4.809 -13.727 9.670 1.00 0.00 C ATOM 1594 CD2 PHE A 104 4.122 -13.913 11.946 1.00 0.00 C ATOM 1595 CE1 PHE A 104 4.834 -15.105 9.565 1.00 0.00 C ATOM 1596 CE2 PHE A 104 4.150 -15.291 11.847 1.00 0.00 C ATOM 1597 CZ PHE A 104 4.505 -15.886 10.655 1.00 0.00 C ATOM 0 H PHE A 104 3.836 -9.234 11.171 1.00 0.00 H new ATOM 0 HA PHE A 104 3.590 -11.042 9.070 1.00 0.00 H new ATOM 0 HB2 PHE A 104 5.374 -11.211 10.681 1.00 0.00 H new ATOM 0 HB3 PHE A 104 4.250 -11.345 12.019 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.071 -13.121 8.816 1.00 0.00 H new ATOM 0 HD2 PHE A 104 3.840 -13.451 12.881 1.00 0.00 H new ATOM 0 HE1 PHE A 104 5.111 -15.571 8.631 1.00 0.00 H new ATOM 0 HE2 PHE A 104 3.894 -15.900 12.701 1.00 0.00 H new ATOM 0 HZ PHE A 104 4.526 -16.963 10.574 1.00 0.00 H new ATOM 1607 N SER A 105 1.381 -11.468 11.473 1.00 0.00 N ATOM 1608 CA SER A 105 0.102 -12.075 11.820 1.00 0.00 C ATOM 1609 C SER A 105 -0.964 -11.700 10.789 1.00 0.00 C ATOM 1610 O SER A 105 -1.833 -12.508 10.450 1.00 0.00 O ATOM 1611 CB SER A 105 -0.317 -11.609 13.215 1.00 0.00 C ATOM 1612 OG SER A 105 -1.367 -12.403 13.744 1.00 0.00 O ATOM 0 H SER A 105 1.752 -10.843 12.189 1.00 0.00 H new ATOM 0 HA SER A 105 0.207 -13.160 11.820 1.00 0.00 H new ATOM 0 HB2 SER A 105 0.542 -11.650 13.885 1.00 0.00 H new ATOM 0 HB3 SER A 105 -0.637 -10.568 13.169 1.00 0.00 H new ATOM 0 HG SER A 105 -2.229 -11.980 13.546 1.00 0.00 H new ATOM 1618 N ILE A 106 -0.887 -10.468 10.293 1.00 0.00 N ATOM 1619 CA ILE A 106 -1.774 -10.006 9.231 1.00 0.00 C ATOM 1620 C ILE A 106 -1.598 -10.861 7.978 1.00 0.00 C ATOM 1621 O ILE A 106 -2.576 -11.346 7.406 1.00 0.00 O ATOM 1622 CB ILE A 106 -1.522 -8.519 8.885 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -1.828 -7.640 10.099 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -2.358 -8.086 7.684 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -1.540 -6.170 9.879 1.00 0.00 C ATOM 0 H ILE A 106 -0.216 -9.769 10.612 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.797 -10.103 9.596 1.00 0.00 H new ATOM 0 HB ILE A 106 -0.471 -8.401 8.619 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -2.878 -7.759 10.366 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -1.242 -7.992 10.948 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -2.161 -7.037 7.463 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -2.095 -8.695 6.819 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -3.416 -8.217 7.911 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -1.782 -5.612 10.784 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.484 -6.037 9.643 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -2.146 -5.800 9.052 1.00 0.00 H new ATOM 1637 N PHE A 107 -0.348 -11.061 7.568 1.00 0.00 N ATOM 1638 CA PHE A 107 -0.044 -11.893 6.408 1.00 0.00 C ATOM 1639 C PHE A 107 -0.519 -13.322 6.621 1.00 0.00 C ATOM 1640 O PHE A 107 -0.904 -14.007 5.669 1.00 0.00 O ATOM 1641 CB PHE A 107 1.453 -11.878 6.110 1.00 0.00 C ATOM 1642 CG PHE A 107 1.863 -10.799 5.154 1.00 0.00 C ATOM 1643 CD1 PHE A 107 1.843 -11.035 3.791 1.00 0.00 C ATOM 1644 CD2 PHE A 107 2.267 -9.559 5.611 1.00 0.00 C ATOM 1645 CE1 PHE A 107 2.219 -10.052 2.901 1.00 0.00 C ATOM 1646 CE2 PHE A 107 2.644 -8.570 4.723 1.00 0.00 C ATOM 1647 CZ PHE A 107 2.620 -8.818 3.366 1.00 0.00 C ATOM 0 H PHE A 107 0.471 -10.658 8.023 1.00 0.00 H new ATOM 0 HA PHE A 107 -0.576 -11.477 5.553 1.00 0.00 H new ATOM 0 HB2 PHE A 107 2.000 -11.751 7.044 1.00 0.00 H new ATOM 0 HB3 PHE A 107 1.743 -12.845 5.700 1.00 0.00 H new ATOM 0 HD1 PHE A 107 1.529 -12.000 3.420 1.00 0.00 H new ATOM 0 HD2 PHE A 107 2.288 -9.361 6.673 1.00 0.00 H new ATOM 0 HE1 PHE A 107 2.199 -10.249 1.839 1.00 0.00 H new ATOM 0 HE2 PHE A 107 2.957 -7.604 5.091 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.915 -8.047 2.670 1.00 0.00 H new ATOM 1657 N ASN A 108 -0.487 -13.768 7.870 1.00 0.00 N ATOM 1658 CA ASN A 108 -1.013 -15.076 8.221 1.00 0.00 C ATOM 1659 C ASN A 108 -2.502 -15.127 7.920 1.00 0.00 C ATOM 1660 O ASN A 108 -2.935 -15.924 7.103 1.00 0.00 O ATOM 1661 CB ASN A 108 -0.773 -15.393 9.697 1.00 0.00 C ATOM 1662 CG ASN A 108 -1.305 -16.759 10.082 1.00 0.00 C ATOM 1663 OD1 ASN A 108 -1.277 -17.698 9.287 1.00 0.00 O ATOM 1664 ND2 ASN A 108 -1.809 -16.874 11.297 1.00 0.00 N ATOM 0 H ASN A 108 -0.102 -13.242 8.655 1.00 0.00 H new ATOM 0 HA ASN A 108 -0.491 -15.824 7.624 1.00 0.00 H new ATOM 0 HB2 ASN A 108 0.296 -15.348 9.908 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -1.251 -14.632 10.313 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -2.194 -17.766 11.607 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -1.813 -16.071 11.926 1.00 0.00 H new ATOM 1671 N ARG A 109 -3.267 -14.236 8.551 1.00 0.00 N ATOM 1672 CA ARG A 109 -4.724 -14.207 8.389 1.00 0.00 C ATOM 1673 C ARG A 109 -5.117 -14.145 6.916 1.00 0.00 C ATOM 1674 O ARG A 109 -5.952 -14.921 6.451 1.00 0.00 O ATOM 1675 CB ARG A 109 -5.321 -13.013 9.162 1.00 0.00 C ATOM 1676 CG ARG A 109 -6.838 -12.858 9.036 1.00 0.00 C ATOM 1677 CD ARG A 109 -7.229 -11.994 7.839 1.00 0.00 C ATOM 1678 NE ARG A 109 -8.679 -11.927 7.638 1.00 0.00 N ATOM 1679 CZ ARG A 109 -9.281 -11.106 6.769 1.00 0.00 C ATOM 1680 NH1 ARG A 109 -8.568 -10.251 6.048 1.00 0.00 N ATOM 1681 NH2 ARG A 109 -10.600 -11.129 6.621 1.00 0.00 N ATOM 0 H ARG A 109 -2.902 -13.522 9.181 1.00 0.00 H new ATOM 0 HA ARG A 109 -5.130 -15.131 8.800 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -5.068 -13.118 10.217 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -4.846 -12.097 8.810 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -7.296 -13.842 8.937 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.234 -12.413 9.949 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -6.839 -10.986 7.981 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -6.760 -12.393 6.940 1.00 0.00 H new ATOM 0 HE ARG A 109 -9.267 -12.546 8.196 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -7.554 -10.216 6.154 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -9.034 -9.628 5.388 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -11.164 -11.776 7.172 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -11.050 -10.499 5.956 1.00 0.00 H new ATOM 1695 N PHE A 110 -4.500 -13.231 6.182 1.00 0.00 N ATOM 1696 CA PHE A 110 -4.851 -13.016 4.785 1.00 0.00 C ATOM 1697 C PHE A 110 -4.569 -14.255 3.934 1.00 0.00 C ATOM 1698 O PHE A 110 -5.465 -14.781 3.277 1.00 0.00 O ATOM 1699 CB PHE A 110 -4.095 -11.808 4.225 1.00 0.00 C ATOM 1700 CG PHE A 110 -4.652 -10.471 4.656 1.00 0.00 C ATOM 1701 CD1 PHE A 110 -4.962 -10.219 5.983 1.00 0.00 C ATOM 1702 CD2 PHE A 110 -4.868 -9.467 3.725 1.00 0.00 C ATOM 1703 CE1 PHE A 110 -5.474 -8.996 6.373 1.00 0.00 C ATOM 1704 CE2 PHE A 110 -5.380 -8.243 4.111 1.00 0.00 C ATOM 1705 CZ PHE A 110 -5.683 -8.007 5.436 1.00 0.00 C ATOM 0 H PHE A 110 -3.755 -12.627 6.529 1.00 0.00 H new ATOM 0 HA PHE A 110 -5.922 -12.819 4.742 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -3.052 -11.871 4.536 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -4.107 -11.859 3.136 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -4.801 -10.989 6.723 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -4.633 -9.644 2.686 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -5.710 -8.815 7.411 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -5.543 -7.470 3.374 1.00 0.00 H new ATOM 0 HZ PHE A 110 -6.083 -7.050 5.738 1.00 0.00 H new ATOM 1715 N ARG A 111 -3.337 -14.744 3.970 1.00 0.00 N ATOM 1716 CA ARG A 111 -2.941 -15.846 3.101 1.00 0.00 C ATOM 1717 C ARG A 111 -3.417 -17.200 3.625 1.00 0.00 C ATOM 1718 O ARG A 111 -3.476 -18.166 2.868 1.00 0.00 O ATOM 1719 CB ARG A 111 -1.426 -15.854 2.881 1.00 0.00 C ATOM 1720 CG ARG A 111 -1.013 -15.217 1.561 1.00 0.00 C ATOM 1721 CD ARG A 111 -1.556 -16.018 0.387 1.00 0.00 C ATOM 1722 NE ARG A 111 -1.477 -15.289 -0.879 1.00 0.00 N ATOM 1723 CZ ARG A 111 -2.250 -15.561 -1.933 1.00 0.00 C ATOM 1724 NH1 ARG A 111 -3.114 -16.572 -1.887 1.00 0.00 N ATOM 1725 NH2 ARG A 111 -2.153 -14.828 -3.038 1.00 0.00 N ATOM 0 H ARG A 111 -2.600 -14.400 4.585 1.00 0.00 H new ATOM 0 HA ARG A 111 -3.432 -15.682 2.141 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -0.943 -15.323 3.701 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -1.066 -16.882 2.910 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -1.385 -14.193 1.513 1.00 0.00 H new ATOM 0 HG3 ARG A 111 0.074 -15.164 1.501 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -0.998 -16.951 0.300 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -2.594 -16.285 0.584 1.00 0.00 H new ATOM 0 HE ARG A 111 -0.796 -14.534 -0.961 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -3.187 -17.142 -1.044 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -3.703 -16.777 -2.694 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -1.487 -14.056 -3.081 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -2.744 -15.037 -3.842 1.00 0.00 H new ATOM 1739 N ASN A 112 -3.765 -17.270 4.905 1.00 0.00 N ATOM 1740 CA ASN A 112 -4.238 -18.520 5.498 1.00 0.00 C ATOM 1741 C ASN A 112 -5.544 -18.948 4.843 1.00 0.00 C ATOM 1742 O ASN A 112 -5.712 -20.104 4.452 1.00 0.00 O ATOM 1743 CB ASN A 112 -4.464 -18.352 7.000 1.00 0.00 C ATOM 1744 CG ASN A 112 -4.278 -19.639 7.773 1.00 0.00 C ATOM 1745 OD1 ASN A 112 -5.201 -20.440 7.914 1.00 0.00 O ATOM 1746 ND2 ASN A 112 -3.078 -19.832 8.296 1.00 0.00 N ATOM 0 H ASN A 112 -3.730 -16.481 5.551 1.00 0.00 H new ATOM 0 HA ASN A 112 -3.477 -19.283 5.334 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -3.774 -17.601 7.384 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -5.472 -17.975 7.170 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -2.889 -20.673 8.842 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -2.342 -19.140 8.153 1.00 0.00 H new ATOM 1753 N SER A 113 -6.467 -17.999 4.719 1.00 0.00 N ATOM 1754 CA SER A 113 -7.761 -18.266 4.111 1.00 0.00 C ATOM 1755 C SER A 113 -7.770 -17.846 2.641 1.00 0.00 C ATOM 1756 O SER A 113 -8.748 -18.077 1.931 1.00 0.00 O ATOM 1757 CB SER A 113 -8.854 -17.518 4.878 1.00 0.00 C ATOM 1758 OG SER A 113 -8.809 -17.835 6.260 1.00 0.00 O ATOM 0 H SER A 113 -6.340 -17.037 5.033 1.00 0.00 H new ATOM 0 HA SER A 113 -7.953 -19.338 4.159 1.00 0.00 H new ATOM 0 HB2 SER A 113 -8.729 -16.444 4.743 1.00 0.00 H new ATOM 0 HB3 SER A 113 -9.832 -17.778 4.473 1.00 0.00 H new ATOM 0 HG SER A 113 -9.515 -17.345 6.731 1.00 0.00 H new ATOM 1764 N GLY A 114 -6.673 -17.239 2.193 1.00 0.00 N ATOM 1765 CA GLY A 114 -6.607 -16.729 0.835 1.00 0.00 C ATOM 1766 C GLY A 114 -7.588 -15.594 0.622 1.00 0.00 C ATOM 1767 O GLY A 114 -8.191 -15.464 -0.444 1.00 0.00 O ATOM 0 H GLY A 114 -5.829 -17.092 2.747 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -5.596 -16.382 0.624 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -6.821 -17.534 0.132 1.00 0.00 H new ATOM 1771 N LYS A 115 -7.730 -14.764 1.643 1.00 0.00 N ATOM 1772 CA LYS A 115 -8.735 -13.730 1.663 1.00 0.00 C ATOM 1773 C LYS A 115 -8.099 -12.417 2.098 1.00 0.00 C ATOM 1774 O LYS A 115 -6.923 -12.381 2.458 1.00 0.00 O ATOM 1775 CB LYS A 115 -9.844 -14.152 2.630 1.00 0.00 C ATOM 1776 CG LYS A 115 -11.126 -13.364 2.503 1.00 0.00 C ATOM 1777 CD LYS A 115 -12.245 -14.012 3.303 1.00 0.00 C ATOM 1778 CE LYS A 115 -13.555 -13.256 3.161 1.00 0.00 C ATOM 1779 NZ LYS A 115 -13.503 -11.920 3.808 1.00 0.00 N ATOM 0 H LYS A 115 -7.147 -14.794 2.480 1.00 0.00 H new ATOM 0 HA LYS A 115 -9.163 -13.587 0.671 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -10.065 -15.207 2.470 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -9.474 -14.055 3.651 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -10.967 -12.344 2.854 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -11.415 -13.299 1.454 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -12.381 -15.040 2.969 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -11.962 -14.054 4.355 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -13.791 -13.137 2.104 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -14.361 -13.842 3.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -14.465 -11.622 4.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -12.914 -11.971 4.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -13.093 -11.230 3.147 1.00 0.00 H new ATOM 1793 N GLY A 116 -8.871 -11.349 2.064 1.00 0.00 N ATOM 1794 CA GLY A 116 -8.357 -10.055 2.449 1.00 0.00 C ATOM 1795 C GLY A 116 -7.679 -9.330 1.301 1.00 0.00 C ATOM 1796 O GLY A 116 -7.333 -9.937 0.283 1.00 0.00 O ATOM 0 H GLY A 116 -9.849 -11.353 1.776 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -9.174 -9.442 2.829 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -7.646 -10.179 3.266 1.00 0.00 H new ATOM 1800 N PHE A 117 -7.511 -8.026 1.463 1.00 0.00 N ATOM 1801 CA PHE A 117 -6.848 -7.193 0.475 1.00 0.00 C ATOM 1802 C PHE A 117 -5.818 -6.313 1.171 1.00 0.00 C ATOM 1803 O PHE A 117 -6.112 -5.693 2.193 1.00 0.00 O ATOM 1804 CB PHE A 117 -7.868 -6.321 -0.263 1.00 0.00 C ATOM 1805 CG PHE A 117 -8.893 -7.093 -1.052 1.00 0.00 C ATOM 1806 CD1 PHE A 117 -10.005 -7.642 -0.430 1.00 0.00 C ATOM 1807 CD2 PHE A 117 -8.746 -7.263 -2.417 1.00 0.00 C ATOM 1808 CE1 PHE A 117 -10.947 -8.345 -1.156 1.00 0.00 C ATOM 1809 CE2 PHE A 117 -9.686 -7.964 -3.149 1.00 0.00 C ATOM 1810 CZ PHE A 117 -10.788 -8.507 -2.516 1.00 0.00 C ATOM 0 H PHE A 117 -7.832 -7.516 2.286 1.00 0.00 H new ATOM 0 HA PHE A 117 -6.351 -7.832 -0.255 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -8.384 -5.693 0.464 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -7.335 -5.653 -0.939 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -10.136 -7.518 0.635 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -7.886 -6.843 -2.917 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -11.807 -8.767 -0.659 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -9.559 -8.087 -4.214 1.00 0.00 H new ATOM 0 HZ PHE A 117 -11.523 -9.057 -3.085 1.00 0.00 H new ATOM 1820 N LEU A 118 -4.619 -6.256 0.622 1.00 0.00 N ATOM 1821 CA LEU A 118 -3.530 -5.521 1.245 1.00 0.00 C ATOM 1822 C LEU A 118 -2.783 -4.689 0.214 1.00 0.00 C ATOM 1823 O LEU A 118 -2.465 -5.156 -0.881 1.00 0.00 O ATOM 1824 CB LEU A 118 -2.558 -6.482 1.922 1.00 0.00 C ATOM 1825 CG LEU A 118 -1.531 -5.837 2.856 1.00 0.00 C ATOM 1826 CD1 LEU A 118 -2.215 -5.155 4.029 1.00 0.00 C ATOM 1827 CD2 LEU A 118 -0.543 -6.877 3.352 1.00 0.00 C ATOM 0 H LEU A 118 -4.372 -6.711 -0.257 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.959 -4.856 1.994 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -3.134 -7.211 2.493 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -2.023 -7.034 1.149 1.00 0.00 H new ATOM 0 HG LEU A 118 -0.989 -5.078 2.292 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -1.463 -4.705 4.677 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -2.886 -4.380 3.658 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -2.788 -5.890 4.594 1.00 0.00 H new ATOM 0 HD21 LEU A 118 0.181 -6.404 4.015 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -1.077 -7.656 3.895 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -0.022 -7.319 2.502 1.00 0.00 H new ATOM 1839 N LEU A 119 -2.484 -3.468 0.588 1.00 0.00 N ATOM 1840 CA LEU A 119 -1.784 -2.545 -0.288 1.00 0.00 C ATOM 1841 C LEU A 119 -0.587 -1.957 0.444 1.00 0.00 C ATOM 1842 O LEU A 119 -0.741 -1.317 1.485 1.00 0.00 O ATOM 1843 CB LEU A 119 -2.737 -1.438 -0.753 1.00 0.00 C ATOM 1844 CG LEU A 119 -2.167 -0.456 -1.781 1.00 0.00 C ATOM 1845 CD1 LEU A 119 -1.691 -1.192 -3.022 1.00 0.00 C ATOM 1846 CD2 LEU A 119 -3.212 0.584 -2.150 1.00 0.00 C ATOM 0 H LEU A 119 -2.716 -3.083 1.503 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.427 -3.079 -1.169 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.626 -1.905 -1.178 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -3.061 -0.873 0.121 1.00 0.00 H new ATOM 0 HG LEU A 119 -1.311 0.050 -1.335 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -1.290 -0.475 -3.739 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -0.913 -1.904 -2.747 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -2.528 -1.726 -3.472 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -2.794 1.276 -2.881 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -4.084 0.088 -2.576 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -3.508 1.135 -1.257 1.00 0.00 H new ATOM 1858 N LEU A 120 0.601 -2.202 -0.089 1.00 0.00 N ATOM 1859 CA LEU A 120 1.833 -1.763 0.549 1.00 0.00 C ATOM 1860 C LEU A 120 2.628 -0.853 -0.379 1.00 0.00 C ATOM 1861 O LEU A 120 2.570 -0.996 -1.604 1.00 0.00 O ATOM 1862 CB LEU A 120 2.685 -2.975 0.937 1.00 0.00 C ATOM 1863 CG LEU A 120 2.017 -3.977 1.882 1.00 0.00 C ATOM 1864 CD1 LEU A 120 2.914 -5.185 2.095 1.00 0.00 C ATOM 1865 CD2 LEU A 120 1.691 -3.321 3.214 1.00 0.00 C ATOM 0 H LEU A 120 0.738 -2.705 -0.966 1.00 0.00 H new ATOM 0 HA LEU A 120 1.571 -1.203 1.447 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.975 -3.499 0.026 1.00 0.00 H new ATOM 0 HB3 LEU A 120 3.602 -2.617 1.405 1.00 0.00 H new ATOM 0 HG LEU A 120 1.086 -4.311 1.424 1.00 0.00 H new ATOM 0 HD11 LEU A 120 2.424 -5.888 2.769 1.00 0.00 H new ATOM 0 HD12 LEU A 120 3.102 -5.672 1.138 1.00 0.00 H new ATOM 0 HD13 LEU A 120 3.860 -4.863 2.531 1.00 0.00 H new ATOM 0 HD21 LEU A 120 1.217 -4.049 3.872 1.00 0.00 H new ATOM 0 HD22 LEU A 120 2.610 -2.959 3.676 1.00 0.00 H new ATOM 0 HD23 LEU A 120 1.013 -2.484 3.051 1.00 0.00 H new ATOM 1877 N GLY A 121 3.364 0.081 0.207 1.00 0.00 N ATOM 1878 CA GLY A 121 4.213 0.958 -0.571 1.00 0.00 C ATOM 1879 C GLY A 121 5.538 1.203 0.117 1.00 0.00 C ATOM 1880 O GLY A 121 5.957 0.397 0.949 1.00 0.00 O ATOM 0 H GLY A 121 3.387 0.247 1.213 1.00 0.00 H new ATOM 0 HA2 GLY A 121 4.388 0.519 -1.553 1.00 0.00 H new ATOM 0 HA3 GLY A 121 3.705 1.909 -0.733 1.00 0.00 H new ATOM 1884 N SER A 122 6.177 2.326 -0.221 1.00 0.00 N ATOM 1885 CA SER A 122 7.464 2.726 0.361 1.00 0.00 C ATOM 1886 C SER A 122 8.622 1.868 -0.155 1.00 0.00 C ATOM 1887 O SER A 122 8.430 0.713 -0.545 1.00 0.00 O ATOM 1888 CB SER A 122 7.418 2.659 1.890 1.00 0.00 C ATOM 1889 OG SER A 122 6.381 3.474 2.407 1.00 0.00 O ATOM 0 H SER A 122 5.816 2.987 -0.909 1.00 0.00 H new ATOM 0 HA SER A 122 7.640 3.756 0.050 1.00 0.00 H new ATOM 0 HB2 SER A 122 7.266 1.627 2.207 1.00 0.00 H new ATOM 0 HB3 SER A 122 8.376 2.980 2.300 1.00 0.00 H new ATOM 0 HG SER A 122 6.758 4.321 2.725 1.00 0.00 H new ATOM 1895 N GLU A 123 9.821 2.458 -0.163 1.00 0.00 N ATOM 1896 CA GLU A 123 11.048 1.746 -0.511 1.00 0.00 C ATOM 1897 C GLU A 123 11.010 1.201 -1.936 1.00 0.00 C ATOM 1898 O GLU A 123 10.218 1.647 -2.771 1.00 0.00 O ATOM 1899 CB GLU A 123 11.318 0.623 0.499 1.00 0.00 C ATOM 1900 CG GLU A 123 12.285 1.012 1.611 1.00 0.00 C ATOM 1901 CD GLU A 123 11.920 2.314 2.296 1.00 0.00 C ATOM 1902 OE1 GLU A 123 12.352 3.383 1.813 1.00 0.00 O ATOM 1903 OE2 GLU A 123 11.220 2.279 3.327 1.00 0.00 O ATOM 0 H GLU A 123 9.965 3.440 0.071 1.00 0.00 H new ATOM 0 HA GLU A 123 11.868 2.462 -0.467 1.00 0.00 H new ATOM 0 HB2 GLU A 123 10.373 0.314 0.945 1.00 0.00 H new ATOM 0 HB3 GLU A 123 11.718 -0.241 -0.031 1.00 0.00 H new ATOM 0 HG2 GLU A 123 12.313 0.215 2.354 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.289 1.097 1.196 1.00 0.00 H new ATOM 1910 N TYR A 124 11.909 0.275 -2.224 1.00 0.00 N ATOM 1911 CA TYR A 124 11.995 -0.306 -3.548 1.00 0.00 C ATOM 1912 C TYR A 124 11.277 -1.647 -3.595 1.00 0.00 C ATOM 1913 O TYR A 124 10.118 -1.714 -3.971 1.00 0.00 O ATOM 1914 CB TYR A 124 13.455 -0.449 -3.976 1.00 0.00 C ATOM 1915 CG TYR A 124 14.190 0.872 -4.000 1.00 0.00 C ATOM 1916 CD1 TYR A 124 14.013 1.767 -5.050 1.00 0.00 C ATOM 1917 CD2 TYR A 124 15.044 1.235 -2.965 1.00 0.00 C ATOM 1918 CE1 TYR A 124 14.666 2.985 -5.066 1.00 0.00 C ATOM 1919 CE2 TYR A 124 15.703 2.450 -2.976 1.00 0.00 C ATOM 1920 CZ TYR A 124 15.510 3.320 -4.028 1.00 0.00 C ATOM 1921 OH TYR A 124 16.158 4.534 -4.039 1.00 0.00 O ATOM 0 H TYR A 124 12.589 -0.089 -1.556 1.00 0.00 H new ATOM 0 HA TYR A 124 11.500 0.363 -4.252 1.00 0.00 H new ATOM 0 HB2 TYR A 124 13.964 -1.130 -3.294 1.00 0.00 H new ATOM 0 HB3 TYR A 124 13.496 -0.900 -4.967 1.00 0.00 H new ATOM 0 HD1 TYR A 124 13.355 1.506 -5.866 1.00 0.00 H new ATOM 0 HD2 TYR A 124 15.195 0.556 -2.139 1.00 0.00 H new ATOM 0 HE1 TYR A 124 14.516 3.671 -5.887 1.00 0.00 H new ATOM 0 HE2 TYR A 124 16.365 2.716 -2.165 1.00 0.00 H new ATOM 0 HH TYR A 124 16.714 4.616 -3.236 1.00 0.00 H new ATOM 1931 N THR A 125 11.948 -2.713 -3.195 1.00 0.00 N ATOM 1932 CA THR A 125 11.334 -4.030 -3.230 1.00 0.00 C ATOM 1933 C THR A 125 11.594 -4.799 -1.937 1.00 0.00 C ATOM 1934 O THR A 125 12.601 -4.569 -1.263 1.00 0.00 O ATOM 1935 CB THR A 125 11.851 -4.852 -4.432 1.00 0.00 C ATOM 1936 OG1 THR A 125 13.271 -4.690 -4.570 1.00 0.00 O ATOM 1937 CG2 THR A 125 11.158 -4.438 -5.722 1.00 0.00 C ATOM 0 H THR A 125 12.906 -2.695 -2.846 1.00 0.00 H new ATOM 0 HA THR A 125 10.260 -3.880 -3.338 1.00 0.00 H new ATOM 0 HB THR A 125 11.623 -5.901 -4.242 1.00 0.00 H new ATOM 0 HG1 THR A 125 13.588 -5.216 -5.334 1.00 0.00 H new ATOM 0 HG21 THR A 125 11.543 -5.034 -6.549 1.00 0.00 H new ATOM 0 HG22 THR A 125 10.084 -4.600 -5.627 1.00 0.00 H new ATOM 0 HG23 THR A 125 11.349 -3.383 -5.915 1.00 0.00 H new ATOM 1945 N PRO A 126 10.691 -5.735 -1.585 1.00 0.00 N ATOM 1946 CA PRO A 126 10.841 -6.593 -0.397 1.00 0.00 C ATOM 1947 C PRO A 126 12.084 -7.469 -0.480 1.00 0.00 C ATOM 1948 O PRO A 126 12.558 -8.006 0.520 1.00 0.00 O ATOM 1949 CB PRO A 126 9.584 -7.466 -0.422 1.00 0.00 C ATOM 1950 CG PRO A 126 8.610 -6.726 -1.270 1.00 0.00 C ATOM 1951 CD PRO A 126 9.433 -6.014 -2.301 1.00 0.00 C ATOM 0 HA PRO A 126 10.952 -6.007 0.516 1.00 0.00 H new ATOM 0 HB2 PRO A 126 9.797 -8.451 -0.836 1.00 0.00 H new ATOM 0 HB3 PRO A 126 9.192 -7.621 0.583 1.00 0.00 H new ATOM 0 HG2 PRO A 126 7.900 -7.408 -1.738 1.00 0.00 H new ATOM 0 HG3 PRO A 126 8.030 -6.020 -0.676 1.00 0.00 H new ATOM 0 HD2 PRO A 126 9.599 -6.633 -3.183 1.00 0.00 H new ATOM 0 HD3 PRO A 126 8.950 -5.098 -2.641 1.00 0.00 H new ATOM 1959 N GLN A 127 12.605 -7.580 -1.688 1.00 0.00 N ATOM 1960 CA GLN A 127 13.787 -8.380 -1.972 1.00 0.00 C ATOM 1961 C GLN A 127 15.029 -7.773 -1.330 1.00 0.00 C ATOM 1962 O GLN A 127 16.037 -8.450 -1.154 1.00 0.00 O ATOM 1963 CB GLN A 127 13.994 -8.475 -3.483 1.00 0.00 C ATOM 1964 CG GLN A 127 12.838 -9.132 -4.215 1.00 0.00 C ATOM 1965 CD GLN A 127 12.924 -8.948 -5.715 1.00 0.00 C ATOM 1966 OE1 GLN A 127 14.012 -8.833 -6.280 1.00 0.00 O ATOM 1967 NE2 GLN A 127 11.773 -8.915 -6.369 1.00 0.00 N ATOM 0 H GLN A 127 12.218 -7.114 -2.509 1.00 0.00 H new ATOM 0 HA GLN A 127 13.632 -9.375 -1.554 1.00 0.00 H new ATOM 0 HB2 GLN A 127 14.145 -7.473 -3.884 1.00 0.00 H new ATOM 0 HB3 GLN A 127 14.906 -9.038 -3.682 1.00 0.00 H new ATOM 0 HG2 GLN A 127 12.823 -10.197 -3.983 1.00 0.00 H new ATOM 0 HG3 GLN A 127 11.898 -8.714 -3.854 1.00 0.00 H new ATOM 0 HE21 GLN A 127 10.894 -9.014 -5.860 1.00 0.00 H new ATOM 0 HE22 GLN A 127 11.765 -8.790 -7.381 1.00 0.00 H new ATOM 1976 N GLN A 128 14.949 -6.497 -0.982 1.00 0.00 N ATOM 1977 CA GLN A 128 16.088 -5.802 -0.404 1.00 0.00 C ATOM 1978 C GLN A 128 15.701 -5.083 0.886 1.00 0.00 C ATOM 1979 O GLN A 128 16.457 -4.258 1.401 1.00 0.00 O ATOM 1980 CB GLN A 128 16.668 -4.818 -1.421 1.00 0.00 C ATOM 1981 CG GLN A 128 15.674 -3.781 -1.908 1.00 0.00 C ATOM 1982 CD GLN A 128 16.208 -2.984 -3.079 1.00 0.00 C ATOM 1983 OE1 GLN A 128 16.836 -1.942 -2.904 1.00 0.00 O ATOM 1984 NE2 GLN A 128 15.964 -3.473 -4.283 1.00 0.00 N ATOM 0 H GLN A 128 14.111 -5.925 -1.089 1.00 0.00 H new ATOM 0 HA GLN A 128 16.850 -6.540 -0.152 1.00 0.00 H new ATOM 0 HB2 GLN A 128 17.520 -4.308 -0.973 1.00 0.00 H new ATOM 0 HB3 GLN A 128 17.045 -5.376 -2.278 1.00 0.00 H new ATOM 0 HG2 GLN A 128 14.748 -4.276 -2.200 1.00 0.00 H new ATOM 0 HG3 GLN A 128 15.429 -3.103 -1.091 1.00 0.00 H new ATOM 0 HE21 GLN A 128 15.439 -4.341 -4.384 1.00 0.00 H new ATOM 0 HE22 GLN A 128 16.301 -2.982 -5.111 1.00 0.00 H new ATOM 1993 N LEU A 129 14.525 -5.404 1.411 1.00 0.00 N ATOM 1994 CA LEU A 129 14.087 -4.847 2.683 1.00 0.00 C ATOM 1995 C LEU A 129 14.787 -5.550 3.841 1.00 0.00 C ATOM 1996 O LEU A 129 15.286 -6.667 3.689 1.00 0.00 O ATOM 1997 CB LEU A 129 12.571 -4.976 2.837 1.00 0.00 C ATOM 1998 CG LEU A 129 11.737 -4.116 1.887 1.00 0.00 C ATOM 1999 CD1 LEU A 129 10.255 -4.285 2.184 1.00 0.00 C ATOM 2000 CD2 LEU A 129 12.140 -2.655 1.999 1.00 0.00 C ATOM 0 H LEU A 129 13.860 -6.045 0.977 1.00 0.00 H new ATOM 0 HA LEU A 129 14.351 -3.790 2.698 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.296 -6.020 2.690 1.00 0.00 H new ATOM 0 HB3 LEU A 129 12.304 -4.718 3.862 1.00 0.00 H new ATOM 0 HG LEU A 129 11.925 -4.446 0.865 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.674 -3.667 1.500 1.00 0.00 H new ATOM 0 HD12 LEU A 129 9.975 -5.330 2.055 1.00 0.00 H new ATOM 0 HD13 LEU A 129 10.052 -3.979 3.210 1.00 0.00 H new ATOM 0 HD21 LEU A 129 11.536 -2.058 1.316 1.00 0.00 H new ATOM 0 HD22 LEU A 129 11.980 -2.311 3.021 1.00 0.00 H new ATOM 0 HD23 LEU A 129 13.194 -2.547 1.741 1.00 0.00 H new ATOM 2012 N VAL A 130 14.825 -4.900 4.997 1.00 0.00 N ATOM 2013 CA VAL A 130 15.470 -5.476 6.168 1.00 0.00 C ATOM 2014 C VAL A 130 14.480 -6.353 6.934 1.00 0.00 C ATOM 2015 O VAL A 130 14.065 -6.040 8.053 1.00 0.00 O ATOM 2016 CB VAL A 130 16.057 -4.388 7.100 1.00 0.00 C ATOM 2017 CG1 VAL A 130 16.921 -5.010 8.188 1.00 0.00 C ATOM 2018 CG2 VAL A 130 16.858 -3.373 6.303 1.00 0.00 C ATOM 0 H VAL A 130 14.418 -3.977 5.148 1.00 0.00 H new ATOM 0 HA VAL A 130 16.301 -6.089 5.819 1.00 0.00 H new ATOM 0 HB VAL A 130 15.225 -3.873 7.579 1.00 0.00 H new ATOM 0 HG11 VAL A 130 17.321 -4.224 8.829 1.00 0.00 H new ATOM 0 HG12 VAL A 130 16.318 -5.693 8.786 1.00 0.00 H new ATOM 0 HG13 VAL A 130 17.744 -5.559 7.730 1.00 0.00 H new ATOM 0 HG21 VAL A 130 17.261 -2.618 6.977 1.00 0.00 H new ATOM 0 HG22 VAL A 130 17.678 -3.877 5.791 1.00 0.00 H new ATOM 0 HG23 VAL A 130 16.211 -2.895 5.568 1.00 0.00 H new ATOM 2028 N ILE A 131 14.085 -7.449 6.308 1.00 0.00 N ATOM 2029 CA ILE A 131 13.122 -8.357 6.897 1.00 0.00 C ATOM 2030 C ILE A 131 13.703 -9.760 7.004 1.00 0.00 C ATOM 2031 O ILE A 131 14.678 -10.089 6.323 1.00 0.00 O ATOM 2032 CB ILE A 131 11.811 -8.398 6.086 1.00 0.00 C ATOM 2033 CG1 ILE A 131 12.102 -8.652 4.604 1.00 0.00 C ATOM 2034 CG2 ILE A 131 11.033 -7.104 6.277 1.00 0.00 C ATOM 2035 CD1 ILE A 131 10.865 -8.681 3.727 1.00 0.00 C ATOM 0 H ILE A 131 14.420 -7.730 5.387 1.00 0.00 H new ATOM 0 HA ILE A 131 12.895 -7.985 7.896 1.00 0.00 H new ATOM 0 HB ILE A 131 11.198 -9.222 6.452 1.00 0.00 H new ATOM 0 HG12 ILE A 131 12.775 -7.877 4.239 1.00 0.00 H new ATOM 0 HG13 ILE A 131 12.627 -9.602 4.505 1.00 0.00 H new ATOM 0 HG21 ILE A 131 10.110 -7.146 5.699 1.00 0.00 H new ATOM 0 HG22 ILE A 131 10.795 -6.975 7.333 1.00 0.00 H new ATOM 0 HG23 ILE A 131 11.637 -6.263 5.936 1.00 0.00 H new ATOM 0 HD11 ILE A 131 11.156 -8.866 2.693 1.00 0.00 H new ATOM 0 HD12 ILE A 131 10.199 -9.475 4.064 1.00 0.00 H new ATOM 0 HD13 ILE A 131 10.350 -7.723 3.793 1.00 0.00 H new ATOM 2047 N ARG A 132 13.111 -10.576 7.866 1.00 0.00 N ATOM 2048 CA ARG A 132 13.594 -11.931 8.099 1.00 0.00 C ATOM 2049 C ARG A 132 12.911 -12.910 7.149 1.00 0.00 C ATOM 2050 O ARG A 132 11.880 -12.587 6.566 1.00 0.00 O ATOM 2051 CB ARG A 132 13.358 -12.328 9.558 1.00 0.00 C ATOM 2052 CG ARG A 132 13.871 -11.291 10.547 1.00 0.00 C ATOM 2053 CD ARG A 132 13.787 -11.785 11.978 1.00 0.00 C ATOM 2054 NE ARG A 132 14.798 -12.798 12.268 1.00 0.00 N ATOM 2055 CZ ARG A 132 14.583 -13.858 13.039 1.00 0.00 C ATOM 2056 NH1 ARG A 132 13.362 -14.104 13.508 1.00 0.00 N ATOM 2057 NH2 ARG A 132 15.584 -14.683 13.316 1.00 0.00 N ATOM 0 H ARG A 132 12.292 -10.322 8.418 1.00 0.00 H new ATOM 0 HA ARG A 132 14.666 -11.964 7.903 1.00 0.00 H new ATOM 0 HB2 ARG A 132 12.291 -12.479 9.720 1.00 0.00 H new ATOM 0 HB3 ARG A 132 13.848 -13.282 9.753 1.00 0.00 H new ATOM 0 HG2 ARG A 132 14.905 -11.042 10.309 1.00 0.00 H new ATOM 0 HG3 ARG A 132 13.291 -10.374 10.445 1.00 0.00 H new ATOM 0 HD2 ARG A 132 13.911 -10.944 12.660 1.00 0.00 H new ATOM 0 HD3 ARG A 132 12.796 -12.200 12.161 1.00 0.00 H new ATOM 0 HE ARG A 132 15.723 -12.685 11.854 1.00 0.00 H new ATOM 0 HH11 ARG A 132 12.591 -13.478 13.275 1.00 0.00 H new ATOM 0 HH12 ARG A 132 13.198 -14.918 14.100 1.00 0.00 H new ATOM 0 HH21 ARG A 132 16.514 -14.502 12.937 1.00 0.00 H new ATOM 0 HH22 ARG A 132 15.424 -15.498 13.908 1.00 0.00 H new ATOM 2071 N GLU A 133 13.470 -14.108 7.030 1.00 0.00 N ATOM 2072 CA GLU A 133 13.082 -15.060 5.984 1.00 0.00 C ATOM 2073 C GLU A 133 11.595 -15.408 6.008 1.00 0.00 C ATOM 2074 O GLU A 133 10.940 -15.403 4.965 1.00 0.00 O ATOM 2075 CB GLU A 133 13.897 -16.343 6.107 1.00 0.00 C ATOM 2076 CG GLU A 133 15.394 -16.132 5.991 1.00 0.00 C ATOM 2077 CD GLU A 133 16.158 -17.432 6.064 1.00 0.00 C ATOM 2078 OE1 GLU A 133 16.368 -17.941 7.187 1.00 0.00 O ATOM 2079 OE2 GLU A 133 16.548 -17.957 5.002 1.00 0.00 O ATOM 0 H GLU A 133 14.203 -14.451 7.651 1.00 0.00 H new ATOM 0 HA GLU A 133 13.287 -14.567 5.034 1.00 0.00 H new ATOM 0 HB2 GLU A 133 13.679 -16.810 7.067 1.00 0.00 H new ATOM 0 HB3 GLU A 133 13.577 -17.041 5.333 1.00 0.00 H new ATOM 0 HG2 GLU A 133 15.617 -15.633 5.048 1.00 0.00 H new ATOM 0 HG3 GLU A 133 15.729 -15.470 6.789 1.00 0.00 H new ATOM 2086 N ASP A 134 11.064 -15.702 7.187 1.00 0.00 N ATOM 2087 CA ASP A 134 9.683 -16.174 7.304 1.00 0.00 C ATOM 2088 C ASP A 134 8.692 -15.073 6.920 1.00 0.00 C ATOM 2089 O ASP A 134 7.606 -15.344 6.408 1.00 0.00 O ATOM 2090 CB ASP A 134 9.407 -16.670 8.727 1.00 0.00 C ATOM 2091 CG ASP A 134 8.127 -17.480 8.829 1.00 0.00 C ATOM 2092 OD1 ASP A 134 8.051 -18.565 8.215 1.00 0.00 O ATOM 2093 OD2 ASP A 134 7.192 -17.038 9.524 1.00 0.00 O ATOM 0 H ASP A 134 11.562 -15.624 8.074 1.00 0.00 H new ATOM 0 HA ASP A 134 9.549 -17.005 6.612 1.00 0.00 H new ATOM 0 HB2 ASP A 134 10.245 -17.280 9.063 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.345 -15.815 9.400 1.00 0.00 H new ATOM 2098 N LEU A 135 9.075 -13.827 7.168 1.00 0.00 N ATOM 2099 CA LEU A 135 8.266 -12.680 6.768 1.00 0.00 C ATOM 2100 C LEU A 135 8.533 -12.352 5.294 1.00 0.00 C ATOM 2101 O LEU A 135 7.626 -11.986 4.545 1.00 0.00 O ATOM 2102 CB LEU A 135 8.589 -11.478 7.674 1.00 0.00 C ATOM 2103 CG LEU A 135 7.546 -10.351 7.704 1.00 0.00 C ATOM 2104 CD1 LEU A 135 7.751 -9.482 8.935 1.00 0.00 C ATOM 2105 CD2 LEU A 135 7.625 -9.492 6.450 1.00 0.00 C ATOM 0 H LEU A 135 9.943 -13.583 7.645 1.00 0.00 H new ATOM 0 HA LEU A 135 7.208 -12.916 6.879 1.00 0.00 H new ATOM 0 HB2 LEU A 135 8.728 -11.844 8.691 1.00 0.00 H new ATOM 0 HB3 LEU A 135 9.541 -11.055 7.355 1.00 0.00 H new ATOM 0 HG LEU A 135 6.558 -10.810 7.743 1.00 0.00 H new ATOM 0 HD11 LEU A 135 7.006 -8.686 8.947 1.00 0.00 H new ATOM 0 HD12 LEU A 135 7.645 -10.091 9.832 1.00 0.00 H new ATOM 0 HD13 LEU A 135 8.749 -9.045 8.910 1.00 0.00 H new ATOM 0 HD21 LEU A 135 6.874 -8.703 6.501 1.00 0.00 H new ATOM 0 HD22 LEU A 135 8.616 -9.045 6.377 1.00 0.00 H new ATOM 0 HD23 LEU A 135 7.441 -10.112 5.572 1.00 0.00 H new ATOM 2117 N ARG A 136 9.787 -12.512 4.895 1.00 0.00 N ATOM 2118 CA ARG A 136 10.237 -12.223 3.535 1.00 0.00 C ATOM 2119 C ARG A 136 9.482 -13.077 2.522 1.00 0.00 C ATOM 2120 O ARG A 136 9.122 -12.609 1.442 1.00 0.00 O ATOM 2121 CB ARG A 136 11.740 -12.503 3.446 1.00 0.00 C ATOM 2122 CG ARG A 136 12.458 -11.823 2.293 1.00 0.00 C ATOM 2123 CD ARG A 136 13.954 -12.098 2.369 1.00 0.00 C ATOM 2124 NE ARG A 136 14.736 -11.213 1.510 1.00 0.00 N ATOM 2125 CZ ARG A 136 15.865 -10.618 1.899 1.00 0.00 C ATOM 2126 NH1 ARG A 136 16.329 -10.805 3.127 1.00 0.00 N ATOM 2127 NH2 ARG A 136 16.536 -9.838 1.063 1.00 0.00 N ATOM 0 H ARG A 136 10.529 -12.849 5.509 1.00 0.00 H new ATOM 0 HA ARG A 136 10.039 -11.177 3.303 1.00 0.00 H new ATOM 0 HB2 ARG A 136 12.207 -12.190 4.379 1.00 0.00 H new ATOM 0 HB3 ARG A 136 11.888 -13.580 3.361 1.00 0.00 H new ATOM 0 HG2 ARG A 136 12.062 -12.185 1.344 1.00 0.00 H new ATOM 0 HG3 ARG A 136 12.276 -10.749 2.325 1.00 0.00 H new ATOM 0 HD2 ARG A 136 14.288 -11.984 3.400 1.00 0.00 H new ATOM 0 HD3 ARG A 136 14.143 -13.133 2.085 1.00 0.00 H new ATOM 0 HE ARG A 136 14.401 -11.041 0.562 1.00 0.00 H new ATOM 0 HH11 ARG A 136 15.822 -11.405 3.778 1.00 0.00 H new ATOM 0 HH12 ARG A 136 17.192 -10.349 3.421 1.00 0.00 H new ATOM 0 HH21 ARG A 136 16.190 -9.689 0.115 1.00 0.00 H new ATOM 0 HH22 ARG A 136 17.398 -9.386 1.368 1.00 0.00 H new ATOM 2141 N THR A 137 9.239 -14.328 2.889 1.00 0.00 N ATOM 2142 CA THR A 137 8.506 -15.251 2.036 1.00 0.00 C ATOM 2143 C THR A 137 7.042 -14.831 1.890 1.00 0.00 C ATOM 2144 O THR A 137 6.459 -14.965 0.817 1.00 0.00 O ATOM 2145 CB THR A 137 8.596 -16.686 2.582 1.00 0.00 C ATOM 2146 OG1 THR A 137 8.554 -16.659 4.015 1.00 0.00 O ATOM 2147 CG2 THR A 137 9.875 -17.368 2.116 1.00 0.00 C ATOM 0 H THR A 137 9.541 -14.728 3.777 1.00 0.00 H new ATOM 0 HA THR A 137 8.967 -15.223 1.048 1.00 0.00 H new ATOM 0 HB THR A 137 7.748 -17.254 2.200 1.00 0.00 H new ATOM 0 HG1 THR A 137 7.920 -15.973 4.311 1.00 0.00 H new ATOM 0 HG21 THR A 137 9.914 -18.381 2.516 1.00 0.00 H new ATOM 0 HG22 THR A 137 9.890 -17.407 1.027 1.00 0.00 H new ATOM 0 HG23 THR A 137 10.738 -16.805 2.471 1.00 0.00 H new ATOM 2155 N ARG A 138 6.460 -14.300 2.965 1.00 0.00 N ATOM 2156 CA ARG A 138 5.099 -13.780 2.921 1.00 0.00 C ATOM 2157 C ARG A 138 4.995 -12.635 1.918 1.00 0.00 C ATOM 2158 O ARG A 138 3.992 -12.498 1.218 1.00 0.00 O ATOM 2159 CB ARG A 138 4.681 -13.293 4.305 1.00 0.00 C ATOM 2160 CG ARG A 138 4.624 -14.394 5.346 1.00 0.00 C ATOM 2161 CD ARG A 138 3.389 -15.265 5.178 1.00 0.00 C ATOM 2162 NE ARG A 138 3.368 -16.357 6.144 1.00 0.00 N ATOM 2163 CZ ARG A 138 2.301 -17.102 6.423 1.00 0.00 C ATOM 2164 NH1 ARG A 138 1.134 -16.860 5.838 1.00 0.00 N ATOM 2165 NH2 ARG A 138 2.412 -18.089 7.303 1.00 0.00 N ATOM 0 H ARG A 138 6.912 -14.220 3.876 1.00 0.00 H new ATOM 0 HA ARG A 138 4.433 -14.583 2.606 1.00 0.00 H new ATOM 0 HB2 ARG A 138 5.381 -12.526 4.638 1.00 0.00 H new ATOM 0 HB3 ARG A 138 3.701 -12.821 4.234 1.00 0.00 H new ATOM 0 HG2 ARG A 138 5.518 -15.013 5.270 1.00 0.00 H new ATOM 0 HG3 ARG A 138 4.625 -13.953 6.343 1.00 0.00 H new ATOM 0 HD2 ARG A 138 2.494 -14.655 5.298 1.00 0.00 H new ATOM 0 HD3 ARG A 138 3.365 -15.672 4.167 1.00 0.00 H new ATOM 0 HE ARG A 138 4.234 -16.565 6.642 1.00 0.00 H new ATOM 0 HH11 ARG A 138 1.048 -16.097 5.167 1.00 0.00 H new ATOM 0 HH12 ARG A 138 0.323 -17.438 6.060 1.00 0.00 H new ATOM 0 HH21 ARG A 138 3.308 -18.269 7.757 1.00 0.00 H new ATOM 0 HH22 ARG A 138 1.602 -18.667 7.526 1.00 0.00 H new ATOM 2179 N MET A 139 6.050 -11.830 1.851 1.00 0.00 N ATOM 2180 CA MET A 139 6.111 -10.696 0.935 1.00 0.00 C ATOM 2181 C MET A 139 6.128 -11.161 -0.519 1.00 0.00 C ATOM 2182 O MET A 139 5.718 -10.431 -1.421 1.00 0.00 O ATOM 2183 CB MET A 139 7.354 -9.854 1.222 1.00 0.00 C ATOM 2184 CG MET A 139 7.245 -9.013 2.480 1.00 0.00 C ATOM 2185 SD MET A 139 5.961 -7.750 2.350 1.00 0.00 S ATOM 2186 CE MET A 139 6.099 -6.965 3.951 1.00 0.00 C ATOM 0 H MET A 139 6.884 -11.944 2.427 1.00 0.00 H new ATOM 0 HA MET A 139 5.218 -10.090 1.091 1.00 0.00 H new ATOM 0 HB2 MET A 139 8.217 -10.514 1.311 1.00 0.00 H new ATOM 0 HB3 MET A 139 7.541 -9.198 0.372 1.00 0.00 H new ATOM 0 HG2 MET A 139 7.030 -9.661 3.330 1.00 0.00 H new ATOM 0 HG3 MET A 139 8.204 -8.534 2.679 1.00 0.00 H new ATOM 0 HE1 MET A 139 5.485 -6.065 3.969 1.00 0.00 H new ATOM 0 HE2 MET A 139 5.757 -7.653 4.724 1.00 0.00 H new ATOM 0 HE3 MET A 139 7.139 -6.699 4.137 1.00 0.00 H new ATOM 2196 N ALA A 140 6.595 -12.384 -0.738 1.00 0.00 N ATOM 2197 CA ALA A 140 6.671 -12.943 -2.081 1.00 0.00 C ATOM 2198 C ALA A 140 5.286 -13.326 -2.598 1.00 0.00 C ATOM 2199 O ALA A 140 5.109 -13.587 -3.790 1.00 0.00 O ATOM 2200 CB ALA A 140 7.602 -14.146 -2.098 1.00 0.00 C ATOM 0 H ALA A 140 6.927 -13.008 -0.002 1.00 0.00 H new ATOM 0 HA ALA A 140 7.074 -12.179 -2.746 1.00 0.00 H new ATOM 0 HB1 ALA A 140 7.650 -14.555 -3.107 1.00 0.00 H new ATOM 0 HB2 ALA A 140 8.599 -13.839 -1.783 1.00 0.00 H new ATOM 0 HB3 ALA A 140 7.225 -14.908 -1.416 1.00 0.00 H new ATOM 2206 N TYR A 141 4.306 -13.348 -1.699 1.00 0.00 N ATOM 2207 CA TYR A 141 2.933 -13.657 -2.071 1.00 0.00 C ATOM 2208 C TYR A 141 2.177 -12.393 -2.474 1.00 0.00 C ATOM 2209 O TYR A 141 0.972 -12.430 -2.725 1.00 0.00 O ATOM 2210 CB TYR A 141 2.211 -14.357 -0.916 1.00 0.00 C ATOM 2211 CG TYR A 141 2.651 -15.789 -0.707 1.00 0.00 C ATOM 2212 CD1 TYR A 141 2.113 -16.813 -1.474 1.00 0.00 C ATOM 2213 CD2 TYR A 141 3.603 -16.118 0.250 1.00 0.00 C ATOM 2214 CE1 TYR A 141 2.509 -18.122 -1.297 1.00 0.00 C ATOM 2215 CE2 TYR A 141 4.006 -17.428 0.434 1.00 0.00 C ATOM 2216 CZ TYR A 141 3.455 -18.425 -0.343 1.00 0.00 C ATOM 2217 OH TYR A 141 3.852 -19.733 -0.166 1.00 0.00 O ATOM 0 H TYR A 141 4.440 -13.155 -0.706 1.00 0.00 H new ATOM 0 HA TYR A 141 2.960 -14.328 -2.930 1.00 0.00 H new ATOM 0 HB2 TYR A 141 2.382 -13.795 0.002 1.00 0.00 H new ATOM 0 HB3 TYR A 141 1.138 -14.339 -1.105 1.00 0.00 H new ATOM 0 HD1 TYR A 141 1.371 -16.580 -2.223 1.00 0.00 H new ATOM 0 HD2 TYR A 141 4.035 -15.338 0.860 1.00 0.00 H new ATOM 0 HE1 TYR A 141 2.079 -18.906 -1.903 1.00 0.00 H new ATOM 0 HE2 TYR A 141 4.748 -17.669 1.181 1.00 0.00 H new ATOM 0 HH TYR A 141 4.526 -19.777 0.544 1.00 0.00 H new ATOM 2227 N CYS A 142 2.894 -11.281 -2.529 1.00 0.00 N ATOM 2228 CA CYS A 142 2.329 -10.023 -2.962 1.00 0.00 C ATOM 2229 C CYS A 142 2.841 -9.685 -4.351 1.00 0.00 C ATOM 2230 O CYS A 142 4.001 -9.949 -4.679 1.00 0.00 O ATOM 2231 CB CYS A 142 2.686 -8.906 -1.981 1.00 0.00 C ATOM 2232 SG CYS A 142 2.077 -9.179 -0.302 1.00 0.00 S ATOM 0 H CYS A 142 3.880 -11.230 -2.274 1.00 0.00 H new ATOM 0 HA CYS A 142 1.243 -10.117 -2.992 1.00 0.00 H new ATOM 0 HB2 CYS A 142 3.770 -8.797 -1.950 1.00 0.00 H new ATOM 0 HB3 CYS A 142 2.281 -7.965 -2.355 1.00 0.00 H new ATOM 0 HG CYS A 142 3.084 -9.283 0.513 1.00 0.00 H new ATOM 2238 N LEU A 143 1.971 -9.118 -5.158 1.00 0.00 N ATOM 2239 CA LEU A 143 2.312 -8.749 -6.522 1.00 0.00 C ATOM 2240 C LEU A 143 3.158 -7.480 -6.529 1.00 0.00 C ATOM 2241 O LEU A 143 3.072 -6.659 -5.616 1.00 0.00 O ATOM 2242 CB LEU A 143 1.049 -8.537 -7.367 1.00 0.00 C ATOM 2243 CG LEU A 143 0.234 -9.791 -7.692 1.00 0.00 C ATOM 2244 CD1 LEU A 143 -0.509 -10.310 -6.469 1.00 0.00 C ATOM 2245 CD2 LEU A 143 -0.745 -9.504 -8.816 1.00 0.00 C ATOM 0 H LEU A 143 1.011 -8.899 -4.893 1.00 0.00 H new ATOM 0 HA LEU A 143 2.886 -9.566 -6.959 1.00 0.00 H new ATOM 0 HB2 LEU A 143 0.401 -7.834 -6.844 1.00 0.00 H new ATOM 0 HB3 LEU A 143 1.340 -8.065 -8.305 1.00 0.00 H new ATOM 0 HG LEU A 143 0.931 -10.566 -8.012 1.00 0.00 H new ATOM 0 HD11 LEU A 143 -1.076 -11.201 -6.739 1.00 0.00 H new ATOM 0 HD12 LEU A 143 0.208 -10.559 -5.687 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -1.191 -9.542 -6.105 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -1.319 -10.404 -9.038 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -1.424 -8.707 -8.513 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -0.197 -9.195 -9.706 1.00 0.00 H new ATOM 2257 N VAL A 144 3.957 -7.317 -7.570 1.00 0.00 N ATOM 2258 CA VAL A 144 4.856 -6.184 -7.674 1.00 0.00 C ATOM 2259 C VAL A 144 4.440 -5.302 -8.838 1.00 0.00 C ATOM 2260 O VAL A 144 4.458 -5.731 -9.994 1.00 0.00 O ATOM 2261 CB VAL A 144 6.319 -6.641 -7.877 1.00 0.00 C ATOM 2262 CG1 VAL A 144 7.261 -5.451 -7.897 1.00 0.00 C ATOM 2263 CG2 VAL A 144 6.731 -7.624 -6.797 1.00 0.00 C ATOM 0 H VAL A 144 4.000 -7.961 -8.360 1.00 0.00 H new ATOM 0 HA VAL A 144 4.797 -5.624 -6.741 1.00 0.00 H new ATOM 0 HB VAL A 144 6.382 -7.143 -8.842 1.00 0.00 H new ATOM 0 HG11 VAL A 144 8.284 -5.799 -8.041 1.00 0.00 H new ATOM 0 HG12 VAL A 144 6.986 -4.783 -8.714 1.00 0.00 H new ATOM 0 HG13 VAL A 144 7.190 -4.915 -6.951 1.00 0.00 H new ATOM 0 HG21 VAL A 144 7.764 -7.932 -6.960 1.00 0.00 H new ATOM 0 HG22 VAL A 144 6.644 -7.149 -5.820 1.00 0.00 H new ATOM 0 HG23 VAL A 144 6.082 -8.499 -6.834 1.00 0.00 H new ATOM 2273 N TYR A 145 4.053 -4.078 -8.534 1.00 0.00 N ATOM 2274 CA TYR A 145 3.603 -3.148 -9.555 1.00 0.00 C ATOM 2275 C TYR A 145 4.262 -1.785 -9.402 1.00 0.00 C ATOM 2276 O TYR A 145 4.522 -1.322 -8.295 1.00 0.00 O ATOM 2277 CB TYR A 145 2.078 -3.015 -9.527 1.00 0.00 C ATOM 2278 CG TYR A 145 1.378 -4.196 -10.164 1.00 0.00 C ATOM 2279 CD1 TYR A 145 1.497 -4.433 -11.526 1.00 0.00 C ATOM 2280 CD2 TYR A 145 0.622 -5.085 -9.409 1.00 0.00 C ATOM 2281 CE1 TYR A 145 0.880 -5.514 -12.121 1.00 0.00 C ATOM 2282 CE2 TYR A 145 0.006 -6.173 -9.998 1.00 0.00 C ATOM 2283 CZ TYR A 145 0.139 -6.380 -11.353 1.00 0.00 C ATOM 2284 OH TYR A 145 -0.468 -7.465 -11.943 1.00 0.00 O ATOM 0 H TYR A 145 4.041 -3.703 -7.586 1.00 0.00 H new ATOM 0 HA TYR A 145 3.901 -3.551 -10.523 1.00 0.00 H new ATOM 0 HB2 TYR A 145 1.745 -2.914 -8.494 1.00 0.00 H new ATOM 0 HB3 TYR A 145 1.787 -2.102 -10.046 1.00 0.00 H new ATOM 0 HD1 TYR A 145 2.084 -3.758 -12.132 1.00 0.00 H new ATOM 0 HD2 TYR A 145 0.514 -4.923 -8.347 1.00 0.00 H new ATOM 0 HE1 TYR A 145 0.979 -5.679 -13.184 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -0.577 -6.857 -9.399 1.00 0.00 H new ATOM 0 HH TYR A 145 0.060 -7.755 -12.716 1.00 0.00 H new ATOM 2294 N GLU A 146 4.532 -1.162 -10.535 1.00 0.00 N ATOM 2295 CA GLU A 146 5.180 0.139 -10.578 1.00 0.00 C ATOM 2296 C GLU A 146 4.212 1.253 -10.190 1.00 0.00 C ATOM 2297 O GLU A 146 3.104 1.342 -10.724 1.00 0.00 O ATOM 2298 CB GLU A 146 5.710 0.388 -11.989 1.00 0.00 C ATOM 2299 CG GLU A 146 4.681 0.078 -13.068 1.00 0.00 C ATOM 2300 CD GLU A 146 5.067 0.612 -14.426 1.00 0.00 C ATOM 2301 OE1 GLU A 146 5.736 -0.113 -15.192 1.00 0.00 O ATOM 2302 OE2 GLU A 146 4.679 1.753 -14.745 1.00 0.00 O ATOM 0 H GLU A 146 4.308 -1.544 -11.454 1.00 0.00 H new ATOM 0 HA GLU A 146 6.001 0.141 -9.861 1.00 0.00 H new ATOM 0 HB2 GLU A 146 6.020 1.429 -12.077 1.00 0.00 H new ATOM 0 HB3 GLU A 146 6.597 -0.224 -12.152 1.00 0.00 H new ATOM 0 HG2 GLU A 146 4.546 -1.002 -13.134 1.00 0.00 H new ATOM 0 HG3 GLU A 146 3.720 0.502 -12.777 1.00 0.00 H new