USER MOD reduce.3.24.130724 H: found=0, std=0, add=736, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 0 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 65 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 85 TYR OH : rot 118:sc= -4.34! USER MOD Set 2.1: A 28 SER OG : rot 143:sc= 0.753 USER MOD Set 2.2: A 77 TYR OH : rot -150:sc= 0.0485 USER MOD Set 3.1: A 12 TYR OH : rot -163:sc= -2.71! USER MOD Set 3.2: A 14 ASN : amide:sc= -1.45 K(o=-8.7,f=-13!) USER MOD Set 3.3: A 50 MET CE :methyl 159:sc= -1.52 (180deg=-2.16!) USER MOD Set 3.4: A 53 GLN :FLIP amide:sc= -3.02! F(o=-12,f=-8.7!) USER MOD Set 4.1: A 10 THR OG1 : rot -22:sc= -0.117 USER MOD Set 4.2: A 90 SER OG : rot -80:sc= -1.52! USER MOD Single : A 8 ASN : amide:sc= -0.566 K(o=-0.57,f=-4.5!) USER MOD Single : A 9 HIS : no HD1:sc= -1.83 K(o=-1.8,f=-3.4!) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 ASN : amide:sc= -1.68 K(o=-1.7,f=-2.9!) USER MOD Single : A 19 LYS NZ :NH3+ -147:sc= 0 (180deg=-0.022) USER MOD Single : A 21 LYS NZ :NH3+ -154:sc= -0.0175 (180deg=-0.644) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 144:sc= -0.28 (180deg=-1.16!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 HIS : no HD1:sc= -1.27 X(o=-1.3,f=-1.5) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc=-0.000122 X(o=-0.00012,f=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -147:sc= -0.173 (180deg=-0.871) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.142 X(o=-0.14,f=0.21) USER MOD Single : A 70 SER OG : rot -48:sc= 1.01 USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 72 GLN : amide:sc= -0.272 X(o=-0.27,f=-0.24) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= -2.14 K(o=-2.1,f=-5!) USER MOD Single : A 87 LYS NZ :NH3+ -160:sc= -0.104 (180deg=-0.693) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.00309 USER MOD ----------------------------------------------------------------- ATOM 682 N PRO A 7 32.073 -2.778 -27.686 1.00 0.00 N ATOM 683 CA PRO A 7 31.105 -2.303 -26.680 1.00 0.00 C ATOM 684 C PRO A 7 31.471 -0.884 -26.216 1.00 0.00 C ATOM 685 O PRO A 7 32.623 -0.608 -25.887 1.00 0.00 O ATOM 686 CB PRO A 7 31.246 -3.309 -25.533 1.00 0.00 C ATOM 687 CG PRO A 7 32.644 -3.951 -25.683 1.00 0.00 C ATOM 688 CD PRO A 7 33.068 -3.740 -27.148 1.00 0.00 C ATOM 0 HA PRO A 7 30.085 -2.246 -27.061 1.00 0.00 H new ATOM 0 HB2 PRO A 7 31.148 -2.813 -24.567 1.00 0.00 H new ATOM 0 HB3 PRO A 7 30.464 -4.066 -25.583 1.00 0.00 H new ATOM 0 HG2 PRO A 7 33.358 -3.488 -25.002 1.00 0.00 H new ATOM 0 HG3 PRO A 7 32.612 -5.013 -25.438 1.00 0.00 H new ATOM 0 HD2 PRO A 7 34.081 -3.343 -27.215 1.00 0.00 H new ATOM 0 HD3 PRO A 7 33.055 -4.677 -27.704 1.00 0.00 H new ATOM 689 N ASN A 8 30.520 0.026 -26.184 1.00 0.00 N ATOM 690 CA ASN A 8 30.834 1.418 -25.745 1.00 0.00 C ATOM 691 C ASN A 8 30.411 1.596 -24.278 1.00 0.00 C ATOM 692 O ASN A 8 30.058 0.630 -23.604 1.00 0.00 O ATOM 693 CB ASN A 8 30.073 2.417 -26.624 1.00 0.00 C ATOM 694 CG ASN A 8 30.286 2.071 -28.104 1.00 0.00 C ATOM 695 OD1 ASN A 8 29.430 1.448 -28.727 1.00 0.00 O ATOM 696 ND2 ASN A 8 31.390 2.441 -28.709 1.00 0.00 N ATOM 0 H ASN A 8 29.547 -0.139 -26.442 1.00 0.00 H new ATOM 0 HA ASN A 8 31.905 1.598 -25.840 1.00 0.00 H new ATOM 0 HB2 ASN A 8 29.010 2.391 -26.384 1.00 0.00 H new ATOM 0 HB3 ASN A 8 30.421 3.431 -26.424 1.00 0.00 H new ATOM 0 HD21 ASN A 8 31.534 2.211 -29.692 1.00 0.00 H new ATOM 0 HD22 ASN A 8 32.104 2.959 -28.196 1.00 0.00 H new ATOM 697 N HIS A 9 30.435 2.809 -23.762 1.00 0.00 N ATOM 698 CA HIS A 9 30.029 3.021 -22.340 1.00 0.00 C ATOM 699 C HIS A 9 28.592 3.579 -22.278 1.00 0.00 C ATOM 700 O HIS A 9 28.271 4.372 -21.395 1.00 0.00 O ATOM 701 CB HIS A 9 30.992 4.026 -21.691 1.00 0.00 C ATOM 702 CG HIS A 9 31.445 3.518 -20.347 1.00 0.00 C ATOM 703 ND1 HIS A 9 32.783 3.315 -20.048 1.00 0.00 N ATOM 704 CD2 HIS A 9 30.751 3.174 -19.213 1.00 0.00 C ATOM 705 CE1 HIS A 9 32.852 2.870 -18.780 1.00 0.00 C ATOM 706 NE2 HIS A 9 31.642 2.765 -18.225 1.00 0.00 N ATOM 0 H HIS A 9 30.717 3.651 -24.264 1.00 0.00 H new ATOM 0 HA HIS A 9 30.064 2.070 -21.808 1.00 0.00 H new ATOM 0 HB2 HIS A 9 31.855 4.184 -22.338 1.00 0.00 H new ATOM 0 HB3 HIS A 9 30.499 4.991 -21.576 1.00 0.00 H new ATOM 0 HD2 HIS A 9 29.677 3.215 -19.104 1.00 0.00 H new ATOM 0 HE1 HIS A 9 33.774 2.627 -18.273 1.00 0.00 H new ATOM 0 HE2 HIS A 9 31.419 2.452 -17.280 1.00 0.00 H new ATOM 707 N THR A 10 27.719 3.188 -23.188 1.00 0.00 N ATOM 708 CA THR A 10 26.317 3.717 -23.151 1.00 0.00 C ATOM 709 C THR A 10 25.422 2.903 -24.106 1.00 0.00 C ATOM 710 O THR A 10 25.740 2.754 -25.284 1.00 0.00 O ATOM 711 CB THR A 10 26.316 5.187 -23.595 1.00 0.00 C ATOM 712 OG1 THR A 10 27.162 5.942 -22.740 1.00 0.00 O ATOM 713 CG2 THR A 10 24.894 5.756 -23.534 1.00 0.00 C ATOM 0 H THR A 10 27.918 2.533 -23.944 1.00 0.00 H new ATOM 0 HA THR A 10 25.932 3.634 -22.135 1.00 0.00 H new ATOM 0 HB THR A 10 26.681 5.247 -24.620 1.00 0.00 H new ATOM 0 HG1 THR A 10 27.275 5.468 -21.890 1.00 0.00 H new ATOM 0 HG21 THR A 10 24.905 6.799 -23.851 1.00 0.00 H new ATOM 0 HG22 THR A 10 24.244 5.183 -24.195 1.00 0.00 H new ATOM 0 HG23 THR A 10 24.520 5.691 -22.512 1.00 0.00 H new ATOM 714 N ILE A 11 24.309 2.383 -23.634 1.00 0.00 N ATOM 715 CA ILE A 11 23.419 1.599 -24.544 1.00 0.00 C ATOM 716 C ILE A 11 22.369 2.540 -25.157 1.00 0.00 C ATOM 717 O ILE A 11 22.273 3.708 -24.776 1.00 0.00 O ATOM 718 CB ILE A 11 22.729 0.466 -23.771 1.00 0.00 C ATOM 719 CG1 ILE A 11 21.856 1.042 -22.651 1.00 0.00 C ATOM 720 CG2 ILE A 11 23.790 -0.453 -23.162 1.00 0.00 C ATOM 721 CD1 ILE A 11 20.837 -0.009 -22.207 1.00 0.00 C ATOM 0 H ILE A 11 23.985 2.468 -22.671 1.00 0.00 H new ATOM 0 HA ILE A 11 24.018 1.155 -25.339 1.00 0.00 H new ATOM 0 HB ILE A 11 22.099 -0.098 -24.459 1.00 0.00 H new ATOM 0 HG12 ILE A 11 22.478 1.340 -21.807 1.00 0.00 H new ATOM 0 HG13 ILE A 11 21.342 1.938 -23.000 1.00 0.00 H new ATOM 0 HG21 ILE A 11 23.302 -1.258 -22.613 1.00 0.00 H new ATOM 0 HG22 ILE A 11 24.404 -0.876 -23.957 1.00 0.00 H new ATOM 0 HG23 ILE A 11 24.421 0.120 -22.482 1.00 0.00 H new ATOM 0 HD11 ILE A 11 20.216 0.400 -21.410 1.00 0.00 H new ATOM 0 HD12 ILE A 11 20.207 -0.285 -23.053 1.00 0.00 H new ATOM 0 HD13 ILE A 11 21.361 -0.892 -21.841 1.00 0.00 H new ATOM 722 N TYR A 12 21.586 2.070 -26.104 1.00 0.00 N ATOM 723 CA TYR A 12 20.565 2.958 -26.733 1.00 0.00 C ATOM 724 C TYR A 12 19.202 2.246 -26.777 1.00 0.00 C ATOM 725 O TYR A 12 19.127 1.038 -26.990 1.00 0.00 O ATOM 726 CB TYR A 12 21.016 3.295 -28.160 1.00 0.00 C ATOM 727 CG TYR A 12 20.001 4.193 -28.829 1.00 0.00 C ATOM 728 CD1 TYR A 12 18.825 3.646 -29.356 1.00 0.00 C ATOM 729 CD2 TYR A 12 20.239 5.569 -28.930 1.00 0.00 C ATOM 730 CE1 TYR A 12 17.888 4.474 -29.983 1.00 0.00 C ATOM 731 CE2 TYR A 12 19.302 6.397 -29.556 1.00 0.00 C ATOM 732 CZ TYR A 12 18.126 5.849 -30.083 1.00 0.00 C ATOM 733 OH TYR A 12 17.202 6.665 -30.705 1.00 0.00 O ATOM 0 H TYR A 12 21.613 1.116 -26.463 1.00 0.00 H new ATOM 0 HA TYR A 12 20.464 3.872 -26.147 1.00 0.00 H new ATOM 0 HB2 TYR A 12 21.988 3.788 -28.135 1.00 0.00 H new ATOM 0 HB3 TYR A 12 21.138 2.378 -28.737 1.00 0.00 H new ATOM 0 HD1 TYR A 12 18.641 2.585 -29.278 1.00 0.00 H new ATOM 0 HD2 TYR A 12 21.147 5.991 -28.524 1.00 0.00 H new ATOM 0 HE1 TYR A 12 16.981 4.052 -30.390 1.00 0.00 H new ATOM 0 HE2 TYR A 12 19.485 7.459 -29.633 1.00 0.00 H new ATOM 0 HH TYR A 12 17.622 7.521 -30.932 1.00 0.00 H new ATOM 734 N ILE A 13 18.120 2.972 -26.587 1.00 0.00 N ATOM 735 CA ILE A 13 16.773 2.332 -26.629 1.00 0.00 C ATOM 736 C ILE A 13 15.905 3.065 -27.665 1.00 0.00 C ATOM 737 O ILE A 13 16.040 4.273 -27.852 1.00 0.00 O ATOM 738 CB ILE A 13 16.113 2.432 -25.251 1.00 0.00 C ATOM 739 CG1 ILE A 13 17.072 1.890 -24.175 1.00 0.00 C ATOM 740 CG2 ILE A 13 14.819 1.612 -25.250 1.00 0.00 C ATOM 741 CD1 ILE A 13 17.219 2.917 -23.050 1.00 0.00 C ATOM 0 H ILE A 13 18.118 3.976 -26.406 1.00 0.00 H new ATOM 0 HA ILE A 13 16.873 1.282 -26.904 1.00 0.00 H new ATOM 0 HB ILE A 13 15.884 3.475 -25.031 1.00 0.00 H new ATOM 0 HG12 ILE A 13 16.691 0.950 -23.775 1.00 0.00 H new ATOM 0 HG13 ILE A 13 18.046 1.677 -24.616 1.00 0.00 H new ATOM 0 HG21 ILE A 13 14.346 1.680 -24.271 1.00 0.00 H new ATOM 0 HG22 ILE A 13 14.141 2.002 -26.009 1.00 0.00 H new ATOM 0 HG23 ILE A 13 15.049 0.569 -25.470 1.00 0.00 H new ATOM 0 HD11 ILE A 13 17.898 2.530 -22.290 1.00 0.00 H new ATOM 0 HD12 ILE A 13 17.620 3.846 -23.456 1.00 0.00 H new ATOM 0 HD13 ILE A 13 16.244 3.107 -22.602 1.00 0.00 H new ATOM 742 N ASN A 14 15.021 2.367 -28.346 1.00 0.00 N ATOM 743 CA ASN A 14 14.167 3.046 -29.362 1.00 0.00 C ATOM 744 C ASN A 14 12.728 2.512 -29.275 1.00 0.00 C ATOM 745 O ASN A 14 12.423 1.657 -28.445 1.00 0.00 O ATOM 746 CB ASN A 14 14.724 2.767 -30.760 1.00 0.00 C ATOM 747 CG ASN A 14 14.579 4.019 -31.634 1.00 0.00 C ATOM 748 OD1 ASN A 14 14.517 5.133 -31.120 1.00 0.00 O ATOM 749 ND2 ASN A 14 14.519 3.902 -32.939 1.00 0.00 N ATOM 0 H ASN A 14 14.859 1.366 -28.239 1.00 0.00 H new ATOM 0 HA ASN A 14 14.166 4.119 -29.171 1.00 0.00 H new ATOM 0 HB2 ASN A 14 15.773 2.478 -30.693 1.00 0.00 H new ATOM 0 HB3 ASN A 14 14.192 1.931 -31.214 1.00 0.00 H new ATOM 0 HD21 ASN A 14 14.421 4.734 -33.522 1.00 0.00 H new ATOM 0 HD22 ASN A 14 14.570 2.980 -33.371 1.00 0.00 H new ATOM 750 N ASN A 15 11.837 2.992 -30.117 1.00 0.00 N ATOM 751 CA ASN A 15 10.430 2.503 -30.078 1.00 0.00 C ATOM 752 C ASN A 15 9.837 2.726 -28.677 1.00 0.00 C ATOM 753 O ASN A 15 9.263 1.813 -28.084 1.00 0.00 O ATOM 754 CB ASN A 15 10.400 1.011 -30.416 1.00 0.00 C ATOM 755 CG ASN A 15 10.780 0.812 -31.889 1.00 0.00 C ATOM 756 OD1 ASN A 15 11.911 0.440 -32.194 1.00 0.00 O ATOM 757 ND2 ASN A 15 9.895 1.040 -32.829 1.00 0.00 N ATOM 0 H ASN A 15 12.030 3.700 -30.826 1.00 0.00 H new ATOM 0 HA ASN A 15 9.838 3.055 -30.808 1.00 0.00 H new ATOM 0 HB2 ASN A 15 11.093 0.468 -29.774 1.00 0.00 H new ATOM 0 HB3 ASN A 15 9.406 0.605 -30.228 1.00 0.00 H new ATOM 0 HD21 ASN A 15 10.146 0.909 -33.809 1.00 0.00 H new ATOM 0 HD22 ASN A 15 8.955 1.349 -32.581 1.00 0.00 H new ATOM 758 N LEU A 16 9.951 3.921 -28.133 1.00 0.00 N ATOM 759 CA LEU A 16 9.377 4.173 -26.776 1.00 0.00 C ATOM 760 C LEU A 16 7.955 4.736 -26.924 1.00 0.00 C ATOM 761 O LEU A 16 7.445 4.870 -28.036 1.00 0.00 O ATOM 762 CB LEU A 16 10.251 5.176 -26.019 1.00 0.00 C ATOM 763 CG LEU A 16 11.677 4.631 -25.908 1.00 0.00 C ATOM 764 CD1 LEU A 16 12.622 5.755 -25.481 1.00 0.00 C ATOM 765 CD2 LEU A 16 11.713 3.511 -24.866 1.00 0.00 C ATOM 0 H LEU A 16 10.412 4.720 -28.568 1.00 0.00 H new ATOM 0 HA LEU A 16 9.345 3.238 -26.217 1.00 0.00 H new ATOM 0 HB2 LEU A 16 10.256 6.134 -26.539 1.00 0.00 H new ATOM 0 HB3 LEU A 16 9.840 5.354 -25.025 1.00 0.00 H new ATOM 0 HG LEU A 16 11.993 4.240 -26.875 1.00 0.00 H new ATOM 0 HD11 LEU A 16 13.637 5.366 -25.402 1.00 0.00 H new ATOM 0 HD12 LEU A 16 12.596 6.554 -26.222 1.00 0.00 H new ATOM 0 HD13 LEU A 16 12.307 6.147 -24.514 1.00 0.00 H new ATOM 0 HD21 LEU A 16 12.728 3.121 -24.785 1.00 0.00 H new ATOM 0 HD22 LEU A 16 11.397 3.903 -23.899 1.00 0.00 H new ATOM 0 HD23 LEU A 16 11.040 2.709 -25.170 1.00 0.00 H new ATOM 766 N ASN A 17 7.297 5.066 -25.832 1.00 0.00 N ATOM 767 CA ASN A 17 5.911 5.612 -25.936 1.00 0.00 C ATOM 768 C ASN A 17 5.945 7.142 -25.809 1.00 0.00 C ATOM 769 O ASN A 17 6.816 7.700 -25.145 1.00 0.00 O ATOM 770 CB ASN A 17 5.046 5.026 -24.818 1.00 0.00 C ATOM 771 CG ASN A 17 4.309 3.786 -25.339 1.00 0.00 C ATOM 772 OD1 ASN A 17 4.855 3.032 -26.143 1.00 0.00 O ATOM 773 ND2 ASN A 17 3.092 3.526 -24.926 1.00 0.00 N ATOM 0 H ASN A 17 7.661 4.980 -24.883 1.00 0.00 H new ATOM 0 HA ASN A 17 5.489 5.340 -26.904 1.00 0.00 H new ATOM 0 HB2 ASN A 17 5.668 4.760 -23.963 1.00 0.00 H new ATOM 0 HB3 ASN A 17 4.329 5.770 -24.471 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.602 2.701 -25.271 1.00 0.00 H new ATOM 0 HD22 ASN A 17 2.636 4.149 -24.259 1.00 0.00 H new ATOM 774 N GLU A 18 5.017 7.834 -26.434 1.00 0.00 N ATOM 775 CA GLU A 18 5.010 9.324 -26.342 1.00 0.00 C ATOM 776 C GLU A 18 3.852 9.788 -25.443 1.00 0.00 C ATOM 777 O GLU A 18 3.207 10.798 -25.722 1.00 0.00 O ATOM 778 CB GLU A 18 4.835 9.916 -27.744 1.00 0.00 C ATOM 779 CG GLU A 18 5.984 9.454 -28.650 1.00 0.00 C ATOM 780 CD GLU A 18 5.418 8.918 -29.968 1.00 0.00 C ATOM 781 OE1 GLU A 18 4.656 7.966 -29.918 1.00 0.00 O ATOM 782 OE2 GLU A 18 5.756 9.466 -31.002 1.00 0.00 O ATOM 0 H GLU A 18 4.270 7.430 -26.999 1.00 0.00 H new ATOM 0 HA GLU A 18 5.953 9.663 -25.913 1.00 0.00 H new ATOM 0 HB2 GLU A 18 3.879 9.603 -28.164 1.00 0.00 H new ATOM 0 HB3 GLU A 18 4.818 11.005 -27.690 1.00 0.00 H new ATOM 0 HG2 GLU A 18 6.662 10.284 -28.845 1.00 0.00 H new ATOM 0 HG3 GLU A 18 6.565 8.679 -28.150 1.00 0.00 H new ATOM 783 N LYS A 19 3.573 9.082 -24.366 1.00 0.00 N ATOM 784 CA LYS A 19 2.463 9.503 -23.466 1.00 0.00 C ATOM 785 C LYS A 19 3.039 9.889 -22.095 1.00 0.00 C ATOM 786 O LYS A 19 2.858 11.010 -21.626 1.00 0.00 O ATOM 787 CB LYS A 19 1.474 8.347 -23.298 1.00 0.00 C ATOM 788 CG LYS A 19 0.788 8.061 -24.637 1.00 0.00 C ATOM 789 CD LYS A 19 0.535 6.558 -24.773 1.00 0.00 C ATOM 790 CE LYS A 19 0.234 6.220 -26.233 1.00 0.00 C ATOM 791 NZ LYS A 19 1.511 6.124 -26.995 1.00 0.00 N ATOM 0 H LYS A 19 4.068 8.238 -24.079 1.00 0.00 H new ATOM 0 HA LYS A 19 1.947 10.360 -23.899 1.00 0.00 H new ATOM 0 HB2 LYS A 19 1.996 7.456 -22.947 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.730 8.599 -22.543 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -0.154 8.606 -24.698 1.00 0.00 H new ATOM 0 HG3 LYS A 19 1.412 8.411 -25.459 1.00 0.00 H new ATOM 0 HD2 LYS A 19 1.407 6.000 -24.432 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -0.301 6.261 -24.140 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -0.310 5.277 -26.294 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -0.406 6.986 -26.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 1.358 6.448 -27.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 2.232 6.721 -26.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 1.836 5.136 -27.005 1.00 0.00 H new ATOM 792 N ILE A 20 3.740 8.986 -21.448 1.00 0.00 N ATOM 793 CA ILE A 20 4.339 9.313 -20.109 1.00 0.00 C ATOM 794 C ILE A 20 5.213 10.562 -20.253 1.00 0.00 C ATOM 795 O ILE A 20 5.674 10.884 -21.346 1.00 0.00 O ATOM 796 CB ILE A 20 5.189 8.134 -19.597 1.00 0.00 C ATOM 797 CG1 ILE A 20 4.289 6.899 -19.422 1.00 0.00 C ATOM 798 CG2 ILE A 20 5.832 8.488 -18.250 1.00 0.00 C ATOM 799 CD1 ILE A 20 4.510 5.923 -20.579 1.00 0.00 C ATOM 0 H ILE A 20 3.923 8.041 -21.786 1.00 0.00 H new ATOM 0 HA ILE A 20 3.541 9.497 -19.389 1.00 0.00 H new ATOM 0 HB ILE A 20 5.976 7.922 -20.321 1.00 0.00 H new ATOM 0 HG12 ILE A 20 4.511 6.409 -18.474 1.00 0.00 H new ATOM 0 HG13 ILE A 20 3.243 7.203 -19.387 1.00 0.00 H new ATOM 0 HG21 ILE A 20 6.430 7.646 -17.900 1.00 0.00 H new ATOM 0 HG22 ILE A 20 6.472 9.362 -18.371 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.052 8.707 -17.521 1.00 0.00 H new ATOM 0 HD11 ILE A 20 3.869 5.051 -20.447 1.00 0.00 H new ATOM 0 HD12 ILE A 20 4.266 6.414 -21.521 1.00 0.00 H new ATOM 0 HD13 ILE A 20 5.553 5.607 -20.594 1.00 0.00 H new ATOM 800 N LYS A 21 5.432 11.285 -19.182 1.00 0.00 N ATOM 801 CA LYS A 21 6.255 12.523 -19.295 1.00 0.00 C ATOM 802 C LYS A 21 7.756 12.178 -19.273 1.00 0.00 C ATOM 803 O LYS A 21 8.138 11.017 -19.403 1.00 0.00 O ATOM 804 CB LYS A 21 5.914 13.485 -18.141 1.00 0.00 C ATOM 805 CG LYS A 21 5.422 14.822 -18.705 1.00 0.00 C ATOM 806 CD LYS A 21 4.951 15.718 -17.557 1.00 0.00 C ATOM 807 CE LYS A 21 3.771 16.572 -18.025 1.00 0.00 C ATOM 808 NZ LYS A 21 4.109 17.214 -19.328 1.00 0.00 N ATOM 0 H LYS A 21 5.081 11.074 -18.248 1.00 0.00 H new ATOM 0 HA LYS A 21 6.028 13.009 -20.244 1.00 0.00 H new ATOM 0 HB2 LYS A 21 5.147 13.045 -17.504 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.794 13.645 -17.517 1.00 0.00 H new ATOM 0 HG2 LYS A 21 6.223 15.312 -19.258 1.00 0.00 H new ATOM 0 HG3 LYS A 21 4.606 14.654 -19.408 1.00 0.00 H new ATOM 0 HD2 LYS A 21 4.656 15.108 -16.703 1.00 0.00 H new ATOM 0 HD3 LYS A 21 5.767 16.359 -17.224 1.00 0.00 H new ATOM 0 HE2 LYS A 21 2.880 15.953 -18.132 1.00 0.00 H new ATOM 0 HE3 LYS A 21 3.542 17.334 -17.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 3.559 18.090 -19.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 5.124 17.438 -19.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 3.880 16.563 -20.106 1.00 0.00 H new ATOM 809 N LYS A 22 8.620 13.166 -19.132 1.00 0.00 N ATOM 810 CA LYS A 22 10.094 12.886 -19.122 1.00 0.00 C ATOM 811 C LYS A 22 10.563 12.471 -17.721 1.00 0.00 C ATOM 812 O LYS A 22 11.457 11.640 -17.582 1.00 0.00 O ATOM 813 CB LYS A 22 10.859 14.147 -19.531 1.00 0.00 C ATOM 814 CG LYS A 22 12.337 13.808 -19.752 1.00 0.00 C ATOM 815 CD LYS A 22 13.213 14.934 -19.194 1.00 0.00 C ATOM 816 CE LYS A 22 13.563 15.914 -20.314 1.00 0.00 C ATOM 817 NZ LYS A 22 14.888 16.535 -20.033 1.00 0.00 N ATOM 0 H LYS A 22 8.366 14.148 -19.024 1.00 0.00 H new ATOM 0 HA LYS A 22 10.288 12.074 -19.823 1.00 0.00 H new ATOM 0 HB2 LYS A 22 10.431 14.563 -20.443 1.00 0.00 H new ATOM 0 HB3 LYS A 22 10.763 14.909 -18.757 1.00 0.00 H new ATOM 0 HG2 LYS A 22 12.582 12.866 -19.261 1.00 0.00 H new ATOM 0 HG3 LYS A 22 12.534 13.673 -20.816 1.00 0.00 H new ATOM 0 HD2 LYS A 22 12.688 15.454 -18.393 1.00 0.00 H new ATOM 0 HD3 LYS A 22 14.124 14.520 -18.762 1.00 0.00 H new ATOM 0 HE2 LYS A 22 13.588 15.394 -21.272 1.00 0.00 H new ATOM 0 HE3 LYS A 22 12.796 16.685 -20.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 15.127 17.202 -20.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 14.848 17.044 -19.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 15.615 15.793 -19.981 1.00 0.00 H new ATOM 818 N ASP A 23 9.993 13.029 -16.677 1.00 0.00 N ATOM 819 CA ASP A 23 10.432 12.649 -15.300 1.00 0.00 C ATOM 820 C ASP A 23 10.002 11.207 -15.023 1.00 0.00 C ATOM 821 O ASP A 23 10.732 10.446 -14.389 1.00 0.00 O ATOM 822 CB ASP A 23 9.798 13.578 -14.255 1.00 0.00 C ATOM 823 CG ASP A 23 10.398 14.980 -14.388 1.00 0.00 C ATOM 824 OD1 ASP A 23 11.570 15.132 -14.085 1.00 0.00 O ATOM 825 OD2 ASP A 23 9.675 15.877 -14.789 1.00 0.00 O ATOM 0 H ASP A 23 9.249 13.725 -16.721 1.00 0.00 H new ATOM 0 HA ASP A 23 11.516 12.740 -15.234 1.00 0.00 H new ATOM 0 HB2 ASP A 23 8.718 13.618 -14.396 1.00 0.00 H new ATOM 0 HB3 ASP A 23 9.974 13.189 -13.252 1.00 0.00 H new ATOM 826 N GLU A 24 8.834 10.807 -15.481 1.00 0.00 N ATOM 827 CA GLU A 24 8.393 9.408 -15.226 1.00 0.00 C ATOM 828 C GLU A 24 9.221 8.452 -16.100 1.00 0.00 C ATOM 829 O GLU A 24 9.669 7.403 -15.642 1.00 0.00 O ATOM 830 CB GLU A 24 6.906 9.245 -15.560 1.00 0.00 C ATOM 831 CG GLU A 24 6.065 9.594 -14.331 1.00 0.00 C ATOM 832 CD GLU A 24 5.865 8.342 -13.475 1.00 0.00 C ATOM 833 OE1 GLU A 24 5.167 7.448 -13.922 1.00 0.00 O ATOM 834 OE2 GLU A 24 6.415 8.298 -12.387 1.00 0.00 O ATOM 0 H GLU A 24 8.182 11.384 -16.011 1.00 0.00 H new ATOM 0 HA GLU A 24 8.542 9.175 -14.172 1.00 0.00 H new ATOM 0 HB2 GLU A 24 6.637 9.893 -16.394 1.00 0.00 H new ATOM 0 HB3 GLU A 24 6.703 8.221 -15.874 1.00 0.00 H new ATOM 0 HG2 GLU A 24 6.560 10.371 -13.748 1.00 0.00 H new ATOM 0 HG3 GLU A 24 5.099 9.994 -14.640 1.00 0.00 H new ATOM 835 N LEU A 25 9.430 8.790 -17.353 1.00 0.00 N ATOM 836 CA LEU A 25 10.233 7.895 -18.258 1.00 0.00 C ATOM 837 C LEU A 25 11.568 7.521 -17.593 1.00 0.00 C ATOM 838 O LEU A 25 11.984 6.366 -17.633 1.00 0.00 O ATOM 839 CB LEU A 25 10.535 8.621 -19.584 1.00 0.00 C ATOM 840 CG LEU A 25 10.604 7.626 -20.755 1.00 0.00 C ATOM 841 CD1 LEU A 25 11.610 6.507 -20.451 1.00 0.00 C ATOM 842 CD2 LEU A 25 9.217 7.022 -20.998 1.00 0.00 C ATOM 0 H LEU A 25 9.081 9.644 -17.789 1.00 0.00 H new ATOM 0 HA LEU A 25 9.651 6.993 -18.448 1.00 0.00 H new ATOM 0 HB2 LEU A 25 9.763 9.365 -19.779 1.00 0.00 H new ATOM 0 HB3 LEU A 25 11.480 9.157 -19.502 1.00 0.00 H new ATOM 0 HG LEU A 25 10.933 8.157 -21.648 1.00 0.00 H new ATOM 0 HD11 LEU A 25 11.646 5.812 -21.290 1.00 0.00 H new ATOM 0 HD12 LEU A 25 12.599 6.939 -20.295 1.00 0.00 H new ATOM 0 HD13 LEU A 25 11.301 5.974 -19.552 1.00 0.00 H new ATOM 0 HD21 LEU A 25 9.267 6.317 -21.828 1.00 0.00 H new ATOM 0 HD22 LEU A 25 8.884 6.502 -20.100 1.00 0.00 H new ATOM 0 HD23 LEU A 25 8.511 7.817 -21.239 1.00 0.00 H new ATOM 843 N LYS A 26 12.256 8.468 -16.993 1.00 0.00 N ATOM 844 CA LYS A 26 13.570 8.136 -16.348 1.00 0.00 C ATOM 845 C LYS A 26 13.350 7.110 -15.227 1.00 0.00 C ATOM 846 O LYS A 26 14.131 6.176 -15.073 1.00 0.00 O ATOM 847 CB LYS A 26 14.210 9.401 -15.757 1.00 0.00 C ATOM 848 CG LYS A 26 15.637 9.087 -15.300 1.00 0.00 C ATOM 849 CD LYS A 26 15.632 8.739 -13.810 1.00 0.00 C ATOM 850 CE LYS A 26 16.936 9.218 -13.169 1.00 0.00 C ATOM 851 NZ LYS A 26 17.022 10.703 -13.268 1.00 0.00 N ATOM 0 H LYS A 26 11.969 9.444 -16.922 1.00 0.00 H new ATOM 0 HA LYS A 26 14.235 7.720 -17.105 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.222 10.197 -16.502 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.618 9.761 -14.915 1.00 0.00 H new ATOM 0 HG2 LYS A 26 16.040 8.255 -15.877 1.00 0.00 H new ATOM 0 HG3 LYS A 26 16.285 9.944 -15.482 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.779 9.208 -13.319 1.00 0.00 H new ATOM 0 HD3 LYS A 26 15.523 7.663 -13.678 1.00 0.00 H new ATOM 0 HE2 LYS A 26 16.975 8.910 -12.124 1.00 0.00 H new ATOM 0 HE3 LYS A 26 17.789 8.759 -13.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 17.475 11.082 -12.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 17.586 10.963 -14.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 16.065 11.101 -13.359 1.00 0.00 H new ATOM 852 N LYS A 27 12.313 7.265 -14.435 1.00 0.00 N ATOM 853 CA LYS A 27 12.072 6.285 -13.323 1.00 0.00 C ATOM 854 C LYS A 27 11.995 4.849 -13.878 1.00 0.00 C ATOM 855 O LYS A 27 12.398 3.900 -13.206 1.00 0.00 O ATOM 856 CB LYS A 27 10.753 6.616 -12.594 1.00 0.00 C ATOM 857 CG LYS A 27 11.054 7.118 -11.177 1.00 0.00 C ATOM 858 CD LYS A 27 10.956 5.953 -10.189 1.00 0.00 C ATOM 859 CE LYS A 27 11.992 6.134 -9.079 1.00 0.00 C ATOM 860 NZ LYS A 27 11.451 7.054 -8.039 1.00 0.00 N ATOM 0 H LYS A 27 11.630 8.019 -14.508 1.00 0.00 H new ATOM 0 HA LYS A 27 12.903 6.357 -12.622 1.00 0.00 H new ATOM 0 HB2 LYS A 27 10.201 7.375 -13.149 1.00 0.00 H new ATOM 0 HB3 LYS A 27 10.120 5.730 -12.549 1.00 0.00 H new ATOM 0 HG2 LYS A 27 12.051 7.557 -11.140 1.00 0.00 H new ATOM 0 HG3 LYS A 27 10.350 7.903 -10.901 1.00 0.00 H new ATOM 0 HD2 LYS A 27 9.954 5.909 -9.762 1.00 0.00 H new ATOM 0 HD3 LYS A 27 11.124 5.009 -10.707 1.00 0.00 H new ATOM 0 HE2 LYS A 27 12.237 5.169 -8.635 1.00 0.00 H new ATOM 0 HE3 LYS A 27 12.916 6.538 -9.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 12.156 7.177 -7.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 11.239 7.977 -8.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 10.580 6.651 -7.638 1.00 0.00 H new ATOM 861 N SER A 28 11.472 4.653 -15.073 1.00 0.00 N ATOM 862 CA SER A 28 11.371 3.256 -15.616 1.00 0.00 C ATOM 863 C SER A 28 12.753 2.748 -16.068 1.00 0.00 C ATOM 864 O SER A 28 13.166 1.650 -15.701 1.00 0.00 O ATOM 865 CB SER A 28 10.409 3.222 -16.808 1.00 0.00 C ATOM 866 OG SER A 28 9.091 3.503 -16.355 1.00 0.00 O ATOM 0 H SER A 28 11.117 5.388 -15.685 1.00 0.00 H new ATOM 0 HA SER A 28 10.995 2.610 -14.823 1.00 0.00 H new ATOM 0 HB2 SER A 28 10.713 3.954 -17.556 1.00 0.00 H new ATOM 0 HB3 SER A 28 10.440 2.244 -17.288 1.00 0.00 H new ATOM 0 HG SER A 28 8.625 4.048 -17.023 1.00 0.00 H new ATOM 867 N LEU A 29 13.470 3.508 -16.865 1.00 0.00 N ATOM 868 CA LEU A 29 14.817 3.034 -17.337 1.00 0.00 C ATOM 869 C LEU A 29 15.741 2.698 -16.148 1.00 0.00 C ATOM 870 O LEU A 29 16.659 1.890 -16.286 1.00 0.00 O ATOM 871 CB LEU A 29 15.488 4.116 -18.195 1.00 0.00 C ATOM 872 CG LEU A 29 14.742 4.249 -19.523 1.00 0.00 C ATOM 873 CD1 LEU A 29 15.130 5.566 -20.198 1.00 0.00 C ATOM 874 CD2 LEU A 29 15.118 3.080 -20.437 1.00 0.00 C ATOM 0 H LEU A 29 13.187 4.426 -17.207 1.00 0.00 H new ATOM 0 HA LEU A 29 14.659 2.132 -17.928 1.00 0.00 H new ATOM 0 HB2 LEU A 29 15.484 5.069 -17.666 1.00 0.00 H new ATOM 0 HB3 LEU A 29 16.531 3.857 -18.376 1.00 0.00 H new ATOM 0 HG LEU A 29 13.668 4.238 -19.338 1.00 0.00 H new ATOM 0 HD11 LEU A 29 14.598 5.660 -21.145 1.00 0.00 H new ATOM 0 HD12 LEU A 29 14.865 6.400 -19.548 1.00 0.00 H new ATOM 0 HD13 LEU A 29 16.204 5.577 -20.383 1.00 0.00 H new ATOM 0 HD21 LEU A 29 14.587 3.173 -21.384 1.00 0.00 H new ATOM 0 HD22 LEU A 29 16.192 3.093 -20.621 1.00 0.00 H new ATOM 0 HD23 LEU A 29 14.843 2.140 -19.958 1.00 0.00 H new ATOM 875 N HIS A 30 15.541 3.293 -14.990 1.00 0.00 N ATOM 876 CA HIS A 30 16.439 2.986 -13.830 1.00 0.00 C ATOM 877 C HIS A 30 15.977 1.710 -13.103 1.00 0.00 C ATOM 878 O HIS A 30 16.796 0.979 -12.551 1.00 0.00 O ATOM 879 CB HIS A 30 16.437 4.158 -12.841 1.00 0.00 C ATOM 880 CG HIS A 30 17.728 4.165 -12.069 1.00 0.00 C ATOM 881 ND1 HIS A 30 17.889 3.450 -10.892 1.00 0.00 N ATOM 882 CD2 HIS A 30 18.927 4.797 -12.290 1.00 0.00 C ATOM 883 CE1 HIS A 30 19.143 3.667 -10.455 1.00 0.00 C ATOM 884 NE2 HIS A 30 19.819 4.480 -11.270 1.00 0.00 N ATOM 0 H HIS A 30 14.802 3.970 -14.802 1.00 0.00 H new ATOM 0 HA HIS A 30 17.447 2.829 -14.214 1.00 0.00 H new ATOM 0 HB2 HIS A 30 16.316 5.100 -13.377 1.00 0.00 H new ATOM 0 HB3 HIS A 30 15.593 4.069 -12.157 1.00 0.00 H new ATOM 0 HD2 HIS A 30 19.145 5.442 -13.128 1.00 0.00 H new ATOM 0 HE1 HIS A 30 19.553 3.236 -9.554 1.00 0.00 H new ATOM 0 HE2 HIS A 30 20.782 4.800 -11.167 1.00 0.00 H new ATOM 885 N ALA A 31 14.693 1.425 -13.073 1.00 0.00 N ATOM 886 CA ALA A 31 14.224 0.192 -12.356 1.00 0.00 C ATOM 887 C ALA A 31 14.634 -1.071 -13.137 1.00 0.00 C ATOM 888 O ALA A 31 14.957 -2.096 -12.540 1.00 0.00 O ATOM 889 CB ALA A 31 12.697 0.215 -12.205 1.00 0.00 C ATOM 0 H ALA A 31 13.959 1.984 -13.508 1.00 0.00 H new ATOM 0 HA ALA A 31 14.688 0.174 -11.370 1.00 0.00 H new ATOM 0 HB1 ALA A 31 12.369 -0.684 -11.684 1.00 0.00 H new ATOM 0 HB2 ALA A 31 12.401 1.094 -11.633 1.00 0.00 H new ATOM 0 HB3 ALA A 31 12.234 0.251 -13.191 1.00 0.00 H new ATOM 890 N ILE A 32 14.615 -1.034 -14.453 1.00 0.00 N ATOM 891 CA ILE A 32 14.988 -2.239 -15.234 1.00 0.00 C ATOM 892 C ILE A 32 16.512 -2.311 -15.439 1.00 0.00 C ATOM 893 O ILE A 32 17.133 -3.330 -15.152 1.00 0.00 O ATOM 894 CB ILE A 32 14.288 -2.270 -16.614 1.00 0.00 C ATOM 895 CG1 ILE A 32 13.895 -0.882 -17.163 1.00 0.00 C ATOM 896 CG2 ILE A 32 13.021 -3.104 -16.506 1.00 0.00 C ATOM 897 CD1 ILE A 32 13.544 -1.007 -18.646 1.00 0.00 C ATOM 0 H ILE A 32 14.357 -0.219 -15.009 1.00 0.00 H new ATOM 0 HA ILE A 32 14.656 -3.102 -14.657 1.00 0.00 H new ATOM 0 HB ILE A 32 15.014 -2.694 -17.308 1.00 0.00 H new ATOM 0 HG12 ILE A 32 13.044 -0.486 -16.608 1.00 0.00 H new ATOM 0 HG13 ILE A 32 14.717 -0.179 -17.030 1.00 0.00 H new ATOM 0 HG21 ILE A 32 12.520 -3.132 -17.474 1.00 0.00 H new ATOM 0 HG22 ILE A 32 13.278 -4.118 -16.201 1.00 0.00 H new ATOM 0 HG23 ILE A 32 12.355 -2.660 -15.766 1.00 0.00 H new ATOM 0 HD11 ILE A 32 13.266 -0.029 -19.038 1.00 0.00 H new ATOM 0 HD12 ILE A 32 14.407 -1.385 -19.194 1.00 0.00 H new ATOM 0 HD13 ILE A 32 12.708 -1.697 -18.765 1.00 0.00 H new ATOM 898 N PHE A 33 17.123 -1.271 -15.948 1.00 0.00 N ATOM 899 CA PHE A 33 18.608 -1.316 -16.185 1.00 0.00 C ATOM 900 C PHE A 33 19.407 -1.360 -14.863 1.00 0.00 C ATOM 901 O PHE A 33 20.599 -1.657 -14.879 1.00 0.00 O ATOM 902 CB PHE A 33 19.047 -0.086 -16.990 1.00 0.00 C ATOM 903 CG PHE A 33 18.642 -0.262 -18.434 1.00 0.00 C ATOM 904 CD1 PHE A 33 19.184 -1.310 -19.187 1.00 0.00 C ATOM 905 CD2 PHE A 33 17.725 0.619 -19.018 1.00 0.00 C ATOM 906 CE1 PHE A 33 18.808 -1.477 -20.525 1.00 0.00 C ATOM 907 CE2 PHE A 33 17.349 0.452 -20.356 1.00 0.00 C ATOM 908 CZ PHE A 33 17.890 -0.597 -21.110 1.00 0.00 C ATOM 0 H PHE A 33 16.667 -0.397 -16.210 1.00 0.00 H new ATOM 0 HA PHE A 33 18.817 -2.230 -16.741 1.00 0.00 H new ATOM 0 HB2 PHE A 33 18.589 0.814 -16.579 1.00 0.00 H new ATOM 0 HB3 PHE A 33 20.127 0.044 -16.917 1.00 0.00 H new ATOM 0 HD1 PHE A 33 19.892 -1.989 -18.736 1.00 0.00 H new ATOM 0 HD2 PHE A 33 17.307 1.428 -18.437 1.00 0.00 H new ATOM 0 HE1 PHE A 33 19.226 -2.285 -21.106 1.00 0.00 H new ATOM 0 HE2 PHE A 33 16.642 1.132 -20.807 1.00 0.00 H new ATOM 0 HZ PHE A 33 17.599 -0.727 -22.142 1.00 0.00 H new ATOM 909 N SER A 34 18.810 -1.065 -13.724 1.00 0.00 N ATOM 910 CA SER A 34 19.601 -1.096 -12.447 1.00 0.00 C ATOM 911 C SER A 34 19.757 -2.540 -11.937 1.00 0.00 C ATOM 912 O SER A 34 20.784 -2.886 -11.354 1.00 0.00 O ATOM 913 CB SER A 34 18.904 -0.257 -11.372 1.00 0.00 C ATOM 914 OG SER A 34 19.545 -0.470 -10.120 1.00 0.00 O ATOM 0 H SER A 34 17.828 -0.809 -13.626 1.00 0.00 H new ATOM 0 HA SER A 34 20.588 -0.682 -12.653 1.00 0.00 H new ATOM 0 HB2 SER A 34 18.942 0.799 -11.638 1.00 0.00 H new ATOM 0 HB3 SER A 34 17.851 -0.532 -11.306 1.00 0.00 H new ATOM 0 HG SER A 34 19.102 0.067 -9.430 1.00 0.00 H new ATOM 915 N ARG A 35 18.768 -3.394 -12.123 1.00 0.00 N ATOM 916 CA ARG A 35 18.895 -4.806 -11.617 1.00 0.00 C ATOM 917 C ARG A 35 20.238 -5.430 -12.053 1.00 0.00 C ATOM 918 O ARG A 35 20.795 -6.266 -11.343 1.00 0.00 O ATOM 919 CB ARG A 35 17.735 -5.671 -12.140 1.00 0.00 C ATOM 920 CG ARG A 35 17.783 -5.748 -13.669 1.00 0.00 C ATOM 921 CD ARG A 35 16.359 -5.847 -14.220 1.00 0.00 C ATOM 922 NE ARG A 35 15.806 -7.198 -13.923 1.00 0.00 N ATOM 923 CZ ARG A 35 15.180 -7.865 -14.854 1.00 0.00 C ATOM 924 NH1 ARG A 35 14.082 -7.388 -15.373 1.00 0.00 N ATOM 925 NH2 ARG A 35 15.652 -9.010 -15.266 1.00 0.00 N ATOM 0 H ARG A 35 17.891 -3.178 -12.596 1.00 0.00 H new ATOM 0 HA ARG A 35 18.859 -4.774 -10.528 1.00 0.00 H new ATOM 0 HB2 ARG A 35 17.798 -6.673 -11.716 1.00 0.00 H new ATOM 0 HB3 ARG A 35 16.783 -5.249 -11.819 1.00 0.00 H new ATOM 0 HG2 ARG A 35 18.280 -4.866 -14.073 1.00 0.00 H new ATOM 0 HG3 ARG A 35 18.366 -6.614 -13.982 1.00 0.00 H new ATOM 0 HD2 ARG A 35 15.730 -5.078 -13.772 1.00 0.00 H new ATOM 0 HD3 ARG A 35 16.360 -5.671 -15.296 1.00 0.00 H new ATOM 0 HE ARG A 35 15.916 -7.601 -12.993 1.00 0.00 H new ATOM 0 HH11 ARG A 35 13.712 -6.493 -15.051 1.00 0.00 H new ATOM 0 HH12 ARG A 35 13.593 -7.910 -16.101 1.00 0.00 H new ATOM 0 HH21 ARG A 35 16.510 -9.384 -14.860 1.00 0.00 H new ATOM 0 HH22 ARG A 35 15.163 -9.531 -15.994 1.00 0.00 H new ATOM 926 N PHE A 36 20.778 -5.051 -13.196 1.00 0.00 N ATOM 927 CA PHE A 36 22.082 -5.650 -13.630 1.00 0.00 C ATOM 928 C PHE A 36 23.209 -5.105 -12.742 1.00 0.00 C ATOM 929 O PHE A 36 23.934 -5.869 -12.107 1.00 0.00 O ATOM 930 CB PHE A 36 22.373 -5.292 -15.094 1.00 0.00 C ATOM 931 CG PHE A 36 21.320 -5.910 -15.982 1.00 0.00 C ATOM 932 CD1 PHE A 36 21.225 -7.302 -16.090 1.00 0.00 C ATOM 933 CD2 PHE A 36 20.439 -5.091 -16.698 1.00 0.00 C ATOM 934 CE1 PHE A 36 20.248 -7.876 -16.913 1.00 0.00 C ATOM 935 CE2 PHE A 36 19.463 -5.664 -17.521 1.00 0.00 C ATOM 936 CZ PHE A 36 19.368 -7.056 -17.629 1.00 0.00 C ATOM 0 H PHE A 36 20.377 -4.364 -13.835 1.00 0.00 H new ATOM 0 HA PHE A 36 22.023 -6.734 -13.536 1.00 0.00 H new ATOM 0 HB2 PHE A 36 22.381 -4.209 -15.220 1.00 0.00 H new ATOM 0 HB3 PHE A 36 23.361 -5.653 -15.378 1.00 0.00 H new ATOM 0 HD1 PHE A 36 21.905 -7.934 -15.538 1.00 0.00 H new ATOM 0 HD2 PHE A 36 20.513 -4.017 -16.615 1.00 0.00 H new ATOM 0 HE1 PHE A 36 20.174 -8.950 -16.995 1.00 0.00 H new ATOM 0 HE2 PHE A 36 18.783 -5.032 -18.073 1.00 0.00 H new ATOM 0 HZ PHE A 36 18.615 -7.498 -18.265 1.00 0.00 H new ATOM 937 N GLY A 37 23.377 -3.801 -12.679 1.00 0.00 N ATOM 938 CA GLY A 37 24.463 -3.232 -11.825 1.00 0.00 C ATOM 939 C GLY A 37 24.059 -1.835 -11.331 1.00 0.00 C ATOM 940 O GLY A 37 23.015 -1.667 -10.703 1.00 0.00 O ATOM 0 H GLY A 37 22.812 -3.115 -13.179 1.00 0.00 H new ATOM 0 HA2 GLY A 37 24.651 -3.888 -10.975 1.00 0.00 H new ATOM 0 HA3 GLY A 37 25.391 -3.172 -12.393 1.00 0.00 H new ATOM 941 N GLN A 38 24.858 -0.824 -11.601 1.00 0.00 N ATOM 942 CA GLN A 38 24.502 0.549 -11.142 1.00 0.00 C ATOM 943 C GLN A 38 24.415 1.485 -12.356 1.00 0.00 C ATOM 944 O GLN A 38 25.208 1.378 -13.290 1.00 0.00 O ATOM 945 CB GLN A 38 25.575 1.061 -10.178 1.00 0.00 C ATOM 946 CG GLN A 38 24.979 2.150 -9.285 1.00 0.00 C ATOM 947 CD GLN A 38 25.908 2.397 -8.088 1.00 0.00 C ATOM 948 OE1 GLN A 38 25.485 2.281 -6.940 1.00 0.00 O ATOM 949 NE2 GLN A 38 27.158 2.732 -8.289 1.00 0.00 N ATOM 0 H GLN A 38 25.735 -0.896 -12.117 1.00 0.00 H new ATOM 0 HA GLN A 38 23.539 0.524 -10.631 1.00 0.00 H new ATOM 0 HB2 GLN A 38 25.952 0.241 -9.567 1.00 0.00 H new ATOM 0 HB3 GLN A 38 26.422 1.458 -10.737 1.00 0.00 H new ATOM 0 HG2 GLN A 38 24.849 3.071 -9.854 1.00 0.00 H new ATOM 0 HG3 GLN A 38 23.991 1.849 -8.936 1.00 0.00 H new ATOM 0 HE21 GLN A 38 27.513 2.829 -9.240 1.00 0.00 H new ATOM 0 HE22 GLN A 38 27.776 2.895 -7.494 1.00 0.00 H new ATOM 950 N ILE A 39 23.470 2.402 -12.369 1.00 0.00 N ATOM 951 CA ILE A 39 23.351 3.329 -13.529 1.00 0.00 C ATOM 952 C ILE A 39 23.850 4.724 -13.125 1.00 0.00 C ATOM 953 O ILE A 39 23.260 5.378 -12.266 1.00 0.00 O ATOM 954 CB ILE A 39 21.886 3.419 -13.962 1.00 0.00 C ATOM 955 CG1 ILE A 39 21.346 2.011 -14.223 1.00 0.00 C ATOM 956 CG2 ILE A 39 21.781 4.248 -15.243 1.00 0.00 C ATOM 957 CD1 ILE A 39 19.836 2.081 -14.461 1.00 0.00 C ATOM 0 H ILE A 39 22.784 2.542 -11.628 1.00 0.00 H new ATOM 0 HA ILE A 39 23.953 2.953 -14.356 1.00 0.00 H new ATOM 0 HB ILE A 39 21.303 3.894 -13.173 1.00 0.00 H new ATOM 0 HG12 ILE A 39 21.842 1.574 -15.090 1.00 0.00 H new ATOM 0 HG13 ILE A 39 21.562 1.364 -13.373 1.00 0.00 H new ATOM 0 HG21 ILE A 39 20.737 4.312 -15.551 1.00 0.00 H new ATOM 0 HG22 ILE A 39 22.167 5.251 -15.060 1.00 0.00 H new ATOM 0 HG23 ILE A 39 22.364 3.773 -16.032 1.00 0.00 H new ATOM 0 HD11 ILE A 39 19.450 1.079 -14.647 1.00 0.00 H new ATOM 0 HD12 ILE A 39 19.348 2.500 -13.581 1.00 0.00 H new ATOM 0 HD13 ILE A 39 19.633 2.714 -15.325 1.00 0.00 H new ATOM 958 N LEU A 40 24.923 5.200 -13.721 1.00 0.00 N ATOM 959 CA LEU A 40 25.435 6.559 -13.350 1.00 0.00 C ATOM 960 C LEU A 40 24.343 7.602 -13.612 1.00 0.00 C ATOM 961 O LEU A 40 24.129 8.506 -12.805 1.00 0.00 O ATOM 962 CB LEU A 40 26.680 6.912 -14.179 1.00 0.00 C ATOM 963 CG LEU A 40 27.822 5.957 -13.826 1.00 0.00 C ATOM 964 CD1 LEU A 40 29.021 6.244 -14.732 1.00 0.00 C ATOM 965 CD2 LEU A 40 28.230 6.163 -12.365 1.00 0.00 C ATOM 0 H LEU A 40 25.459 4.712 -14.439 1.00 0.00 H new ATOM 0 HA LEU A 40 25.704 6.555 -12.294 1.00 0.00 H new ATOM 0 HB2 LEU A 40 26.452 6.844 -15.243 1.00 0.00 H new ATOM 0 HB3 LEU A 40 26.980 7.941 -13.982 1.00 0.00 H new ATOM 0 HG LEU A 40 27.492 4.928 -13.969 1.00 0.00 H new ATOM 0 HD11 LEU A 40 29.836 5.565 -14.483 1.00 0.00 H new ATOM 0 HD12 LEU A 40 28.733 6.099 -15.773 1.00 0.00 H new ATOM 0 HD13 LEU A 40 29.349 7.273 -14.587 1.00 0.00 H new ATOM 0 HD21 LEU A 40 29.044 5.482 -12.115 1.00 0.00 H new ATOM 0 HD22 LEU A 40 28.561 7.192 -12.221 1.00 0.00 H new ATOM 0 HD23 LEU A 40 27.377 5.962 -11.717 1.00 0.00 H new ATOM 966 N ASP A 41 23.645 7.503 -14.721 1.00 0.00 N ATOM 967 CA ASP A 41 22.569 8.501 -15.014 1.00 0.00 C ATOM 968 C ASP A 41 21.840 8.136 -16.320 1.00 0.00 C ATOM 969 O ASP A 41 22.370 7.406 -17.156 1.00 0.00 O ATOM 970 CB ASP A 41 23.195 9.890 -15.157 1.00 0.00 C ATOM 971 CG ASP A 41 22.143 10.958 -14.853 1.00 0.00 C ATOM 972 OD1 ASP A 41 22.006 11.315 -13.695 1.00 0.00 O ATOM 973 OD2 ASP A 41 21.492 11.402 -15.785 1.00 0.00 O ATOM 0 H ASP A 41 23.774 6.780 -15.429 1.00 0.00 H new ATOM 0 HA ASP A 41 21.850 8.497 -14.195 1.00 0.00 H new ATOM 0 HB2 ASP A 41 24.039 9.992 -14.475 1.00 0.00 H new ATOM 0 HB3 ASP A 41 23.583 10.024 -16.167 1.00 0.00 H new ATOM 974 N ILE A 42 20.634 8.627 -16.515 1.00 0.00 N ATOM 975 CA ILE A 42 19.889 8.301 -17.764 1.00 0.00 C ATOM 976 C ILE A 42 19.376 9.603 -18.399 1.00 0.00 C ATOM 977 O ILE A 42 18.649 10.366 -17.765 1.00 0.00 O ATOM 978 CB ILE A 42 18.704 7.390 -17.431 1.00 0.00 C ATOM 979 CG1 ILE A 42 19.196 6.184 -16.626 1.00 0.00 C ATOM 980 CG2 ILE A 42 18.052 6.900 -18.726 1.00 0.00 C ATOM 981 CD1 ILE A 42 17.995 5.422 -16.063 1.00 0.00 C ATOM 0 H ILE A 42 20.141 9.236 -15.862 1.00 0.00 H new ATOM 0 HA ILE A 42 20.550 7.789 -18.463 1.00 0.00 H new ATOM 0 HB ILE A 42 17.975 7.949 -16.845 1.00 0.00 H new ATOM 0 HG12 ILE A 42 19.791 5.528 -17.261 1.00 0.00 H new ATOM 0 HG13 ILE A 42 19.843 6.515 -15.814 1.00 0.00 H new ATOM 0 HG21 ILE A 42 17.209 6.252 -18.486 1.00 0.00 H new ATOM 0 HG22 ILE A 42 17.700 7.755 -19.302 1.00 0.00 H new ATOM 0 HG23 ILE A 42 18.782 6.343 -19.313 1.00 0.00 H new ATOM 0 HD11 ILE A 42 18.345 4.563 -15.490 1.00 0.00 H new ATOM 0 HD12 ILE A 42 17.418 6.081 -15.414 1.00 0.00 H new ATOM 0 HD13 ILE A 42 17.365 5.078 -16.883 1.00 0.00 H new ATOM 982 N LEU A 43 19.740 9.883 -19.633 1.00 0.00 N ATOM 983 CA LEU A 43 19.268 11.143 -20.280 1.00 0.00 C ATOM 984 C LEU A 43 18.054 10.846 -21.172 1.00 0.00 C ATOM 985 O LEU A 43 18.086 9.937 -22.001 1.00 0.00 O ATOM 986 CB LEU A 43 20.392 11.735 -21.137 1.00 0.00 C ATOM 987 CG LEU A 43 21.624 12.014 -20.262 1.00 0.00 C ATOM 988 CD1 LEU A 43 22.678 10.928 -20.493 1.00 0.00 C ATOM 989 CD2 LEU A 43 22.218 13.377 -20.631 1.00 0.00 C ATOM 0 H LEU A 43 20.339 9.295 -20.212 1.00 0.00 H new ATOM 0 HA LEU A 43 18.984 11.856 -19.506 1.00 0.00 H new ATOM 0 HB2 LEU A 43 20.653 11.044 -21.938 1.00 0.00 H new ATOM 0 HB3 LEU A 43 20.054 12.657 -21.609 1.00 0.00 H new ATOM 0 HG LEU A 43 21.325 12.015 -19.214 1.00 0.00 H new ATOM 0 HD11 LEU A 43 23.550 11.129 -19.871 1.00 0.00 H new ATOM 0 HD12 LEU A 43 22.262 9.955 -20.231 1.00 0.00 H new ATOM 0 HD13 LEU A 43 22.974 10.925 -21.542 1.00 0.00 H new ATOM 0 HD21 LEU A 43 23.092 13.573 -20.010 1.00 0.00 H new ATOM 0 HD22 LEU A 43 22.513 13.373 -21.680 1.00 0.00 H new ATOM 0 HD23 LEU A 43 21.473 14.155 -20.466 1.00 0.00 H new ATOM 990 N VAL A 44 16.982 11.599 -21.031 1.00 0.00 N ATOM 991 CA VAL A 44 15.780 11.353 -21.883 1.00 0.00 C ATOM 992 C VAL A 44 15.790 12.356 -23.047 1.00 0.00 C ATOM 993 O VAL A 44 16.468 13.382 -22.983 1.00 0.00 O ATOM 994 CB VAL A 44 14.501 11.544 -21.055 1.00 0.00 C ATOM 995 CG1 VAL A 44 13.304 10.982 -21.824 1.00 0.00 C ATOM 996 CG2 VAL A 44 14.628 10.807 -19.717 1.00 0.00 C ATOM 0 H VAL A 44 16.893 12.367 -20.366 1.00 0.00 H new ATOM 0 HA VAL A 44 15.804 10.332 -22.265 1.00 0.00 H new ATOM 0 HB VAL A 44 14.355 12.608 -20.870 1.00 0.00 H new ATOM 0 HG11 VAL A 44 12.397 11.118 -21.235 1.00 0.00 H new ATOM 0 HG12 VAL A 44 13.203 11.507 -22.774 1.00 0.00 H new ATOM 0 HG13 VAL A 44 13.459 9.919 -22.012 1.00 0.00 H new ATOM 0 HG21 VAL A 44 13.716 10.948 -19.136 1.00 0.00 H new ATOM 0 HG22 VAL A 44 14.781 9.743 -19.900 1.00 0.00 H new ATOM 0 HG23 VAL A 44 15.477 11.205 -19.162 1.00 0.00 H new ATOM 997 N SER A 45 15.066 12.090 -24.112 1.00 0.00 N ATOM 998 CA SER A 45 15.061 13.041 -25.262 1.00 0.00 C ATOM 999 C SER A 45 13.613 13.403 -25.631 1.00 0.00 C ATOM 1000 O SER A 45 12.841 12.550 -26.065 1.00 0.00 O ATOM 1001 CB SER A 45 15.746 12.387 -26.460 1.00 0.00 C ATOM 1002 OG SER A 45 17.051 11.968 -26.083 1.00 0.00 O ATOM 0 H SER A 45 14.484 11.261 -24.230 1.00 0.00 H new ATOM 0 HA SER A 45 15.597 13.949 -24.984 1.00 0.00 H new ATOM 0 HB2 SER A 45 15.163 11.533 -26.806 1.00 0.00 H new ATOM 0 HB3 SER A 45 15.803 13.091 -27.290 1.00 0.00 H new ATOM 0 HG SER A 45 17.493 11.546 -26.849 1.00 0.00 H new ATOM 1003 N ARG A 46 13.224 14.650 -25.467 1.00 0.00 N ATOM 1004 CA ARG A 46 11.823 15.047 -25.808 1.00 0.00 C ATOM 1005 C ARG A 46 11.754 15.685 -27.214 1.00 0.00 C ATOM 1006 O ARG A 46 10.729 15.588 -27.885 1.00 0.00 O ATOM 1007 CB ARG A 46 11.312 16.055 -24.773 1.00 0.00 C ATOM 1008 CG ARG A 46 9.818 15.827 -24.533 1.00 0.00 C ATOM 1009 CD ARG A 46 9.366 16.635 -23.314 1.00 0.00 C ATOM 1010 NE ARG A 46 8.327 15.870 -22.569 1.00 0.00 N ATOM 1011 CZ ARG A 46 7.068 16.198 -22.681 1.00 0.00 C ATOM 1012 NH1 ARG A 46 6.698 17.437 -22.503 1.00 0.00 N ATOM 1013 NH2 ARG A 46 6.180 15.288 -22.972 1.00 0.00 N ATOM 0 H ARG A 46 13.815 15.403 -25.114 1.00 0.00 H new ATOM 0 HA ARG A 46 11.202 14.151 -25.801 1.00 0.00 H new ATOM 0 HB2 ARG A 46 11.862 15.944 -23.839 1.00 0.00 H new ATOM 0 HB3 ARG A 46 11.484 17.072 -25.125 1.00 0.00 H new ATOM 0 HG2 ARG A 46 9.248 16.127 -25.412 1.00 0.00 H new ATOM 0 HG3 ARG A 46 9.623 14.767 -24.372 1.00 0.00 H new ATOM 0 HD2 ARG A 46 10.217 16.841 -22.665 1.00 0.00 H new ATOM 0 HD3 ARG A 46 8.966 17.598 -23.631 1.00 0.00 H new ATOM 0 HE ARG A 46 8.599 15.090 -21.971 1.00 0.00 H new ATOM 0 HH11 ARG A 46 7.392 18.149 -22.276 1.00 0.00 H new ATOM 0 HH12 ARG A 46 5.715 17.693 -22.591 1.00 0.00 H new ATOM 0 HH21 ARG A 46 6.469 14.320 -23.112 1.00 0.00 H new ATOM 0 HH22 ARG A 46 5.197 15.545 -23.059 1.00 0.00 H new ATOM 1014 N SER A 47 12.802 16.346 -27.676 1.00 0.00 N ATOM 1015 CA SER A 47 12.751 16.989 -29.038 1.00 0.00 C ATOM 1016 C SER A 47 12.209 15.995 -30.085 1.00 0.00 C ATOM 1017 O SER A 47 12.042 14.810 -29.801 1.00 0.00 O ATOM 1018 CB SER A 47 14.153 17.447 -29.461 1.00 0.00 C ATOM 1019 OG SER A 47 14.998 16.312 -29.595 1.00 0.00 O ATOM 0 H SER A 47 13.681 16.466 -27.173 1.00 0.00 H new ATOM 0 HA SER A 47 12.086 17.851 -28.981 1.00 0.00 H new ATOM 0 HB2 SER A 47 14.101 17.990 -30.405 1.00 0.00 H new ATOM 0 HB3 SER A 47 14.562 18.134 -28.720 1.00 0.00 H new ATOM 0 HG SER A 47 15.894 16.601 -29.867 1.00 0.00 H new ATOM 1020 N LEU A 48 11.921 16.453 -31.288 1.00 0.00 N ATOM 1021 CA LEU A 48 11.381 15.520 -32.332 1.00 0.00 C ATOM 1022 C LEU A 48 12.516 14.646 -32.884 1.00 0.00 C ATOM 1023 O LEU A 48 12.405 13.421 -32.922 1.00 0.00 O ATOM 1024 CB LEU A 48 10.755 16.315 -33.487 1.00 0.00 C ATOM 1025 CG LEU A 48 9.621 15.507 -34.119 1.00 0.00 C ATOM 1026 CD1 LEU A 48 8.496 16.455 -34.549 1.00 0.00 C ATOM 1027 CD2 LEU A 48 10.149 14.754 -35.344 1.00 0.00 C ATOM 0 H LEU A 48 12.036 17.422 -31.587 1.00 0.00 H new ATOM 0 HA LEU A 48 10.618 14.891 -31.873 1.00 0.00 H new ATOM 0 HB2 LEU A 48 10.374 17.268 -33.120 1.00 0.00 H new ATOM 0 HB3 LEU A 48 11.513 16.543 -34.237 1.00 0.00 H new ATOM 0 HG LEU A 48 9.237 14.792 -33.391 1.00 0.00 H new ATOM 0 HD11 LEU A 48 7.687 15.879 -35.000 1.00 0.00 H new ATOM 0 HD12 LEU A 48 8.119 16.990 -33.678 1.00 0.00 H new ATOM 0 HD13 LEU A 48 8.881 17.170 -35.276 1.00 0.00 H new ATOM 0 HD21 LEU A 48 9.340 14.178 -35.794 1.00 0.00 H new ATOM 0 HD22 LEU A 48 10.534 15.468 -36.072 1.00 0.00 H new ATOM 0 HD23 LEU A 48 10.949 14.079 -35.039 1.00 0.00 H new ATOM 1028 N LYS A 49 13.608 15.242 -33.321 1.00 0.00 N ATOM 1029 CA LYS A 49 14.741 14.422 -33.876 1.00 0.00 C ATOM 1030 C LYS A 49 15.106 13.291 -32.898 1.00 0.00 C ATOM 1031 O LYS A 49 15.433 12.182 -33.316 1.00 0.00 O ATOM 1032 CB LYS A 49 15.975 15.306 -34.103 1.00 0.00 C ATOM 1033 CG LYS A 49 15.633 16.412 -35.103 1.00 0.00 C ATOM 1034 CD LYS A 49 16.868 16.742 -35.943 1.00 0.00 C ATOM 1035 CE LYS A 49 16.434 17.136 -37.356 1.00 0.00 C ATOM 1036 NZ LYS A 49 15.817 15.960 -38.032 1.00 0.00 N ATOM 0 H LYS A 49 13.762 16.250 -33.318 1.00 0.00 H new ATOM 0 HA LYS A 49 14.421 13.994 -34.826 1.00 0.00 H new ATOM 0 HB2 LYS A 49 16.301 15.743 -33.159 1.00 0.00 H new ATOM 0 HB3 LYS A 49 16.802 14.704 -34.479 1.00 0.00 H new ATOM 0 HG2 LYS A 49 14.816 16.092 -35.749 1.00 0.00 H new ATOM 0 HG3 LYS A 49 15.292 17.302 -34.574 1.00 0.00 H new ATOM 0 HD2 LYS A 49 17.427 17.557 -35.482 1.00 0.00 H new ATOM 0 HD3 LYS A 49 17.535 15.881 -35.983 1.00 0.00 H new ATOM 0 HE2 LYS A 49 15.721 17.959 -37.313 1.00 0.00 H new ATOM 0 HE3 LYS A 49 17.293 17.488 -37.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 16.025 15.996 -39.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 16.207 15.084 -37.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 14.787 15.978 -37.888 1.00 0.00 H new ATOM 1037 N MET A 50 15.055 13.540 -31.608 1.00 0.00 N ATOM 1038 CA MET A 50 15.396 12.470 -30.631 1.00 0.00 C ATOM 1039 C MET A 50 14.134 12.090 -29.843 1.00 0.00 C ATOM 1040 O MET A 50 14.105 12.174 -28.616 1.00 0.00 O ATOM 1041 CB MET A 50 16.471 12.984 -29.671 1.00 0.00 C ATOM 1042 CG MET A 50 17.696 13.434 -30.467 1.00 0.00 C ATOM 1043 SD MET A 50 19.181 13.250 -29.450 1.00 0.00 S ATOM 1044 CE MET A 50 19.632 11.589 -30.009 1.00 0.00 C ATOM 0 H MET A 50 14.792 14.436 -31.197 1.00 0.00 H new ATOM 0 HA MET A 50 15.774 11.593 -31.157 1.00 0.00 H new ATOM 0 HB2 MET A 50 16.081 13.815 -29.084 1.00 0.00 H new ATOM 0 HB3 MET A 50 16.750 12.200 -28.967 1.00 0.00 H new ATOM 0 HG2 MET A 50 17.790 12.840 -31.376 1.00 0.00 H new ATOM 0 HG3 MET A 50 17.580 14.473 -30.775 1.00 0.00 H new ATOM 0 HE1 MET A 50 20.689 11.413 -29.811 1.00 0.00 H new ATOM 0 HE2 MET A 50 19.035 10.850 -29.474 1.00 0.00 H new ATOM 0 HE3 MET A 50 19.444 11.502 -31.079 1.00 0.00 H new ATOM 1045 N ARG A 51 13.082 11.680 -30.520 1.00 0.00 N ATOM 1046 CA ARG A 51 11.832 11.310 -29.798 1.00 0.00 C ATOM 1047 C ARG A 51 11.680 9.782 -29.777 1.00 0.00 C ATOM 1048 O ARG A 51 12.247 9.079 -30.611 1.00 0.00 O ATOM 1049 CB ARG A 51 10.627 11.934 -30.511 1.00 0.00 C ATOM 1050 CG ARG A 51 9.631 12.464 -29.475 1.00 0.00 C ATOM 1051 CD ARG A 51 8.623 13.392 -30.159 1.00 0.00 C ATOM 1052 NE ARG A 51 8.335 14.553 -29.268 1.00 0.00 N ATOM 1053 CZ ARG A 51 7.397 14.467 -28.366 1.00 0.00 C ATOM 1054 NH1 ARG A 51 7.446 13.526 -27.463 1.00 0.00 N ATOM 1055 NH2 ARG A 51 6.410 15.321 -28.365 1.00 0.00 N ATOM 0 H ARG A 51 13.041 11.588 -31.535 1.00 0.00 H new ATOM 0 HA ARG A 51 11.883 11.681 -28.774 1.00 0.00 H new ATOM 0 HB2 ARG A 51 10.957 12.745 -31.161 1.00 0.00 H new ATOM 0 HB3 ARG A 51 10.144 11.192 -31.147 1.00 0.00 H new ATOM 0 HG2 ARG A 51 9.110 11.634 -28.998 1.00 0.00 H new ATOM 0 HG3 ARG A 51 10.160 13.002 -28.689 1.00 0.00 H new ATOM 0 HD2 ARG A 51 9.021 13.741 -31.112 1.00 0.00 H new ATOM 0 HD3 ARG A 51 7.703 12.850 -30.377 1.00 0.00 H new ATOM 0 HE ARG A 51 8.872 15.415 -29.364 1.00 0.00 H new ATOM 0 HH11 ARG A 51 8.217 12.859 -27.463 1.00 0.00 H new ATOM 0 HH12 ARG A 51 6.713 13.458 -26.757 1.00 0.00 H new ATOM 0 HH21 ARG A 51 6.372 16.057 -29.070 1.00 0.00 H new ATOM 0 HH22 ARG A 51 5.677 15.253 -27.659 1.00 0.00 H new ATOM 1056 N GLY A 52 10.923 9.250 -28.842 1.00 0.00 N ATOM 1057 CA GLY A 52 10.740 7.770 -28.778 1.00 0.00 C ATOM 1058 C GLY A 52 12.101 7.069 -28.627 1.00 0.00 C ATOM 1059 O GLY A 52 12.302 5.977 -29.157 1.00 0.00 O ATOM 0 H GLY A 52 10.427 9.779 -28.125 1.00 0.00 H new ATOM 0 HA2 GLY A 52 10.096 7.513 -27.937 1.00 0.00 H new ATOM 0 HA3 GLY A 52 10.241 7.419 -29.681 1.00 0.00 H new ATOM 1060 N GLN A 53 13.042 7.660 -27.916 1.00 0.00 N ATOM 1061 CA GLN A 53 14.376 7.001 -27.751 1.00 0.00 C ATOM 1062 C GLN A 53 15.055 7.502 -26.464 1.00 0.00 C ATOM 1063 O GLN A 53 14.541 8.396 -25.791 1.00 0.00 O ATOM 1064 CB GLN A 53 15.260 7.336 -28.954 1.00 0.00 C ATOM 1065 CG GLN A 53 15.375 8.854 -29.099 1.00 0.00 C ATOM 1066 CD GLN A 53 16.103 9.188 -30.406 1.00 0.00 C ATOM 1067 OE1 GLN A 53 17.413 9.229 -30.434 1.00 0.00 O flip ATOM 1068 NE2 GLN A 53 15.465 9.419 -31.431 1.00 0.00 N flip ATOM 0 H GLN A 53 12.941 8.561 -27.449 1.00 0.00 H new ATOM 0 HA GLN A 53 14.236 5.922 -27.685 1.00 0.00 H new ATOM 0 HB2 GLN A 53 16.249 6.897 -28.825 1.00 0.00 H new ATOM 0 HB3 GLN A 53 14.836 6.905 -29.861 1.00 0.00 H new ATOM 0 HG2 GLN A 53 14.383 9.307 -29.097 1.00 0.00 H new ATOM 0 HG3 GLN A 53 15.918 9.271 -28.251 1.00 0.00 H new ATOM 0 HE21 GLN A 53 14.446 9.388 -31.415 1.00 0.00 H new ATOM 0 HE22 GLN A 53 15.955 9.641 -32.298 1.00 0.00 H new ATOM 1069 N ALA A 54 16.195 6.952 -26.101 1.00 0.00 N ATOM 1070 CA ALA A 54 16.875 7.421 -24.852 1.00 0.00 C ATOM 1071 C ALA A 54 18.323 6.899 -24.789 1.00 0.00 C ATOM 1072 O ALA A 54 18.736 6.074 -25.601 1.00 0.00 O ATOM 1073 CB ALA A 54 16.101 6.909 -23.634 1.00 0.00 C ATOM 0 H ALA A 54 16.676 6.210 -26.609 1.00 0.00 H new ATOM 0 HA ALA A 54 16.897 8.511 -24.854 1.00 0.00 H new ATOM 0 HB1 ALA A 54 16.592 7.248 -22.722 1.00 0.00 H new ATOM 0 HB2 ALA A 54 15.082 7.295 -23.662 1.00 0.00 H new ATOM 0 HB3 ALA A 54 16.077 5.819 -23.650 1.00 0.00 H new ATOM 1074 N PHE A 55 19.103 7.359 -23.833 1.00 0.00 N ATOM 1075 CA PHE A 55 20.513 6.884 -23.718 1.00 0.00 C ATOM 1076 C PHE A 55 20.788 6.489 -22.261 1.00 0.00 C ATOM 1077 O PHE A 55 20.495 7.253 -21.341 1.00 0.00 O ATOM 1078 CB PHE A 55 21.468 8.008 -24.124 1.00 0.00 C ATOM 1079 CG PHE A 55 21.218 8.397 -25.561 1.00 0.00 C ATOM 1080 CD1 PHE A 55 20.140 9.229 -25.884 1.00 0.00 C ATOM 1081 CD2 PHE A 55 22.067 7.927 -26.571 1.00 0.00 C ATOM 1082 CE1 PHE A 55 19.910 9.592 -27.217 1.00 0.00 C ATOM 1083 CE2 PHE A 55 21.838 8.290 -27.904 1.00 0.00 C ATOM 1084 CZ PHE A 55 20.759 9.122 -28.227 1.00 0.00 C ATOM 0 H PHE A 55 18.819 8.042 -23.131 1.00 0.00 H new ATOM 0 HA PHE A 55 20.665 6.026 -24.373 1.00 0.00 H new ATOM 0 HB2 PHE A 55 21.326 8.871 -23.474 1.00 0.00 H new ATOM 0 HB3 PHE A 55 22.501 7.683 -24.000 1.00 0.00 H new ATOM 0 HD1 PHE A 55 19.485 9.591 -25.105 1.00 0.00 H new ATOM 0 HD2 PHE A 55 22.898 7.284 -26.322 1.00 0.00 H new ATOM 0 HE1 PHE A 55 19.078 10.234 -27.466 1.00 0.00 H new ATOM 0 HE2 PHE A 55 22.493 7.928 -28.683 1.00 0.00 H new ATOM 0 HZ PHE A 55 20.581 9.401 -29.255 1.00 0.00 H new ATOM 1085 N VAL A 56 21.338 5.320 -22.018 1.00 0.00 N ATOM 1086 CA VAL A 56 21.614 4.911 -20.608 1.00 0.00 C ATOM 1087 C VAL A 56 23.130 4.824 -20.383 1.00 0.00 C ATOM 1088 O VAL A 56 23.872 4.378 -21.256 1.00 0.00 O ATOM 1089 CB VAL A 56 20.982 3.544 -20.337 1.00 0.00 C ATOM 1090 CG1 VAL A 56 21.122 3.203 -18.853 1.00 0.00 C ATOM 1091 CG2 VAL A 56 19.500 3.580 -20.714 1.00 0.00 C ATOM 0 H VAL A 56 21.604 4.640 -22.730 1.00 0.00 H new ATOM 0 HA VAL A 56 21.188 5.650 -19.930 1.00 0.00 H new ATOM 0 HB VAL A 56 21.489 2.786 -20.934 1.00 0.00 H new ATOM 0 HG11 VAL A 56 20.672 2.229 -18.659 1.00 0.00 H new ATOM 0 HG12 VAL A 56 22.178 3.175 -18.584 1.00 0.00 H new ATOM 0 HG13 VAL A 56 20.616 3.962 -18.256 1.00 0.00 H new ATOM 0 HG21 VAL A 56 19.052 2.606 -20.520 1.00 0.00 H new ATOM 0 HG22 VAL A 56 18.991 4.338 -20.119 1.00 0.00 H new ATOM 0 HG23 VAL A 56 19.399 3.822 -21.772 1.00 0.00 H new ATOM 1092 N ILE A 57 23.611 5.237 -19.229 1.00 0.00 N ATOM 1093 CA ILE A 57 25.076 5.168 -18.965 1.00 0.00 C ATOM 1094 C ILE A 57 25.330 4.262 -17.751 1.00 0.00 C ATOM 1095 O ILE A 57 24.766 4.475 -16.679 1.00 0.00 O ATOM 1096 CB ILE A 57 25.611 6.573 -18.678 1.00 0.00 C ATOM 1097 CG1 ILE A 57 25.279 7.495 -19.854 1.00 0.00 C ATOM 1098 CG2 ILE A 57 27.129 6.516 -18.489 1.00 0.00 C ATOM 1099 CD1 ILE A 57 25.009 8.908 -19.335 1.00 0.00 C ATOM 0 H ILE A 57 23.050 5.616 -18.466 1.00 0.00 H new ATOM 0 HA ILE A 57 25.586 4.760 -19.838 1.00 0.00 H new ATOM 0 HB ILE A 57 25.147 6.958 -17.770 1.00 0.00 H new ATOM 0 HG12 ILE A 57 26.106 7.509 -20.564 1.00 0.00 H new ATOM 0 HG13 ILE A 57 24.406 7.120 -20.389 1.00 0.00 H new ATOM 0 HG21 ILE A 57 27.508 7.517 -18.285 1.00 0.00 H new ATOM 0 HG22 ILE A 57 27.367 5.860 -17.652 1.00 0.00 H new ATOM 0 HG23 ILE A 57 27.594 6.130 -19.396 1.00 0.00 H new ATOM 0 HD11 ILE A 57 24.773 9.564 -20.173 1.00 0.00 H new ATOM 0 HD12 ILE A 57 24.168 8.887 -18.642 1.00 0.00 H new ATOM 0 HD13 ILE A 57 25.894 9.282 -18.820 1.00 0.00 H new ATOM 1100 N PHE A 58 26.165 3.254 -17.889 1.00 0.00 N ATOM 1101 CA PHE A 58 26.437 2.351 -16.733 1.00 0.00 C ATOM 1102 C PHE A 58 27.807 2.690 -16.128 1.00 0.00 C ATOM 1103 O PHE A 58 28.709 3.146 -16.829 1.00 0.00 O ATOM 1104 CB PHE A 58 26.441 0.899 -17.210 1.00 0.00 C ATOM 1105 CG PHE A 58 25.027 0.460 -17.509 1.00 0.00 C ATOM 1106 CD1 PHE A 58 24.471 0.708 -18.769 1.00 0.00 C ATOM 1107 CD2 PHE A 58 24.275 -0.198 -16.528 1.00 0.00 C ATOM 1108 CE1 PHE A 58 23.162 0.299 -19.048 1.00 0.00 C ATOM 1109 CE2 PHE A 58 22.967 -0.608 -16.808 1.00 0.00 C ATOM 1110 CZ PHE A 58 22.410 -0.360 -18.068 1.00 0.00 C ATOM 0 H PHE A 58 26.664 3.023 -18.748 1.00 0.00 H new ATOM 0 HA PHE A 58 25.662 2.486 -15.979 1.00 0.00 H new ATOM 0 HB2 PHE A 58 27.059 0.800 -18.102 1.00 0.00 H new ATOM 0 HB3 PHE A 58 26.878 0.256 -16.446 1.00 0.00 H new ATOM 0 HD1 PHE A 58 25.052 1.215 -19.526 1.00 0.00 H new ATOM 0 HD2 PHE A 58 24.705 -0.389 -15.556 1.00 0.00 H new ATOM 0 HE1 PHE A 58 22.732 0.492 -20.020 1.00 0.00 H new ATOM 0 HE2 PHE A 58 22.387 -1.116 -16.052 1.00 0.00 H new ATOM 0 HZ PHE A 58 21.400 -0.677 -18.284 1.00 0.00 H new ATOM 1111 N LYS A 59 27.990 2.475 -14.841 1.00 0.00 N ATOM 1112 CA LYS A 59 29.318 2.788 -14.221 1.00 0.00 C ATOM 1113 C LYS A 59 30.395 1.916 -14.881 1.00 0.00 C ATOM 1114 O LYS A 59 31.486 2.391 -15.193 1.00 0.00 O ATOM 1115 CB LYS A 59 29.289 2.503 -12.713 1.00 0.00 C ATOM 1116 CG LYS A 59 30.559 3.056 -12.064 1.00 0.00 C ATOM 1117 CD LYS A 59 30.253 3.492 -10.630 1.00 0.00 C ATOM 1118 CE LYS A 59 31.510 3.344 -9.771 1.00 0.00 C ATOM 1119 NZ LYS A 59 31.120 2.995 -8.375 1.00 0.00 N ATOM 0 H LYS A 59 27.286 2.102 -14.204 1.00 0.00 H new ATOM 0 HA LYS A 59 29.541 3.844 -14.373 1.00 0.00 H new ATOM 0 HB2 LYS A 59 28.409 2.961 -12.263 1.00 0.00 H new ATOM 0 HB3 LYS A 59 29.215 1.430 -12.536 1.00 0.00 H new ATOM 0 HG2 LYS A 59 31.341 2.296 -12.065 1.00 0.00 H new ATOM 0 HG3 LYS A 59 30.935 3.902 -12.640 1.00 0.00 H new ATOM 0 HD2 LYS A 59 29.912 4.527 -10.619 1.00 0.00 H new ATOM 0 HD3 LYS A 59 29.446 2.886 -10.219 1.00 0.00 H new ATOM 0 HE2 LYS A 59 32.156 2.569 -10.184 1.00 0.00 H new ATOM 0 HE3 LYS A 59 32.080 4.273 -9.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 31.974 2.894 -7.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 30.520 3.749 -7.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 30.593 2.098 -8.376 1.00 0.00 H new ATOM 1120 N GLU A 60 30.114 0.650 -15.106 1.00 0.00 N ATOM 1121 CA GLU A 60 31.124 -0.232 -15.748 1.00 0.00 C ATOM 1122 C GLU A 60 30.643 -0.608 -17.158 1.00 0.00 C ATOM 1123 O GLU A 60 29.446 -0.773 -17.390 1.00 0.00 O ATOM 1124 CB GLU A 60 31.302 -1.504 -14.910 1.00 0.00 C ATOM 1125 CG GLU A 60 32.606 -1.421 -14.112 1.00 0.00 C ATOM 1126 CD GLU A 60 32.596 -2.477 -13.005 1.00 0.00 C ATOM 1127 OE1 GLU A 60 32.329 -3.627 -13.314 1.00 0.00 O ATOM 1128 OE2 GLU A 60 32.857 -2.118 -11.869 1.00 0.00 O ATOM 0 H GLU A 60 29.230 0.199 -14.871 1.00 0.00 H new ATOM 0 HA GLU A 60 32.078 0.291 -15.814 1.00 0.00 H new ATOM 0 HB2 GLU A 60 30.457 -1.625 -14.232 1.00 0.00 H new ATOM 0 HB3 GLU A 60 31.317 -2.379 -15.560 1.00 0.00 H new ATOM 0 HG2 GLU A 60 33.459 -1.579 -14.772 1.00 0.00 H new ATOM 0 HG3 GLU A 60 32.717 -0.427 -13.680 1.00 0.00 H new ATOM 1129 N VAL A 61 31.543 -0.748 -18.108 1.00 0.00 N ATOM 1130 CA VAL A 61 31.105 -1.114 -19.495 1.00 0.00 C ATOM 1131 C VAL A 61 30.434 -2.496 -19.481 1.00 0.00 C ATOM 1132 O VAL A 61 29.466 -2.728 -20.200 1.00 0.00 O ATOM 1133 CB VAL A 61 32.309 -1.147 -20.446 1.00 0.00 C ATOM 1134 CG1 VAL A 61 31.826 -1.412 -21.875 1.00 0.00 C ATOM 1135 CG2 VAL A 61 33.035 0.200 -20.398 1.00 0.00 C ATOM 0 H VAL A 61 32.548 -0.626 -17.985 1.00 0.00 H new ATOM 0 HA VAL A 61 30.396 -0.363 -19.843 1.00 0.00 H new ATOM 0 HB VAL A 61 32.991 -1.940 -20.139 1.00 0.00 H new ATOM 0 HG11 VAL A 61 32.682 -1.435 -22.550 1.00 0.00 H new ATOM 0 HG12 VAL A 61 31.308 -2.370 -21.912 1.00 0.00 H new ATOM 0 HG13 VAL A 61 31.144 -0.619 -22.181 1.00 0.00 H new ATOM 0 HG21 VAL A 61 33.890 0.177 -21.073 1.00 0.00 H new ATOM 0 HG22 VAL A 61 32.352 0.992 -20.704 1.00 0.00 H new ATOM 0 HG23 VAL A 61 33.380 0.391 -19.382 1.00 0.00 H new ATOM 1136 N SER A 62 30.926 -3.423 -18.687 1.00 0.00 N ATOM 1137 CA SER A 62 30.298 -4.787 -18.655 1.00 0.00 C ATOM 1138 C SER A 62 28.815 -4.686 -18.249 1.00 0.00 C ATOM 1139 O SER A 62 27.996 -5.478 -18.703 1.00 0.00 O ATOM 1140 CB SER A 62 31.040 -5.694 -17.662 1.00 0.00 C ATOM 1141 OG SER A 62 30.119 -6.594 -17.057 1.00 0.00 O ATOM 0 H SER A 62 31.726 -3.296 -18.067 1.00 0.00 H new ATOM 0 HA SER A 62 30.367 -5.218 -19.654 1.00 0.00 H new ATOM 0 HB2 SER A 62 31.823 -6.251 -18.177 1.00 0.00 H new ATOM 0 HB3 SER A 62 31.529 -5.090 -16.898 1.00 0.00 H new ATOM 0 HG SER A 62 30.594 -7.173 -16.425 1.00 0.00 H new ATOM 1142 N SER A 63 28.444 -3.747 -17.401 1.00 0.00 N ATOM 1143 CA SER A 63 27.001 -3.644 -16.991 1.00 0.00 C ATOM 1144 C SER A 63 26.124 -3.385 -18.230 1.00 0.00 C ATOM 1145 O SER A 63 25.034 -3.950 -18.362 1.00 0.00 O ATOM 1146 CB SER A 63 26.812 -2.495 -15.992 1.00 0.00 C ATOM 1147 OG SER A 63 27.233 -2.921 -14.703 1.00 0.00 O ATOM 0 H SER A 63 29.068 -3.058 -16.981 1.00 0.00 H new ATOM 0 HA SER A 63 26.706 -4.582 -16.520 1.00 0.00 H new ATOM 0 HB2 SER A 63 27.389 -1.625 -16.307 1.00 0.00 H new ATOM 0 HB3 SER A 63 25.766 -2.191 -15.964 1.00 0.00 H new ATOM 0 HG SER A 63 27.115 -2.189 -14.062 1.00 0.00 H new ATOM 1148 N ALA A 64 26.573 -2.558 -19.150 1.00 0.00 N ATOM 1149 CA ALA A 64 25.755 -2.293 -20.372 1.00 0.00 C ATOM 1150 C ALA A 64 25.795 -3.520 -21.294 1.00 0.00 C ATOM 1151 O ALA A 64 24.864 -3.754 -22.061 1.00 0.00 O ATOM 1152 CB ALA A 64 26.297 -1.069 -21.126 1.00 0.00 C ATOM 0 H ALA A 64 27.463 -2.061 -19.105 1.00 0.00 H new ATOM 0 HA ALA A 64 24.727 -2.093 -20.069 1.00 0.00 H new ATOM 0 HB1 ALA A 64 25.690 -0.890 -22.013 1.00 0.00 H new ATOM 0 HB2 ALA A 64 26.257 -0.195 -20.477 1.00 0.00 H new ATOM 0 HB3 ALA A 64 27.329 -1.253 -21.424 1.00 0.00 H new ATOM 1153 N THR A 65 26.848 -4.314 -21.245 1.00 0.00 N ATOM 1154 CA THR A 65 26.907 -5.512 -22.131 1.00 0.00 C ATOM 1155 C THR A 65 25.846 -6.542 -21.699 1.00 0.00 C ATOM 1156 O THR A 65 25.301 -7.264 -22.533 1.00 0.00 O ATOM 1157 CB THR A 65 28.300 -6.158 -22.065 1.00 0.00 C ATOM 1158 OG1 THR A 65 29.290 -5.139 -22.030 1.00 0.00 O ATOM 1159 CG2 THR A 65 28.520 -7.041 -23.294 1.00 0.00 C ATOM 0 H THR A 65 27.655 -4.180 -20.635 1.00 0.00 H new ATOM 0 HA THR A 65 26.708 -5.194 -23.154 1.00 0.00 H new ATOM 0 HB THR A 65 28.372 -6.770 -21.166 1.00 0.00 H new ATOM 0 HG1 THR A 65 30.179 -5.548 -21.986 1.00 0.00 H new ATOM 0 HG21 THR A 65 29.509 -7.497 -23.242 1.00 0.00 H new ATOM 0 HG22 THR A 65 27.761 -7.823 -23.321 1.00 0.00 H new ATOM 0 HG23 THR A 65 28.447 -6.434 -24.196 1.00 0.00 H new ATOM 1160 N ASN A 66 25.535 -6.636 -20.420 1.00 0.00 N ATOM 1161 CA ASN A 66 24.509 -7.629 -19.975 1.00 0.00 C ATOM 1162 C ASN A 66 23.104 -7.092 -20.281 1.00 0.00 C ATOM 1163 O ASN A 66 22.223 -7.845 -20.686 1.00 0.00 O ATOM 1164 CB ASN A 66 24.635 -7.887 -18.467 1.00 0.00 C ATOM 1165 CG ASN A 66 24.369 -9.369 -18.176 1.00 0.00 C ATOM 1166 OD1 ASN A 66 23.430 -9.703 -17.457 1.00 0.00 O ATOM 1167 ND2 ASN A 66 25.147 -10.287 -18.698 1.00 0.00 N ATOM 0 H ASN A 66 25.946 -6.071 -19.677 1.00 0.00 H new ATOM 0 HA ASN A 66 24.672 -8.564 -20.512 1.00 0.00 H new ATOM 0 HB2 ASN A 66 25.632 -7.611 -18.122 1.00 0.00 H new ATOM 0 HB3 ASN A 66 23.926 -7.265 -17.921 1.00 0.00 H new ATOM 0 HD21 ASN A 66 24.971 -11.273 -18.507 1.00 0.00 H new ATOM 0 HD22 ASN A 66 25.928 -10.014 -19.295 1.00 0.00 H new ATOM 1168 N ALA A 67 22.867 -5.808 -20.098 1.00 0.00 N ATOM 1169 CA ALA A 67 21.500 -5.260 -20.392 1.00 0.00 C ATOM 1170 C ALA A 67 21.148 -5.494 -21.872 1.00 0.00 C ATOM 1171 O ALA A 67 19.999 -5.782 -22.204 1.00 0.00 O ATOM 1172 CB ALA A 67 21.454 -3.754 -20.100 1.00 0.00 C ATOM 0 H ALA A 67 23.549 -5.128 -19.764 1.00 0.00 H new ATOM 0 HA ALA A 67 20.779 -5.774 -19.756 1.00 0.00 H new ATOM 0 HB1 ALA A 67 20.457 -3.371 -20.318 1.00 0.00 H new ATOM 0 HB2 ALA A 67 21.688 -3.580 -19.050 1.00 0.00 H new ATOM 0 HB3 ALA A 67 22.184 -3.240 -20.725 1.00 0.00 H new ATOM 1173 N LEU A 68 22.101 -5.373 -22.771 1.00 0.00 N ATOM 1174 CA LEU A 68 21.788 -5.587 -24.222 1.00 0.00 C ATOM 1175 C LEU A 68 21.596 -7.087 -24.499 1.00 0.00 C ATOM 1176 O LEU A 68 20.721 -7.475 -25.271 1.00 0.00 O ATOM 1177 CB LEU A 68 22.934 -5.055 -25.092 1.00 0.00 C ATOM 1178 CG LEU A 68 22.384 -4.603 -26.448 1.00 0.00 C ATOM 1179 CD1 LEU A 68 23.124 -3.345 -26.907 1.00 0.00 C ATOM 1180 CD2 LEU A 68 22.586 -5.717 -27.479 1.00 0.00 C ATOM 0 H LEU A 68 23.072 -5.138 -22.565 1.00 0.00 H new ATOM 0 HA LEU A 68 20.871 -5.050 -24.465 1.00 0.00 H new ATOM 0 HB2 LEU A 68 23.426 -4.221 -24.592 1.00 0.00 H new ATOM 0 HB3 LEU A 68 23.686 -5.831 -25.234 1.00 0.00 H new ATOM 0 HG LEU A 68 21.320 -4.384 -26.352 1.00 0.00 H new ATOM 0 HD11 LEU A 68 22.732 -3.024 -27.872 1.00 0.00 H new ATOM 0 HD12 LEU A 68 22.980 -2.551 -26.175 1.00 0.00 H new ATOM 0 HD13 LEU A 68 24.188 -3.563 -27.002 1.00 0.00 H new ATOM 0 HD21 LEU A 68 22.194 -5.395 -28.444 1.00 0.00 H new ATOM 0 HD22 LEU A 68 23.649 -5.937 -27.574 1.00 0.00 H new ATOM 0 HD23 LEU A 68 22.058 -6.614 -27.154 1.00 0.00 H new ATOM 1181 N ARG A 69 22.389 -7.943 -23.890 1.00 0.00 N ATOM 1182 CA ARG A 69 22.228 -9.413 -24.142 1.00 0.00 C ATOM 1183 C ARG A 69 20.992 -9.981 -23.407 1.00 0.00 C ATOM 1184 O ARG A 69 20.621 -11.133 -23.631 1.00 0.00 O ATOM 1185 CB ARG A 69 23.480 -10.165 -23.675 1.00 0.00 C ATOM 1186 CG ARG A 69 24.667 -9.772 -24.557 1.00 0.00 C ATOM 1187 CD ARG A 69 25.957 -9.810 -23.734 1.00 0.00 C ATOM 1188 NE ARG A 69 26.654 -11.107 -23.965 1.00 0.00 N ATOM 1189 CZ ARG A 69 27.895 -11.118 -24.371 1.00 0.00 C ATOM 1190 NH1 ARG A 69 28.288 -10.283 -25.295 1.00 0.00 N ATOM 1191 NH2 ARG A 69 28.742 -11.965 -23.856 1.00 0.00 N ATOM 0 H ARG A 69 23.131 -7.690 -23.238 1.00 0.00 H new ATOM 0 HA ARG A 69 22.087 -9.551 -25.214 1.00 0.00 H new ATOM 0 HB2 ARG A 69 23.693 -9.927 -22.633 1.00 0.00 H new ATOM 0 HB3 ARG A 69 23.313 -11.241 -23.729 1.00 0.00 H new ATOM 0 HG2 ARG A 69 24.744 -10.454 -25.404 1.00 0.00 H new ATOM 0 HG3 ARG A 69 24.514 -8.773 -24.965 1.00 0.00 H new ATOM 0 HD2 ARG A 69 26.606 -8.981 -24.016 1.00 0.00 H new ATOM 0 HD3 ARG A 69 25.729 -9.691 -22.675 1.00 0.00 H new ATOM 0 HE ARG A 69 26.162 -11.986 -23.806 1.00 0.00 H new ATOM 0 HH11 ARG A 69 27.625 -9.622 -25.700 1.00 0.00 H new ATOM 0 HH12 ARG A 69 29.258 -10.292 -25.612 1.00 0.00 H new ATOM 0 HH21 ARG A 69 28.435 -12.619 -23.136 1.00 0.00 H new ATOM 0 HH22 ARG A 69 29.711 -11.974 -24.173 1.00 0.00 H new ATOM 1192 N SER A 70 20.338 -9.226 -22.542 1.00 0.00 N ATOM 1193 CA SER A 70 19.145 -9.774 -21.837 1.00 0.00 C ATOM 1194 C SER A 70 17.886 -8.932 -22.143 1.00 0.00 C ATOM 1195 O SER A 70 16.890 -9.027 -21.426 1.00 0.00 O ATOM 1196 CB SER A 70 19.401 -9.766 -20.331 1.00 0.00 C ATOM 1197 OG SER A 70 18.206 -10.124 -19.649 1.00 0.00 O ATOM 0 H SER A 70 20.583 -8.265 -22.303 1.00 0.00 H new ATOM 0 HA SER A 70 18.975 -10.792 -22.186 1.00 0.00 H new ATOM 0 HB2 SER A 70 20.199 -10.466 -20.082 1.00 0.00 H new ATOM 0 HB3 SER A 70 19.733 -8.778 -20.012 1.00 0.00 H new ATOM 0 HG SER A 70 17.456 -9.605 -20.008 1.00 0.00 H new ATOM 1198 N MET A 71 17.888 -8.118 -23.184 1.00 0.00 N ATOM 1199 CA MET A 71 16.673 -7.307 -23.494 1.00 0.00 C ATOM 1200 C MET A 71 16.559 -7.110 -25.016 1.00 0.00 C ATOM 1201 O MET A 71 16.204 -6.030 -25.485 1.00 0.00 O ATOM 1202 CB MET A 71 16.779 -5.941 -22.809 1.00 0.00 C ATOM 1203 CG MET A 71 16.055 -5.988 -21.461 1.00 0.00 C ATOM 1204 SD MET A 71 15.309 -4.374 -21.121 1.00 0.00 S ATOM 1205 CE MET A 71 13.759 -4.985 -20.413 1.00 0.00 C ATOM 0 H MET A 71 18.674 -7.987 -23.821 1.00 0.00 H new ATOM 0 HA MET A 71 15.788 -7.828 -23.128 1.00 0.00 H new ATOM 0 HB2 MET A 71 17.826 -5.676 -22.662 1.00 0.00 H new ATOM 0 HB3 MET A 71 16.341 -5.170 -23.442 1.00 0.00 H new ATOM 0 HG2 MET A 71 15.286 -6.760 -21.476 1.00 0.00 H new ATOM 0 HG3 MET A 71 16.756 -6.251 -20.669 1.00 0.00 H new ATOM 0 HE1 MET A 71 13.132 -4.141 -20.127 1.00 0.00 H new ATOM 0 HE2 MET A 71 13.236 -5.592 -21.152 1.00 0.00 H new ATOM 0 HE3 MET A 71 13.975 -5.591 -19.533 1.00 0.00 H new ATOM 1206 N GLN A 72 16.851 -8.129 -25.799 1.00 0.00 N ATOM 1207 CA GLN A 72 16.750 -7.975 -27.285 1.00 0.00 C ATOM 1208 C GLN A 72 15.279 -8.098 -27.706 1.00 0.00 C ATOM 1209 O GLN A 72 14.655 -9.140 -27.508 1.00 0.00 O ATOM 1210 CB GLN A 72 17.574 -9.059 -27.989 1.00 0.00 C ATOM 1211 CG GLN A 72 18.996 -8.545 -28.228 1.00 0.00 C ATOM 1212 CD GLN A 72 18.978 -7.487 -29.338 1.00 0.00 C ATOM 1213 OE1 GLN A 72 18.753 -7.812 -30.502 1.00 0.00 O ATOM 1214 NE2 GLN A 72 19.203 -6.230 -29.046 1.00 0.00 N ATOM 0 H GLN A 72 17.151 -9.048 -25.475 1.00 0.00 H new ATOM 0 HA GLN A 72 17.138 -6.997 -27.569 1.00 0.00 H new ATOM 0 HB2 GLN A 72 17.600 -9.963 -27.381 1.00 0.00 H new ATOM 0 HB3 GLN A 72 17.108 -9.326 -28.938 1.00 0.00 H new ATOM 0 HG2 GLN A 72 19.399 -8.117 -27.310 1.00 0.00 H new ATOM 0 HG3 GLN A 72 19.650 -9.371 -28.509 1.00 0.00 H new ATOM 0 HE21 GLN A 72 19.390 -5.956 -28.081 1.00 0.00 H new ATOM 0 HE22 GLN A 72 19.191 -5.525 -29.783 1.00 0.00 H new ATOM 1215 N GLY A 73 14.707 -7.061 -28.278 1.00 0.00 N ATOM 1216 CA GLY A 73 13.277 -7.139 -28.697 1.00 0.00 C ATOM 1217 C GLY A 73 12.407 -7.449 -27.470 1.00 0.00 C ATOM 1218 O GLY A 73 11.720 -8.468 -27.430 1.00 0.00 O ATOM 0 H GLY A 73 15.169 -6.172 -28.470 1.00 0.00 H new ATOM 0 HA2 GLY A 73 12.966 -6.197 -29.149 1.00 0.00 H new ATOM 0 HA3 GLY A 73 13.149 -7.913 -29.453 1.00 0.00 H new ATOM 1219 N PHE A 74 12.423 -6.598 -26.466 1.00 0.00 N ATOM 1220 CA PHE A 74 11.597 -6.868 -25.253 1.00 0.00 C ATOM 1221 C PHE A 74 10.570 -5.737 -25.068 1.00 0.00 C ATOM 1222 O PHE A 74 10.787 -4.627 -25.548 1.00 0.00 O ATOM 1223 CB PHE A 74 12.505 -6.938 -24.021 1.00 0.00 C ATOM 1224 CG PHE A 74 12.712 -8.382 -23.623 1.00 0.00 C ATOM 1225 CD1 PHE A 74 13.340 -9.269 -24.505 1.00 0.00 C ATOM 1226 CD2 PHE A 74 12.273 -8.832 -22.372 1.00 0.00 C ATOM 1227 CE1 PHE A 74 13.530 -10.605 -24.137 1.00 0.00 C ATOM 1228 CE2 PHE A 74 12.463 -10.168 -22.003 1.00 0.00 C ATOM 1229 CZ PHE A 74 13.093 -11.055 -22.886 1.00 0.00 C ATOM 0 H PHE A 74 12.969 -5.737 -26.439 1.00 0.00 H new ATOM 0 HA PHE A 74 11.075 -7.817 -25.375 1.00 0.00 H new ATOM 0 HB2 PHE A 74 13.465 -6.469 -24.237 1.00 0.00 H new ATOM 0 HB3 PHE A 74 12.058 -6.384 -23.196 1.00 0.00 H new ATOM 0 HD1 PHE A 74 13.678 -8.922 -25.470 1.00 0.00 H new ATOM 0 HD2 PHE A 74 11.788 -8.148 -21.692 1.00 0.00 H new ATOM 0 HE1 PHE A 74 14.014 -11.289 -24.818 1.00 0.00 H new ATOM 0 HE2 PHE A 74 12.124 -10.515 -21.038 1.00 0.00 H new ATOM 0 HZ PHE A 74 13.241 -12.086 -22.601 1.00 0.00 H new ATOM 1230 N PRO A 75 9.477 -6.026 -24.382 1.00 0.00 N ATOM 1231 CA PRO A 75 8.425 -5.024 -24.138 1.00 0.00 C ATOM 1232 C PRO A 75 8.857 -4.065 -23.017 1.00 0.00 C ATOM 1233 O PRO A 75 9.296 -4.497 -21.953 1.00 0.00 O ATOM 1234 CB PRO A 75 7.216 -5.860 -23.709 1.00 0.00 C ATOM 1235 CG PRO A 75 7.776 -7.204 -23.185 1.00 0.00 C ATOM 1236 CD PRO A 75 9.184 -7.357 -23.787 1.00 0.00 C ATOM 0 HA PRO A 75 8.213 -4.403 -25.008 1.00 0.00 H new ATOM 0 HB2 PRO A 75 6.646 -5.348 -22.934 1.00 0.00 H new ATOM 0 HB3 PRO A 75 6.539 -6.022 -24.548 1.00 0.00 H new ATOM 0 HG2 PRO A 75 7.818 -7.208 -22.096 1.00 0.00 H new ATOM 0 HG3 PRO A 75 7.135 -8.034 -23.483 1.00 0.00 H new ATOM 0 HD2 PRO A 75 9.916 -7.621 -23.024 1.00 0.00 H new ATOM 0 HD3 PRO A 75 9.211 -8.144 -24.541 1.00 0.00 H new ATOM 1237 N PHE A 76 8.744 -2.771 -23.229 1.00 0.00 N ATOM 1238 CA PHE A 76 9.153 -1.806 -22.170 1.00 0.00 C ATOM 1239 C PHE A 76 7.982 -0.857 -21.877 1.00 0.00 C ATOM 1240 O PHE A 76 7.450 -0.839 -20.768 1.00 0.00 O ATOM 1241 CB PHE A 76 10.369 -1.003 -22.658 1.00 0.00 C ATOM 1242 CG PHE A 76 10.765 0.041 -21.630 1.00 0.00 C ATOM 1243 CD1 PHE A 76 10.820 -0.288 -20.269 1.00 0.00 C ATOM 1244 CD2 PHE A 76 11.081 1.342 -22.046 1.00 0.00 C ATOM 1245 CE1 PHE A 76 11.189 0.681 -19.328 1.00 0.00 C ATOM 1246 CE2 PHE A 76 11.451 2.309 -21.104 1.00 0.00 C ATOM 1247 CZ PHE A 76 11.504 1.979 -19.746 1.00 0.00 C ATOM 0 H PHE A 76 8.387 -2.350 -24.087 1.00 0.00 H new ATOM 0 HA PHE A 76 9.420 -2.342 -21.259 1.00 0.00 H new ATOM 0 HB2 PHE A 76 11.206 -1.676 -22.842 1.00 0.00 H new ATOM 0 HB3 PHE A 76 10.135 -0.518 -23.606 1.00 0.00 H new ATOM 0 HD1 PHE A 76 10.578 -1.290 -19.946 1.00 0.00 H new ATOM 0 HD2 PHE A 76 11.039 1.598 -23.094 1.00 0.00 H new ATOM 0 HE1 PHE A 76 11.231 0.427 -18.279 1.00 0.00 H new ATOM 0 HE2 PHE A 76 11.696 3.310 -21.426 1.00 0.00 H new ATOM 0 HZ PHE A 76 11.788 2.726 -19.020 1.00 0.00 H new ATOM 1248 N TYR A 77 7.569 -0.065 -22.842 1.00 0.00 N ATOM 1249 CA TYR A 77 6.440 0.872 -22.601 1.00 0.00 C ATOM 1250 C TYR A 77 5.254 0.485 -23.498 1.00 0.00 C ATOM 1251 O TYR A 77 4.887 1.222 -24.412 1.00 0.00 O ATOM 1252 CB TYR A 77 6.894 2.300 -22.921 1.00 0.00 C ATOM 1253 CG TYR A 77 7.334 2.995 -21.649 1.00 0.00 C ATOM 1254 CD1 TYR A 77 8.192 2.348 -20.748 1.00 0.00 C ATOM 1255 CD2 TYR A 77 6.881 4.289 -21.371 1.00 0.00 C ATOM 1256 CE1 TYR A 77 8.593 2.994 -19.575 1.00 0.00 C ATOM 1257 CE2 TYR A 77 7.284 4.936 -20.195 1.00 0.00 C ATOM 1258 CZ TYR A 77 8.140 4.287 -19.298 1.00 0.00 C ATOM 1259 OH TYR A 77 8.536 4.924 -18.140 1.00 0.00 O ATOM 0 H TYR A 77 7.968 -0.033 -23.780 1.00 0.00 H new ATOM 0 HA TYR A 77 6.130 0.817 -21.557 1.00 0.00 H new ATOM 0 HB2 TYR A 77 7.715 2.278 -23.637 1.00 0.00 H new ATOM 0 HB3 TYR A 77 6.079 2.855 -23.386 1.00 0.00 H new ATOM 0 HD1 TYR A 77 8.543 1.349 -20.961 1.00 0.00 H new ATOM 0 HD2 TYR A 77 6.220 4.790 -22.063 1.00 0.00 H new ATOM 0 HE1 TYR A 77 9.253 2.494 -18.882 1.00 0.00 H new ATOM 0 HE2 TYR A 77 6.934 5.935 -19.981 1.00 0.00 H new ATOM 0 HH TYR A 77 7.832 5.541 -17.849 1.00 0.00 H new ATOM 1260 N ASP A 78 4.644 -0.658 -23.259 1.00 0.00 N ATOM 1261 CA ASP A 78 3.488 -1.077 -24.101 1.00 0.00 C ATOM 1262 C ASP A 78 3.931 -1.179 -25.568 1.00 0.00 C ATOM 1263 O ASP A 78 3.202 -0.776 -26.473 1.00 0.00 O ATOM 1264 CB ASP A 78 2.364 -0.046 -23.979 1.00 0.00 C ATOM 1265 CG ASP A 78 1.013 -0.764 -23.940 1.00 0.00 C ATOM 1266 OD1 ASP A 78 0.607 -1.276 -24.970 1.00 0.00 O ATOM 1267 OD2 ASP A 78 0.409 -0.789 -22.881 1.00 0.00 O ATOM 0 H ASP A 78 4.901 -1.311 -22.519 1.00 0.00 H new ATOM 0 HA ASP A 78 3.128 -2.048 -23.762 1.00 0.00 H new ATOM 0 HB2 ASP A 78 2.498 0.548 -23.075 1.00 0.00 H new ATOM 0 HB3 ASP A 78 2.397 0.644 -24.822 1.00 0.00 H new ATOM 1268 N LYS A 79 5.108 -1.709 -25.830 1.00 0.00 N ATOM 1269 CA LYS A 79 5.569 -1.823 -27.252 1.00 0.00 C ATOM 1270 C LYS A 79 6.929 -2.552 -27.312 1.00 0.00 C ATOM 1271 O LYS A 79 7.671 -2.546 -26.333 1.00 0.00 O ATOM 1272 CB LYS A 79 5.714 -0.415 -27.850 1.00 0.00 C ATOM 1273 CG LYS A 79 4.675 -0.207 -28.957 1.00 0.00 C ATOM 1274 CD LYS A 79 5.046 1.030 -29.777 1.00 0.00 C ATOM 1275 CE LYS A 79 4.005 1.243 -30.879 1.00 0.00 C ATOM 1276 NZ LYS A 79 4.373 0.432 -32.073 1.00 0.00 N ATOM 0 H LYS A 79 5.760 -2.062 -25.129 1.00 0.00 H new ATOM 0 HA LYS A 79 4.837 -2.394 -27.823 1.00 0.00 H new ATOM 0 HB2 LYS A 79 5.582 0.336 -27.071 1.00 0.00 H new ATOM 0 HB3 LYS A 79 6.718 -0.284 -28.253 1.00 0.00 H new ATOM 0 HG2 LYS A 79 4.634 -1.085 -29.602 1.00 0.00 H new ATOM 0 HG3 LYS A 79 3.683 -0.084 -28.522 1.00 0.00 H new ATOM 0 HD2 LYS A 79 5.092 1.907 -29.131 1.00 0.00 H new ATOM 0 HD3 LYS A 79 6.036 0.905 -30.216 1.00 0.00 H new ATOM 0 HE2 LYS A 79 3.017 0.955 -30.521 1.00 0.00 H new ATOM 0 HE3 LYS A 79 3.952 2.299 -31.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 3.666 0.576 -32.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 5.309 0.727 -32.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 4.402 -0.575 -31.813 1.00 0.00 H new ATOM 1277 N PRO A 80 7.236 -3.159 -28.447 1.00 0.00 N ATOM 1278 CA PRO A 80 8.508 -3.883 -28.622 1.00 0.00 C ATOM 1279 C PRO A 80 9.651 -2.887 -28.869 1.00 0.00 C ATOM 1280 O PRO A 80 9.464 -1.872 -29.538 1.00 0.00 O ATOM 1281 CB PRO A 80 8.265 -4.756 -29.856 1.00 0.00 C ATOM 1282 CG PRO A 80 7.115 -4.088 -30.646 1.00 0.00 C ATOM 1283 CD PRO A 80 6.364 -3.184 -29.650 1.00 0.00 C ATOM 0 HA PRO A 80 8.794 -4.469 -27.749 1.00 0.00 H new ATOM 0 HB2 PRO A 80 9.166 -4.825 -30.466 1.00 0.00 H new ATOM 0 HB3 PRO A 80 7.998 -5.772 -29.566 1.00 0.00 H new ATOM 0 HG2 PRO A 80 7.505 -3.505 -31.480 1.00 0.00 H new ATOM 0 HG3 PRO A 80 6.447 -4.839 -31.067 1.00 0.00 H new ATOM 0 HD2 PRO A 80 6.216 -2.183 -30.055 1.00 0.00 H new ATOM 0 HD3 PRO A 80 5.377 -3.583 -29.417 1.00 0.00 H new ATOM 1284 N MET A 81 10.829 -3.146 -28.343 1.00 0.00 N ATOM 1285 CA MET A 81 11.959 -2.197 -28.558 1.00 0.00 C ATOM 1286 C MET A 81 13.286 -2.966 -28.638 1.00 0.00 C ATOM 1287 O MET A 81 13.501 -3.936 -27.911 1.00 0.00 O ATOM 1288 CB MET A 81 12.017 -1.196 -27.400 1.00 0.00 C ATOM 1289 CG MET A 81 12.044 -1.950 -26.069 1.00 0.00 C ATOM 1290 SD MET A 81 12.825 -0.914 -24.808 1.00 0.00 S ATOM 1291 CE MET A 81 13.789 -2.219 -24.009 1.00 0.00 C ATOM 0 H MET A 81 11.050 -3.967 -27.780 1.00 0.00 H new ATOM 0 HA MET A 81 11.800 -1.663 -29.495 1.00 0.00 H new ATOM 0 HB2 MET A 81 12.904 -0.569 -27.492 1.00 0.00 H new ATOM 0 HB3 MET A 81 11.153 -0.533 -27.436 1.00 0.00 H new ATOM 0 HG2 MET A 81 11.030 -2.210 -25.765 1.00 0.00 H new ATOM 0 HG3 MET A 81 12.594 -2.885 -26.179 1.00 0.00 H new ATOM 0 HE1 MET A 81 14.361 -1.795 -23.184 1.00 0.00 H new ATOM 0 HE2 MET A 81 13.116 -2.987 -23.628 1.00 0.00 H new ATOM 0 HE3 MET A 81 14.472 -2.663 -24.734 1.00 0.00 H new ATOM 1292 N ARG A 82 14.187 -2.551 -29.504 1.00 0.00 N ATOM 1293 CA ARG A 82 15.494 -3.255 -29.619 1.00 0.00 C ATOM 1294 C ARG A 82 16.592 -2.374 -29.011 1.00 0.00 C ATOM 1295 O ARG A 82 16.519 -1.147 -29.074 1.00 0.00 O ATOM 1296 CB ARG A 82 15.807 -3.519 -31.094 1.00 0.00 C ATOM 1297 CG ARG A 82 15.192 -4.855 -31.516 1.00 0.00 C ATOM 1298 CD ARG A 82 16.072 -5.509 -32.581 1.00 0.00 C ATOM 1299 NE ARG A 82 15.383 -6.715 -33.122 1.00 0.00 N ATOM 1300 CZ ARG A 82 15.051 -6.766 -34.383 1.00 0.00 C ATOM 1301 NH1 ARG A 82 15.953 -6.562 -35.304 1.00 0.00 N ATOM 1302 NH2 ARG A 82 13.817 -7.022 -34.723 1.00 0.00 N ATOM 0 H ARG A 82 14.067 -1.756 -30.132 1.00 0.00 H new ATOM 0 HA ARG A 82 15.448 -4.205 -29.087 1.00 0.00 H new ATOM 0 HB2 ARG A 82 15.410 -2.713 -31.711 1.00 0.00 H new ATOM 0 HB3 ARG A 82 16.886 -3.538 -31.250 1.00 0.00 H new ATOM 0 HG2 ARG A 82 15.099 -5.513 -30.652 1.00 0.00 H new ATOM 0 HG3 ARG A 82 14.187 -4.697 -31.907 1.00 0.00 H new ATOM 0 HD2 ARG A 82 16.275 -4.802 -33.385 1.00 0.00 H new ATOM 0 HD3 ARG A 82 17.034 -5.788 -32.152 1.00 0.00 H new ATOM 0 HE ARG A 82 15.171 -7.500 -32.507 1.00 0.00 H new ATOM 0 HH11 ARG A 82 16.917 -6.363 -35.038 1.00 0.00 H new ATOM 0 HH12 ARG A 82 15.694 -6.602 -36.290 1.00 0.00 H new ATOM 0 HH21 ARG A 82 13.112 -7.182 -34.003 1.00 0.00 H new ATOM 0 HH22 ARG A 82 13.557 -7.062 -35.709 1.00 0.00 H new ATOM 1303 N ILE A 83 17.604 -2.964 -28.415 1.00 0.00 N ATOM 1304 CA ILE A 83 18.685 -2.138 -27.803 1.00 0.00 C ATOM 1305 C ILE A 83 19.973 -2.261 -28.631 1.00 0.00 C ATOM 1306 O ILE A 83 20.336 -3.348 -29.077 1.00 0.00 O ATOM 1307 CB ILE A 83 18.945 -2.621 -26.376 1.00 0.00 C ATOM 1308 CG1 ILE A 83 17.635 -2.583 -25.586 1.00 0.00 C ATOM 1309 CG2 ILE A 83 19.972 -1.705 -25.706 1.00 0.00 C ATOM 1310 CD1 ILE A 83 17.854 -3.200 -24.204 1.00 0.00 C ATOM 0 H ILE A 83 17.724 -3.973 -28.329 1.00 0.00 H new ATOM 0 HA ILE A 83 18.373 -1.094 -27.786 1.00 0.00 H new ATOM 0 HB ILE A 83 19.330 -3.640 -26.398 1.00 0.00 H new ATOM 0 HG12 ILE A 83 17.288 -1.555 -25.486 1.00 0.00 H new ATOM 0 HG13 ILE A 83 16.859 -3.130 -26.121 1.00 0.00 H new ATOM 0 HG21 ILE A 83 20.157 -2.049 -24.689 1.00 0.00 H new ATOM 0 HG22 ILE A 83 20.903 -1.727 -26.272 1.00 0.00 H new ATOM 0 HG23 ILE A 83 19.588 -0.685 -25.680 1.00 0.00 H new ATOM 0 HD11 ILE A 83 16.921 -3.173 -23.641 1.00 0.00 H new ATOM 0 HD12 ILE A 83 18.181 -4.234 -24.315 1.00 0.00 H new ATOM 0 HD13 ILE A 83 18.617 -2.634 -23.669 1.00 0.00 H new ATOM 1311 N GLN A 84 20.675 -1.169 -28.841 1.00 0.00 N ATOM 1312 CA GLN A 84 21.938 -1.231 -29.633 1.00 0.00 C ATOM 1313 C GLN A 84 22.974 -0.307 -28.981 1.00 0.00 C ATOM 1314 O GLN A 84 22.638 0.786 -28.530 1.00 0.00 O ATOM 1315 CB GLN A 84 21.679 -0.761 -31.071 1.00 0.00 C ATOM 1316 CG GLN A 84 20.429 -1.445 -31.632 1.00 0.00 C ATOM 1317 CD GLN A 84 19.214 -0.528 -31.438 1.00 0.00 C ATOM 1318 OE1 GLN A 84 18.231 -0.924 -30.815 1.00 0.00 O ATOM 1319 NE2 GLN A 84 19.220 0.685 -31.938 1.00 0.00 N ATOM 0 H GLN A 84 20.424 -0.242 -28.497 1.00 0.00 H new ATOM 0 HA GLN A 84 22.305 -2.257 -29.654 1.00 0.00 H new ATOM 0 HB2 GLN A 84 21.550 0.321 -31.090 1.00 0.00 H new ATOM 0 HB3 GLN A 84 22.541 -0.991 -31.698 1.00 0.00 H new ATOM 0 HG2 GLN A 84 20.566 -1.666 -32.691 1.00 0.00 H new ATOM 0 HG3 GLN A 84 20.264 -2.397 -31.127 1.00 0.00 H new ATOM 0 HE21 GLN A 84 20.033 1.019 -32.456 1.00 0.00 H new ATOM 0 HE22 GLN A 84 18.412 1.294 -31.809 1.00 0.00 H new ATOM 1320 N TYR A 85 24.229 -0.706 -28.916 1.00 0.00 N ATOM 1321 CA TYR A 85 25.258 0.186 -28.280 1.00 0.00 C ATOM 1322 C TYR A 85 25.191 1.584 -28.917 1.00 0.00 C ATOM 1323 O TYR A 85 24.523 1.780 -29.931 1.00 0.00 O ATOM 1324 CB TYR A 85 26.669 -0.387 -28.483 1.00 0.00 C ATOM 1325 CG TYR A 85 26.894 -1.567 -27.562 1.00 0.00 C ATOM 1326 CD1 TYR A 85 26.559 -1.485 -26.201 1.00 0.00 C ATOM 1327 CD2 TYR A 85 27.451 -2.745 -28.073 1.00 0.00 C ATOM 1328 CE1 TYR A 85 26.781 -2.581 -25.359 1.00 0.00 C ATOM 1329 CE2 TYR A 85 27.672 -3.840 -27.230 1.00 0.00 C ATOM 1330 CZ TYR A 85 27.337 -3.758 -25.875 1.00 0.00 C ATOM 1331 OH TYR A 85 27.558 -4.837 -25.047 1.00 0.00 O ATOM 0 H TYR A 85 24.580 -1.596 -29.270 1.00 0.00 H new ATOM 0 HA TYR A 85 25.049 0.249 -27.212 1.00 0.00 H new ATOM 0 HB2 TYR A 85 26.797 -0.697 -29.520 1.00 0.00 H new ATOM 0 HB3 TYR A 85 27.414 0.384 -28.286 1.00 0.00 H new ATOM 0 HD1 TYR A 85 26.130 -0.577 -25.804 1.00 0.00 H new ATOM 0 HD2 TYR A 85 27.711 -2.809 -29.119 1.00 0.00 H new ATOM 0 HE1 TYR A 85 26.524 -2.519 -24.312 1.00 0.00 H new ATOM 0 HE2 TYR A 85 28.101 -4.748 -27.626 1.00 0.00 H new ATOM 0 HH TYR A 85 27.021 -5.598 -25.351 1.00 0.00 H new ATOM 1332 N ALA A 86 25.867 2.560 -28.351 1.00 0.00 N ATOM 1333 CA ALA A 86 25.827 3.929 -28.942 1.00 0.00 C ATOM 1334 C ALA A 86 26.972 4.079 -29.954 1.00 0.00 C ATOM 1335 O ALA A 86 27.773 3.162 -30.135 1.00 0.00 O ATOM 1336 CB ALA A 86 25.974 4.982 -27.836 1.00 0.00 C ATOM 0 H ALA A 86 26.439 2.464 -27.512 1.00 0.00 H new ATOM 0 HA ALA A 86 24.872 4.076 -29.446 1.00 0.00 H new ATOM 0 HB1 ALA A 86 25.944 5.979 -28.276 1.00 0.00 H new ATOM 0 HB2 ALA A 86 25.158 4.876 -27.122 1.00 0.00 H new ATOM 0 HB3 ALA A 86 26.925 4.841 -27.323 1.00 0.00 H new ATOM 1337 N LYS A 87 27.073 5.209 -30.620 1.00 0.00 N ATOM 1338 CA LYS A 87 28.175 5.389 -31.612 1.00 0.00 C ATOM 1339 C LYS A 87 29.406 5.975 -30.906 1.00 0.00 C ATOM 1340 O LYS A 87 30.526 5.507 -31.102 1.00 0.00 O ATOM 1341 CB LYS A 87 27.726 6.337 -32.729 1.00 0.00 C ATOM 1342 CG LYS A 87 26.628 5.666 -33.557 1.00 0.00 C ATOM 1343 CD LYS A 87 25.871 6.727 -34.359 1.00 0.00 C ATOM 1344 CE LYS A 87 24.756 6.059 -35.163 1.00 0.00 C ATOM 1345 NZ LYS A 87 25.342 5.031 -36.068 1.00 0.00 N ATOM 0 H LYS A 87 26.444 6.005 -30.518 1.00 0.00 H new ATOM 0 HA LYS A 87 28.427 4.422 -32.046 1.00 0.00 H new ATOM 0 HB2 LYS A 87 27.356 7.269 -32.302 1.00 0.00 H new ATOM 0 HB3 LYS A 87 28.573 6.592 -33.366 1.00 0.00 H new ATOM 0 HG2 LYS A 87 27.065 4.929 -34.231 1.00 0.00 H new ATOM 0 HG3 LYS A 87 25.940 5.131 -32.902 1.00 0.00 H new ATOM 0 HD2 LYS A 87 25.451 7.475 -33.687 1.00 0.00 H new ATOM 0 HD3 LYS A 87 26.555 7.248 -35.029 1.00 0.00 H new ATOM 0 HE2 LYS A 87 24.034 5.597 -34.489 1.00 0.00 H new ATOM 0 HE3 LYS A 87 24.216 6.806 -35.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 24.672 4.821 -36.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 26.230 5.391 -36.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 25.534 4.163 -35.529 1.00 0.00 H new ATOM 1346 N THR A 88 29.226 6.987 -30.084 1.00 0.00 N ATOM 1347 CA THR A 88 30.390 7.585 -29.376 1.00 0.00 C ATOM 1348 C THR A 88 30.388 7.118 -27.913 1.00 0.00 C ATOM 1349 O THR A 88 29.501 6.377 -27.491 1.00 0.00 O ATOM 1350 CB THR A 88 30.291 9.111 -29.427 1.00 0.00 C ATOM 1351 OG1 THR A 88 28.954 9.506 -29.159 1.00 0.00 O ATOM 1352 CG2 THR A 88 30.703 9.605 -30.815 1.00 0.00 C ATOM 0 H THR A 88 28.324 7.417 -29.879 1.00 0.00 H new ATOM 0 HA THR A 88 31.314 7.268 -29.859 1.00 0.00 H new ATOM 0 HB THR A 88 30.955 9.544 -28.679 1.00 0.00 H new ATOM 0 HG1 THR A 88 28.889 10.483 -29.190 1.00 0.00 H new ATOM 0 HG21 THR A 88 30.632 10.692 -30.850 1.00 0.00 H new ATOM 0 HG22 THR A 88 31.730 9.302 -31.019 1.00 0.00 H new ATOM 0 HG23 THR A 88 30.041 9.174 -31.566 1.00 0.00 H new ATOM 1353 N ASP A 89 31.356 7.533 -27.124 1.00 0.00 N ATOM 1354 CA ASP A 89 31.383 7.101 -25.694 1.00 0.00 C ATOM 1355 C ASP A 89 30.588 8.103 -24.845 1.00 0.00 C ATOM 1356 O ASP A 89 30.181 9.156 -25.335 1.00 0.00 O ATOM 1357 CB ASP A 89 32.831 7.043 -25.192 1.00 0.00 C ATOM 1358 CG ASP A 89 33.604 5.990 -25.986 1.00 0.00 C ATOM 1359 OD1 ASP A 89 34.040 6.303 -27.081 1.00 0.00 O ATOM 1360 OD2 ASP A 89 33.748 4.886 -25.485 1.00 0.00 O ATOM 0 H ASP A 89 32.120 8.146 -27.409 1.00 0.00 H new ATOM 0 HA ASP A 89 30.936 6.111 -25.610 1.00 0.00 H new ATOM 0 HB2 ASP A 89 33.305 8.018 -25.303 1.00 0.00 H new ATOM 0 HB3 ASP A 89 32.849 6.799 -24.130 1.00 0.00 H new ATOM 1361 N SER A 90 30.357 7.808 -23.583 1.00 0.00 N ATOM 1362 CA SER A 90 29.587 8.766 -22.729 1.00 0.00 C ATOM 1363 C SER A 90 30.497 9.939 -22.338 1.00 0.00 C ATOM 1364 O SER A 90 31.695 9.761 -22.124 1.00 0.00 O ATOM 1365 CB SER A 90 29.088 8.065 -21.459 1.00 0.00 C ATOM 1366 OG SER A 90 27.860 8.653 -21.051 1.00 0.00 O ATOM 0 H SER A 90 30.665 6.956 -23.115 1.00 0.00 H new ATOM 0 HA SER A 90 28.728 9.132 -23.291 1.00 0.00 H new ATOM 0 HB2 SER A 90 28.950 7.000 -21.648 1.00 0.00 H new ATOM 0 HB3 SER A 90 29.829 8.155 -20.665 1.00 0.00 H new ATOM 0 HG SER A 90 28.041 9.488 -20.570 1.00 0.00 H new ATOM 1367 N ASP A 91 29.960 11.137 -22.240 1.00 0.00 N ATOM 1368 CA ASP A 91 30.813 12.302 -21.865 1.00 0.00 C ATOM 1369 C ASP A 91 30.987 12.366 -20.345 1.00 0.00 C ATOM 1370 O ASP A 91 32.021 12.822 -19.860 1.00 0.00 O ATOM 1371 CB ASP A 91 30.187 13.608 -22.368 1.00 0.00 C ATOM 1372 CG ASP A 91 31.293 14.618 -22.680 1.00 0.00 C ATOM 1373 OD1 ASP A 91 31.811 14.577 -23.784 1.00 0.00 O ATOM 1374 OD2 ASP A 91 31.603 15.415 -21.810 1.00 0.00 O ATOM 0 H ASP A 91 28.976 11.351 -22.403 1.00 0.00 H new ATOM 0 HA ASP A 91 31.790 12.175 -22.331 1.00 0.00 H new ATOM 0 HB2 ASP A 91 29.591 13.418 -23.261 1.00 0.00 H new ATOM 0 HB3 ASP A 91 29.512 14.014 -21.615 1.00 0.00 H new ATOM 1375 N ILE A 92 30.022 11.914 -19.565 1.00 0.00 N ATOM 1376 CA ILE A 92 30.208 11.959 -18.084 1.00 0.00 C ATOM 1377 C ILE A 92 31.495 11.191 -17.704 1.00 0.00 C ATOM 1378 O ILE A 92 32.127 11.510 -16.700 1.00 0.00 O ATOM 1379 CB ILE A 92 28.991 11.360 -17.363 1.00 0.00 C ATOM 1380 CG1 ILE A 92 28.705 9.941 -17.883 1.00 0.00 C ATOM 1381 CG2 ILE A 92 27.771 12.252 -17.609 1.00 0.00 C ATOM 1382 CD1 ILE A 92 29.026 8.917 -16.790 1.00 0.00 C ATOM 0 H ILE A 92 29.136 11.526 -19.888 1.00 0.00 H new ATOM 0 HA ILE A 92 30.304 12.999 -17.770 1.00 0.00 H new ATOM 0 HB ILE A 92 29.201 11.305 -16.295 1.00 0.00 H new ATOM 0 HG12 ILE A 92 27.660 9.856 -18.179 1.00 0.00 H new ATOM 0 HG13 ILE A 92 29.305 9.740 -18.770 1.00 0.00 H new ATOM 0 HG21 ILE A 92 26.904 11.831 -17.099 1.00 0.00 H new ATOM 0 HG22 ILE A 92 27.968 13.252 -17.224 1.00 0.00 H new ATOM 0 HG23 ILE A 92 27.571 12.308 -18.679 1.00 0.00 H new ATOM 0 HD11 ILE A 92 28.822 7.913 -17.161 1.00 0.00 H new ATOM 0 HD12 ILE A 92 30.078 8.996 -16.515 1.00 0.00 H new ATOM 0 HD13 ILE A 92 28.407 9.113 -15.915 1.00 0.00 H new ATOM 1383 N ILE A 93 31.933 10.216 -18.496 1.00 0.00 N ATOM 1384 CA ILE A 93 33.208 9.507 -18.147 1.00 0.00 C ATOM 1385 C ILE A 93 34.348 10.510 -18.343 1.00 0.00 C ATOM 1386 O ILE A 93 35.234 10.638 -17.505 1.00 0.00 O ATOM 1387 CB ILE A 93 33.487 8.282 -19.055 1.00 0.00 C ATOM 1388 CG1 ILE A 93 32.207 7.579 -19.563 1.00 0.00 C ATOM 1389 CG2 ILE A 93 34.320 7.267 -18.273 1.00 0.00 C ATOM 1390 CD1 ILE A 93 31.148 7.476 -18.465 1.00 0.00 C ATOM 0 H ILE A 93 31.469 9.895 -19.345 1.00 0.00 H new ATOM 0 HA ILE A 93 33.127 9.142 -17.123 1.00 0.00 H new ATOM 0 HB ILE A 93 34.015 8.657 -19.932 1.00 0.00 H new ATOM 0 HG12 ILE A 93 31.800 8.130 -20.411 1.00 0.00 H new ATOM 0 HG13 ILE A 93 32.458 6.581 -19.922 1.00 0.00 H new ATOM 0 HG21 ILE A 93 34.522 6.400 -18.902 1.00 0.00 H new ATOM 0 HG22 ILE A 93 35.262 7.725 -17.972 1.00 0.00 H new ATOM 0 HG23 ILE A 93 33.770 6.951 -17.386 1.00 0.00 H new ATOM 0 HD11 ILE A 93 30.263 6.976 -18.859 1.00 0.00 H new ATOM 0 HD12 ILE A 93 31.546 6.902 -17.628 1.00 0.00 H new ATOM 0 HD13 ILE A 93 30.879 8.476 -18.124 1.00 0.00 H new