USER MOD reduce.3.24.130724 H: found=0, std=0, add=1347, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1170 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: B 637 GLN : amide:sc= -0.659 K(o=-2.5,f=-4.9!) USER MOD Set 1.2: B 641 GLN : amide:sc= -1.83 K(o=-2.5,f=-3.2!) USER MOD Set 2.1: A 75 ASN :FLIP amide:sc= -1.34 F(o=-3.2,f=-1.8) USER MOD Set 2.2: B 648 THR OG1 : rot 128:sc= -0.492 USER MOD Set 3.1: A 66 ASN :FLIP amide:sc= -0.0748 F(o=0.42,f=1.2) USER MOD Set 3.2: A 67 THR OG1 : rot 78:sc= 1.24 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 7 HIS : no HD1:sc= -0.0719 X(o=-0.072,f=-0.15) USER MOD Single : A 10 GLN : amide:sc= -0.0838 X(o=-0.084,f=-0.39) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 156:sc= 0 (180deg=-0.158) USER MOD Single : A 25 MET CE :methyl -142:sc= -1.62 (180deg=-4.74!) USER MOD Single : A 27 HIS : no HD1:sc= -1.39 X(o=-1.4,f=-1.3) USER MOD Single : A 28 THR OG1 : rot -50:sc= -2.44! USER MOD Single : A 31 GLN : amide:sc= -0.325 X(o=-0.33,f=-0.24) USER MOD Single : A 34 GLN : amide:sc=-0.00748 X(o=-0.0075,f=-0.14) USER MOD Single : A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot -91:sc= 1.25 USER MOD Single : A 40 GLN : amide:sc= -0.0615 K(o=-0.061,f=-0.94) USER MOD Single : A 43 HIS : no HD1:sc= -0.334 X(o=-0.33,f=0) USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= -0.435 USER MOD Single : A 52 GLN : amide:sc= -0.0886 K(o=-0.089,f=-1) USER MOD Single : A 55 HIS :FLIP no HD1:sc= -0.111 F(o=-0.7,f=-0.11) USER MOD Single : A 64 LYS NZ :NH3+ -149:sc= -0.124 (180deg=-0.734) USER MOD Single : A 73 GLN : amide:sc= -0.545 X(o=-0.55,f=-0.072) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0.0143 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.0568 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot -118:sc= 0.22 USER MOD Single : B 601 SER OG : rot 55:sc= 0.335 USER MOD Single : B 602 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 603 SER OG : rot 180:sc= 0 USER MOD Single : B 604 GLN : amide:sc= 0 X(o=0,f=0.47) USER MOD Single : B 606 MET CE :methyl -113:sc= -0.508 (180deg=-0.991) USER MOD Single : B 607 TYR OH : rot 180:sc= 0 USER MOD Single : B 608 ASN : amide:sc= -0.17 K(o=-0.17,f=-0.92) USER MOD Single : B 609 TYR OH : rot 180:sc= 0 USER MOD Single : B 612 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 615 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 619 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 622 TYR OH : rot 180:sc= 0 USER MOD Single : B 625 THR OG1 : rot 83:sc= 0.373 USER MOD Single : B 627 GLN : amide:sc=-0.00101 X(o=-0.001,f=-0.11) USER MOD Single : B 628 SER OG : rot 75:sc= 0.405 USER MOD Single : B 642 SER OG : rot 180:sc= 0 USER MOD Single : B 645 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 651 THR OG1 : rot 180:sc= 0 USER MOD Single : B 652 TYR OH : rot 180:sc= 0 USER MOD Single : B 653 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 656 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 658 GLN : amide:sc= -3.72! X(o=-3.7!,f=-3.6) USER MOD Single : B 660 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 661 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 663 MET CE :methyl 141:sc= -1.23 (180deg=-5.52!) USER MOD Single : B 670 TYR OH : rot 180:sc= 0 USER MOD Single : B 671 HIS : no HD1:sc= -0.0257 X(o=-0.026,f=-0.21) USER MOD Single : B 673 MET CE :methyl -116:sc= -0.611 (180deg=-1.22) USER MOD Single : B 674 SER OG : rot 130:sc= 0 USER MOD Single : B 675 SER OG : rot 66:sc= 1.27 USER MOD Single : B 676 THR OG1 : rot 180:sc=0.000875 USER MOD Single : B 677 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 680 ASN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : B 681 THR OG1 : rot -36:sc= 0.758 USER MOD Single : B 682 MET CE :methyl -124:sc= -1.52 (180deg=-6.03!) USER MOD Single : B 684 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 685 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 689 THR OG1 : rot 180:sc= 0 USER MOD Single : B 694 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 18.701 -26.861 7.753 1.00 0.00 N ATOM 2 CA MET A 1 17.685 -27.872 8.024 1.00 0.00 C ATOM 3 C MET A 1 17.214 -27.796 9.473 1.00 0.00 C ATOM 4 O MET A 1 18.025 -27.814 10.400 1.00 0.00 O ATOM 5 CB MET A 1 18.233 -29.268 7.725 1.00 0.00 C ATOM 6 CG MET A 1 17.159 -30.343 7.664 1.00 0.00 C ATOM 7 SD MET A 1 17.488 -31.719 8.781 1.00 0.00 S ATOM 8 CE MET A 1 18.784 -32.576 7.889 1.00 0.00 C ATOM 0 H1 MET A 1 19.006 -26.932 6.761 1.00 0.00 H new ATOM 0 H2 MET A 1 18.305 -25.915 7.926 1.00 0.00 H new ATOM 0 H3 MET A 1 19.518 -27.014 8.378 1.00 0.00 H new ATOM 0 HA MET A 1 16.832 -27.678 7.374 1.00 0.00 H new ATOM 0 HB2 MET A 1 18.766 -29.244 6.774 1.00 0.00 H new ATOM 0 HB3 MET A 1 18.960 -29.536 8.492 1.00 0.00 H new ATOM 0 HG2 MET A 1 16.194 -29.901 7.913 1.00 0.00 H new ATOM 0 HG3 MET A 1 17.084 -30.719 6.644 1.00 0.00 H new ATOM 0 HE1 MET A 1 19.095 -33.454 8.454 1.00 0.00 H new ATOM 0 HE2 MET A 1 18.410 -32.886 6.913 1.00 0.00 H new ATOM 0 HE3 MET A 1 19.636 -31.909 7.756 1.00 0.00 H new ATOM 16 N SER A 2 15.902 -27.710 9.662 1.00 0.00 N ATOM 17 CA SER A 2 15.325 -27.628 10.998 1.00 0.00 C ATOM 18 C SER A 2 13.900 -28.173 11.010 1.00 0.00 C ATOM 19 O SER A 2 13.246 -28.256 9.969 1.00 0.00 O ATOM 20 CB SER A 2 15.332 -26.179 11.491 1.00 0.00 C ATOM 21 OG SER A 2 15.772 -25.297 10.474 1.00 0.00 O ATOM 0 H SER A 2 15.218 -27.695 8.906 1.00 0.00 H new ATOM 0 HA SER A 2 15.934 -28.236 11.667 1.00 0.00 H new ATOM 0 HB2 SER A 2 14.330 -25.896 11.813 1.00 0.00 H new ATOM 0 HB3 SER A 2 15.983 -26.090 12.360 1.00 0.00 H new ATOM 0 HG SER A 2 15.766 -24.378 10.813 1.00 0.00 H new ATOM 26 N LEU A 3 13.425 -28.544 12.193 1.00 0.00 N ATOM 27 CA LEU A 3 12.078 -29.083 12.343 1.00 0.00 C ATOM 28 C LEU A 3 11.068 -27.965 12.583 1.00 0.00 C ATOM 29 O LEU A 3 10.161 -27.749 11.777 1.00 0.00 O ATOM 30 CB LEU A 3 12.033 -30.084 13.498 1.00 0.00 C ATOM 31 CG LEU A 3 12.673 -31.447 13.232 1.00 0.00 C ATOM 32 CD1 LEU A 3 14.137 -31.436 13.641 1.00 0.00 C ATOM 33 CD2 LEU A 3 11.920 -32.544 13.969 1.00 0.00 C ATOM 0 H LEU A 3 13.953 -28.482 13.063 1.00 0.00 H new ATOM 0 HA LEU A 3 11.813 -29.595 11.418 1.00 0.00 H new ATOM 0 HB2 LEU A 3 12.527 -29.636 14.360 1.00 0.00 H new ATOM 0 HB3 LEU A 3 10.991 -30.242 13.774 1.00 0.00 H new ATOM 0 HG LEU A 3 12.616 -31.651 12.163 1.00 0.00 H new ATOM 0 HD11 LEU A 3 14.577 -32.414 13.445 1.00 0.00 H new ATOM 0 HD12 LEU A 3 14.669 -30.677 13.068 1.00 0.00 H new ATOM 0 HD13 LEU A 3 14.216 -31.209 14.704 1.00 0.00 H new ATOM 0 HD21 LEU A 3 12.390 -33.507 13.768 1.00 0.00 H new ATOM 0 HD22 LEU A 3 11.944 -32.345 15.040 1.00 0.00 H new ATOM 0 HD23 LEU A 3 10.885 -32.567 13.628 1.00 0.00 H new ATOM 44 N LEU A 4 11.233 -27.256 13.694 1.00 0.00 N ATOM 45 CA LEU A 4 10.336 -26.157 14.039 1.00 0.00 C ATOM 46 C LEU A 4 8.888 -26.631 14.087 1.00 0.00 C ATOM 47 O LEU A 4 8.611 -27.826 13.985 1.00 0.00 O ATOM 48 CB LEU A 4 10.480 -25.019 13.028 1.00 0.00 C ATOM 49 CG LEU A 4 10.785 -23.638 13.611 1.00 0.00 C ATOM 50 CD1 LEU A 4 12.130 -23.642 14.319 1.00 0.00 C ATOM 51 CD2 LEU A 4 10.759 -22.581 12.517 1.00 0.00 C ATOM 0 H LEU A 4 11.978 -27.421 14.371 1.00 0.00 H new ATOM 0 HA LEU A 4 10.612 -25.792 15.028 1.00 0.00 H new ATOM 0 HB2 LEU A 4 11.274 -25.280 12.328 1.00 0.00 H new ATOM 0 HB3 LEU A 4 9.557 -24.952 12.452 1.00 0.00 H new ATOM 0 HG LEU A 4 10.014 -23.395 14.342 1.00 0.00 H new ATOM 0 HD11 LEU A 4 12.329 -22.651 14.727 1.00 0.00 H new ATOM 0 HD12 LEU A 4 12.113 -24.371 15.129 1.00 0.00 H new ATOM 0 HD13 LEU A 4 12.914 -23.907 13.609 1.00 0.00 H new ATOM 0 HD21 LEU A 4 10.978 -21.605 12.949 1.00 0.00 H new ATOM 0 HD22 LEU A 4 11.508 -22.820 11.762 1.00 0.00 H new ATOM 0 HD23 LEU A 4 9.772 -22.560 12.055 1.00 0.00 H new ATOM 62 N ASP A 5 7.967 -25.686 14.240 1.00 0.00 N ATOM 63 CA ASP A 5 6.545 -26.005 14.298 1.00 0.00 C ATOM 64 C ASP A 5 6.233 -26.879 15.510 1.00 0.00 C ATOM 65 O ASP A 5 5.992 -28.078 15.376 1.00 0.00 O ATOM 66 CB ASP A 5 6.107 -26.716 13.016 1.00 0.00 C ATOM 67 CG ASP A 5 6.734 -26.108 11.776 1.00 0.00 C ATOM 68 OD1 ASP A 5 6.501 -24.908 11.521 1.00 0.00 O ATOM 69 OD2 ASP A 5 7.456 -26.834 11.060 1.00 0.00 O ATOM 0 H ASP A 5 8.180 -24.692 14.326 1.00 0.00 H new ATOM 0 HA ASP A 5 5.992 -25.071 14.394 1.00 0.00 H new ATOM 0 HB2 ASP A 5 6.378 -27.770 13.077 1.00 0.00 H new ATOM 0 HB3 ASP A 5 5.021 -26.670 12.931 1.00 0.00 H new ATOM 73 N ALA A 6 6.241 -26.270 16.691 1.00 0.00 N ATOM 74 CA ALA A 6 5.959 -26.991 17.924 1.00 0.00 C ATOM 75 C ALA A 6 4.772 -26.378 18.660 1.00 0.00 C ATOM 76 O ALA A 6 3.754 -27.036 18.874 1.00 0.00 O ATOM 77 CB ALA A 6 7.188 -27.004 18.822 1.00 0.00 C ATOM 0 H ALA A 6 6.440 -25.278 16.819 1.00 0.00 H new ATOM 0 HA ALA A 6 5.702 -28.018 17.663 1.00 0.00 H new ATOM 0 HB1 ALA A 6 6.962 -27.546 19.740 1.00 0.00 H new ATOM 0 HB2 ALA A 6 8.012 -27.495 18.304 1.00 0.00 H new ATOM 0 HB3 ALA A 6 7.471 -25.980 19.066 1.00 0.00 H new ATOM 83 N HIS A 7 4.909 -25.113 19.045 1.00 0.00 N ATOM 84 CA HIS A 7 3.847 -24.410 19.756 1.00 0.00 C ATOM 85 C HIS A 7 3.598 -23.037 19.141 1.00 0.00 C ATOM 86 O HIS A 7 3.420 -22.049 19.855 1.00 0.00 O ATOM 87 CB HIS A 7 4.207 -24.262 21.235 1.00 0.00 C ATOM 88 CG HIS A 7 3.015 -24.213 22.139 1.00 0.00 C ATOM 89 ND1 HIS A 7 2.012 -25.159 22.116 1.00 0.00 N ATOM 90 CD2 HIS A 7 2.667 -23.322 23.099 1.00 0.00 C ATOM 91 CE1 HIS A 7 1.100 -24.853 23.021 1.00 0.00 C ATOM 92 NE2 HIS A 7 1.474 -23.743 23.631 1.00 0.00 N ATOM 0 H HIS A 7 5.745 -24.554 18.876 1.00 0.00 H new ATOM 0 HA HIS A 7 2.933 -24.998 19.669 1.00 0.00 H new ATOM 0 HB2 HIS A 7 4.843 -25.096 21.531 1.00 0.00 H new ATOM 0 HB3 HIS A 7 4.792 -23.352 21.369 1.00 0.00 H new ATOM 0 HD2 HIS A 7 3.225 -22.444 23.391 1.00 0.00 H new ATOM 0 HE1 HIS A 7 0.201 -25.415 23.227 1.00 0.00 H new ATOM 0 HE2 HIS A 7 0.960 -23.274 24.377 1.00 0.00 H new ATOM 99 N ILE A 8 3.585 -22.982 17.813 1.00 0.00 N ATOM 100 CA ILE A 8 3.357 -21.730 17.103 1.00 0.00 C ATOM 101 C ILE A 8 2.107 -21.810 16.233 1.00 0.00 C ATOM 102 O ILE A 8 1.708 -22.881 15.775 1.00 0.00 O ATOM 103 CB ILE A 8 4.561 -21.356 16.218 1.00 0.00 C ATOM 104 CG1 ILE A 8 4.689 -22.338 15.053 1.00 0.00 C ATOM 105 CG2 ILE A 8 5.839 -21.336 17.044 1.00 0.00 C ATOM 106 CD1 ILE A 8 5.875 -22.060 14.155 1.00 0.00 C ATOM 0 H ILE A 8 3.730 -23.790 17.208 1.00 0.00 H new ATOM 0 HA ILE A 8 3.220 -20.959 17.861 1.00 0.00 H new ATOM 0 HB ILE A 8 4.399 -20.358 15.811 1.00 0.00 H new ATOM 0 HG12 ILE A 8 4.773 -23.350 15.449 1.00 0.00 H new ATOM 0 HG13 ILE A 8 3.777 -22.303 14.457 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.681 -21.070 16.405 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.744 -20.601 17.844 1.00 0.00 H new ATOM 0 HG23 ILE A 8 6.009 -22.322 17.476 1.00 0.00 H new ATOM 0 HD11 ILE A 8 5.903 -22.795 13.351 1.00 0.00 H new ATOM 0 HD12 ILE A 8 5.783 -21.061 13.730 1.00 0.00 H new ATOM 0 HD13 ILE A 8 6.795 -22.123 14.737 1.00 0.00 H new ATOM 117 N PRO A 9 1.473 -20.653 15.998 1.00 0.00 N ATOM 118 CA PRO A 9 0.260 -20.565 15.179 1.00 0.00 C ATOM 119 C PRO A 9 0.538 -20.826 13.703 1.00 0.00 C ATOM 120 O PRO A 9 0.706 -19.892 12.919 1.00 0.00 O ATOM 121 CB PRO A 9 -0.206 -19.123 15.388 1.00 0.00 C ATOM 122 CG PRO A 9 1.030 -18.373 15.747 1.00 0.00 C ATOM 123 CD PRO A 9 1.892 -19.338 16.513 1.00 0.00 C ATOM 0 HA PRO A 9 -0.480 -21.312 15.466 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -0.665 -18.721 14.485 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -0.952 -19.059 16.180 1.00 0.00 H new ATOM 0 HG2 PRO A 9 1.543 -18.016 14.854 1.00 0.00 H new ATOM 0 HG3 PRO A 9 0.793 -17.497 16.351 1.00 0.00 H new ATOM 0 HD2 PRO A 9 2.952 -19.157 16.337 1.00 0.00 H new ATOM 0 HD3 PRO A 9 1.729 -19.257 17.588 1.00 0.00 H new ATOM 128 N GLN A 10 0.584 -22.101 13.331 1.00 0.00 N ATOM 129 CA GLN A 10 0.841 -22.484 11.947 1.00 0.00 C ATOM 130 C GLN A 10 -0.458 -22.831 11.227 1.00 0.00 C ATOM 131 O GLN A 10 -0.796 -22.228 10.209 1.00 0.00 O ATOM 132 CB GLN A 10 1.801 -23.674 11.895 1.00 0.00 C ATOM 133 CG GLN A 10 2.244 -24.037 10.486 1.00 0.00 C ATOM 134 CD GLN A 10 3.701 -23.706 10.230 1.00 0.00 C ATOM 135 OE1 GLN A 10 4.457 -24.533 9.722 1.00 0.00 O ATOM 136 NE2 GLN A 10 4.102 -22.490 10.582 1.00 0.00 N ATOM 0 H GLN A 10 0.447 -22.886 13.968 1.00 0.00 H new ATOM 0 HA GLN A 10 1.299 -21.634 11.441 1.00 0.00 H new ATOM 0 HB2 GLN A 10 2.681 -23.447 12.497 1.00 0.00 H new ATOM 0 HB3 GLN A 10 1.319 -24.539 12.350 1.00 0.00 H new ATOM 0 HG2 GLN A 10 2.083 -25.102 10.322 1.00 0.00 H new ATOM 0 HG3 GLN A 10 1.622 -23.506 9.765 1.00 0.00 H new ATOM 0 HE21 GLN A 10 3.440 -21.836 11.000 1.00 0.00 H new ATOM 0 HE22 GLN A 10 5.072 -22.210 10.434 1.00 0.00 H new ATOM 143 N LEU A 11 -1.182 -23.807 11.763 1.00 0.00 N ATOM 144 CA LEU A 11 -2.445 -24.236 11.172 1.00 0.00 C ATOM 145 C LEU A 11 -3.619 -23.879 12.078 1.00 0.00 C ATOM 146 O LEU A 11 -4.677 -24.507 12.018 1.00 0.00 O ATOM 147 CB LEU A 11 -2.425 -25.743 10.914 1.00 0.00 C ATOM 148 CG LEU A 11 -1.757 -26.193 9.613 1.00 0.00 C ATOM 149 CD1 LEU A 11 -2.507 -25.643 8.410 1.00 0.00 C ATOM 150 CD2 LEU A 11 -0.301 -25.753 9.583 1.00 0.00 C ATOM 0 H LEU A 11 -0.916 -24.316 12.606 1.00 0.00 H new ATOM 0 HA LEU A 11 -2.570 -23.713 10.224 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -1.915 -26.227 11.747 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -3.453 -26.105 10.915 1.00 0.00 H new ATOM 0 HG LEU A 11 -1.788 -27.282 9.568 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.017 -25.973 7.494 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -3.534 -26.007 8.424 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -2.508 -24.554 8.449 1.00 0.00 H new ATOM 0 HD21 LEU A 11 0.159 -26.081 8.651 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -0.248 -24.666 9.651 1.00 0.00 H new ATOM 0 HD23 LEU A 11 0.230 -26.196 10.425 1.00 0.00 H new ATOM 161 N VAL A 12 -3.427 -22.865 12.916 1.00 0.00 N ATOM 162 CA VAL A 12 -4.471 -22.422 13.832 1.00 0.00 C ATOM 163 C VAL A 12 -5.552 -21.638 13.097 1.00 0.00 C ATOM 164 O VAL A 12 -6.703 -21.594 13.529 1.00 0.00 O ATOM 165 CB VAL A 12 -3.893 -21.547 14.960 1.00 0.00 C ATOM 166 CG1 VAL A 12 -2.944 -22.355 15.832 1.00 0.00 C ATOM 167 CG2 VAL A 12 -3.192 -20.328 14.381 1.00 0.00 C ATOM 0 H VAL A 12 -2.558 -22.335 12.979 1.00 0.00 H new ATOM 0 HA VAL A 12 -4.911 -23.319 14.268 1.00 0.00 H new ATOM 0 HB VAL A 12 -4.716 -21.202 15.586 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -2.546 -21.719 16.623 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -3.482 -23.193 16.276 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -2.123 -22.733 15.223 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -2.789 -19.721 15.192 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -2.379 -20.651 13.731 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -3.905 -19.738 13.805 1.00 0.00 H new ATOM 177 N ALA A 13 -5.172 -21.019 11.984 1.00 0.00 N ATOM 178 CA ALA A 13 -6.108 -20.237 11.186 1.00 0.00 C ATOM 179 C ALA A 13 -5.936 -20.525 9.698 1.00 0.00 C ATOM 180 O ALA A 13 -5.764 -19.608 8.896 1.00 0.00 O ATOM 181 CB ALA A 13 -5.926 -18.752 11.463 1.00 0.00 C ATOM 0 H ALA A 13 -4.222 -21.044 11.614 1.00 0.00 H new ATOM 0 HA ALA A 13 -7.119 -20.527 11.470 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -6.632 -18.180 10.860 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -6.108 -18.554 12.519 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -4.908 -18.456 11.208 1.00 0.00 H new ATOM 187 N SER A 14 -5.983 -21.804 9.339 1.00 0.00 N ATOM 188 CA SER A 14 -5.828 -22.212 7.947 1.00 0.00 C ATOM 189 C SER A 14 -7.111 -21.962 7.162 1.00 0.00 C ATOM 190 O SER A 14 -7.078 -21.769 5.946 1.00 0.00 O ATOM 191 CB SER A 14 -5.449 -23.692 7.869 1.00 0.00 C ATOM 192 OG SER A 14 -4.849 -23.999 6.622 1.00 0.00 O ATOM 0 H SER A 14 -6.127 -22.575 9.991 1.00 0.00 H new ATOM 0 HA SER A 14 -5.030 -21.615 7.504 1.00 0.00 H new ATOM 0 HB2 SER A 14 -4.761 -23.938 8.678 1.00 0.00 H new ATOM 0 HB3 SER A 14 -6.338 -24.306 8.010 1.00 0.00 H new ATOM 0 HG SER A 14 -4.614 -24.950 6.597 1.00 0.00 H new ATOM 197 N GLN A 15 -8.239 -21.964 7.865 1.00 0.00 N ATOM 198 CA GLN A 15 -9.533 -21.738 7.233 1.00 0.00 C ATOM 199 C GLN A 15 -9.514 -20.464 6.395 1.00 0.00 C ATOM 200 O GLN A 15 -9.920 -20.468 5.233 1.00 0.00 O ATOM 201 CB GLN A 15 -10.633 -21.649 8.292 1.00 0.00 C ATOM 202 CG GLN A 15 -12.038 -21.632 7.711 1.00 0.00 C ATOM 203 CD GLN A 15 -12.954 -22.643 8.371 1.00 0.00 C ATOM 204 OE1 GLN A 15 -13.657 -22.326 9.331 1.00 0.00 O ATOM 205 NE2 GLN A 15 -12.952 -23.868 7.860 1.00 0.00 N ATOM 0 H GLN A 15 -8.283 -22.120 8.872 1.00 0.00 H new ATOM 0 HA GLN A 15 -9.740 -22.582 6.575 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -10.540 -22.496 8.972 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -10.483 -20.747 8.885 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -12.462 -20.634 7.825 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -11.987 -21.837 6.642 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -12.354 -24.087 7.064 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -13.549 -24.590 8.264 1.00 0.00 H new ATOM 212 N SER A 16 -9.040 -19.375 6.992 1.00 0.00 N ATOM 213 CA SER A 16 -8.972 -18.093 6.302 1.00 0.00 C ATOM 214 C SER A 16 -8.131 -17.094 7.092 1.00 0.00 C ATOM 215 O SER A 16 -8.589 -16.530 8.087 1.00 0.00 O ATOM 216 CB SER A 16 -10.379 -17.532 6.083 1.00 0.00 C ATOM 217 OG SER A 16 -11.281 -18.023 7.060 1.00 0.00 O ATOM 0 H SER A 16 -8.697 -19.355 7.953 1.00 0.00 H new ATOM 0 HA SER A 16 -8.498 -18.255 5.334 1.00 0.00 H new ATOM 0 HB2 SER A 16 -10.350 -16.443 6.124 1.00 0.00 H new ATOM 0 HB3 SER A 16 -10.732 -17.804 5.088 1.00 0.00 H new ATOM 0 HG SER A 16 -12.172 -17.649 6.900 1.00 0.00 H new ATOM 222 N ALA A 17 -6.899 -16.880 6.643 1.00 0.00 N ATOM 223 CA ALA A 17 -5.995 -15.949 7.305 1.00 0.00 C ATOM 224 C ALA A 17 -5.727 -14.729 6.431 1.00 0.00 C ATOM 225 O ALA A 17 -5.438 -13.643 6.935 1.00 0.00 O ATOM 226 CB ALA A 17 -4.688 -16.644 7.659 1.00 0.00 C ATOM 0 H ALA A 17 -6.504 -17.340 5.822 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.473 -15.608 8.223 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.022 -15.937 8.153 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.890 -17.480 8.328 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.214 -17.014 6.749 1.00 0.00 H new ATOM 232 N PHE A 18 -5.822 -14.914 5.118 1.00 0.00 N ATOM 233 CA PHE A 18 -5.587 -13.828 4.174 1.00 0.00 C ATOM 234 C PHE A 18 -6.738 -12.825 4.202 1.00 0.00 C ATOM 235 O PHE A 18 -6.524 -11.623 4.348 1.00 0.00 O ATOM 236 CB PHE A 18 -5.414 -14.382 2.759 1.00 0.00 C ATOM 237 CG PHE A 18 -4.751 -13.421 1.815 1.00 0.00 C ATOM 238 CD1 PHE A 18 -5.505 -12.527 1.073 1.00 0.00 C ATOM 239 CD2 PHE A 18 -3.373 -13.412 1.670 1.00 0.00 C ATOM 240 CE1 PHE A 18 -4.897 -11.640 0.204 1.00 0.00 C ATOM 241 CE2 PHE A 18 -2.760 -12.527 0.803 1.00 0.00 C ATOM 242 CZ PHE A 18 -3.522 -11.642 0.068 1.00 0.00 C ATOM 0 H PHE A 18 -6.060 -15.806 4.684 1.00 0.00 H new ATOM 0 HA PHE A 18 -4.672 -13.314 4.470 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.825 -15.298 2.806 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -6.392 -14.653 2.361 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -6.580 -12.523 1.174 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.771 -14.104 2.241 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -5.496 -10.947 -0.368 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -1.685 -12.528 0.701 1.00 0.00 H new ATOM 0 HZ PHE A 18 -3.045 -10.952 -0.612 1.00 0.00 H new ATOM 251 N ALA A 19 -7.959 -13.331 4.060 1.00 0.00 N ATOM 252 CA ALA A 19 -9.143 -12.481 4.071 1.00 0.00 C ATOM 253 C ALA A 19 -9.163 -11.582 5.303 1.00 0.00 C ATOM 254 O ALA A 19 -9.683 -10.468 5.262 1.00 0.00 O ATOM 255 CB ALA A 19 -10.403 -13.331 4.014 1.00 0.00 C ATOM 0 H ALA A 19 -8.154 -14.325 3.936 1.00 0.00 H new ATOM 0 HA ALA A 19 -9.109 -11.842 3.189 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -11.280 -12.683 4.023 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -10.400 -13.925 3.100 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -10.434 -13.995 4.878 1.00 0.00 H new ATOM 261 N ALA A 20 -8.595 -12.075 6.399 1.00 0.00 N ATOM 262 CA ALA A 20 -8.547 -11.316 7.641 1.00 0.00 C ATOM 263 C ALA A 20 -7.643 -10.096 7.505 1.00 0.00 C ATOM 264 O ALA A 20 -7.961 -9.014 8.001 1.00 0.00 O ATOM 265 CB ALA A 20 -8.072 -12.202 8.783 1.00 0.00 C ATOM 0 H ALA A 20 -8.162 -12.997 6.451 1.00 0.00 H new ATOM 0 HA ALA A 20 -9.555 -10.966 7.862 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -8.041 -11.622 9.705 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -8.759 -13.039 8.904 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -7.075 -12.581 8.559 1.00 0.00 H new ATOM 271 N LYS A 21 -6.511 -10.276 6.833 1.00 0.00 N ATOM 272 CA LYS A 21 -5.560 -9.191 6.629 1.00 0.00 C ATOM 273 C LYS A 21 -6.058 -8.221 5.562 1.00 0.00 C ATOM 274 O LYS A 21 -5.888 -7.009 5.683 1.00 0.00 O ATOM 275 CB LYS A 21 -4.193 -9.751 6.227 1.00 0.00 C ATOM 276 CG LYS A 21 -3.625 -10.744 7.225 1.00 0.00 C ATOM 277 CD LYS A 21 -2.355 -10.218 7.873 1.00 0.00 C ATOM 278 CE LYS A 21 -2.636 -9.012 8.756 1.00 0.00 C ATOM 279 NZ LYS A 21 -2.080 -9.186 10.126 1.00 0.00 N ATOM 0 H LYS A 21 -6.230 -11.165 6.420 1.00 0.00 H new ATOM 0 HA LYS A 21 -5.461 -8.648 7.569 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -4.280 -10.236 5.255 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -3.492 -8.925 6.110 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -4.368 -10.953 7.995 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -3.414 -11.687 6.721 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -1.896 -11.007 8.469 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -1.637 -9.944 7.100 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -2.206 -8.120 8.300 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -3.712 -8.851 8.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -1.920 -8.253 10.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -2.753 -9.725 10.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -1.178 -9.701 10.072 1.00 0.00 H new ATOM 289 N ALA A 22 -6.676 -8.766 4.518 1.00 0.00 N ATOM 290 CA ALA A 22 -7.203 -7.948 3.433 1.00 0.00 C ATOM 291 C ALA A 22 -8.221 -6.937 3.949 1.00 0.00 C ATOM 292 O ALA A 22 -8.194 -5.766 3.572 1.00 0.00 O ATOM 293 CB ALA A 22 -7.829 -8.832 2.364 1.00 0.00 C ATOM 0 H ALA A 22 -6.823 -9.769 4.402 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.374 -7.394 2.993 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -8.219 -8.209 1.559 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -7.075 -9.510 1.965 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -8.642 -9.411 2.801 1.00 0.00 H new ATOM 299 N GLY A 23 -9.119 -7.399 4.814 1.00 0.00 N ATOM 300 CA GLY A 23 -10.134 -6.521 5.368 1.00 0.00 C ATOM 301 C GLY A 23 -9.556 -5.495 6.322 1.00 0.00 C ATOM 302 O GLY A 23 -10.051 -4.371 6.411 1.00 0.00 O ATOM 0 H GLY A 23 -9.162 -8.364 5.141 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -10.648 -6.008 4.556 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -10.881 -7.119 5.891 1.00 0.00 H new ATOM 306 N LEU A 24 -8.506 -5.880 7.037 1.00 0.00 N ATOM 307 CA LEU A 24 -7.859 -4.986 7.992 1.00 0.00 C ATOM 308 C LEU A 24 -7.136 -3.853 7.272 1.00 0.00 C ATOM 309 O LEU A 24 -6.966 -2.764 7.819 1.00 0.00 O ATOM 310 CB LEU A 24 -6.873 -5.765 8.863 1.00 0.00 C ATOM 311 CG LEU A 24 -6.991 -5.545 10.372 1.00 0.00 C ATOM 312 CD1 LEU A 24 -6.697 -6.834 11.124 1.00 0.00 C ATOM 313 CD2 LEU A 24 -6.052 -4.436 10.824 1.00 0.00 C ATOM 0 H LEU A 24 -8.083 -6.806 6.974 1.00 0.00 H new ATOM 0 HA LEU A 24 -8.631 -4.553 8.628 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -7.001 -6.828 8.660 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -5.861 -5.502 8.556 1.00 0.00 H new ATOM 0 HG LEU A 24 -8.014 -5.242 10.597 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -6.786 -6.658 12.196 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -7.409 -7.602 10.822 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -5.685 -7.167 10.894 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -6.149 -4.293 11.900 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -5.024 -4.710 10.586 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -6.309 -3.510 10.310 1.00 0.00 H new ATOM 324 N MET A 25 -6.713 -4.116 6.040 1.00 0.00 N ATOM 325 CA MET A 25 -6.011 -3.117 5.242 1.00 0.00 C ATOM 326 C MET A 25 -6.871 -1.872 5.052 1.00 0.00 C ATOM 327 O MET A 25 -6.475 -0.769 5.428 1.00 0.00 O ATOM 328 CB MET A 25 -5.624 -3.698 3.881 1.00 0.00 C ATOM 329 CG MET A 25 -4.919 -2.704 2.974 1.00 0.00 C ATOM 330 SD MET A 25 -3.186 -3.121 2.701 1.00 0.00 S ATOM 331 CE MET A 25 -2.567 -3.118 4.381 1.00 0.00 C ATOM 0 H MET A 25 -6.844 -5.013 5.572 1.00 0.00 H new ATOM 0 HA MET A 25 -5.105 -2.833 5.777 1.00 0.00 H new ATOM 0 HB2 MET A 25 -4.975 -4.560 4.035 1.00 0.00 H new ATOM 0 HB3 MET A 25 -6.522 -4.060 3.381 1.00 0.00 H new ATOM 0 HG2 MET A 25 -5.435 -2.664 2.015 1.00 0.00 H new ATOM 0 HG3 MET A 25 -4.984 -1.708 3.412 1.00 0.00 H new ATOM 0 HE1 MET A 25 -1.563 -2.694 4.398 1.00 0.00 H new ATOM 0 HE2 MET A 25 -3.225 -2.519 5.010 1.00 0.00 H new ATOM 0 HE3 MET A 25 -2.535 -4.140 4.759 1.00 0.00 H new ATOM 339 N ARG A 26 -8.048 -2.056 4.463 1.00 0.00 N ATOM 340 CA ARG A 26 -8.963 -0.947 4.220 1.00 0.00 C ATOM 341 C ARG A 26 -9.272 -0.204 5.517 1.00 0.00 C ATOM 342 O ARG A 26 -9.601 0.983 5.501 1.00 0.00 O ATOM 343 CB ARG A 26 -10.261 -1.457 3.590 1.00 0.00 C ATOM 344 CG ARG A 26 -10.120 -1.830 2.124 1.00 0.00 C ATOM 345 CD ARG A 26 -11.231 -2.768 1.678 1.00 0.00 C ATOM 346 NE ARG A 26 -11.992 -2.221 0.559 1.00 0.00 N ATOM 347 CZ ARG A 26 -13.028 -2.840 0.002 1.00 0.00 C ATOM 348 NH1 ARG A 26 -13.423 -4.020 0.460 1.00 0.00 N ATOM 349 NH2 ARG A 26 -13.671 -2.278 -1.013 1.00 0.00 N ATOM 0 H ARG A 26 -8.391 -2.963 4.145 1.00 0.00 H new ATOM 0 HA ARG A 26 -8.480 -0.255 3.530 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.607 -2.328 4.146 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -11.029 -0.690 3.689 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -10.138 -0.927 1.514 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -9.153 -2.306 1.960 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -10.802 -3.727 1.390 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -11.903 -2.958 2.515 1.00 0.00 H new ATOM 0 HE ARG A 26 -11.714 -1.314 0.184 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -12.932 -4.454 1.241 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -14.218 -4.493 0.031 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -13.371 -1.370 -1.367 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -14.466 -2.754 -1.440 1.00 0.00 H new ATOM 360 N HIS A 27 -9.165 -0.910 6.638 1.00 0.00 N ATOM 361 CA HIS A 27 -9.433 -0.317 7.943 1.00 0.00 C ATOM 362 C HIS A 27 -8.310 0.634 8.349 1.00 0.00 C ATOM 363 O HIS A 27 -8.535 1.606 9.071 1.00 0.00 O ATOM 364 CB HIS A 27 -9.599 -1.410 8.999 1.00 0.00 C ATOM 365 CG HIS A 27 -10.037 -0.892 10.335 1.00 0.00 C ATOM 366 ND1 HIS A 27 -10.608 0.351 10.509 1.00 0.00 N ATOM 367 CD2 HIS A 27 -9.986 -1.457 11.563 1.00 0.00 C ATOM 368 CE1 HIS A 27 -10.888 0.528 11.787 1.00 0.00 C ATOM 369 NE2 HIS A 27 -10.521 -0.555 12.449 1.00 0.00 N ATOM 0 H HIS A 27 -8.895 -1.893 6.669 1.00 0.00 H new ATOM 0 HA HIS A 27 -10.360 0.253 7.872 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -10.328 -2.138 8.644 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -8.652 -1.937 9.116 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -9.597 -2.436 11.802 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -11.340 1.409 12.218 1.00 0.00 H new ATOM 0 HE2 HIS A 27 -10.619 -0.698 13.454 1.00 0.00 H new ATOM 376 N THR A 28 -7.100 0.346 7.882 1.00 0.00 N ATOM 377 CA THR A 28 -5.942 1.173 8.198 1.00 0.00 C ATOM 378 C THR A 28 -6.006 2.509 7.467 1.00 0.00 C ATOM 379 O THR A 28 -5.761 3.562 8.057 1.00 0.00 O ATOM 380 CB THR A 28 -4.626 0.461 7.829 1.00 0.00 C ATOM 381 OG1 THR A 28 -4.797 -0.958 7.909 1.00 0.00 O ATOM 382 CG2 THR A 28 -3.499 0.895 8.754 1.00 0.00 C ATOM 0 H THR A 28 -6.896 -0.454 7.283 1.00 0.00 H new ATOM 0 HA THR A 28 -5.962 1.349 9.274 1.00 0.00 H new ATOM 0 HB THR A 28 -4.363 0.737 6.808 1.00 0.00 H new ATOM 0 HG1 THR A 28 -5.202 -1.191 8.771 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.580 0.380 8.475 1.00 0.00 H new ATOM 0 HG22 THR A 28 -3.352 1.972 8.668 1.00 0.00 H new ATOM 0 HG23 THR A 28 -3.757 0.645 9.783 1.00 0.00 H new ATOM 390 N ILE A 29 -6.337 2.460 6.181 1.00 0.00 N ATOM 391 CA ILE A 29 -6.435 3.669 5.372 1.00 0.00 C ATOM 392 C ILE A 29 -7.684 4.469 5.727 1.00 0.00 C ATOM 393 O ILE A 29 -7.620 5.681 5.931 1.00 0.00 O ATOM 394 CB ILE A 29 -6.461 3.339 3.868 1.00 0.00 C ATOM 395 CG1 ILE A 29 -5.165 2.638 3.454 1.00 0.00 C ATOM 396 CG2 ILE A 29 -6.670 4.604 3.051 1.00 0.00 C ATOM 397 CD1 ILE A 29 -5.197 1.140 3.654 1.00 0.00 C ATOM 0 H ILE A 29 -6.542 1.597 5.677 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.550 4.267 5.590 1.00 0.00 H new ATOM 0 HB ILE A 29 -7.294 2.664 3.674 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -4.966 2.852 2.404 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -4.337 3.055 4.027 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -6.686 4.354 1.990 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -7.618 5.064 3.329 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -5.856 5.302 3.247 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -4.246 0.711 3.339 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -5.365 0.917 4.708 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -6.003 0.711 3.059 1.00 0.00 H new ATOM 408 N GLY A 30 -8.819 3.781 5.802 1.00 0.00 N ATOM 409 CA GLY A 30 -10.067 4.444 6.135 1.00 0.00 C ATOM 410 C GLY A 30 -9.975 5.240 7.421 1.00 0.00 C ATOM 411 O GLY A 30 -10.407 6.391 7.478 1.00 0.00 O ATOM 0 H GLY A 30 -8.897 2.777 5.638 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -10.351 5.109 5.319 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -10.857 3.699 6.228 1.00 0.00 H new ATOM 415 N GLN A 31 -9.412 4.627 8.457 1.00 0.00 N ATOM 416 CA GLN A 31 -9.268 5.286 9.749 1.00 0.00 C ATOM 417 C GLN A 31 -8.179 6.352 9.699 1.00 0.00 C ATOM 418 O GLN A 31 -8.276 7.385 10.360 1.00 0.00 O ATOM 419 CB GLN A 31 -8.944 4.259 10.836 1.00 0.00 C ATOM 420 CG GLN A 31 -10.176 3.631 11.467 1.00 0.00 C ATOM 421 CD GLN A 31 -11.052 4.646 12.175 1.00 0.00 C ATOM 422 OE1 GLN A 31 -10.736 5.094 13.277 1.00 0.00 O ATOM 423 NE2 GLN A 31 -12.160 5.015 11.543 1.00 0.00 N ATOM 0 H GLN A 31 -9.048 3.675 8.427 1.00 0.00 H new ATOM 0 HA GLN A 31 -10.214 5.771 9.988 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.324 3.471 10.407 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -8.353 4.741 11.615 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -10.759 3.130 10.695 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -9.865 2.866 12.179 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -12.383 4.618 10.630 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -12.788 5.696 11.970 1.00 0.00 H new ATOM 430 N ALA A 32 -7.140 6.092 8.910 1.00 0.00 N ATOM 431 CA ALA A 32 -6.033 7.029 8.773 1.00 0.00 C ATOM 432 C ALA A 32 -6.466 8.283 8.021 1.00 0.00 C ATOM 433 O ALA A 32 -5.906 9.361 8.221 1.00 0.00 O ATOM 434 CB ALA A 32 -4.864 6.363 8.061 1.00 0.00 C ATOM 0 H ALA A 32 -7.043 5.240 8.357 1.00 0.00 H new ATOM 0 HA ALA A 32 -5.715 7.327 9.772 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -4.043 7.074 7.965 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -4.531 5.500 8.637 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -5.179 6.037 7.070 1.00 0.00 H new ATOM 440 N GLU A 33 -7.466 8.135 7.159 1.00 0.00 N ATOM 441 CA GLU A 33 -7.972 9.258 6.377 1.00 0.00 C ATOM 442 C GLU A 33 -8.747 10.231 7.262 1.00 0.00 C ATOM 443 O GLU A 33 -8.746 11.438 7.022 1.00 0.00 O ATOM 444 CB GLU A 33 -8.871 8.756 5.244 1.00 0.00 C ATOM 445 CG GLU A 33 -8.906 9.682 4.040 1.00 0.00 C ATOM 446 CD GLU A 33 -9.729 9.120 2.896 1.00 0.00 C ATOM 447 OE1 GLU A 33 -10.747 8.451 3.171 1.00 0.00 O ATOM 448 OE2 GLU A 33 -9.353 9.348 1.727 1.00 0.00 O ATOM 0 H GLU A 33 -7.942 7.250 6.984 1.00 0.00 H new ATOM 0 HA GLU A 33 -7.118 9.783 5.948 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -8.525 7.773 4.926 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -9.885 8.630 5.624 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -9.317 10.646 4.339 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -7.888 9.863 3.696 1.00 0.00 H new ATOM 453 N GLN A 34 -9.408 9.696 8.284 1.00 0.00 N ATOM 454 CA GLN A 34 -10.187 10.516 9.202 1.00 0.00 C ATOM 455 C GLN A 34 -9.352 11.673 9.742 1.00 0.00 C ATOM 456 O GLN A 34 -9.866 12.767 9.975 1.00 0.00 O ATOM 457 CB GLN A 34 -10.710 9.664 10.361 1.00 0.00 C ATOM 458 CG GLN A 34 -11.671 10.406 11.275 1.00 0.00 C ATOM 459 CD GLN A 34 -12.910 9.596 11.600 1.00 0.00 C ATOM 460 OE1 GLN A 34 -12.832 8.393 11.848 1.00 0.00 O ATOM 461 NE2 GLN A 34 -14.064 10.253 11.602 1.00 0.00 N ATOM 0 H GLN A 34 -9.419 8.698 8.496 1.00 0.00 H new ATOM 0 HA GLN A 34 -11.033 10.929 8.652 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -11.211 8.784 9.957 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -9.865 9.307 10.949 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -11.158 10.666 12.201 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -11.967 11.342 10.801 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -14.083 11.251 11.391 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -14.931 9.760 11.815 1.00 0.00 H new ATOM 468 N ALA A 35 -8.061 11.422 9.940 1.00 0.00 N ATOM 469 CA ALA A 35 -7.155 12.444 10.450 1.00 0.00 C ATOM 470 C ALA A 35 -6.888 13.516 9.399 1.00 0.00 C ATOM 471 O ALA A 35 -6.706 14.688 9.727 1.00 0.00 O ATOM 472 CB ALA A 35 -5.849 11.810 10.905 1.00 0.00 C ATOM 0 H ALA A 35 -7.620 10.521 9.755 1.00 0.00 H new ATOM 0 HA ALA A 35 -7.631 12.923 11.305 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -5.181 12.584 11.284 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -6.051 11.087 11.695 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.377 11.304 10.063 1.00 0.00 H new ATOM 478 N ALA A 36 -6.865 13.106 8.135 1.00 0.00 N ATOM 479 CA ALA A 36 -6.621 14.032 7.036 1.00 0.00 C ATOM 480 C ALA A 36 -7.864 14.863 6.732 1.00 0.00 C ATOM 481 O ALA A 36 -7.779 15.917 6.104 1.00 0.00 O ATOM 482 CB ALA A 36 -6.175 13.273 5.795 1.00 0.00 C ATOM 0 H ALA A 36 -7.012 12.139 7.847 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.825 14.713 7.337 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -5.996 13.977 4.982 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.256 12.729 6.012 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -6.953 12.569 5.500 1.00 0.00 H new ATOM 488 N MET A 37 -9.017 14.379 7.181 1.00 0.00 N ATOM 489 CA MET A 37 -10.278 15.077 6.957 1.00 0.00 C ATOM 490 C MET A 37 -10.178 16.534 7.399 1.00 0.00 C ATOM 491 O MET A 37 -10.842 17.408 6.841 1.00 0.00 O ATOM 492 CB MET A 37 -11.413 14.380 7.708 1.00 0.00 C ATOM 493 CG MET A 37 -11.752 13.005 7.158 1.00 0.00 C ATOM 494 SD MET A 37 -12.944 13.072 5.806 1.00 0.00 S ATOM 495 CE MET A 37 -12.568 11.548 4.946 1.00 0.00 C ATOM 0 H MET A 37 -9.105 13.506 7.702 1.00 0.00 H new ATOM 0 HA MET A 37 -10.493 15.054 5.889 1.00 0.00 H new ATOM 0 HB2 MET A 37 -11.137 14.284 8.758 1.00 0.00 H new ATOM 0 HB3 MET A 37 -12.303 15.008 7.668 1.00 0.00 H new ATOM 0 HG2 MET A 37 -10.839 12.522 6.809 1.00 0.00 H new ATOM 0 HG3 MET A 37 -12.153 12.386 7.960 1.00 0.00 H new ATOM 0 HE1 MET A 37 -13.225 11.446 4.082 1.00 0.00 H new ATOM 0 HE2 MET A 37 -11.530 11.565 4.613 1.00 0.00 H new ATOM 0 HE3 MET A 37 -12.720 10.704 5.619 1.00 0.00 H new ATOM 503 N SER A 38 -9.346 16.787 8.403 1.00 0.00 N ATOM 504 CA SER A 38 -9.163 18.136 8.923 1.00 0.00 C ATOM 505 C SER A 38 -8.838 19.114 7.796 1.00 0.00 C ATOM 506 O SER A 38 -9.377 20.218 7.742 1.00 0.00 O ATOM 507 CB SER A 38 -8.046 18.157 9.969 1.00 0.00 C ATOM 508 OG SER A 38 -6.986 17.292 9.599 1.00 0.00 O ATOM 0 H SER A 38 -8.787 16.075 8.873 1.00 0.00 H new ATOM 0 HA SER A 38 -10.096 18.446 9.393 1.00 0.00 H new ATOM 0 HB2 SER A 38 -7.668 19.173 10.082 1.00 0.00 H new ATOM 0 HB3 SER A 38 -8.445 17.856 10.938 1.00 0.00 H new ATOM 0 HG SER A 38 -7.142 16.402 9.978 1.00 0.00 H new ATOM 513 N ALA A 39 -7.951 18.696 6.898 1.00 0.00 N ATOM 514 CA ALA A 39 -7.555 19.532 5.771 1.00 0.00 C ATOM 515 C ALA A 39 -8.634 19.549 4.694 1.00 0.00 C ATOM 516 O ALA A 39 -8.776 20.527 3.960 1.00 0.00 O ATOM 517 CB ALA A 39 -6.235 19.044 5.192 1.00 0.00 C ATOM 0 H ALA A 39 -7.494 17.785 6.929 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.426 20.552 6.134 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.950 19.677 4.351 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.462 19.090 5.959 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -6.346 18.015 4.850 1.00 0.00 H new ATOM 523 N GLN A 40 -9.392 18.460 4.605 1.00 0.00 N ATOM 524 CA GLN A 40 -10.457 18.351 3.616 1.00 0.00 C ATOM 525 C GLN A 40 -11.583 19.334 3.918 1.00 0.00 C ATOM 526 O GLN A 40 -12.452 19.574 3.080 1.00 0.00 O ATOM 527 CB GLN A 40 -11.006 16.923 3.581 1.00 0.00 C ATOM 528 CG GLN A 40 -12.075 16.707 2.523 1.00 0.00 C ATOM 529 CD GLN A 40 -12.214 15.252 2.123 1.00 0.00 C ATOM 530 OE1 GLN A 40 -11.224 14.528 2.016 1.00 0.00 O ATOM 531 NE2 GLN A 40 -13.449 14.814 1.899 1.00 0.00 N ATOM 0 H GLN A 40 -9.288 17.642 5.205 1.00 0.00 H new ATOM 0 HA GLN A 40 -10.038 18.595 2.640 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -10.183 16.231 3.401 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -11.420 16.678 4.559 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -13.032 17.069 2.899 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -11.834 17.301 1.641 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -14.241 15.449 1.999 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -13.604 13.843 1.627 1.00 0.00 H new ATOM 538 N ALA A 41 -11.562 19.901 5.119 1.00 0.00 N ATOM 539 CA ALA A 41 -12.580 20.859 5.530 1.00 0.00 C ATOM 540 C ALA A 41 -12.669 22.021 4.549 1.00 0.00 C ATOM 541 O ALA A 41 -13.760 22.474 4.203 1.00 0.00 O ATOM 542 CB ALA A 41 -12.287 21.371 6.933 1.00 0.00 C ATOM 0 H ALA A 41 -10.850 19.713 5.825 1.00 0.00 H new ATOM 0 HA ALA A 41 -13.543 20.348 5.535 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -13.055 22.086 7.227 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -12.283 20.535 7.632 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -11.313 21.860 6.946 1.00 0.00 H new ATOM 548 N PHE A 42 -11.513 22.502 4.102 1.00 0.00 N ATOM 549 CA PHE A 42 -11.461 23.614 3.160 1.00 0.00 C ATOM 550 C PHE A 42 -12.040 24.881 3.781 1.00 0.00 C ATOM 551 O PHE A 42 -11.306 25.731 4.287 1.00 0.00 O ATOM 552 CB PHE A 42 -12.224 23.263 1.881 1.00 0.00 C ATOM 553 CG PHE A 42 -11.362 22.643 0.819 1.00 0.00 C ATOM 554 CD1 PHE A 42 -10.774 21.405 1.022 1.00 0.00 C ATOM 555 CD2 PHE A 42 -11.140 23.297 -0.382 1.00 0.00 C ATOM 556 CE1 PHE A 42 -9.979 20.832 0.046 1.00 0.00 C ATOM 557 CE2 PHE A 42 -10.347 22.729 -1.361 1.00 0.00 C ATOM 558 CZ PHE A 42 -9.766 21.494 -1.146 1.00 0.00 C ATOM 0 H PHE A 42 -10.600 22.139 4.377 1.00 0.00 H new ATOM 0 HA PHE A 42 -10.416 23.798 2.912 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -13.033 22.576 2.127 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -12.684 24.167 1.482 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -10.938 20.882 1.952 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -11.592 24.262 -0.555 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -9.525 19.867 0.217 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -10.182 23.250 -2.293 1.00 0.00 H new ATOM 0 HZ PHE A 42 -9.146 21.047 -1.909 1.00 0.00 H new ATOM 567 N HIS A 43 -13.363 25.003 3.738 1.00 0.00 N ATOM 568 CA HIS A 43 -14.044 26.165 4.297 1.00 0.00 C ATOM 569 C HIS A 43 -14.833 25.786 5.545 1.00 0.00 C ATOM 570 O HIS A 43 -15.807 26.448 5.901 1.00 0.00 O ATOM 571 CB HIS A 43 -14.979 26.783 3.257 1.00 0.00 C ATOM 572 CG HIS A 43 -14.260 27.469 2.136 1.00 0.00 C ATOM 573 ND1 HIS A 43 -14.715 28.630 1.548 1.00 0.00 N ATOM 574 CD2 HIS A 43 -13.109 27.152 1.498 1.00 0.00 C ATOM 575 CE1 HIS A 43 -13.877 28.996 0.594 1.00 0.00 C ATOM 576 NE2 HIS A 43 -12.893 28.115 0.544 1.00 0.00 N ATOM 0 H HIS A 43 -13.985 24.310 3.321 1.00 0.00 H new ATOM 0 HA HIS A 43 -13.287 26.898 4.577 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -15.617 26.001 2.844 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -15.634 27.501 3.751 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -12.478 26.300 1.702 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -13.979 29.866 -0.037 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -12.102 28.146 -0.099 1.00 0.00 H new ATOM 583 N GLN A 44 -14.406 24.714 6.206 1.00 0.00 N ATOM 584 CA GLN A 44 -15.075 24.246 7.415 1.00 0.00 C ATOM 585 C GLN A 44 -14.157 24.370 8.627 1.00 0.00 C ATOM 586 O GLN A 44 -14.304 23.639 9.606 1.00 0.00 O ATOM 587 CB GLN A 44 -15.522 22.793 7.245 1.00 0.00 C ATOM 588 CG GLN A 44 -16.787 22.639 6.418 1.00 0.00 C ATOM 589 CD GLN A 44 -17.913 21.978 7.190 1.00 0.00 C ATOM 590 OE1 GLN A 44 -17.889 20.771 7.434 1.00 0.00 O ATOM 591 NE2 GLN A 44 -18.907 22.767 7.580 1.00 0.00 N ATOM 0 H GLN A 44 -13.601 24.154 5.925 1.00 0.00 H new ATOM 0 HA GLN A 44 -15.952 24.871 7.581 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -14.718 22.227 6.774 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -15.686 22.354 8.229 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -17.114 23.621 6.075 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -16.566 22.048 5.529 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -18.886 23.762 7.356 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -19.691 22.378 8.104 1.00 0.00 H new ATOM 598 N GLY A 45 -13.210 25.300 8.554 1.00 0.00 N ATOM 599 CA GLY A 45 -12.282 25.502 9.651 1.00 0.00 C ATOM 600 C GLY A 45 -10.893 25.878 9.175 1.00 0.00 C ATOM 601 O GLY A 45 -10.280 26.806 9.701 1.00 0.00 O ATOM 0 H GLY A 45 -13.069 25.917 7.754 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -12.663 26.286 10.305 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -12.224 24.591 10.246 1.00 0.00 H new ATOM 605 N GLU A 46 -10.395 25.155 8.177 1.00 0.00 N ATOM 606 CA GLU A 46 -9.069 25.417 7.632 1.00 0.00 C ATOM 607 C GLU A 46 -9.040 25.171 6.126 1.00 0.00 C ATOM 608 O GLU A 46 -9.519 24.144 5.645 1.00 0.00 O ATOM 609 CB GLU A 46 -8.026 24.536 8.323 1.00 0.00 C ATOM 610 CG GLU A 46 -7.551 25.088 9.657 1.00 0.00 C ATOM 611 CD GLU A 46 -7.037 24.005 10.586 1.00 0.00 C ATOM 612 OE1 GLU A 46 -7.673 22.934 10.660 1.00 0.00 O ATOM 613 OE2 GLU A 46 -5.996 24.230 11.240 1.00 0.00 O ATOM 0 H GLU A 46 -10.890 24.383 7.730 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.830 26.464 7.816 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -8.448 23.543 8.480 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -7.167 24.417 7.662 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -6.760 25.818 9.483 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -8.372 25.617 10.141 1.00 0.00 H new ATOM 618 N SER A 47 -8.476 26.121 5.387 1.00 0.00 N ATOM 619 CA SER A 47 -8.388 26.010 3.937 1.00 0.00 C ATOM 620 C SER A 47 -6.984 25.598 3.507 1.00 0.00 C ATOM 621 O SER A 47 -5.994 25.982 4.129 1.00 0.00 O ATOM 622 CB SER A 47 -8.765 27.339 3.279 1.00 0.00 C ATOM 623 OG SER A 47 -9.325 28.235 4.224 1.00 0.00 O ATOM 0 H SER A 47 -8.073 26.976 5.770 1.00 0.00 H new ATOM 0 HA SER A 47 -9.089 25.240 3.614 1.00 0.00 H new ATOM 0 HB2 SER A 47 -7.881 27.788 2.827 1.00 0.00 H new ATOM 0 HB3 SER A 47 -9.479 27.161 2.475 1.00 0.00 H new ATOM 0 HG SER A 47 -9.556 29.077 3.779 1.00 0.00 H new ATOM 628 N SER A 48 -6.906 24.812 2.436 1.00 0.00 N ATOM 629 CA SER A 48 -5.623 24.343 1.924 1.00 0.00 C ATOM 630 C SER A 48 -5.813 23.538 0.643 1.00 0.00 C ATOM 631 O SER A 48 -5.909 22.312 0.675 1.00 0.00 O ATOM 632 CB SER A 48 -4.912 23.490 2.976 1.00 0.00 C ATOM 633 OG SER A 48 -5.801 23.109 4.012 1.00 0.00 O ATOM 0 H SER A 48 -7.715 24.487 1.907 1.00 0.00 H new ATOM 0 HA SER A 48 -5.008 25.214 1.698 1.00 0.00 H new ATOM 0 HB2 SER A 48 -4.495 22.600 2.505 1.00 0.00 H new ATOM 0 HB3 SER A 48 -4.076 24.049 3.397 1.00 0.00 H new ATOM 0 HG SER A 48 -5.322 22.564 4.670 1.00 0.00 H new ATOM 638 N ALA A 49 -5.865 24.238 -0.487 1.00 0.00 N ATOM 639 CA ALA A 49 -6.040 23.589 -1.780 1.00 0.00 C ATOM 640 C ALA A 49 -4.952 22.548 -2.024 1.00 0.00 C ATOM 641 O ALA A 49 -5.150 21.595 -2.777 1.00 0.00 O ATOM 642 CB ALA A 49 -6.041 24.626 -2.894 1.00 0.00 C ATOM 0 H ALA A 49 -5.788 25.254 -0.532 1.00 0.00 H new ATOM 0 HA ALA A 49 -7.002 23.076 -1.775 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -6.172 24.128 -3.855 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -6.858 25.330 -2.735 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -5.093 25.164 -2.891 1.00 0.00 H new ATOM 648 N ALA A 50 -3.803 22.739 -1.383 1.00 0.00 N ATOM 649 CA ALA A 50 -2.685 21.815 -1.530 1.00 0.00 C ATOM 650 C ALA A 50 -3.083 20.402 -1.121 1.00 0.00 C ATOM 651 O ALA A 50 -2.505 19.422 -1.592 1.00 0.00 O ATOM 652 CB ALA A 50 -1.497 22.290 -0.707 1.00 0.00 C ATOM 0 H ALA A 50 -3.622 23.524 -0.758 1.00 0.00 H new ATOM 0 HA ALA A 50 -2.399 21.793 -2.582 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -0.669 21.591 -0.826 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -1.189 23.278 -1.049 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -1.780 22.342 0.344 1.00 0.00 H new ATOM 658 N PHE A 51 -4.074 20.302 -0.241 1.00 0.00 N ATOM 659 CA PHE A 51 -4.548 19.007 0.233 1.00 0.00 C ATOM 660 C PHE A 51 -4.994 18.131 -0.933 1.00 0.00 C ATOM 661 O PHE A 51 -4.824 16.912 -0.906 1.00 0.00 O ATOM 662 CB PHE A 51 -5.705 19.193 1.217 1.00 0.00 C ATOM 663 CG PHE A 51 -6.361 17.904 1.622 1.00 0.00 C ATOM 664 CD1 PHE A 51 -5.667 16.960 2.362 1.00 0.00 C ATOM 665 CD2 PHE A 51 -7.672 17.635 1.263 1.00 0.00 C ATOM 666 CE1 PHE A 51 -6.267 15.773 2.734 1.00 0.00 C ATOM 667 CE2 PHE A 51 -8.278 16.450 1.633 1.00 0.00 C ATOM 668 CZ PHE A 51 -7.575 15.518 2.371 1.00 0.00 C ATOM 0 H PHE A 51 -4.564 21.102 0.158 1.00 0.00 H new ATOM 0 HA PHE A 51 -3.722 18.510 0.743 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -5.335 19.699 2.109 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -6.453 19.846 0.767 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -4.645 17.155 2.651 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -8.227 18.361 0.687 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -5.714 15.045 3.308 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -9.300 16.253 1.346 1.00 0.00 H new ATOM 0 HZ PHE A 51 -8.047 14.592 2.664 1.00 0.00 H new ATOM 677 N GLN A 52 -5.563 18.760 -1.956 1.00 0.00 N ATOM 678 CA GLN A 52 -6.034 18.038 -3.131 1.00 0.00 C ATOM 679 C GLN A 52 -4.876 17.354 -3.850 1.00 0.00 C ATOM 680 O GLN A 52 -4.956 16.176 -4.195 1.00 0.00 O ATOM 681 CB GLN A 52 -6.753 18.992 -4.088 1.00 0.00 C ATOM 682 CG GLN A 52 -6.980 18.407 -5.473 1.00 0.00 C ATOM 683 CD GLN A 52 -8.398 18.613 -5.968 1.00 0.00 C ATOM 684 OE1 GLN A 52 -9.094 19.528 -5.528 1.00 0.00 O ATOM 685 NE2 GLN A 52 -8.833 17.761 -6.889 1.00 0.00 N ATOM 0 H GLN A 52 -5.709 19.769 -1.995 1.00 0.00 H new ATOM 0 HA GLN A 52 -6.735 17.272 -2.799 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -7.715 19.269 -3.657 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -6.170 19.908 -4.181 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -6.284 18.865 -6.175 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -6.757 17.340 -5.454 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -8.221 17.017 -7.225 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -9.779 17.850 -7.260 1.00 0.00 H new ATOM 692 N ALA A 53 -3.801 18.102 -4.073 1.00 0.00 N ATOM 693 CA ALA A 53 -2.625 17.568 -4.749 1.00 0.00 C ATOM 694 C ALA A 53 -2.208 16.230 -4.149 1.00 0.00 C ATOM 695 O ALA A 53 -2.119 15.224 -4.853 1.00 0.00 O ATOM 696 CB ALA A 53 -1.477 18.563 -4.677 1.00 0.00 C ATOM 0 H ALA A 53 -3.720 19.080 -3.795 1.00 0.00 H new ATOM 0 HA ALA A 53 -2.881 17.403 -5.795 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -0.606 18.151 -5.186 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -1.772 19.495 -5.160 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -1.229 18.758 -3.634 1.00 0.00 H new ATOM 702 N ALA A 54 -1.951 16.225 -2.845 1.00 0.00 N ATOM 703 CA ALA A 54 -1.543 15.010 -2.150 1.00 0.00 C ATOM 704 C ALA A 54 -2.705 14.029 -2.034 1.00 0.00 C ATOM 705 O ALA A 54 -2.502 12.816 -1.979 1.00 0.00 O ATOM 706 CB ALA A 54 -0.996 15.350 -0.771 1.00 0.00 C ATOM 0 H ALA A 54 -2.018 17.049 -2.248 1.00 0.00 H new ATOM 0 HA ALA A 54 -0.756 14.533 -2.733 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -0.695 14.434 -0.263 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -0.133 16.008 -0.874 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -1.768 15.852 -0.187 1.00 0.00 H new ATOM 712 N HIS A 55 -3.922 14.562 -1.997 1.00 0.00 N ATOM 713 CA HIS A 55 -5.117 13.732 -1.887 1.00 0.00 C ATOM 714 C HIS A 55 -5.258 12.821 -3.102 1.00 0.00 C ATOM 715 O HIS A 55 -5.401 11.606 -2.966 1.00 0.00 O ATOM 716 CB HIS A 55 -6.361 14.608 -1.745 1.00 0.00 C ATOM 717 CG HIS A 55 -7.643 13.874 -1.990 1.00 0.00 C ATOM 718 ND1 HIS A 55 -7.990 12.591 -1.737 1.00 0.00 N flip ATOM 719 CD2 HIS A 55 -8.750 14.463 -2.564 1.00 0.00 C flip ATOM 720 CE1 HIS A 55 -9.287 12.429 -2.159 1.00 0.00 C flip ATOM 721 NE2 HIS A 55 -9.723 13.574 -2.653 1.00 0.00 N flip ATOM 0 H HIS A 55 -4.107 15.564 -2.042 1.00 0.00 H new ATOM 0 HA HIS A 55 -5.017 13.110 -0.997 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -6.382 15.034 -0.742 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -6.290 15.441 -2.444 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -8.812 15.491 -2.890 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -9.858 11.514 -2.097 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -10.653 13.743 -3.038 1.00 0.00 H new ATOM 728 N ALA A 56 -5.219 13.415 -4.290 1.00 0.00 N ATOM 729 CA ALA A 56 -5.343 12.658 -5.529 1.00 0.00 C ATOM 730 C ALA A 56 -4.240 11.610 -5.644 1.00 0.00 C ATOM 731 O ALA A 56 -4.436 10.552 -6.240 1.00 0.00 O ATOM 732 CB ALA A 56 -5.310 13.594 -6.727 1.00 0.00 C ATOM 0 H ALA A 56 -5.102 14.420 -4.420 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.302 12.140 -5.514 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -5.404 13.014 -7.645 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -6.137 14.301 -6.659 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -4.366 14.139 -6.737 1.00 0.00 H new ATOM 738 N ARG A 57 -3.080 11.914 -5.069 1.00 0.00 N ATOM 739 CA ARG A 57 -1.946 10.999 -5.109 1.00 0.00 C ATOM 740 C ARG A 57 -2.224 9.751 -4.277 1.00 0.00 C ATOM 741 O ARG A 57 -1.854 8.641 -4.659 1.00 0.00 O ATOM 742 CB ARG A 57 -0.684 11.695 -4.597 1.00 0.00 C ATOM 743 CG ARG A 57 0.076 12.449 -5.676 1.00 0.00 C ATOM 744 CD ARG A 57 1.444 12.897 -5.185 1.00 0.00 C ATOM 745 NE ARG A 57 2.471 11.887 -5.430 1.00 0.00 N ATOM 746 CZ ARG A 57 3.771 12.107 -5.268 1.00 0.00 C ATOM 747 NH1 ARG A 57 4.200 13.295 -4.863 1.00 0.00 N ATOM 748 NH2 ARG A 57 4.643 11.138 -5.512 1.00 0.00 N ATOM 0 H ARG A 57 -2.902 12.786 -4.571 1.00 0.00 H new ATOM 0 HA ARG A 57 -1.792 10.697 -6.145 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -0.959 12.391 -3.805 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.024 10.950 -4.152 1.00 0.00 H new ATOM 0 HG2 ARG A 57 0.194 11.812 -6.552 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -0.502 13.318 -5.989 1.00 0.00 H new ATOM 0 HD2 ARG A 57 1.722 13.825 -5.684 1.00 0.00 H new ATOM 0 HD3 ARG A 57 1.394 13.111 -4.117 1.00 0.00 H new ATOM 0 HE ARG A 57 2.174 10.963 -5.742 1.00 0.00 H new ATOM 0 HH11 ARG A 57 3.531 14.042 -4.675 1.00 0.00 H new ATOM 0 HH12 ARG A 57 5.199 13.462 -4.739 1.00 0.00 H new ATOM 0 HH21 ARG A 57 4.315 10.224 -5.824 1.00 0.00 H new ATOM 0 HH22 ARG A 57 5.641 11.307 -5.388 1.00 0.00 H new ATOM 759 N PHE A 58 -2.879 9.940 -3.136 1.00 0.00 N ATOM 760 CA PHE A 58 -3.205 8.831 -2.248 1.00 0.00 C ATOM 761 C PHE A 58 -4.255 7.920 -2.879 1.00 0.00 C ATOM 762 O PHE A 58 -4.053 6.711 -2.999 1.00 0.00 O ATOM 763 CB PHE A 58 -3.713 9.357 -0.904 1.00 0.00 C ATOM 764 CG PHE A 58 -3.704 8.324 0.186 1.00 0.00 C ATOM 765 CD1 PHE A 58 -4.546 7.226 0.126 1.00 0.00 C ATOM 766 CD2 PHE A 58 -2.852 8.453 1.273 1.00 0.00 C ATOM 767 CE1 PHE A 58 -4.539 6.275 1.129 1.00 0.00 C ATOM 768 CE2 PHE A 58 -2.842 7.504 2.278 1.00 0.00 C ATOM 769 CZ PHE A 58 -3.686 6.413 2.205 1.00 0.00 C ATOM 0 H PHE A 58 -3.194 10.852 -2.805 1.00 0.00 H new ATOM 0 HA PHE A 58 -2.297 8.252 -2.084 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -3.097 10.202 -0.597 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -4.729 9.732 -1.030 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -5.215 7.112 -0.714 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -2.190 9.304 1.335 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -5.201 5.424 1.071 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -2.175 7.616 3.120 1.00 0.00 H new ATOM 0 HZ PHE A 58 -3.678 5.670 2.988 1.00 0.00 H new ATOM 778 N VAL A 59 -5.377 8.510 -3.281 1.00 0.00 N ATOM 779 CA VAL A 59 -6.459 7.753 -3.900 1.00 0.00 C ATOM 780 C VAL A 59 -5.951 6.938 -5.083 1.00 0.00 C ATOM 781 O VAL A 59 -6.400 5.816 -5.316 1.00 0.00 O ATOM 782 CB VAL A 59 -7.591 8.681 -4.378 1.00 0.00 C ATOM 783 CG1 VAL A 59 -7.044 9.760 -5.300 1.00 0.00 C ATOM 784 CG2 VAL A 59 -8.681 7.878 -5.072 1.00 0.00 C ATOM 0 H VAL A 59 -5.560 9.509 -3.189 1.00 0.00 H new ATOM 0 HA VAL A 59 -6.850 7.078 -3.138 1.00 0.00 H new ATOM 0 HB VAL A 59 -8.029 9.169 -3.507 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -7.859 10.406 -5.628 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -6.303 10.354 -4.765 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -6.578 9.295 -6.169 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -9.473 8.550 -5.403 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -8.259 7.361 -5.934 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -9.093 7.147 -4.377 1.00 0.00 H new ATOM 794 N ALA A 60 -5.011 7.508 -5.829 1.00 0.00 N ATOM 795 CA ALA A 60 -4.439 6.834 -6.988 1.00 0.00 C ATOM 796 C ALA A 60 -3.667 5.587 -6.572 1.00 0.00 C ATOM 797 O ALA A 60 -3.684 4.572 -7.269 1.00 0.00 O ATOM 798 CB ALA A 60 -3.534 7.784 -7.759 1.00 0.00 C ATOM 0 H ALA A 60 -4.629 8.437 -5.651 1.00 0.00 H new ATOM 0 HA ALA A 60 -5.258 6.524 -7.637 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -3.114 7.267 -8.622 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -4.113 8.643 -8.098 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -2.726 8.123 -7.111 1.00 0.00 H new ATOM 804 N ALA A 61 -2.990 5.668 -5.431 1.00 0.00 N ATOM 805 CA ALA A 61 -2.213 4.545 -4.920 1.00 0.00 C ATOM 806 C ALA A 61 -3.113 3.518 -4.242 1.00 0.00 C ATOM 807 O ALA A 61 -2.909 2.312 -4.380 1.00 0.00 O ATOM 808 CB ALA A 61 -1.147 5.038 -3.953 1.00 0.00 C ATOM 0 H ALA A 61 -2.964 6.501 -4.842 1.00 0.00 H new ATOM 0 HA ALA A 61 -1.724 4.058 -5.764 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -0.574 4.189 -3.579 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -0.479 5.728 -4.469 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -1.623 5.551 -3.117 1.00 0.00 H new ATOM 814 N ALA A 62 -4.108 4.004 -3.508 1.00 0.00 N ATOM 815 CA ALA A 62 -5.041 3.128 -2.809 1.00 0.00 C ATOM 816 C ALA A 62 -5.658 2.110 -3.762 1.00 0.00 C ATOM 817 O ALA A 62 -5.754 0.926 -3.442 1.00 0.00 O ATOM 818 CB ALA A 62 -6.129 3.947 -2.132 1.00 0.00 C ATOM 0 H ALA A 62 -4.289 5.000 -3.382 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.485 2.582 -2.046 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -6.818 3.280 -1.614 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -5.676 4.630 -1.413 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -6.674 4.519 -2.883 1.00 0.00 H new ATOM 824 N ALA A 63 -6.073 2.579 -4.934 1.00 0.00 N ATOM 825 CA ALA A 63 -6.680 1.710 -5.934 1.00 0.00 C ATOM 826 C ALA A 63 -5.748 0.559 -6.298 1.00 0.00 C ATOM 827 O ALA A 63 -6.191 -0.570 -6.509 1.00 0.00 O ATOM 828 CB ALA A 63 -7.045 2.508 -7.176 1.00 0.00 C ATOM 0 H ALA A 63 -6.000 3.557 -5.214 1.00 0.00 H new ATOM 0 HA ALA A 63 -7.590 1.287 -5.508 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -7.497 1.846 -7.914 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.754 3.292 -6.909 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -6.146 2.959 -7.596 1.00 0.00 H new ATOM 834 N LYS A 64 -4.454 0.851 -6.370 1.00 0.00 N ATOM 835 CA LYS A 64 -3.459 -0.158 -6.709 1.00 0.00 C ATOM 836 C LYS A 64 -3.367 -1.220 -5.616 1.00 0.00 C ATOM 837 O LYS A 64 -3.377 -2.418 -5.898 1.00 0.00 O ATOM 838 CB LYS A 64 -2.090 0.494 -6.916 1.00 0.00 C ATOM 839 CG LYS A 64 -0.950 -0.505 -7.026 1.00 0.00 C ATOM 840 CD LYS A 64 -1.210 -1.531 -8.116 1.00 0.00 C ATOM 841 CE LYS A 64 0.014 -1.734 -8.993 1.00 0.00 C ATOM 842 NZ LYS A 64 0.435 -0.471 -9.659 1.00 0.00 N ATOM 0 H LYS A 64 -4.070 1.780 -6.198 1.00 0.00 H new ATOM 0 HA LYS A 64 -3.769 -0.640 -7.636 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -2.119 1.100 -7.821 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -1.890 1.171 -6.085 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -0.021 0.024 -7.237 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -0.817 -1.013 -6.071 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -1.496 -2.480 -7.663 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -2.049 -1.206 -8.731 1.00 0.00 H new ATOM 0 HE2 LYS A 64 0.835 -2.116 -8.387 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -0.202 -2.489 -9.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 0.868 -0.691 -10.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -0.395 0.138 -9.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 1.127 0.023 -9.060 1.00 0.00 H new ATOM 852 N VAL A 65 -3.280 -0.771 -4.368 1.00 0.00 N ATOM 853 CA VAL A 65 -3.190 -1.682 -3.233 1.00 0.00 C ATOM 854 C VAL A 65 -4.417 -2.583 -3.152 1.00 0.00 C ATOM 855 O VAL A 65 -4.300 -3.792 -2.964 1.00 0.00 O ATOM 856 CB VAL A 65 -3.042 -0.913 -1.907 1.00 0.00 C ATOM 857 CG1 VAL A 65 -2.739 -1.872 -0.765 1.00 0.00 C ATOM 858 CG2 VAL A 65 -1.959 0.149 -2.024 1.00 0.00 C ATOM 0 H VAL A 65 -3.270 0.218 -4.117 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.303 -2.296 -3.389 1.00 0.00 H new ATOM 0 HB VAL A 65 -3.986 -0.413 -1.690 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -2.638 -1.311 0.164 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -3.553 -2.591 -0.668 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -1.809 -2.402 -0.972 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -1.869 0.682 -1.078 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -1.008 -0.326 -2.265 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -2.223 0.853 -2.813 1.00 0.00 H new ATOM 868 N ASN A 66 -5.594 -1.984 -3.297 1.00 0.00 N ATOM 869 CA ASN A 66 -6.845 -2.731 -3.240 1.00 0.00 C ATOM 870 C ASN A 66 -6.911 -3.767 -4.359 1.00 0.00 C ATOM 871 O ASN A 66 -7.195 -4.941 -4.119 1.00 0.00 O ATOM 872 CB ASN A 66 -8.038 -1.779 -3.340 1.00 0.00 C ATOM 873 CG ASN A 66 -9.267 -2.450 -3.920 1.00 0.00 C ATOM 874 OD1 ASN A 66 -9.383 -2.433 -5.243 1.00 0.00 O flip ATOM 875 ND2 ASN A 66 -10.103 -2.981 -3.187 1.00 0.00 N flip ATOM 0 H ASN A 66 -5.708 -0.983 -3.455 1.00 0.00 H new ATOM 0 HA ASN A 66 -6.885 -3.252 -2.283 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -8.273 -1.391 -2.349 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -7.767 -0.925 -3.961 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -9.974 -2.971 -2.175 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -10.924 -3.431 -3.592 1.00 0.00 H new ATOM 881 N THR A 67 -6.645 -3.323 -5.584 1.00 0.00 N ATOM 882 CA THR A 67 -6.675 -4.210 -6.740 1.00 0.00 C ATOM 883 C THR A 67 -5.770 -5.418 -6.531 1.00 0.00 C ATOM 884 O THR A 67 -6.162 -6.555 -6.795 1.00 0.00 O ATOM 885 CB THR A 67 -6.242 -3.475 -8.023 1.00 0.00 C ATOM 886 OG1 THR A 67 -7.137 -2.389 -8.292 1.00 0.00 O ATOM 887 CG2 THR A 67 -6.219 -4.426 -9.210 1.00 0.00 C ATOM 0 H THR A 67 -6.407 -2.355 -5.801 1.00 0.00 H new ATOM 0 HA THR A 67 -7.705 -4.547 -6.852 1.00 0.00 H new ATOM 0 HB THR A 67 -5.235 -3.086 -7.870 1.00 0.00 H new ATOM 0 HG1 THR A 67 -6.919 -1.633 -7.708 1.00 0.00 H new ATOM 0 HG21 THR A 67 -5.910 -3.884 -10.104 1.00 0.00 H new ATOM 0 HG22 THR A 67 -5.515 -5.235 -9.015 1.00 0.00 H new ATOM 0 HG23 THR A 67 -7.215 -4.841 -9.363 1.00 0.00 H new ATOM 895 N LEU A 68 -4.556 -5.166 -6.052 1.00 0.00 N ATOM 896 CA LEU A 68 -3.594 -6.234 -5.805 1.00 0.00 C ATOM 897 C LEU A 68 -4.138 -7.233 -4.788 1.00 0.00 C ATOM 898 O LEU A 68 -4.038 -8.445 -4.978 1.00 0.00 O ATOM 899 CB LEU A 68 -2.271 -5.650 -5.306 1.00 0.00 C ATOM 900 CG LEU A 68 -1.473 -4.833 -6.321 1.00 0.00 C ATOM 901 CD1 LEU A 68 -0.442 -3.965 -5.616 1.00 0.00 C ATOM 902 CD2 LEU A 68 -0.799 -5.749 -7.332 1.00 0.00 C ATOM 0 H LEU A 68 -4.215 -4.231 -5.827 1.00 0.00 H new ATOM 0 HA LEU A 68 -3.421 -6.758 -6.745 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -2.479 -5.017 -4.443 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.644 -6.470 -4.956 1.00 0.00 H new ATOM 0 HG LEU A 68 -2.163 -4.180 -6.855 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.117 -3.391 -6.355 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -0.947 -3.283 -4.932 1.00 0.00 H new ATOM 0 HD13 LEU A 68 0.245 -4.599 -5.055 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.235 -5.150 -8.047 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.122 -6.427 -6.813 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -1.557 -6.327 -7.861 1.00 0.00 H new ATOM 913 N LEU A 69 -4.717 -6.716 -3.710 1.00 0.00 N ATOM 914 CA LEU A 69 -5.281 -7.563 -2.664 1.00 0.00 C ATOM 915 C LEU A 69 -6.335 -8.505 -3.235 1.00 0.00 C ATOM 916 O LEU A 69 -6.269 -9.719 -3.037 1.00 0.00 O ATOM 917 CB LEU A 69 -5.895 -6.701 -1.560 1.00 0.00 C ATOM 918 CG LEU A 69 -5.231 -6.798 -0.186 1.00 0.00 C ATOM 919 CD1 LEU A 69 -5.936 -5.892 0.812 1.00 0.00 C ATOM 920 CD2 LEU A 69 -5.229 -8.237 0.306 1.00 0.00 C ATOM 0 H LEU A 69 -4.808 -5.715 -3.537 1.00 0.00 H new ATOM 0 HA LEU A 69 -4.475 -8.163 -2.242 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -5.868 -5.660 -1.882 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -6.945 -6.975 -1.454 1.00 0.00 H new ATOM 0 HG LEU A 69 -4.197 -6.467 -0.280 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -5.450 -5.974 1.784 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -5.884 -4.860 0.466 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -6.980 -6.192 0.902 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -4.752 -8.286 1.285 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -6.255 -8.596 0.383 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.678 -8.861 -0.397 1.00 0.00 H new ATOM 931 N ASP A 70 -7.304 -7.939 -3.946 1.00 0.00 N ATOM 932 CA ASP A 70 -8.371 -8.730 -4.549 1.00 0.00 C ATOM 933 C ASP A 70 -7.798 -9.803 -5.470 1.00 0.00 C ATOM 934 O ASP A 70 -8.166 -10.973 -5.381 1.00 0.00 O ATOM 935 CB ASP A 70 -9.325 -7.826 -5.331 1.00 0.00 C ATOM 936 CG ASP A 70 -10.776 -8.057 -4.959 1.00 0.00 C ATOM 937 OD1 ASP A 70 -11.410 -8.946 -5.566 1.00 0.00 O ATOM 938 OD2 ASP A 70 -11.280 -7.349 -4.061 1.00 0.00 O ATOM 0 H ASP A 70 -7.373 -6.936 -4.119 1.00 0.00 H new ATOM 0 HA ASP A 70 -8.923 -9.221 -3.748 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -9.067 -6.783 -5.146 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -9.194 -8.002 -6.399 1.00 0.00 H new ATOM 942 N VAL A 71 -6.896 -9.394 -6.357 1.00 0.00 N ATOM 943 CA VAL A 71 -6.271 -10.319 -7.295 1.00 0.00 C ATOM 944 C VAL A 71 -5.587 -11.467 -6.561 1.00 0.00 C ATOM 945 O VAL A 71 -5.539 -12.594 -7.057 1.00 0.00 O ATOM 946 CB VAL A 71 -5.237 -9.605 -8.185 1.00 0.00 C ATOM 947 CG1 VAL A 71 -4.576 -10.593 -9.134 1.00 0.00 C ATOM 948 CG2 VAL A 71 -5.894 -8.470 -8.956 1.00 0.00 C ATOM 0 H VAL A 71 -6.582 -8.428 -6.446 1.00 0.00 H new ATOM 0 HA VAL A 71 -7.067 -10.716 -7.925 1.00 0.00 H new ATOM 0 HB VAL A 71 -4.463 -9.180 -7.546 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.848 -10.070 -9.755 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -4.071 -11.368 -8.558 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -5.334 -11.049 -9.770 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -5.150 -7.976 -9.580 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -6.688 -8.870 -9.586 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -6.316 -7.750 -8.255 1.00 0.00 H new ATOM 958 N ALA A 72 -5.059 -11.175 -5.377 1.00 0.00 N ATOM 959 CA ALA A 72 -4.379 -12.183 -4.573 1.00 0.00 C ATOM 960 C ALA A 72 -5.331 -13.311 -4.188 1.00 0.00 C ATOM 961 O ALA A 72 -5.005 -14.488 -4.340 1.00 0.00 O ATOM 962 CB ALA A 72 -3.778 -11.548 -3.328 1.00 0.00 C ATOM 0 H ALA A 72 -5.089 -10.248 -4.953 1.00 0.00 H new ATOM 0 HA ALA A 72 -3.575 -12.610 -5.173 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -3.273 -12.312 -2.737 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -3.059 -10.782 -3.621 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -4.570 -11.093 -2.733 1.00 0.00 H new ATOM 968 N GLN A 73 -6.506 -12.943 -3.688 1.00 0.00 N ATOM 969 CA GLN A 73 -7.503 -13.925 -3.280 1.00 0.00 C ATOM 970 C GLN A 73 -8.089 -14.642 -4.492 1.00 0.00 C ATOM 971 O GLN A 73 -8.391 -15.834 -4.434 1.00 0.00 O ATOM 972 CB GLN A 73 -8.621 -13.248 -2.484 1.00 0.00 C ATOM 973 CG GLN A 73 -8.126 -12.503 -1.255 1.00 0.00 C ATOM 974 CD GLN A 73 -9.251 -11.847 -0.479 1.00 0.00 C ATOM 975 OE1 GLN A 73 -9.947 -10.971 -0.993 1.00 0.00 O ATOM 976 NE2 GLN A 73 -9.435 -12.269 0.767 1.00 0.00 N ATOM 0 H GLN A 73 -6.791 -11.972 -3.556 1.00 0.00 H new ATOM 0 HA GLN A 73 -7.011 -14.663 -2.647 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -9.148 -12.550 -3.135 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -9.344 -14.003 -2.175 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -7.596 -13.197 -0.603 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -7.408 -11.742 -1.561 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -8.834 -12.998 1.153 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -10.177 -11.864 1.338 1.00 0.00 H new ATOM 983 N ALA A 74 -8.246 -13.908 -5.589 1.00 0.00 N ATOM 984 CA ALA A 74 -8.794 -14.474 -6.816 1.00 0.00 C ATOM 985 C ALA A 74 -7.809 -15.443 -7.460 1.00 0.00 C ATOM 986 O ALA A 74 -8.209 -16.432 -8.075 1.00 0.00 O ATOM 987 CB ALA A 74 -9.162 -13.366 -7.790 1.00 0.00 C ATOM 0 H ALA A 74 -8.001 -12.920 -5.653 1.00 0.00 H new ATOM 0 HA ALA A 74 -9.696 -15.030 -6.560 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.570 -13.803 -8.701 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.908 -12.714 -7.335 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.272 -12.785 -8.033 1.00 0.00 H new ATOM 993 N ASN A 75 -6.520 -15.153 -7.316 1.00 0.00 N ATOM 994 CA ASN A 75 -5.478 -16.000 -7.887 1.00 0.00 C ATOM 995 C ASN A 75 -5.227 -17.220 -7.007 1.00 0.00 C ATOM 996 O ASN A 75 -5.040 -18.331 -7.505 1.00 0.00 O ATOM 997 CB ASN A 75 -4.182 -15.203 -8.057 1.00 0.00 C ATOM 998 CG ASN A 75 -4.130 -14.459 -9.377 1.00 0.00 C ATOM 999 OD1 ASN A 75 -5.091 -13.569 -9.593 1.00 0.00 O flip ATOM 1000 ND2 ASN A 75 -3.236 -14.682 -10.193 1.00 0.00 N flip ATOM 0 H ASN A 75 -6.172 -14.339 -6.809 1.00 0.00 H new ATOM 0 HA ASN A 75 -5.817 -16.343 -8.865 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -4.087 -14.491 -7.238 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -3.331 -15.881 -7.991 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -2.517 -15.375 -9.985 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -3.214 -14.174 -11.077 1.00 0.00 H new ATOM 1006 N LEU A 76 -5.223 -17.007 -5.695 1.00 0.00 N ATOM 1007 CA LEU A 76 -4.996 -18.089 -4.745 1.00 0.00 C ATOM 1008 C LEU A 76 -6.219 -18.995 -4.648 1.00 0.00 C ATOM 1009 O LEU A 76 -6.097 -20.198 -4.415 1.00 0.00 O ATOM 1010 CB LEU A 76 -4.657 -17.521 -3.366 1.00 0.00 C ATOM 1011 CG LEU A 76 -3.317 -16.795 -3.250 1.00 0.00 C ATOM 1012 CD1 LEU A 76 -3.170 -16.160 -1.875 1.00 0.00 C ATOM 1013 CD2 LEU A 76 -2.166 -17.754 -3.521 1.00 0.00 C ATOM 0 H LEU A 76 -5.375 -16.094 -5.266 1.00 0.00 H new ATOM 0 HA LEU A 76 -4.155 -18.683 -5.103 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -5.448 -16.830 -3.075 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -4.668 -18.339 -2.646 1.00 0.00 H new ATOM 0 HG LEU A 76 -3.289 -16.003 -3.998 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -2.210 -15.648 -1.812 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -3.975 -15.442 -1.718 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -3.219 -16.934 -1.109 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -1.220 -17.220 -3.434 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -2.192 -18.567 -2.796 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -2.262 -18.162 -4.527 1.00 0.00 H new ATOM 1024 N GLY A 77 -7.398 -18.409 -4.830 1.00 0.00 N ATOM 1025 CA GLY A 77 -8.627 -19.179 -4.761 1.00 0.00 C ATOM 1026 C GLY A 77 -9.025 -19.511 -3.337 1.00 0.00 C ATOM 1027 O GLY A 77 -10.016 -18.990 -2.825 1.00 0.00 O ATOM 0 H GLY A 77 -7.525 -17.416 -5.024 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -9.431 -18.618 -5.238 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -8.505 -20.103 -5.326 1.00 0.00 H new ATOM 1031 N GLU A 78 -8.251 -20.381 -2.695 1.00 0.00 N ATOM 1032 CA GLU A 78 -8.531 -20.783 -1.321 1.00 0.00 C ATOM 1033 C GLU A 78 -8.664 -19.563 -0.414 1.00 0.00 C ATOM 1034 O GLU A 78 -9.428 -19.575 0.551 1.00 0.00 O ATOM 1035 CB GLU A 78 -7.423 -21.701 -0.800 1.00 0.00 C ATOM 1036 CG GLU A 78 -7.931 -22.820 0.095 1.00 0.00 C ATOM 1037 CD GLU A 78 -6.852 -23.830 0.435 1.00 0.00 C ATOM 1038 OE1 GLU A 78 -5.835 -23.879 -0.288 1.00 0.00 O ATOM 1039 OE2 GLU A 78 -7.026 -24.571 1.425 1.00 0.00 O ATOM 0 H GLU A 78 -7.426 -20.820 -3.104 1.00 0.00 H new ATOM 0 HA GLU A 78 -9.477 -21.325 -1.313 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -6.895 -22.137 -1.648 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -6.699 -21.104 -0.246 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -8.326 -22.392 1.016 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -8.757 -23.330 -0.400 1.00 0.00 H new ATOM 1044 N ALA A 79 -7.915 -18.512 -0.731 1.00 0.00 N ATOM 1045 CA ALA A 79 -7.949 -17.284 0.053 1.00 0.00 C ATOM 1046 C ALA A 79 -9.350 -16.680 0.066 1.00 0.00 C ATOM 1047 O ALA A 79 -9.868 -16.314 1.120 1.00 0.00 O ATOM 1048 CB ALA A 79 -6.945 -16.280 -0.492 1.00 0.00 C ATOM 0 H ALA A 79 -7.277 -18.487 -1.526 1.00 0.00 H new ATOM 0 HA ALA A 79 -7.678 -17.531 1.079 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -6.982 -15.368 0.104 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -5.942 -16.705 -0.443 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -7.190 -16.046 -1.528 1.00 0.00 H new ATOM 1054 N ALA A 80 -9.957 -16.580 -1.112 1.00 0.00 N ATOM 1055 CA ALA A 80 -11.297 -16.021 -1.235 1.00 0.00 C ATOM 1056 C ALA A 80 -12.359 -17.066 -0.906 1.00 0.00 C ATOM 1057 O ALA A 80 -12.047 -18.146 -0.407 1.00 0.00 O ATOM 1058 CB ALA A 80 -11.513 -15.472 -2.638 1.00 0.00 C ATOM 0 H ALA A 80 -9.542 -16.879 -1.994 1.00 0.00 H new ATOM 0 HA ALA A 80 -11.391 -15.205 -0.518 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -12.518 -15.058 -2.716 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -10.781 -14.690 -2.839 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -11.395 -16.275 -3.365 1.00 0.00 H new ATOM 1064 N GLY A 81 -13.616 -16.734 -1.186 1.00 0.00 N ATOM 1065 CA GLY A 81 -14.704 -17.653 -0.911 1.00 0.00 C ATOM 1066 C GLY A 81 -15.792 -17.597 -1.966 1.00 0.00 C ATOM 1067 O GLY A 81 -16.299 -18.631 -2.402 1.00 0.00 O ATOM 0 H GLY A 81 -13.900 -15.845 -1.598 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -14.312 -18.668 -0.852 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -15.134 -17.420 0.063 1.00 0.00 H new ATOM 1071 N THR A 82 -16.152 -16.385 -2.378 1.00 0.00 N ATOM 1072 CA THR A 82 -17.188 -16.199 -3.386 1.00 0.00 C ATOM 1073 C THR A 82 -16.864 -15.017 -4.294 1.00 0.00 C ATOM 1074 O THR A 82 -16.708 -13.889 -3.828 1.00 0.00 O ATOM 1075 CB THR A 82 -18.567 -15.971 -2.738 1.00 0.00 C ATOM 1076 OG1 THR A 82 -18.851 -17.021 -1.808 1.00 0.00 O ATOM 1077 CG2 THR A 82 -19.658 -15.914 -3.796 1.00 0.00 C ATOM 0 H THR A 82 -15.742 -15.519 -2.029 1.00 0.00 H new ATOM 0 HA THR A 82 -17.220 -17.112 -3.980 1.00 0.00 H new ATOM 0 HB THR A 82 -18.544 -15.017 -2.211 1.00 0.00 H new ATOM 0 HG1 THR A 82 -19.729 -16.868 -1.399 1.00 0.00 H new ATOM 0 HG21 THR A 82 -20.623 -15.752 -3.315 1.00 0.00 H new ATOM 0 HG22 THR A 82 -19.454 -15.094 -4.485 1.00 0.00 H new ATOM 0 HG23 THR A 82 -19.680 -16.854 -4.347 1.00 0.00 H new ATOM 1085 N TYR A 83 -16.765 -15.285 -5.591 1.00 0.00 N ATOM 1086 CA TYR A 83 -16.458 -14.243 -6.564 1.00 0.00 C ATOM 1087 C TYR A 83 -17.730 -13.545 -7.034 1.00 0.00 C ATOM 1088 O TYR A 83 -18.827 -13.851 -6.571 1.00 0.00 O ATOM 1089 CB TYR A 83 -15.717 -14.839 -7.763 1.00 0.00 C ATOM 1090 CG TYR A 83 -16.541 -15.832 -8.551 1.00 0.00 C ATOM 1091 CD1 TYR A 83 -17.400 -15.407 -9.558 1.00 0.00 C ATOM 1092 CD2 TYR A 83 -16.462 -17.194 -8.289 1.00 0.00 C ATOM 1093 CE1 TYR A 83 -18.155 -16.312 -10.281 1.00 0.00 C ATOM 1094 CE2 TYR A 83 -17.212 -18.104 -9.007 1.00 0.00 C ATOM 1095 CZ TYR A 83 -18.058 -17.658 -10.002 1.00 0.00 C ATOM 1096 OH TYR A 83 -18.807 -18.561 -10.720 1.00 0.00 O ATOM 0 H TYR A 83 -16.893 -16.214 -5.993 1.00 0.00 H new ATOM 0 HA TYR A 83 -15.818 -13.505 -6.079 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -15.406 -14.031 -8.425 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -14.810 -15.330 -7.411 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -17.479 -14.353 -9.779 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -15.802 -17.547 -7.510 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -18.817 -15.966 -11.061 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -17.137 -19.160 -8.791 1.00 0.00 H new ATOM 0 HH TYR A 83 -18.621 -19.468 -10.400 1.00 0.00 H new ATOM 1105 N VAL A 84 -17.572 -12.602 -7.959 1.00 0.00 N ATOM 1106 CA VAL A 84 -18.707 -11.859 -8.494 1.00 0.00 C ATOM 1107 C VAL A 84 -19.428 -12.660 -9.572 1.00 0.00 C ATOM 1108 O VAL A 84 -19.174 -12.485 -10.763 1.00 0.00 O ATOM 1109 CB VAL A 84 -18.264 -10.507 -9.083 1.00 0.00 C ATOM 1110 CG1 VAL A 84 -19.459 -9.756 -9.653 1.00 0.00 C ATOM 1111 CG2 VAL A 84 -17.556 -9.673 -8.027 1.00 0.00 C ATOM 0 H VAL A 84 -16.670 -12.335 -8.353 1.00 0.00 H new ATOM 0 HA VAL A 84 -19.389 -11.679 -7.663 1.00 0.00 H new ATOM 0 HB VAL A 84 -17.562 -10.696 -9.895 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -19.127 -8.803 -10.065 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -19.920 -10.351 -10.441 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -20.187 -9.576 -8.862 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -17.250 -8.721 -8.460 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -18.233 -9.491 -7.193 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -16.676 -10.209 -7.670 1.00 0.00 H new ATOM 1121 N ALA A 85 -20.329 -13.539 -9.146 1.00 0.00 N ATOM 1122 CA ALA A 85 -21.089 -14.365 -10.076 1.00 0.00 C ATOM 1123 C ALA A 85 -22.227 -13.572 -10.711 1.00 0.00 C ATOM 1124 O ALA A 85 -23.396 -13.931 -10.579 1.00 0.00 O ATOM 1125 CB ALA A 85 -21.634 -15.595 -9.365 1.00 0.00 C ATOM 0 H ALA A 85 -20.550 -13.697 -8.163 1.00 0.00 H new ATOM 0 HA ALA A 85 -20.416 -14.686 -10.871 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -22.199 -16.203 -10.071 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -20.806 -16.180 -8.964 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -22.287 -15.284 -8.550 1.00 0.00 H new ATOM 1131 N ALA A 86 -21.876 -12.491 -11.400 1.00 0.00 N ATOM 1132 CA ALA A 86 -22.868 -11.647 -12.055 1.00 0.00 C ATOM 1133 C ALA A 86 -22.727 -11.714 -13.573 1.00 0.00 C ATOM 1134 O ALA A 86 -23.699 -11.525 -14.304 1.00 0.00 O ATOM 1135 CB ALA A 86 -22.740 -10.211 -11.573 1.00 0.00 C ATOM 0 H ALA A 86 -20.912 -12.179 -11.519 1.00 0.00 H new ATOM 0 HA ALA A 86 -23.858 -12.019 -11.791 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -23.487 -9.592 -12.070 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -22.897 -10.174 -10.495 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -21.744 -9.836 -11.807 1.00 0.00 H new ATOM 1141 N ASP A 87 -21.512 -11.982 -14.037 1.00 0.00 N ATOM 1142 CA ASP A 87 -21.244 -12.073 -15.469 1.00 0.00 C ATOM 1143 C ASP A 87 -21.498 -10.734 -16.155 1.00 0.00 C ATOM 1144 O ASP A 87 -21.875 -9.756 -15.510 1.00 0.00 O ATOM 1145 CB ASP A 87 -22.114 -13.158 -16.104 1.00 0.00 C ATOM 1146 CG ASP A 87 -22.133 -14.436 -15.288 1.00 0.00 C ATOM 1147 OD1 ASP A 87 -21.057 -14.847 -14.805 1.00 0.00 O ATOM 1148 OD2 ASP A 87 -23.223 -15.025 -15.133 1.00 0.00 O ATOM 0 H ASP A 87 -20.697 -12.140 -13.444 1.00 0.00 H new ATOM 0 HA ASP A 87 -20.195 -12.336 -15.602 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -23.132 -12.785 -16.214 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -21.745 -13.376 -17.106 1.00 0.00 H new ATOM 1152 N ALA A 88 -21.287 -10.699 -17.467 1.00 0.00 N ATOM 1153 CA ALA A 88 -21.493 -9.480 -18.241 1.00 0.00 C ATOM 1154 C ALA A 88 -22.965 -9.297 -18.593 1.00 0.00 C ATOM 1155 O ALA A 88 -23.730 -10.261 -18.628 1.00 0.00 O ATOM 1156 CB ALA A 88 -20.646 -9.508 -19.504 1.00 0.00 C ATOM 0 H ALA A 88 -20.974 -11.500 -18.016 1.00 0.00 H new ATOM 0 HA ALA A 88 -21.184 -8.633 -17.629 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -20.810 -8.592 -20.072 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -19.593 -9.584 -19.234 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -20.928 -10.367 -20.112 1.00 0.00 H new ATOM 1162 N ALA A 89 -23.357 -8.053 -18.852 1.00 0.00 N ATOM 1163 CA ALA A 89 -24.737 -7.744 -19.202 1.00 0.00 C ATOM 1164 C ALA A 89 -24.964 -7.874 -20.705 1.00 0.00 C ATOM 1165 O ALA A 89 -26.031 -8.301 -21.145 1.00 0.00 O ATOM 1166 CB ALA A 89 -25.100 -6.344 -18.730 1.00 0.00 C ATOM 0 H ALA A 89 -22.737 -7.243 -18.826 1.00 0.00 H new ATOM 0 HA ALA A 89 -25.384 -8.464 -18.700 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -26.134 -6.126 -18.998 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -24.985 -6.284 -17.648 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -24.441 -5.617 -19.206 1.00 0.00 H new ATOM 1172 N ALA A 90 -23.955 -7.502 -21.485 1.00 0.00 N ATOM 1173 CA ALA A 90 -24.044 -7.577 -22.938 1.00 0.00 C ATOM 1174 C ALA A 90 -23.526 -8.917 -23.451 1.00 0.00 C ATOM 1175 O ALA A 90 -23.260 -9.075 -24.642 1.00 0.00 O ATOM 1176 CB ALA A 90 -23.272 -6.432 -23.575 1.00 0.00 C ATOM 0 H ALA A 90 -23.066 -7.145 -21.135 1.00 0.00 H new ATOM 0 HA ALA A 90 -25.094 -7.491 -23.217 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -23.348 -6.501 -24.660 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -23.690 -5.482 -23.242 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -22.224 -6.491 -23.280 1.00 0.00 H new ATOM 1182 N ALA A 91 -23.386 -9.878 -22.544 1.00 0.00 N ATOM 1183 CA ALA A 91 -22.902 -11.204 -22.906 1.00 0.00 C ATOM 1184 C ALA A 91 -23.893 -11.922 -23.814 1.00 0.00 C ATOM 1185 O ALA A 91 -23.566 -12.278 -24.946 1.00 0.00 O ATOM 1186 CB ALA A 91 -22.637 -12.028 -21.654 1.00 0.00 C ATOM 0 H ALA A 91 -23.601 -9.763 -21.554 1.00 0.00 H new ATOM 0 HA ALA A 91 -21.968 -11.085 -23.455 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -22.276 -13.016 -21.939 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -21.885 -11.529 -21.042 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -23.560 -12.129 -21.083 1.00 0.00 H new ATOM 1192 N SER A 92 -25.105 -12.134 -23.311 1.00 0.00 N ATOM 1193 CA SER A 92 -26.143 -12.813 -24.076 1.00 0.00 C ATOM 1194 C SER A 92 -26.339 -12.149 -25.436 1.00 0.00 C ATOM 1195 O SER A 92 -25.815 -11.064 -25.692 1.00 0.00 O ATOM 1196 CB SER A 92 -27.462 -12.811 -23.301 1.00 0.00 C ATOM 1197 OG SER A 92 -27.251 -13.117 -21.933 1.00 0.00 O ATOM 0 H SER A 92 -25.392 -11.845 -22.376 1.00 0.00 H new ATOM 0 HA SER A 92 -25.825 -13.843 -24.236 1.00 0.00 H new ATOM 0 HB2 SER A 92 -27.938 -11.834 -23.389 1.00 0.00 H new ATOM 0 HB3 SER A 92 -28.145 -13.539 -23.738 1.00 0.00 H new ATOM 0 HG SER A 92 -28.109 -13.108 -21.460 1.00 0.00 H new ATOM 1202 N THR A 93 -27.097 -12.810 -26.306 1.00 0.00 N ATOM 1203 CA THR A 93 -27.362 -12.286 -27.641 1.00 0.00 C ATOM 1204 C THR A 93 -28.642 -11.459 -27.663 1.00 0.00 C ATOM 1205 O THR A 93 -29.427 -11.486 -26.714 1.00 0.00 O ATOM 1206 CB THR A 93 -27.479 -13.419 -28.676 1.00 0.00 C ATOM 1207 OG1 THR A 93 -27.871 -14.635 -28.029 1.00 0.00 O ATOM 1208 CG2 THR A 93 -26.157 -13.629 -29.400 1.00 0.00 C ATOM 0 H THR A 93 -27.538 -13.709 -26.110 1.00 0.00 H new ATOM 0 HA THR A 93 -26.517 -11.650 -27.904 1.00 0.00 H new ATOM 0 HB THR A 93 -28.236 -13.136 -29.408 1.00 0.00 H new ATOM 0 HG1 THR A 93 -27.945 -15.351 -28.695 1.00 0.00 H new ATOM 0 HG21 THR A 93 -26.264 -14.435 -30.126 1.00 0.00 H new ATOM 0 HG22 THR A 93 -25.874 -12.711 -29.915 1.00 0.00 H new ATOM 0 HG23 THR A 93 -25.384 -13.892 -28.678 1.00 0.00 H new ATOM 1216 N TYR A 94 -28.848 -10.725 -28.750 1.00 0.00 N ATOM 1217 CA TYR A 94 -30.034 -9.889 -28.895 1.00 0.00 C ATOM 1218 C TYR A 94 -31.299 -10.740 -28.942 1.00 0.00 C ATOM 1219 O TYR A 94 -31.247 -11.961 -28.787 1.00 0.00 O ATOM 1220 CB TYR A 94 -29.931 -9.037 -30.161 1.00 0.00 C ATOM 1221 CG TYR A 94 -29.908 -9.848 -31.436 1.00 0.00 C ATOM 1222 CD1 TYR A 94 -31.088 -10.225 -32.064 1.00 0.00 C ATOM 1223 CD2 TYR A 94 -28.705 -10.236 -32.014 1.00 0.00 C ATOM 1224 CE1 TYR A 94 -31.072 -10.967 -33.230 1.00 0.00 C ATOM 1225 CE2 TYR A 94 -28.679 -10.977 -33.180 1.00 0.00 C ATOM 1226 CZ TYR A 94 -29.865 -11.340 -33.783 1.00 0.00 C ATOM 1227 OH TYR A 94 -29.844 -12.078 -34.945 1.00 0.00 O ATOM 0 H TYR A 94 -28.209 -10.692 -29.544 1.00 0.00 H new ATOM 0 HA TYR A 94 -30.093 -9.232 -28.027 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -30.774 -8.347 -30.194 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -29.026 -8.432 -30.109 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -32.035 -9.933 -31.634 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -27.775 -9.954 -31.544 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -31.999 -11.253 -33.705 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -27.736 -11.270 -33.616 1.00 0.00 H new ATOM 0 HH TYR A 94 -28.915 -12.257 -35.202 1.00 0.00 H new ATOM 1236 N THR A 95 -32.436 -10.087 -29.159 1.00 0.00 N ATOM 1237 CA THR A 95 -33.716 -10.783 -29.227 1.00 0.00 C ATOM 1238 C THR A 95 -34.780 -9.911 -29.885 1.00 0.00 C ATOM 1239 O THR A 95 -34.480 -8.846 -30.420 1.00 0.00 O ATOM 1240 CB THR A 95 -34.204 -11.200 -27.827 1.00 0.00 C ATOM 1241 OG1 THR A 95 -35.255 -12.165 -27.943 1.00 0.00 O ATOM 1242 CG2 THR A 95 -34.698 -9.993 -27.044 1.00 0.00 C ATOM 0 H THR A 95 -32.497 -9.077 -29.291 1.00 0.00 H new ATOM 0 HA THR A 95 -33.558 -11.678 -29.829 1.00 0.00 H new ATOM 0 HB THR A 95 -33.365 -11.641 -27.289 1.00 0.00 H new ATOM 0 HG1 THR A 95 -36.076 -11.803 -27.549 1.00 0.00 H new ATOM 0 HG21 THR A 95 -35.037 -10.313 -26.059 1.00 0.00 H new ATOM 0 HG22 THR A 95 -33.886 -9.274 -26.933 1.00 0.00 H new ATOM 0 HG23 THR A 95 -35.525 -9.526 -27.579 1.00 0.00 H new ATOM 1250 N GLY A 96 -36.026 -10.373 -29.839 1.00 0.00 N ATOM 1251 CA GLY A 96 -37.117 -9.621 -30.434 1.00 0.00 C ATOM 1252 C GLY A 96 -37.408 -10.054 -31.857 1.00 0.00 C ATOM 1253 O GLY A 96 -37.842 -9.248 -32.681 1.00 0.00 O ATOM 0 H GLY A 96 -36.300 -11.253 -29.401 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -38.014 -9.747 -29.828 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -36.871 -8.559 -30.423 1.00 0.00 H new ATOM 1257 N PHE A 97 -37.170 -11.328 -32.148 1.00 0.00 N ATOM 1258 CA PHE A 97 -37.408 -11.865 -33.483 1.00 0.00 C ATOM 1259 C PHE A 97 -37.330 -13.389 -33.479 1.00 0.00 C ATOM 1260 O PHE A 97 -36.233 -13.937 -33.572 1.00 0.00 O ATOM 1261 CB PHE A 97 -36.390 -11.294 -34.473 1.00 0.00 C ATOM 1262 CG PHE A 97 -36.849 -11.348 -35.903 1.00 0.00 C ATOM 1263 CD1 PHE A 97 -36.660 -12.491 -36.663 1.00 0.00 C ATOM 1264 CD2 PHE A 97 -37.473 -10.256 -36.485 1.00 0.00 C ATOM 1265 CE1 PHE A 97 -37.081 -12.543 -37.978 1.00 0.00 C ATOM 1266 CE2 PHE A 97 -37.896 -10.302 -37.801 1.00 0.00 C ATOM 1267 CZ PHE A 97 -37.701 -11.448 -38.547 1.00 0.00 C ATOM 0 H PHE A 97 -36.812 -12.008 -31.477 1.00 0.00 H new ATOM 0 HA PHE A 97 -38.411 -11.571 -33.792 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -36.178 -10.259 -34.207 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -35.455 -11.846 -34.379 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -36.178 -13.351 -36.222 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -37.631 -9.359 -35.904 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -36.925 -13.439 -38.560 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -38.378 -9.443 -38.245 1.00 0.00 H new ATOM 0 HZ PHE A 97 -38.033 -11.488 -39.574 1.00 0.00 H new TER 1276 PHE A 97 ATOM 1277 N SER B 601 -2.050 29.249 -10.547 1.00 0.00 N ATOM 1278 CA SER B 601 -0.933 28.349 -10.813 1.00 0.00 C ATOM 1279 C SER B 601 0.323 28.811 -10.081 1.00 0.00 C ATOM 1280 O SER B 601 1.201 29.440 -10.670 1.00 0.00 O ATOM 1281 CB SER B 601 -0.662 28.268 -12.316 1.00 0.00 C ATOM 1282 OG SER B 601 -0.497 29.560 -12.874 1.00 0.00 O ATOM 0 HA SER B 601 -1.202 27.358 -10.447 1.00 0.00 H new ATOM 0 HB2 SER B 601 0.234 27.674 -12.496 1.00 0.00 H new ATOM 0 HB3 SER B 601 -1.488 27.757 -12.811 1.00 0.00 H new ATOM 0 HG SER B 601 0.204 30.040 -12.386 1.00 0.00 H new ATOM 1287 N MET B 602 0.401 28.494 -8.793 1.00 0.00 N ATOM 1288 CA MET B 602 1.549 28.876 -7.980 1.00 0.00 C ATOM 1289 C MET B 602 2.454 27.675 -7.719 1.00 0.00 C ATOM 1290 O MET B 602 2.509 27.159 -6.603 1.00 0.00 O ATOM 1291 CB MET B 602 1.086 29.477 -6.653 1.00 0.00 C ATOM 1292 CG MET B 602 0.941 30.990 -6.688 1.00 0.00 C ATOM 1293 SD MET B 602 -0.687 31.546 -6.147 1.00 0.00 S ATOM 1294 CE MET B 602 -0.605 31.176 -4.395 1.00 0.00 C ATOM 0 H MET B 602 -0.317 27.973 -8.290 1.00 0.00 H new ATOM 0 HA MET B 602 2.118 29.626 -8.530 1.00 0.00 H new ATOM 0 HB2 MET B 602 0.128 29.035 -6.378 1.00 0.00 H new ATOM 0 HB3 MET B 602 1.798 29.206 -5.873 1.00 0.00 H new ATOM 0 HG2 MET B 602 1.704 31.439 -6.052 1.00 0.00 H new ATOM 0 HG3 MET B 602 1.123 31.345 -7.702 1.00 0.00 H new ATOM 0 HE1 MET B 602 -1.542 31.464 -3.918 1.00 0.00 H new ATOM 0 HE2 MET B 602 -0.441 30.107 -4.256 1.00 0.00 H new ATOM 0 HE3 MET B 602 0.217 31.731 -3.944 1.00 0.00 H new ATOM 1302 N SER B 603 3.160 27.235 -8.755 1.00 0.00 N ATOM 1303 CA SER B 603 4.059 26.092 -8.638 1.00 0.00 C ATOM 1304 C SER B 603 5.506 26.512 -8.878 1.00 0.00 C ATOM 1305 O SER B 603 6.437 25.859 -8.408 1.00 0.00 O ATOM 1306 CB SER B 603 3.661 25.001 -9.634 1.00 0.00 C ATOM 1307 OG SER B 603 3.810 25.450 -10.970 1.00 0.00 O ATOM 0 H SER B 603 3.127 27.652 -9.685 1.00 0.00 H new ATOM 0 HA SER B 603 3.977 25.698 -7.625 1.00 0.00 H new ATOM 0 HB2 SER B 603 4.277 24.116 -9.474 1.00 0.00 H new ATOM 0 HB3 SER B 603 2.626 24.705 -9.460 1.00 0.00 H new ATOM 0 HG SER B 603 3.551 24.734 -11.587 1.00 0.00 H new ATOM 1312 N GLN B 604 5.684 27.606 -9.611 1.00 0.00 N ATOM 1313 CA GLN B 604 7.017 28.114 -9.913 1.00 0.00 C ATOM 1314 C GLN B 604 7.482 29.096 -8.844 1.00 0.00 C ATOM 1315 O GLN B 604 8.489 29.783 -9.014 1.00 0.00 O ATOM 1316 CB GLN B 604 7.029 28.791 -11.285 1.00 0.00 C ATOM 1317 CG GLN B 604 6.214 30.072 -11.337 1.00 0.00 C ATOM 1318 CD GLN B 604 7.012 31.251 -11.862 1.00 0.00 C ATOM 1319 OE1 GLN B 604 8.107 31.538 -11.378 1.00 0.00 O ATOM 1320 NE2 GLN B 604 6.466 31.939 -12.857 1.00 0.00 N ATOM 0 H GLN B 604 4.923 28.157 -10.007 1.00 0.00 H new ATOM 0 HA GLN B 604 7.705 27.269 -9.926 1.00 0.00 H new ATOM 0 HB2 GLN B 604 8.059 29.014 -11.562 1.00 0.00 H new ATOM 0 HB3 GLN B 604 6.643 28.094 -12.029 1.00 0.00 H new ATOM 0 HG2 GLN B 604 5.341 29.917 -11.972 1.00 0.00 H new ATOM 0 HG3 GLN B 604 5.845 30.304 -10.338 1.00 0.00 H new ATOM 0 HE21 GLN B 604 5.556 31.665 -13.227 1.00 0.00 H new ATOM 0 HE22 GLN B 604 6.957 32.742 -13.251 1.00 0.00 H new ATOM 1327 N ILE B 605 6.742 29.156 -7.742 1.00 0.00 N ATOM 1328 CA ILE B 605 7.079 30.054 -6.645 1.00 0.00 C ATOM 1329 C ILE B 605 8.210 29.484 -5.795 1.00 0.00 C ATOM 1330 O ILE B 605 9.325 30.003 -5.801 1.00 0.00 O ATOM 1331 CB ILE B 605 5.860 30.323 -5.742 1.00 0.00 C ATOM 1332 CG1 ILE B 605 4.645 30.704 -6.590 1.00 0.00 C ATOM 1333 CG2 ILE B 605 6.177 31.421 -4.737 1.00 0.00 C ATOM 1334 CD1 ILE B 605 4.884 31.898 -7.487 1.00 0.00 C ATOM 0 H ILE B 605 5.906 28.594 -7.585 1.00 0.00 H new ATOM 0 HA ILE B 605 7.403 30.993 -7.095 1.00 0.00 H new ATOM 0 HB ILE B 605 5.625 29.412 -5.192 1.00 0.00 H new ATOM 0 HG12 ILE B 605 4.359 29.850 -7.204 1.00 0.00 H new ATOM 0 HG13 ILE B 605 3.804 30.918 -5.930 1.00 0.00 H new ATOM 0 HG21 ILE B 605 5.306 31.600 -4.106 1.00 0.00 H new ATOM 0 HG22 ILE B 605 7.018 31.114 -4.116 1.00 0.00 H new ATOM 0 HG23 ILE B 605 6.434 32.337 -5.268 1.00 0.00 H new ATOM 0 HD11 ILE B 605 3.980 32.111 -8.058 1.00 0.00 H new ATOM 0 HD12 ILE B 605 5.141 32.765 -6.878 1.00 0.00 H new ATOM 0 HD13 ILE B 605 5.703 31.680 -8.172 1.00 0.00 H new ATOM 1345 N MET B 606 7.914 28.413 -5.068 1.00 0.00 N ATOM 1346 CA MET B 606 8.908 27.769 -4.216 1.00 0.00 C ATOM 1347 C MET B 606 8.480 26.350 -3.857 1.00 0.00 C ATOM 1348 O MET B 606 8.505 25.960 -2.690 1.00 0.00 O ATOM 1349 CB MET B 606 9.122 28.587 -2.941 1.00 0.00 C ATOM 1350 CG MET B 606 7.832 28.931 -2.215 1.00 0.00 C ATOM 1351 SD MET B 606 8.100 30.006 -0.792 1.00 0.00 S ATOM 1352 CE MET B 606 8.742 31.474 -1.594 1.00 0.00 C ATOM 0 H MET B 606 6.994 27.972 -5.051 1.00 0.00 H new ATOM 0 HA MET B 606 9.846 27.717 -4.769 1.00 0.00 H new ATOM 0 HB2 MET B 606 9.771 28.029 -2.266 1.00 0.00 H new ATOM 0 HB3 MET B 606 9.644 29.510 -3.195 1.00 0.00 H new ATOM 0 HG2 MET B 606 7.148 29.418 -2.910 1.00 0.00 H new ATOM 0 HG3 MET B 606 7.349 28.011 -1.885 1.00 0.00 H new ATOM 0 HE1 MET B 606 9.785 31.616 -1.311 1.00 0.00 H new ATOM 0 HE2 MET B 606 8.672 31.358 -2.676 1.00 0.00 H new ATOM 0 HE3 MET B 606 8.160 32.342 -1.284 1.00 0.00 H new ATOM 1360 N TYR B 607 8.088 25.583 -4.869 1.00 0.00 N ATOM 1361 CA TYR B 607 7.652 24.207 -4.659 1.00 0.00 C ATOM 1362 C TYR B 607 8.495 23.237 -5.482 1.00 0.00 C ATOM 1363 O TYR B 607 7.967 22.446 -6.261 1.00 0.00 O ATOM 1364 CB TYR B 607 6.175 24.056 -5.028 1.00 0.00 C ATOM 1365 CG TYR B 607 5.267 25.021 -4.300 1.00 0.00 C ATOM 1366 CD1 TYR B 607 5.145 26.340 -4.718 1.00 0.00 C ATOM 1367 CD2 TYR B 607 4.532 24.613 -3.193 1.00 0.00 C ATOM 1368 CE1 TYR B 607 4.316 27.225 -4.055 1.00 0.00 C ATOM 1369 CE2 TYR B 607 3.700 25.491 -2.525 1.00 0.00 C ATOM 1370 CZ TYR B 607 3.597 26.796 -2.959 1.00 0.00 C ATOM 1371 OH TYR B 607 2.770 27.674 -2.297 1.00 0.00 O ATOM 0 H TYR B 607 8.063 25.890 -5.841 1.00 0.00 H new ATOM 0 HA TYR B 607 7.782 23.968 -3.603 1.00 0.00 H new ATOM 0 HB2 TYR B 607 6.061 24.203 -6.102 1.00 0.00 H new ATOM 0 HB3 TYR B 607 5.857 23.036 -4.810 1.00 0.00 H new ATOM 0 HD1 TYR B 607 5.707 26.680 -5.575 1.00 0.00 H new ATOM 0 HD2 TYR B 607 4.613 23.592 -2.849 1.00 0.00 H new ATOM 0 HE1 TYR B 607 4.232 28.247 -4.393 1.00 0.00 H new ATOM 0 HE2 TYR B 607 3.134 25.157 -1.668 1.00 0.00 H new ATOM 0 HH TYR B 607 2.336 27.213 -1.549 1.00 0.00 H new ATOM 1380 N ASN B 608 9.809 23.306 -5.301 1.00 0.00 N ATOM 1381 CA ASN B 608 10.728 22.435 -6.026 1.00 0.00 C ATOM 1382 C ASN B 608 11.290 21.353 -5.109 1.00 0.00 C ATOM 1383 O ASN B 608 11.644 20.264 -5.560 1.00 0.00 O ATOM 1384 CB ASN B 608 11.872 23.253 -6.628 1.00 0.00 C ATOM 1385 CG ASN B 608 11.808 23.308 -8.143 1.00 0.00 C ATOM 1386 OD1 ASN B 608 11.402 22.344 -8.793 1.00 0.00 O ATOM 1387 ND2 ASN B 608 12.213 24.437 -8.713 1.00 0.00 N ATOM 0 H ASN B 608 10.262 23.956 -4.659 1.00 0.00 H new ATOM 0 HA ASN B 608 10.173 21.953 -6.830 1.00 0.00 H new ATOM 0 HB2 ASN B 608 11.840 24.267 -6.229 1.00 0.00 H new ATOM 0 HB3 ASN B 608 12.825 22.820 -6.323 1.00 0.00 H new ATOM 0 HD21 ASN B 608 12.195 24.531 -9.729 1.00 0.00 H new ATOM 0 HD22 ASN B 608 12.542 25.211 -8.135 1.00 0.00 H new ATOM 1393 N TYR B 609 11.369 21.662 -3.819 1.00 0.00 N ATOM 1394 CA TYR B 609 11.889 20.717 -2.838 1.00 0.00 C ATOM 1395 C TYR B 609 10.900 20.520 -1.693 1.00 0.00 C ATOM 1396 O TYR B 609 10.886 21.267 -0.714 1.00 0.00 O ATOM 1397 CB TYR B 609 13.230 21.207 -2.289 1.00 0.00 C ATOM 1398 CG TYR B 609 14.262 21.473 -3.361 1.00 0.00 C ATOM 1399 CD1 TYR B 609 14.746 20.445 -4.159 1.00 0.00 C ATOM 1400 CD2 TYR B 609 14.752 22.756 -3.577 1.00 0.00 C ATOM 1401 CE1 TYR B 609 15.690 20.684 -5.139 1.00 0.00 C ATOM 1402 CE2 TYR B 609 15.694 23.005 -4.556 1.00 0.00 C ATOM 1403 CZ TYR B 609 16.160 21.966 -5.334 1.00 0.00 C ATOM 1404 OH TYR B 609 17.099 22.208 -6.311 1.00 0.00 O ATOM 0 H TYR B 609 11.080 22.559 -3.429 1.00 0.00 H new ATOM 0 HA TYR B 609 12.035 19.759 -3.336 1.00 0.00 H new ATOM 0 HB2 TYR B 609 13.067 22.121 -1.718 1.00 0.00 H new ATOM 0 HB3 TYR B 609 13.622 20.464 -1.595 1.00 0.00 H new ATOM 0 HD1 TYR B 609 14.378 19.441 -4.011 1.00 0.00 H new ATOM 0 HD2 TYR B 609 14.390 23.572 -2.969 1.00 0.00 H new ATOM 0 HE1 TYR B 609 16.058 19.872 -5.749 1.00 0.00 H new ATOM 0 HE2 TYR B 609 16.064 24.008 -4.711 1.00 0.00 H new ATOM 0 HH TYR B 609 17.324 23.162 -6.320 1.00 0.00 H new ATOM 1413 N PRO B 610 10.051 19.489 -1.817 1.00 0.00 N ATOM 1414 CA PRO B 610 9.042 19.167 -0.803 1.00 0.00 C ATOM 1415 C PRO B 610 9.663 18.629 0.481 1.00 0.00 C ATOM 1416 O PRO B 610 9.022 18.609 1.532 1.00 0.00 O ATOM 1417 CB PRO B 610 8.192 18.089 -1.478 1.00 0.00 C ATOM 1418 CG PRO B 610 9.100 17.460 -2.478 1.00 0.00 C ATOM 1419 CD PRO B 610 10.011 18.557 -2.957 1.00 0.00 C ATOM 0 HA PRO B 610 8.475 20.047 -0.498 1.00 0.00 H new ATOM 0 HB2 PRO B 610 7.833 17.357 -0.754 1.00 0.00 H new ATOM 0 HB3 PRO B 610 7.313 18.521 -1.958 1.00 0.00 H new ATOM 0 HG2 PRO B 610 9.671 16.647 -2.030 1.00 0.00 H new ATOM 0 HG3 PRO B 610 8.533 17.034 -3.306 1.00 0.00 H new ATOM 0 HD2 PRO B 610 11.003 18.178 -3.201 1.00 0.00 H new ATOM 0 HD3 PRO B 610 9.624 19.037 -3.856 1.00 0.00 H new ATOM 1424 N ALA B 611 10.916 18.192 0.390 1.00 0.00 N ATOM 1425 CA ALA B 611 11.624 17.657 1.546 1.00 0.00 C ATOM 1426 C ALA B 611 12.106 18.776 2.462 1.00 0.00 C ATOM 1427 O ALA B 611 12.149 18.617 3.682 1.00 0.00 O ATOM 1428 CB ALA B 611 12.797 16.799 1.095 1.00 0.00 C ATOM 0 H ALA B 611 11.461 18.198 -0.472 1.00 0.00 H new ATOM 0 HA ALA B 611 10.929 17.036 2.111 1.00 0.00 H new ATOM 0 HB1 ALA B 611 13.317 16.406 1.968 1.00 0.00 H new ATOM 0 HB2 ALA B 611 12.430 15.971 0.488 1.00 0.00 H new ATOM 0 HB3 ALA B 611 13.485 17.405 0.505 1.00 0.00 H new ATOM 1434 N MET B 612 12.469 19.907 1.867 1.00 0.00 N ATOM 1435 CA MET B 612 12.949 21.053 2.630 1.00 0.00 C ATOM 1436 C MET B 612 11.782 21.899 3.131 1.00 0.00 C ATOM 1437 O MET B 612 11.884 22.571 4.158 1.00 0.00 O ATOM 1438 CB MET B 612 13.884 21.909 1.774 1.00 0.00 C ATOM 1439 CG MET B 612 15.337 21.844 2.213 1.00 0.00 C ATOM 1440 SD MET B 612 16.482 21.788 0.820 1.00 0.00 S ATOM 1441 CE MET B 612 16.790 23.533 0.563 1.00 0.00 C ATOM 0 H MET B 612 12.440 20.055 0.858 1.00 0.00 H new ATOM 0 HA MET B 612 13.501 20.678 3.492 1.00 0.00 H new ATOM 0 HB2 MET B 612 13.812 21.585 0.736 1.00 0.00 H new ATOM 0 HB3 MET B 612 13.548 22.945 1.809 1.00 0.00 H new ATOM 0 HG2 MET B 612 15.565 22.712 2.831 1.00 0.00 H new ATOM 0 HG3 MET B 612 15.485 20.962 2.836 1.00 0.00 H new ATOM 0 HE1 MET B 612 17.483 23.662 -0.269 1.00 0.00 H new ATOM 0 HE2 MET B 612 15.852 24.038 0.335 1.00 0.00 H new ATOM 0 HE3 MET B 612 17.224 23.963 1.466 1.00 0.00 H new ATOM 1449 N LEU B 613 10.674 21.864 2.399 1.00 0.00 N ATOM 1450 CA LEU B 613 9.488 22.627 2.769 1.00 0.00 C ATOM 1451 C LEU B 613 8.988 22.221 4.151 1.00 0.00 C ATOM 1452 O LEU B 613 8.571 23.065 4.944 1.00 0.00 O ATOM 1453 CB LEU B 613 8.381 22.421 1.733 1.00 0.00 C ATOM 1454 CG LEU B 613 7.164 23.338 1.859 1.00 0.00 C ATOM 1455 CD1 LEU B 613 6.572 23.632 0.489 1.00 0.00 C ATOM 1456 CD2 LEU B 613 6.118 22.713 2.770 1.00 0.00 C ATOM 0 H LEU B 613 10.573 21.315 1.545 1.00 0.00 H new ATOM 0 HA LEU B 613 9.760 23.682 2.797 1.00 0.00 H new ATOM 0 HB2 LEU B 613 8.811 22.555 0.740 1.00 0.00 H new ATOM 0 HB3 LEU B 613 8.040 21.388 1.796 1.00 0.00 H new ATOM 0 HG LEU B 613 7.488 24.280 2.302 1.00 0.00 H new ATOM 0 HD11 LEU B 613 5.707 24.286 0.599 1.00 0.00 H new ATOM 0 HD12 LEU B 613 7.321 24.122 -0.133 1.00 0.00 H new ATOM 0 HD13 LEU B 613 6.264 22.699 0.018 1.00 0.00 H new ATOM 0 HD21 LEU B 613 5.259 23.379 2.848 1.00 0.00 H new ATOM 0 HD22 LEU B 613 5.799 21.757 2.355 1.00 0.00 H new ATOM 0 HD23 LEU B 613 6.546 22.555 3.760 1.00 0.00 H new ATOM 1467 N GLY B 614 9.034 20.923 4.434 1.00 0.00 N ATOM 1468 CA GLY B 614 8.585 20.428 5.722 1.00 0.00 C ATOM 1469 C GLY B 614 9.503 19.362 6.286 1.00 0.00 C ATOM 1470 O GLY B 614 10.013 18.518 5.548 1.00 0.00 O ATOM 0 H GLY B 614 9.374 20.205 3.794 1.00 0.00 H new ATOM 0 HA2 GLY B 614 8.523 21.258 6.425 1.00 0.00 H new ATOM 0 HA3 GLY B 614 7.579 20.020 5.620 1.00 0.00 H new ATOM 1474 N HIS B 615 9.715 19.399 7.598 1.00 0.00 N ATOM 1475 CA HIS B 615 10.579 18.428 8.259 1.00 0.00 C ATOM 1476 C HIS B 615 10.048 18.086 9.649 1.00 0.00 C ATOM 1477 O HIS B 615 9.368 18.895 10.280 1.00 0.00 O ATOM 1478 CB HIS B 615 12.004 18.971 8.366 1.00 0.00 C ATOM 1479 CG HIS B 615 12.073 20.376 8.882 1.00 0.00 C ATOM 1480 ND1 HIS B 615 12.157 20.681 10.224 1.00 0.00 N ATOM 1481 CD2 HIS B 615 12.071 21.560 8.228 1.00 0.00 C ATOM 1482 CE1 HIS B 615 12.203 21.993 10.373 1.00 0.00 C ATOM 1483 NE2 HIS B 615 12.153 22.549 9.176 1.00 0.00 N ATOM 0 H HIS B 615 9.301 20.090 8.223 1.00 0.00 H new ATOM 0 HA HIS B 615 10.588 17.519 7.658 1.00 0.00 H new ATOM 0 HB2 HIS B 615 12.583 18.322 9.024 1.00 0.00 H new ATOM 0 HB3 HIS B 615 12.474 18.930 7.384 1.00 0.00 H new ATOM 0 HD2 HIS B 615 12.015 21.701 7.159 1.00 0.00 H new ATOM 0 HE1 HIS B 615 12.270 22.521 11.313 1.00 0.00 H new ATOM 0 HE2 HIS B 615 12.172 23.551 8.987 1.00 0.00 H new ATOM 1490 N ALA B 616 10.361 16.883 10.117 1.00 0.00 N ATOM 1491 CA ALA B 616 9.916 16.435 11.431 1.00 0.00 C ATOM 1492 C ALA B 616 8.395 16.393 11.511 1.00 0.00 C ATOM 1493 O ALA B 616 7.760 17.344 11.966 1.00 0.00 O ATOM 1494 CB ALA B 616 10.479 17.341 12.516 1.00 0.00 C ATOM 0 H ALA B 616 10.921 16.201 9.606 1.00 0.00 H new ATOM 0 HA ALA B 616 10.289 15.423 11.588 1.00 0.00 H new ATOM 0 HB1 ALA B 616 10.139 16.995 13.492 1.00 0.00 H new ATOM 0 HB2 ALA B 616 11.568 17.316 12.482 1.00 0.00 H new ATOM 0 HB3 ALA B 616 10.134 18.362 12.353 1.00 0.00 H new ATOM 1500 N GLY B 617 7.813 15.283 11.064 1.00 0.00 N ATOM 1501 CA GLY B 617 6.370 15.139 11.093 1.00 0.00 C ATOM 1502 C GLY B 617 5.911 14.099 12.095 1.00 0.00 C ATOM 1503 O GLY B 617 6.492 13.017 12.187 1.00 0.00 O ATOM 0 H GLY B 617 8.316 14.482 10.683 1.00 0.00 H new ATOM 0 HA2 GLY B 617 5.917 16.100 11.338 1.00 0.00 H new ATOM 0 HA3 GLY B 617 6.015 14.863 10.100 1.00 0.00 H new ATOM 1507 N ASP B 618 4.867 14.426 12.849 1.00 0.00 N ATOM 1508 CA ASP B 618 4.331 13.512 13.851 1.00 0.00 C ATOM 1509 C ASP B 618 3.269 12.601 13.242 1.00 0.00 C ATOM 1510 O ASP B 618 3.184 11.420 13.578 1.00 0.00 O ATOM 1511 CB ASP B 618 3.738 14.296 15.023 1.00 0.00 C ATOM 1512 CG ASP B 618 4.196 13.764 16.366 1.00 0.00 C ATOM 1513 OD1 ASP B 618 3.523 12.863 16.909 1.00 0.00 O ATOM 1514 OD2 ASP B 618 5.228 14.250 16.876 1.00 0.00 O ATOM 0 H ASP B 618 4.375 15.317 12.785 1.00 0.00 H new ATOM 0 HA ASP B 618 5.150 12.892 14.217 1.00 0.00 H new ATOM 0 HB2 ASP B 618 4.021 15.345 14.935 1.00 0.00 H new ATOM 0 HB3 ASP B 618 2.650 14.254 14.971 1.00 0.00 H new ATOM 1518 N MET B 619 2.461 13.159 12.347 1.00 0.00 N ATOM 1519 CA MET B 619 1.405 12.396 11.692 1.00 0.00 C ATOM 1520 C MET B 619 1.993 11.299 10.810 1.00 0.00 C ATOM 1521 O MET B 619 1.354 10.276 10.567 1.00 0.00 O ATOM 1522 CB MET B 619 0.523 13.323 10.853 1.00 0.00 C ATOM 1523 CG MET B 619 -0.556 14.029 11.658 1.00 0.00 C ATOM 1524 SD MET B 619 -0.334 15.818 11.696 1.00 0.00 S ATOM 1525 CE MET B 619 -2.003 16.358 12.063 1.00 0.00 C ATOM 0 H MET B 619 2.517 14.136 12.059 1.00 0.00 H new ATOM 0 HA MET B 619 0.796 11.928 12.465 1.00 0.00 H new ATOM 0 HB2 MET B 619 1.152 14.071 10.370 1.00 0.00 H new ATOM 0 HB3 MET B 619 0.052 12.743 10.060 1.00 0.00 H new ATOM 0 HG2 MET B 619 -1.532 13.797 11.232 1.00 0.00 H new ATOM 0 HG3 MET B 619 -0.553 13.645 12.678 1.00 0.00 H new ATOM 0 HE1 MET B 619 -2.029 17.446 12.119 1.00 0.00 H new ATOM 0 HE2 MET B 619 -2.676 16.019 11.276 1.00 0.00 H new ATOM 0 HE3 MET B 619 -2.320 15.938 13.018 1.00 0.00 H new ATOM 1533 N ALA B 620 3.214 11.519 10.335 1.00 0.00 N ATOM 1534 CA ALA B 620 3.889 10.549 9.482 1.00 0.00 C ATOM 1535 C ALA B 620 3.977 9.187 10.163 1.00 0.00 C ATOM 1536 O ALA B 620 3.956 8.149 9.503 1.00 0.00 O ATOM 1537 CB ALA B 620 5.278 11.046 9.112 1.00 0.00 C ATOM 0 H ALA B 620 3.756 12.361 10.527 1.00 0.00 H new ATOM 0 HA ALA B 620 3.302 10.434 8.571 1.00 0.00 H new ATOM 0 HB1 ALA B 620 5.770 10.311 8.475 1.00 0.00 H new ATOM 0 HB2 ALA B 620 5.195 11.992 8.577 1.00 0.00 H new ATOM 0 HB3 ALA B 620 5.866 11.192 10.018 1.00 0.00 H new ATOM 1543 N GLY B 621 4.077 9.199 11.489 1.00 0.00 N ATOM 1544 CA GLY B 621 4.166 7.958 12.237 1.00 0.00 C ATOM 1545 C GLY B 621 3.039 7.001 11.910 1.00 0.00 C ATOM 1546 O GLY B 621 3.222 5.783 11.937 1.00 0.00 O ATOM 0 H GLY B 621 4.098 10.045 12.058 1.00 0.00 H new ATOM 0 HA2 GLY B 621 5.120 7.477 12.023 1.00 0.00 H new ATOM 0 HA3 GLY B 621 4.152 8.179 13.304 1.00 0.00 H new ATOM 1550 N TYR B 622 1.869 7.549 11.602 1.00 0.00 N ATOM 1551 CA TYR B 622 0.706 6.734 11.273 1.00 0.00 C ATOM 1552 C TYR B 622 0.864 6.089 9.900 1.00 0.00 C ATOM 1553 O TYR B 622 0.527 4.921 9.707 1.00 0.00 O ATOM 1554 CB TYR B 622 -0.565 7.586 11.305 1.00 0.00 C ATOM 1555 CG TYR B 622 -1.441 7.321 12.508 1.00 0.00 C ATOM 1556 CD1 TYR B 622 -2.203 6.161 12.596 1.00 0.00 C ATOM 1557 CD2 TYR B 622 -1.509 8.229 13.557 1.00 0.00 C ATOM 1558 CE1 TYR B 622 -3.005 5.915 13.692 1.00 0.00 C ATOM 1559 CE2 TYR B 622 -2.307 7.990 14.659 1.00 0.00 C ATOM 1560 CZ TYR B 622 -3.054 6.832 14.722 1.00 0.00 C ATOM 1561 OH TYR B 622 -3.851 6.591 15.817 1.00 0.00 O ATOM 0 H TYR B 622 1.701 8.555 11.573 1.00 0.00 H new ATOM 0 HA TYR B 622 0.625 5.943 12.019 1.00 0.00 H new ATOM 0 HB2 TYR B 622 -0.286 8.640 11.294 1.00 0.00 H new ATOM 0 HB3 TYR B 622 -1.141 7.399 10.399 1.00 0.00 H new ATOM 0 HD1 TYR B 622 -2.167 5.440 11.793 1.00 0.00 H new ATOM 0 HD2 TYR B 622 -0.928 9.138 13.510 1.00 0.00 H new ATOM 0 HE1 TYR B 622 -3.591 5.009 13.743 1.00 0.00 H new ATOM 0 HE2 TYR B 622 -2.346 8.706 15.467 1.00 0.00 H new ATOM 0 HH TYR B 622 -3.770 7.334 16.451 1.00 0.00 H new ATOM 1570 N ALA B 623 1.381 6.859 8.948 1.00 0.00 N ATOM 1571 CA ALA B 623 1.586 6.362 7.592 1.00 0.00 C ATOM 1572 C ALA B 623 2.391 5.067 7.599 1.00 0.00 C ATOM 1573 O ALA B 623 2.049 4.109 6.905 1.00 0.00 O ATOM 1574 CB ALA B 623 2.286 7.416 6.746 1.00 0.00 C ATOM 0 H ALA B 623 1.665 7.828 9.090 1.00 0.00 H new ATOM 0 HA ALA B 623 0.610 6.150 7.156 1.00 0.00 H new ATOM 0 HB1 ALA B 623 2.433 7.033 5.736 1.00 0.00 H new ATOM 0 HB2 ALA B 623 1.673 8.317 6.707 1.00 0.00 H new ATOM 0 HB3 ALA B 623 3.253 7.654 7.188 1.00 0.00 H new ATOM 1580 N GLY B 624 3.461 5.043 8.387 1.00 0.00 N ATOM 1581 CA GLY B 624 4.297 3.859 8.468 1.00 0.00 C ATOM 1582 C GLY B 624 3.510 2.617 8.833 1.00 0.00 C ATOM 1583 O GLY B 624 3.916 1.499 8.515 1.00 0.00 O ATOM 0 H GLY B 624 3.764 5.822 8.971 1.00 0.00 H new ATOM 0 HA2 GLY B 624 4.793 3.702 7.510 1.00 0.00 H new ATOM 0 HA3 GLY B 624 5.079 4.021 9.210 1.00 0.00 H new ATOM 1587 N THR B 625 2.379 2.811 9.506 1.00 0.00 N ATOM 1588 CA THR B 625 1.534 1.698 9.917 1.00 0.00 C ATOM 1589 C THR B 625 1.104 0.861 8.718 1.00 0.00 C ATOM 1590 O THR B 625 0.975 -0.360 8.815 1.00 0.00 O ATOM 1591 CB THR B 625 0.279 2.191 10.662 1.00 0.00 C ATOM 1592 OG1 THR B 625 0.658 3.006 11.777 1.00 0.00 O ATOM 1593 CG2 THR B 625 -0.559 1.017 11.147 1.00 0.00 C ATOM 0 H THR B 625 2.028 3.729 9.777 1.00 0.00 H new ATOM 0 HA THR B 625 2.129 1.082 10.591 1.00 0.00 H new ATOM 0 HB THR B 625 -0.319 2.782 9.968 1.00 0.00 H new ATOM 0 HG1 THR B 625 0.829 3.921 11.470 1.00 0.00 H new ATOM 0 HG21 THR B 625 -1.440 1.390 11.670 1.00 0.00 H new ATOM 0 HG22 THR B 625 -0.872 0.416 10.293 1.00 0.00 H new ATOM 0 HG23 THR B 625 0.033 0.403 11.826 1.00 0.00 H new ATOM 1601 N LEU B 626 0.883 1.524 7.588 1.00 0.00 N ATOM 1602 CA LEU B 626 0.468 0.841 6.369 1.00 0.00 C ATOM 1603 C LEU B 626 1.591 -0.038 5.828 1.00 0.00 C ATOM 1604 O LEU B 626 1.362 -1.181 5.434 1.00 0.00 O ATOM 1605 CB LEU B 626 0.046 1.859 5.308 1.00 0.00 C ATOM 1606 CG LEU B 626 -1.019 2.869 5.734 1.00 0.00 C ATOM 1607 CD1 LEU B 626 -1.233 3.911 4.647 1.00 0.00 C ATOM 1608 CD2 LEU B 626 -2.326 2.161 6.061 1.00 0.00 C ATOM 0 H LEU B 626 0.985 2.534 7.491 1.00 0.00 H new ATOM 0 HA LEU B 626 -0.383 0.204 6.611 1.00 0.00 H new ATOM 0 HB2 LEU B 626 0.931 2.408 4.987 1.00 0.00 H new ATOM 0 HB3 LEU B 626 -0.324 1.316 4.439 1.00 0.00 H new ATOM 0 HG LEU B 626 -0.670 3.378 6.632 1.00 0.00 H new ATOM 0 HD11 LEU B 626 -1.995 4.621 4.969 1.00 0.00 H new ATOM 0 HD12 LEU B 626 -0.298 4.440 4.461 1.00 0.00 H new ATOM 0 HD13 LEU B 626 -1.559 3.419 3.731 1.00 0.00 H new ATOM 0 HD21 LEU B 626 -3.072 2.896 6.362 1.00 0.00 H new ATOM 0 HD22 LEU B 626 -2.680 1.625 5.180 1.00 0.00 H new ATOM 0 HD23 LEU B 626 -2.163 1.454 6.875 1.00 0.00 H new ATOM 1619 N GLN B 627 2.805 0.503 5.813 1.00 0.00 N ATOM 1620 CA GLN B 627 3.964 -0.233 5.322 1.00 0.00 C ATOM 1621 C GLN B 627 4.190 -1.500 6.140 1.00 0.00 C ATOM 1622 O GLN B 627 4.582 -2.536 5.602 1.00 0.00 O ATOM 1623 CB GLN B 627 5.213 0.649 5.370 1.00 0.00 C ATOM 1624 CG GLN B 627 5.772 0.987 3.998 1.00 0.00 C ATOM 1625 CD GLN B 627 7.211 0.540 3.828 1.00 0.00 C ATOM 1626 OE1 GLN B 627 8.058 0.801 4.682 1.00 0.00 O ATOM 1627 NE2 GLN B 627 7.494 -0.137 2.721 1.00 0.00 N ATOM 0 H GLN B 627 3.011 1.448 6.135 1.00 0.00 H new ATOM 0 HA GLN B 627 3.770 -0.519 4.288 1.00 0.00 H new ATOM 0 HB2 GLN B 627 4.974 1.575 5.894 1.00 0.00 H new ATOM 0 HB3 GLN B 627 5.983 0.143 5.952 1.00 0.00 H new ATOM 0 HG2 GLN B 627 5.156 0.515 3.233 1.00 0.00 H new ATOM 0 HG3 GLN B 627 5.709 2.063 3.839 1.00 0.00 H new ATOM 0 HE21 GLN B 627 6.760 -0.331 2.040 1.00 0.00 H new ATOM 0 HE22 GLN B 627 8.446 -0.463 2.552 1.00 0.00 H new ATOM 1634 N SER B 628 3.942 -1.411 7.443 1.00 0.00 N ATOM 1635 CA SER B 628 4.122 -2.549 8.336 1.00 0.00 C ATOM 1636 C SER B 628 2.982 -3.550 8.178 1.00 0.00 C ATOM 1637 O SER B 628 3.210 -4.739 7.952 1.00 0.00 O ATOM 1638 CB SER B 628 4.205 -2.077 9.788 1.00 0.00 C ATOM 1639 OG SER B 628 5.010 -0.917 9.903 1.00 0.00 O ATOM 0 H SER B 628 3.616 -0.562 7.904 1.00 0.00 H new ATOM 0 HA SER B 628 5.056 -3.044 8.069 1.00 0.00 H new ATOM 0 HB2 SER B 628 3.203 -1.867 10.163 1.00 0.00 H new ATOM 0 HB3 SER B 628 4.617 -2.872 10.409 1.00 0.00 H new ATOM 0 HG SER B 628 4.516 -0.141 9.564 1.00 0.00 H new ATOM 1644 N LEU B 629 1.753 -3.060 8.298 1.00 0.00 N ATOM 1645 CA LEU B 629 0.575 -3.910 8.169 1.00 0.00 C ATOM 1646 C LEU B 629 0.553 -4.609 6.813 1.00 0.00 C ATOM 1647 O LEU B 629 0.425 -5.830 6.734 1.00 0.00 O ATOM 1648 CB LEU B 629 -0.698 -3.081 8.349 1.00 0.00 C ATOM 1649 CG LEU B 629 -1.941 -3.850 8.800 1.00 0.00 C ATOM 1650 CD1 LEU B 629 -3.051 -2.888 9.191 1.00 0.00 C ATOM 1651 CD2 LEU B 629 -2.412 -4.793 7.702 1.00 0.00 C ATOM 0 H LEU B 629 1.547 -2.079 8.484 1.00 0.00 H new ATOM 0 HA LEU B 629 0.619 -4.671 8.948 1.00 0.00 H new ATOM 0 HB2 LEU B 629 -0.497 -2.296 9.078 1.00 0.00 H new ATOM 0 HB3 LEU B 629 -0.923 -2.588 7.403 1.00 0.00 H new ATOM 0 HG LEU B 629 -1.679 -4.445 9.675 1.00 0.00 H new ATOM 0 HD11 LEU B 629 -3.927 -3.453 9.509 1.00 0.00 H new ATOM 0 HD12 LEU B 629 -2.711 -2.254 10.010 1.00 0.00 H new ATOM 0 HD13 LEU B 629 -3.312 -2.266 8.335 1.00 0.00 H new ATOM 0 HD21 LEU B 629 -3.297 -5.332 8.040 1.00 0.00 H new ATOM 0 HD22 LEU B 629 -2.656 -4.218 6.809 1.00 0.00 H new ATOM 0 HD23 LEU B 629 -1.620 -5.505 7.470 1.00 0.00 H new ATOM 1662 N GLY B 630 0.682 -3.824 5.747 1.00 0.00 N ATOM 1663 CA GLY B 630 0.676 -4.385 4.408 1.00 0.00 C ATOM 1664 C GLY B 630 1.681 -5.508 4.246 1.00 0.00 C ATOM 1665 O GLY B 630 1.423 -6.485 3.544 1.00 0.00 O ATOM 0 H GLY B 630 0.790 -2.811 5.787 1.00 0.00 H new ATOM 0 HA2 GLY B 630 -0.322 -4.759 4.178 1.00 0.00 H new ATOM 0 HA3 GLY B 630 0.896 -3.598 3.687 1.00 0.00 H new ATOM 1669 N ALA B 631 2.831 -5.369 4.897 1.00 0.00 N ATOM 1670 CA ALA B 631 3.879 -6.379 4.822 1.00 0.00 C ATOM 1671 C ALA B 631 3.339 -7.759 5.186 1.00 0.00 C ATOM 1672 O ALA B 631 3.802 -8.773 4.666 1.00 0.00 O ATOM 1673 CB ALA B 631 5.039 -6.007 5.734 1.00 0.00 C ATOM 0 H ALA B 631 3.061 -4.566 5.483 1.00 0.00 H new ATOM 0 HA ALA B 631 4.238 -6.417 3.794 1.00 0.00 H new ATOM 0 HB1 ALA B 631 5.814 -6.771 5.667 1.00 0.00 H new ATOM 0 HB2 ALA B 631 5.450 -5.045 5.426 1.00 0.00 H new ATOM 0 HB3 ALA B 631 4.685 -5.938 6.763 1.00 0.00 H new ATOM 1679 N GLU B 632 2.358 -7.787 6.083 1.00 0.00 N ATOM 1680 CA GLU B 632 1.757 -9.042 6.517 1.00 0.00 C ATOM 1681 C GLU B 632 1.052 -9.738 5.355 1.00 0.00 C ATOM 1682 O GLU B 632 1.031 -10.967 5.276 1.00 0.00 O ATOM 1683 CB GLU B 632 0.763 -8.791 7.653 1.00 0.00 C ATOM 1684 CG GLU B 632 1.421 -8.361 8.953 1.00 0.00 C ATOM 1685 CD GLU B 632 1.513 -9.490 9.961 1.00 0.00 C ATOM 1686 OE1 GLU B 632 1.650 -10.656 9.537 1.00 0.00 O ATOM 1687 OE2 GLU B 632 1.449 -9.207 11.176 1.00 0.00 O ATOM 0 H GLU B 632 1.963 -6.956 6.523 1.00 0.00 H new ATOM 0 HA GLU B 632 2.554 -9.691 6.878 1.00 0.00 H new ATOM 0 HB2 GLU B 632 0.055 -8.022 7.342 1.00 0.00 H new ATOM 0 HB3 GLU B 632 0.189 -9.700 7.830 1.00 0.00 H new ATOM 0 HG2 GLU B 632 2.422 -7.985 8.742 1.00 0.00 H new ATOM 0 HG3 GLU B 632 0.855 -7.537 9.387 1.00 0.00 H new ATOM 1692 N ILE B 633 0.478 -8.945 4.458 1.00 0.00 N ATOM 1693 CA ILE B 633 -0.226 -9.484 3.302 1.00 0.00 C ATOM 1694 C ILE B 633 0.753 -10.041 2.273 1.00 0.00 C ATOM 1695 O ILE B 633 0.499 -11.075 1.657 1.00 0.00 O ATOM 1696 CB ILE B 633 -1.105 -8.414 2.629 1.00 0.00 C ATOM 1697 CG1 ILE B 633 -2.124 -7.859 3.627 1.00 0.00 C ATOM 1698 CG2 ILE B 633 -1.811 -8.996 1.413 1.00 0.00 C ATOM 1699 CD1 ILE B 633 -2.934 -6.702 3.083 1.00 0.00 C ATOM 0 H ILE B 633 0.487 -7.926 4.509 1.00 0.00 H new ATOM 0 HA ILE B 633 -0.863 -10.289 3.668 1.00 0.00 H new ATOM 0 HB ILE B 633 -0.466 -7.596 2.297 1.00 0.00 H new ATOM 0 HG12 ILE B 633 -2.802 -8.659 3.924 1.00 0.00 H new ATOM 0 HG13 ILE B 633 -1.600 -7.534 4.526 1.00 0.00 H new ATOM 0 HG21 ILE B 633 -2.428 -8.227 0.948 1.00 0.00 H new ATOM 0 HG22 ILE B 633 -1.070 -9.349 0.696 1.00 0.00 H new ATOM 0 HG23 ILE B 633 -2.441 -9.830 1.723 1.00 0.00 H new ATOM 0 HD11 ILE B 633 -3.635 -6.359 3.844 1.00 0.00 H new ATOM 0 HD12 ILE B 633 -2.265 -5.885 2.812 1.00 0.00 H new ATOM 0 HD13 ILE B 633 -3.486 -7.027 2.201 1.00 0.00 H new ATOM 1710 N ALA B 634 1.874 -9.350 2.095 1.00 0.00 N ATOM 1711 CA ALA B 634 2.893 -9.777 1.144 1.00 0.00 C ATOM 1712 C ALA B 634 3.577 -11.056 1.613 1.00 0.00 C ATOM 1713 O ALA B 634 3.990 -11.885 0.801 1.00 0.00 O ATOM 1714 CB ALA B 634 3.918 -8.673 0.937 1.00 0.00 C ATOM 0 H ALA B 634 2.100 -8.491 2.597 1.00 0.00 H new ATOM 0 HA ALA B 634 2.404 -9.985 0.192 1.00 0.00 H new ATOM 0 HB1 ALA B 634 4.673 -9.006 0.225 1.00 0.00 H new ATOM 0 HB2 ALA B 634 3.421 -7.783 0.550 1.00 0.00 H new ATOM 0 HB3 ALA B 634 4.396 -8.437 1.888 1.00 0.00 H new ATOM 1720 N VAL B 635 3.697 -11.210 2.928 1.00 0.00 N ATOM 1721 CA VAL B 635 4.333 -12.389 3.504 1.00 0.00 C ATOM 1722 C VAL B 635 3.407 -13.599 3.442 1.00 0.00 C ATOM 1723 O VAL B 635 3.863 -14.735 3.316 1.00 0.00 O ATOM 1724 CB VAL B 635 4.743 -12.146 4.969 1.00 0.00 C ATOM 1725 CG1 VAL B 635 5.381 -13.394 5.560 1.00 0.00 C ATOM 1726 CG2 VAL B 635 5.686 -10.957 5.068 1.00 0.00 C ATOM 0 H VAL B 635 3.362 -10.533 3.614 1.00 0.00 H new ATOM 0 HA VAL B 635 5.226 -12.588 2.912 1.00 0.00 H new ATOM 0 HB VAL B 635 3.846 -11.918 5.546 1.00 0.00 H new ATOM 0 HG11 VAL B 635 5.664 -13.203 6.595 1.00 0.00 H new ATOM 0 HG12 VAL B 635 4.669 -14.218 5.525 1.00 0.00 H new ATOM 0 HG13 VAL B 635 6.268 -13.657 4.984 1.00 0.00 H new ATOM 0 HG21 VAL B 635 5.965 -10.800 6.110 1.00 0.00 H new ATOM 0 HG22 VAL B 635 6.581 -11.153 4.478 1.00 0.00 H new ATOM 0 HG23 VAL B 635 5.188 -10.065 4.687 1.00 0.00 H new ATOM 1736 N GLU B 636 2.106 -13.346 3.529 1.00 0.00 N ATOM 1737 CA GLU B 636 1.115 -14.416 3.482 1.00 0.00 C ATOM 1738 C GLU B 636 1.068 -15.053 2.096 1.00 0.00 C ATOM 1739 O GLU B 636 1.152 -16.272 1.960 1.00 0.00 O ATOM 1740 CB GLU B 636 -0.268 -13.877 3.855 1.00 0.00 C ATOM 1741 CG GLU B 636 -0.891 -14.577 5.052 1.00 0.00 C ATOM 1742 CD GLU B 636 -1.434 -15.951 4.707 1.00 0.00 C ATOM 1743 OE1 GLU B 636 -2.586 -16.030 4.231 1.00 0.00 O ATOM 1744 OE2 GLU B 636 -0.707 -16.945 4.911 1.00 0.00 O ATOM 0 H GLU B 636 1.713 -12.411 3.632 1.00 0.00 H new ATOM 0 HA GLU B 636 1.407 -15.179 4.204 1.00 0.00 H new ATOM 0 HB2 GLU B 636 -0.188 -12.811 4.069 1.00 0.00 H new ATOM 0 HB3 GLU B 636 -0.933 -13.981 2.997 1.00 0.00 H new ATOM 0 HG2 GLU B 636 -0.145 -14.673 5.841 1.00 0.00 H new ATOM 0 HG3 GLU B 636 -1.698 -13.961 5.449 1.00 0.00 H new ATOM 1749 N GLN B 637 0.931 -14.217 1.072 1.00 0.00 N ATOM 1750 CA GLN B 637 0.872 -14.698 -0.304 1.00 0.00 C ATOM 1751 C GLN B 637 2.191 -15.344 -0.712 1.00 0.00 C ATOM 1752 O GLN B 637 2.218 -16.254 -1.540 1.00 0.00 O ATOM 1753 CB GLN B 637 0.536 -13.549 -1.255 1.00 0.00 C ATOM 1754 CG GLN B 637 1.695 -12.592 -1.486 1.00 0.00 C ATOM 1755 CD GLN B 637 2.479 -12.918 -2.742 1.00 0.00 C ATOM 1756 OE1 GLN B 637 1.950 -13.510 -3.682 1.00 0.00 O ATOM 1757 NE2 GLN B 637 3.750 -12.531 -2.764 1.00 0.00 N ATOM 0 H GLN B 637 0.859 -13.204 1.169 1.00 0.00 H new ATOM 0 HA GLN B 637 0.086 -15.451 -0.365 1.00 0.00 H new ATOM 0 HB2 GLN B 637 0.220 -13.962 -2.213 1.00 0.00 H new ATOM 0 HB3 GLN B 637 -0.310 -12.992 -0.853 1.00 0.00 H new ATOM 0 HG2 GLN B 637 1.312 -11.574 -1.555 1.00 0.00 H new ATOM 0 HG3 GLN B 637 2.364 -12.623 -0.626 1.00 0.00 H new ATOM 0 HE21 GLN B 637 4.148 -12.042 -1.962 1.00 0.00 H new ATOM 0 HE22 GLN B 637 4.327 -12.722 -3.583 1.00 0.00 H new ATOM 1764 N ALA B 638 3.284 -14.865 -0.127 1.00 0.00 N ATOM 1765 CA ALA B 638 4.608 -15.397 -0.429 1.00 0.00 C ATOM 1766 C ALA B 638 4.707 -16.871 -0.052 1.00 0.00 C ATOM 1767 O ALA B 638 5.517 -17.611 -0.609 1.00 0.00 O ATOM 1768 CB ALA B 638 5.678 -14.592 0.294 1.00 0.00 C ATOM 0 H ALA B 638 3.279 -14.110 0.559 1.00 0.00 H new ATOM 0 HA ALA B 638 4.770 -15.313 -1.504 1.00 0.00 H new ATOM 0 HB1 ALA B 638 6.661 -15.000 0.059 1.00 0.00 H new ATOM 0 HB2 ALA B 638 5.631 -13.552 -0.028 1.00 0.00 H new ATOM 0 HB3 ALA B 638 5.510 -14.647 1.370 1.00 0.00 H new ATOM 1774 N ALA B 639 3.877 -17.291 0.898 1.00 0.00 N ATOM 1775 CA ALA B 639 3.871 -18.677 1.348 1.00 0.00 C ATOM 1776 C ALA B 639 2.977 -19.538 0.462 1.00 0.00 C ATOM 1777 O ALA B 639 3.171 -20.750 0.359 1.00 0.00 O ATOM 1778 CB ALA B 639 3.416 -18.759 2.798 1.00 0.00 C ATOM 0 H ALA B 639 3.201 -16.691 1.370 1.00 0.00 H new ATOM 0 HA ALA B 639 4.888 -19.061 1.275 1.00 0.00 H new ATOM 0 HB1 ALA B 639 3.416 -19.800 3.121 1.00 0.00 H new ATOM 0 HB2 ALA B 639 4.097 -18.184 3.426 1.00 0.00 H new ATOM 0 HB3 ALA B 639 2.409 -18.352 2.887 1.00 0.00 H new ATOM 1784 N LEU B 640 1.998 -18.906 -0.175 1.00 0.00 N ATOM 1785 CA LEU B 640 1.074 -19.615 -1.052 1.00 0.00 C ATOM 1786 C LEU B 640 1.440 -19.399 -2.518 1.00 0.00 C ATOM 1787 O LEU B 640 0.577 -19.435 -3.395 1.00 0.00 O ATOM 1788 CB LEU B 640 -0.361 -19.148 -0.799 1.00 0.00 C ATOM 1789 CG LEU B 640 -0.754 -18.955 0.665 1.00 0.00 C ATOM 1790 CD1 LEU B 640 -2.069 -18.197 0.769 1.00 0.00 C ATOM 1791 CD2 LEU B 640 -0.853 -20.298 1.373 1.00 0.00 C ATOM 0 H LEU B 640 1.824 -17.904 -0.101 1.00 0.00 H new ATOM 0 HA LEU B 640 1.147 -20.680 -0.831 1.00 0.00 H new ATOM 0 HB2 LEU B 640 -0.513 -18.204 -1.323 1.00 0.00 H new ATOM 0 HB3 LEU B 640 -1.042 -19.873 -1.245 1.00 0.00 H new ATOM 0 HG LEU B 640 0.021 -18.366 1.155 1.00 0.00 H new ATOM 0 HD11 LEU B 640 -2.333 -18.069 1.819 1.00 0.00 H new ATOM 0 HD12 LEU B 640 -1.963 -17.219 0.299 1.00 0.00 H new ATOM 0 HD13 LEU B 640 -2.854 -18.759 0.263 1.00 0.00 H new ATOM 0 HD21 LEU B 640 -1.134 -20.140 2.414 1.00 0.00 H new ATOM 0 HD22 LEU B 640 -1.608 -20.913 0.883 1.00 0.00 H new ATOM 0 HD23 LEU B 640 0.111 -20.804 1.330 1.00 0.00 H new ATOM 1802 N GLN B 641 2.724 -19.176 -2.775 1.00 0.00 N ATOM 1803 CA GLN B 641 3.204 -18.956 -4.134 1.00 0.00 C ATOM 1804 C GLN B 641 2.823 -20.120 -5.042 1.00 0.00 C ATOM 1805 O GLN B 641 2.272 -19.923 -6.124 1.00 0.00 O ATOM 1806 CB GLN B 641 4.722 -18.767 -4.138 1.00 0.00 C ATOM 1807 CG GLN B 641 5.175 -17.471 -3.486 1.00 0.00 C ATOM 1808 CD GLN B 641 5.145 -16.295 -4.442 1.00 0.00 C ATOM 1809 OE1 GLN B 641 6.082 -16.083 -5.214 1.00 0.00 O ATOM 1810 NE2 GLN B 641 4.066 -15.523 -4.398 1.00 0.00 N ATOM 0 H GLN B 641 3.451 -19.143 -2.060 1.00 0.00 H new ATOM 0 HA GLN B 641 2.731 -18.051 -4.516 1.00 0.00 H new ATOM 0 HB2 GLN B 641 5.186 -19.606 -3.620 1.00 0.00 H new ATOM 0 HB3 GLN B 641 5.080 -18.791 -5.167 1.00 0.00 H new ATOM 0 HG2 GLN B 641 4.534 -17.256 -2.631 1.00 0.00 H new ATOM 0 HG3 GLN B 641 6.187 -17.596 -3.102 1.00 0.00 H new ATOM 0 HE21 GLN B 641 3.313 -15.735 -3.743 1.00 0.00 H new ATOM 0 HE22 GLN B 641 3.989 -14.718 -5.019 1.00 0.00 H new ATOM 1817 N SER B 642 3.120 -21.336 -4.593 1.00 0.00 N ATOM 1818 CA SER B 642 2.812 -22.534 -5.367 1.00 0.00 C ATOM 1819 C SER B 642 1.320 -22.612 -5.675 1.00 0.00 C ATOM 1820 O SER B 642 0.912 -23.208 -6.671 1.00 0.00 O ATOM 1821 CB SER B 642 3.255 -23.786 -4.607 1.00 0.00 C ATOM 1822 OG SER B 642 2.493 -23.960 -3.424 1.00 0.00 O ATOM 0 H SER B 642 3.573 -21.518 -3.698 1.00 0.00 H new ATOM 0 HA SER B 642 3.357 -22.479 -6.309 1.00 0.00 H new ATOM 0 HB2 SER B 642 3.145 -24.662 -5.247 1.00 0.00 H new ATOM 0 HB3 SER B 642 4.312 -23.707 -4.354 1.00 0.00 H new ATOM 0 HG SER B 642 2.794 -24.767 -2.957 1.00 0.00 H new ATOM 1827 N ALA B 643 0.511 -22.007 -4.810 1.00 0.00 N ATOM 1828 CA ALA B 643 -0.935 -22.006 -4.990 1.00 0.00 C ATOM 1829 C ALA B 643 -1.354 -21.012 -6.069 1.00 0.00 C ATOM 1830 O ALA B 643 -2.353 -21.216 -6.758 1.00 0.00 O ATOM 1831 CB ALA B 643 -1.630 -21.686 -3.675 1.00 0.00 C ATOM 0 H ALA B 643 0.833 -21.512 -3.978 1.00 0.00 H new ATOM 0 HA ALA B 643 -1.237 -23.002 -5.315 1.00 0.00 H new ATOM 0 HB1 ALA B 643 -2.710 -21.689 -3.824 1.00 0.00 H new ATOM 0 HB2 ALA B 643 -1.365 -22.437 -2.931 1.00 0.00 H new ATOM 0 HB3 ALA B 643 -1.314 -20.703 -3.326 1.00 0.00 H new ATOM 1837 N TRP B 644 -0.585 -19.939 -6.208 1.00 0.00 N ATOM 1838 CA TRP B 644 -0.878 -18.913 -7.202 1.00 0.00 C ATOM 1839 C TRP B 644 -1.060 -19.531 -8.584 1.00 0.00 C ATOM 1840 O TRP B 644 -0.457 -20.557 -8.898 1.00 0.00 O ATOM 1841 CB TRP B 644 0.244 -17.874 -7.238 1.00 0.00 C ATOM 1842 CG TRP B 644 -0.126 -16.625 -7.979 1.00 0.00 C ATOM 1843 CD1 TRP B 644 -0.083 -16.430 -9.330 1.00 0.00 C ATOM 1844 CD2 TRP B 644 -0.596 -15.398 -7.409 1.00 0.00 C ATOM 1845 NE1 TRP B 644 -0.497 -15.155 -9.634 1.00 0.00 N ATOM 1846 CE2 TRP B 644 -0.817 -14.502 -8.474 1.00 0.00 C ATOM 1847 CE3 TRP B 644 -0.852 -14.970 -6.104 1.00 0.00 C ATOM 1848 CZ2 TRP B 644 -1.282 -13.206 -8.271 1.00 0.00 C ATOM 1849 CZ3 TRP B 644 -1.312 -13.682 -5.904 1.00 0.00 C ATOM 1850 CH2 TRP B 644 -1.524 -12.812 -6.983 1.00 0.00 C ATOM 0 H TRP B 644 0.246 -19.756 -5.645 1.00 0.00 H new ATOM 0 HA TRP B 644 -1.809 -18.422 -6.918 1.00 0.00 H new ATOM 0 HB2 TRP B 644 0.521 -17.613 -6.216 1.00 0.00 H new ATOM 0 HB3 TRP B 644 1.124 -18.317 -7.704 1.00 0.00 H new ATOM 0 HD1 TRP B 644 0.230 -17.169 -10.053 1.00 0.00 H new ATOM 0 HE1 TRP B 644 -0.556 -14.759 -10.572 1.00 0.00 H new ATOM 0 HE3 TRP B 644 -0.693 -15.633 -5.267 1.00 0.00 H new ATOM 0 HZ2 TRP B 644 -1.446 -12.535 -9.101 1.00 0.00 H new ATOM 0 HZ3 TRP B 644 -1.512 -13.340 -4.899 1.00 0.00 H new ATOM 0 HH2 TRP B 644 -1.885 -11.812 -6.794 1.00 0.00 H new ATOM 1860 N GLN B 645 -1.893 -18.900 -9.404 1.00 0.00 N ATOM 1861 CA GLN B 645 -2.154 -19.390 -10.753 1.00 0.00 C ATOM 1862 C GLN B 645 -1.261 -18.687 -11.770 1.00 0.00 C ATOM 1863 O GLN B 645 -0.325 -19.281 -12.304 1.00 0.00 O ATOM 1864 CB GLN B 645 -3.625 -19.182 -11.118 1.00 0.00 C ATOM 1865 CG GLN B 645 -4.592 -19.865 -10.164 1.00 0.00 C ATOM 1866 CD GLN B 645 -4.717 -21.353 -10.426 1.00 0.00 C ATOM 1867 OE1 GLN B 645 -5.421 -21.776 -11.343 1.00 0.00 O ATOM 1868 NE2 GLN B 645 -4.032 -22.156 -9.620 1.00 0.00 N ATOM 0 H GLN B 645 -2.399 -18.049 -9.159 1.00 0.00 H new ATOM 0 HA GLN B 645 -1.929 -20.456 -10.775 1.00 0.00 H new ATOM 0 HB2 GLN B 645 -3.839 -18.113 -11.135 1.00 0.00 H new ATOM 0 HB3 GLN B 645 -3.797 -19.558 -12.127 1.00 0.00 H new ATOM 0 HG2 GLN B 645 -4.257 -19.707 -9.139 1.00 0.00 H new ATOM 0 HG3 GLN B 645 -5.574 -19.400 -10.254 1.00 0.00 H new ATOM 0 HE21 GLN B 645 -3.461 -21.762 -8.872 1.00 0.00 H new ATOM 0 HE22 GLN B 645 -4.077 -23.167 -9.749 1.00 0.00 H new ATOM 1875 N GLY B 646 -1.558 -17.418 -12.033 1.00 0.00 N ATOM 1876 CA GLY B 646 -0.772 -16.655 -12.986 1.00 0.00 C ATOM 1877 C GLY B 646 -1.469 -16.506 -14.324 1.00 0.00 C ATOM 1878 O GLY B 646 -1.124 -15.630 -15.117 1.00 0.00 O ATOM 0 H GLY B 646 -2.328 -16.905 -11.604 1.00 0.00 H new ATOM 0 HA2 GLY B 646 -0.567 -15.667 -12.575 1.00 0.00 H new ATOM 0 HA3 GLY B 646 0.190 -17.145 -13.134 1.00 0.00 H new ATOM 1882 N ASP B 647 -2.449 -17.365 -14.577 1.00 0.00 N ATOM 1883 CA ASP B 647 -3.196 -17.326 -15.829 1.00 0.00 C ATOM 1884 C ASP B 647 -4.488 -16.532 -15.667 1.00 0.00 C ATOM 1885 O ASP B 647 -5.462 -16.754 -16.388 1.00 0.00 O ATOM 1886 CB ASP B 647 -3.511 -18.746 -16.305 1.00 0.00 C ATOM 1887 CG ASP B 647 -2.331 -19.401 -16.994 1.00 0.00 C ATOM 1888 OD1 ASP B 647 -1.250 -18.778 -17.038 1.00 0.00 O ATOM 1889 OD2 ASP B 647 -2.488 -20.537 -17.488 1.00 0.00 O ATOM 0 H ASP B 647 -2.745 -18.097 -13.932 1.00 0.00 H new ATOM 0 HA ASP B 647 -2.577 -16.830 -16.577 1.00 0.00 H new ATOM 0 HB2 ASP B 647 -3.813 -19.353 -15.452 1.00 0.00 H new ATOM 0 HB3 ASP B 647 -4.358 -18.717 -16.991 1.00 0.00 H new ATOM 1893 N THR B 648 -4.491 -15.604 -14.714 1.00 0.00 N ATOM 1894 CA THR B 648 -5.664 -14.779 -14.456 1.00 0.00 C ATOM 1895 C THR B 648 -5.359 -13.303 -14.687 1.00 0.00 C ATOM 1896 O THR B 648 -6.245 -12.522 -15.031 1.00 0.00 O ATOM 1897 CB THR B 648 -6.176 -14.966 -13.015 1.00 0.00 C ATOM 1898 OG1 THR B 648 -5.115 -14.732 -12.083 1.00 0.00 O ATOM 1899 CG2 THR B 648 -6.732 -16.368 -12.816 1.00 0.00 C ATOM 0 H THR B 648 -3.694 -15.406 -14.109 1.00 0.00 H new ATOM 0 HA THR B 648 -6.437 -15.101 -15.153 1.00 0.00 H new ATOM 0 HB THR B 648 -6.976 -14.246 -12.842 1.00 0.00 H new ATOM 0 HG1 THR B 648 -5.405 -14.076 -11.415 1.00 0.00 H new ATOM 0 HG21 THR B 648 -7.087 -16.476 -11.791 1.00 0.00 H new ATOM 0 HG22 THR B 648 -7.559 -16.533 -13.506 1.00 0.00 H new ATOM 0 HG23 THR B 648 -5.948 -17.101 -13.008 1.00 0.00 H new ATOM 1907 N GLY B 649 -4.098 -12.927 -14.496 1.00 0.00 N ATOM 1908 CA GLY B 649 -3.699 -11.545 -14.689 1.00 0.00 C ATOM 1909 C GLY B 649 -2.319 -11.257 -14.133 1.00 0.00 C ATOM 1910 O GLY B 649 -1.338 -11.220 -14.878 1.00 0.00 O ATOM 0 H GLY B 649 -3.346 -13.555 -14.211 1.00 0.00 H new ATOM 0 HA2 GLY B 649 -3.715 -11.311 -15.753 1.00 0.00 H new ATOM 0 HA3 GLY B 649 -4.425 -10.890 -14.208 1.00 0.00 H new ATOM 1914 N ILE B 650 -2.241 -11.052 -12.824 1.00 0.00 N ATOM 1915 CA ILE B 650 -0.970 -10.766 -12.169 1.00 0.00 C ATOM 1916 C ILE B 650 -0.281 -12.049 -11.720 1.00 0.00 C ATOM 1917 O ILE B 650 -0.934 -12.999 -11.285 1.00 0.00 O ATOM 1918 CB ILE B 650 -1.161 -9.845 -10.949 1.00 0.00 C ATOM 1919 CG1 ILE B 650 -1.821 -8.531 -11.372 1.00 0.00 C ATOM 1920 CG2 ILE B 650 0.177 -9.579 -10.273 1.00 0.00 C ATOM 1921 CD1 ILE B 650 -2.051 -7.573 -10.224 1.00 0.00 C ATOM 0 H ILE B 650 -3.043 -11.078 -12.194 1.00 0.00 H new ATOM 0 HA ILE B 650 -0.344 -10.259 -12.903 1.00 0.00 H new ATOM 0 HB ILE B 650 -1.815 -10.344 -10.234 1.00 0.00 H new ATOM 0 HG12 ILE B 650 -1.196 -8.045 -12.121 1.00 0.00 H new ATOM 0 HG13 ILE B 650 -2.777 -8.751 -11.848 1.00 0.00 H new ATOM 0 HG21 ILE B 650 0.027 -8.927 -9.413 1.00 0.00 H new ATOM 0 HG22 ILE B 650 0.611 -10.522 -9.942 1.00 0.00 H new ATOM 0 HG23 ILE B 650 0.852 -9.097 -10.980 1.00 0.00 H new ATOM 0 HD11 ILE B 650 -2.522 -6.664 -10.598 1.00 0.00 H new ATOM 0 HD12 ILE B 650 -2.701 -8.041 -9.485 1.00 0.00 H new ATOM 0 HD13 ILE B 650 -1.096 -7.324 -9.761 1.00 0.00 H new ATOM 1932 N THR B 651 1.043 -12.072 -11.827 1.00 0.00 N ATOM 1933 CA THR B 651 1.823 -13.239 -11.432 1.00 0.00 C ATOM 1934 C THR B 651 2.418 -13.057 -10.040 1.00 0.00 C ATOM 1935 O THR B 651 2.307 -11.986 -9.442 1.00 0.00 O ATOM 1936 CB THR B 651 2.960 -13.520 -12.431 1.00 0.00 C ATOM 1937 OG1 THR B 651 2.810 -12.691 -13.589 1.00 0.00 O ATOM 1938 CG2 THR B 651 2.965 -14.984 -12.847 1.00 0.00 C ATOM 0 H THR B 651 1.599 -11.295 -12.184 1.00 0.00 H new ATOM 0 HA THR B 651 1.139 -14.088 -11.424 1.00 0.00 H new ATOM 0 HB THR B 651 3.908 -13.294 -11.942 1.00 0.00 H new ATOM 0 HG1 THR B 651 3.538 -12.874 -14.219 1.00 0.00 H new ATOM 0 HG21 THR B 651 3.777 -15.159 -13.553 1.00 0.00 H new ATOM 0 HG22 THR B 651 3.108 -15.612 -11.967 1.00 0.00 H new ATOM 0 HG23 THR B 651 2.014 -15.231 -13.319 1.00 0.00 H new ATOM 1946 N TYR B 652 3.051 -14.108 -9.531 1.00 0.00 N ATOM 1947 CA TYR B 652 3.663 -14.064 -8.208 1.00 0.00 C ATOM 1948 C TYR B 652 4.831 -13.084 -8.180 1.00 0.00 C ATOM 1949 O TYR B 652 5.032 -12.369 -7.198 1.00 0.00 O ATOM 1950 CB TYR B 652 4.143 -15.457 -7.798 1.00 0.00 C ATOM 1951 CG TYR B 652 5.212 -16.021 -8.706 1.00 0.00 C ATOM 1952 CD1 TYR B 652 4.875 -16.750 -9.839 1.00 0.00 C ATOM 1953 CD2 TYR B 652 6.560 -15.824 -8.431 1.00 0.00 C ATOM 1954 CE1 TYR B 652 5.848 -17.268 -10.672 1.00 0.00 C ATOM 1955 CE2 TYR B 652 7.540 -16.336 -9.259 1.00 0.00 C ATOM 1956 CZ TYR B 652 7.180 -17.058 -10.378 1.00 0.00 C ATOM 1957 OH TYR B 652 8.153 -17.570 -11.204 1.00 0.00 O ATOM 0 H TYR B 652 3.154 -15.000 -10.014 1.00 0.00 H new ATOM 0 HA TYR B 652 2.909 -13.723 -7.499 1.00 0.00 H new ATOM 0 HB2 TYR B 652 4.529 -15.414 -6.780 1.00 0.00 H new ATOM 0 HB3 TYR B 652 3.291 -16.137 -7.788 1.00 0.00 H new ATOM 0 HD1 TYR B 652 3.834 -16.915 -10.073 1.00 0.00 H new ATOM 0 HD2 TYR B 652 6.846 -15.261 -7.555 1.00 0.00 H new ATOM 0 HE1 TYR B 652 5.568 -17.834 -11.548 1.00 0.00 H new ATOM 0 HE2 TYR B 652 8.583 -16.172 -9.031 1.00 0.00 H new ATOM 0 HH TYR B 652 9.037 -17.331 -10.855 1.00 0.00 H new ATOM 1966 N GLN B 653 5.597 -13.055 -9.266 1.00 0.00 N ATOM 1967 CA GLN B 653 6.746 -12.162 -9.367 1.00 0.00 C ATOM 1968 C GLN B 653 6.297 -10.720 -9.575 1.00 0.00 C ATOM 1969 O GLN B 653 6.859 -9.794 -8.989 1.00 0.00 O ATOM 1970 CB GLN B 653 7.656 -12.596 -10.517 1.00 0.00 C ATOM 1971 CG GLN B 653 6.959 -12.626 -11.868 1.00 0.00 C ATOM 1972 CD GLN B 653 7.846 -13.166 -12.971 1.00 0.00 C ATOM 1973 OE1 GLN B 653 8.205 -14.343 -12.975 1.00 0.00 O ATOM 1974 NE2 GLN B 653 8.207 -12.305 -13.916 1.00 0.00 N ATOM 0 H GLN B 653 5.443 -13.639 -10.088 1.00 0.00 H new ATOM 0 HA GLN B 653 7.302 -12.219 -8.431 1.00 0.00 H new ATOM 0 HB2 GLN B 653 8.507 -11.917 -10.572 1.00 0.00 H new ATOM 0 HB3 GLN B 653 8.053 -13.588 -10.300 1.00 0.00 H new ATOM 0 HG2 GLN B 653 6.061 -13.240 -11.796 1.00 0.00 H new ATOM 0 HG3 GLN B 653 6.636 -11.618 -12.128 1.00 0.00 H new ATOM 0 HE21 GLN B 653 7.886 -11.338 -13.874 1.00 0.00 H new ATOM 0 HE22 GLN B 653 8.805 -12.611 -14.684 1.00 0.00 H new ATOM 1981 N ALA B 654 5.282 -10.536 -10.413 1.00 0.00 N ATOM 1982 CA ALA B 654 4.758 -9.206 -10.696 1.00 0.00 C ATOM 1983 C ALA B 654 4.026 -8.635 -9.486 1.00 0.00 C ATOM 1984 O ALA B 654 4.180 -7.460 -9.154 1.00 0.00 O ATOM 1985 CB ALA B 654 3.831 -9.250 -11.903 1.00 0.00 C ATOM 0 H ALA B 654 4.807 -11.291 -10.907 1.00 0.00 H new ATOM 0 HA ALA B 654 5.600 -8.551 -10.921 1.00 0.00 H new ATOM 0 HB1 ALA B 654 3.447 -8.250 -12.103 1.00 0.00 H new ATOM 0 HB2 ALA B 654 4.383 -9.608 -12.772 1.00 0.00 H new ATOM 0 HB3 ALA B 654 2.999 -9.924 -11.699 1.00 0.00 H new ATOM 1991 N TRP B 655 3.230 -9.472 -8.832 1.00 0.00 N ATOM 1992 CA TRP B 655 2.475 -9.049 -7.658 1.00 0.00 C ATOM 1993 C TRP B 655 3.411 -8.616 -6.535 1.00 0.00 C ATOM 1994 O TRP B 655 3.172 -7.608 -5.871 1.00 0.00 O ATOM 1995 CB TRP B 655 1.567 -10.182 -7.175 1.00 0.00 C ATOM 1996 CG TRP B 655 0.572 -9.746 -6.143 1.00 0.00 C ATOM 1997 CD1 TRP B 655 -0.760 -9.513 -6.336 1.00 0.00 C ATOM 1998 CD2 TRP B 655 0.829 -9.490 -4.758 1.00 0.00 C ATOM 1999 NE1 TRP B 655 -1.345 -9.127 -5.155 1.00 0.00 N ATOM 2000 CE2 TRP B 655 -0.392 -9.106 -4.171 1.00 0.00 C ATOM 2001 CE3 TRP B 655 1.972 -9.550 -3.957 1.00 0.00 C ATOM 2002 CZ2 TRP B 655 -0.500 -8.783 -2.821 1.00 0.00 C ATOM 2003 CZ3 TRP B 655 1.864 -9.229 -2.617 1.00 0.00 C ATOM 2004 CH2 TRP B 655 0.634 -8.850 -2.060 1.00 0.00 C ATOM 0 H TRP B 655 3.090 -10.448 -9.094 1.00 0.00 H new ATOM 0 HA TRP B 655 1.859 -8.195 -7.941 1.00 0.00 H new ATOM 0 HB2 TRP B 655 1.034 -10.600 -8.029 1.00 0.00 H new ATOM 0 HB3 TRP B 655 2.183 -10.980 -6.761 1.00 0.00 H new ATOM 0 HD1 TRP B 655 -1.277 -9.617 -7.279 1.00 0.00 H new ATOM 0 HE1 TRP B 655 -2.330 -8.894 -5.031 1.00 0.00 H new ATOM 0 HE3 TRP B 655 2.923 -9.842 -4.377 1.00 0.00 H new ATOM 0 HZ2 TRP B 655 -1.446 -8.490 -2.390 1.00 0.00 H new ATOM 0 HZ3 TRP B 655 2.741 -9.271 -1.989 1.00 0.00 H new ATOM 0 HH2 TRP B 655 0.581 -8.606 -1.009 1.00 0.00 H new ATOM 2014 N GLN B 656 4.475 -9.384 -6.329 1.00 0.00 N ATOM 2015 CA GLN B 656 5.447 -9.078 -5.286 1.00 0.00 C ATOM 2016 C GLN B 656 5.982 -7.658 -5.440 1.00 0.00 C ATOM 2017 O GLN B 656 5.906 -6.852 -4.513 1.00 0.00 O ATOM 2018 CB GLN B 656 6.602 -10.080 -5.325 1.00 0.00 C ATOM 2019 CG GLN B 656 6.365 -11.317 -4.475 1.00 0.00 C ATOM 2020 CD GLN B 656 7.656 -11.967 -4.018 1.00 0.00 C ATOM 2021 OE1 GLN B 656 8.070 -12.997 -4.552 1.00 0.00 O ATOM 2022 NE2 GLN B 656 8.301 -11.368 -3.023 1.00 0.00 N ATOM 0 H GLN B 656 4.686 -10.222 -6.870 1.00 0.00 H new ATOM 0 HA GLN B 656 4.944 -9.154 -4.322 1.00 0.00 H new ATOM 0 HB2 GLN B 656 6.771 -10.386 -6.357 1.00 0.00 H new ATOM 0 HB3 GLN B 656 7.512 -9.586 -4.986 1.00 0.00 H new ATOM 0 HG2 GLN B 656 5.771 -11.045 -3.603 1.00 0.00 H new ATOM 0 HG3 GLN B 656 5.781 -12.039 -5.046 1.00 0.00 H new ATOM 0 HE21 GLN B 656 7.922 -10.516 -2.609 1.00 0.00 H new ATOM 0 HE22 GLN B 656 9.175 -11.760 -2.673 1.00 0.00 H new ATOM 2029 N ALA B 657 6.525 -7.360 -6.615 1.00 0.00 N ATOM 2030 CA ALA B 657 7.072 -6.037 -6.890 1.00 0.00 C ATOM 2031 C ALA B 657 5.967 -4.986 -6.939 1.00 0.00 C ATOM 2032 O ALA B 657 6.154 -3.858 -6.484 1.00 0.00 O ATOM 2033 CB ALA B 657 7.849 -6.050 -8.198 1.00 0.00 C ATOM 0 H ALA B 657 6.598 -8.017 -7.392 1.00 0.00 H new ATOM 0 HA ALA B 657 7.751 -5.775 -6.079 1.00 0.00 H new ATOM 0 HB1 ALA B 657 8.252 -5.056 -8.392 1.00 0.00 H new ATOM 0 HB2 ALA B 657 8.668 -6.766 -8.128 1.00 0.00 H new ATOM 0 HB3 ALA B 657 7.185 -6.337 -9.013 1.00 0.00 H new ATOM 2039 N GLN B 658 4.821 -5.365 -7.494 1.00 0.00 N ATOM 2040 CA GLN B 658 3.689 -4.453 -7.603 1.00 0.00 C ATOM 2041 C GLN B 658 3.255 -3.957 -6.228 1.00 0.00 C ATOM 2042 O GLN B 658 3.142 -2.753 -5.998 1.00 0.00 O ATOM 2043 CB GLN B 658 2.516 -5.143 -8.303 1.00 0.00 C ATOM 2044 CG GLN B 658 2.539 -4.996 -9.816 1.00 0.00 C ATOM 2045 CD GLN B 658 1.392 -5.725 -10.489 1.00 0.00 C ATOM 2046 OE1 GLN B 658 0.230 -5.348 -10.341 1.00 0.00 O ATOM 2047 NE2 GLN B 658 1.715 -6.774 -11.236 1.00 0.00 N ATOM 0 H GLN B 658 4.652 -6.296 -7.875 1.00 0.00 H new ATOM 0 HA GLN B 658 4.003 -3.594 -8.196 1.00 0.00 H new ATOM 0 HB2 GLN B 658 2.525 -6.203 -8.049 1.00 0.00 H new ATOM 0 HB3 GLN B 658 1.582 -4.731 -7.920 1.00 0.00 H new ATOM 0 HG2 GLN B 658 2.495 -3.938 -10.076 1.00 0.00 H new ATOM 0 HG3 GLN B 658 3.484 -5.379 -10.201 1.00 0.00 H new ATOM 0 HE21 GLN B 658 2.692 -7.051 -11.331 1.00 0.00 H new ATOM 0 HE22 GLN B 658 0.986 -7.303 -11.715 1.00 0.00 H new ATOM 2054 N TRP B 659 3.012 -4.893 -5.316 1.00 0.00 N ATOM 2055 CA TRP B 659 2.589 -4.550 -3.963 1.00 0.00 C ATOM 2056 C TRP B 659 3.556 -3.558 -3.326 1.00 0.00 C ATOM 2057 O TRP B 659 3.164 -2.459 -2.937 1.00 0.00 O ATOM 2058 CB TRP B 659 2.493 -5.810 -3.102 1.00 0.00 C ATOM 2059 CG TRP B 659 1.970 -5.549 -1.722 1.00 0.00 C ATOM 2060 CD1 TRP B 659 2.705 -5.413 -0.580 1.00 0.00 C ATOM 2061 CD2 TRP B 659 0.598 -5.396 -1.341 1.00 0.00 C ATOM 2062 NE1 TRP B 659 1.874 -5.183 0.490 1.00 0.00 N ATOM 2063 CE2 TRP B 659 0.577 -5.167 0.049 1.00 0.00 C ATOM 2064 CE3 TRP B 659 -0.613 -5.426 -2.037 1.00 0.00 C ATOM 2065 CZ2 TRP B 659 -0.609 -4.973 0.752 1.00 0.00 C ATOM 2066 CZ3 TRP B 659 -1.788 -5.234 -1.337 1.00 0.00 C ATOM 2067 CH2 TRP B 659 -1.780 -5.008 0.045 1.00 0.00 C ATOM 0 H TRP B 659 3.101 -5.894 -5.489 1.00 0.00 H new ATOM 0 HA TRP B 659 1.606 -4.084 -4.024 1.00 0.00 H new ATOM 0 HB2 TRP B 659 1.844 -6.532 -3.598 1.00 0.00 H new ATOM 0 HB3 TRP B 659 3.480 -6.267 -3.028 1.00 0.00 H new ATOM 0 HD1 TRP B 659 3.782 -5.477 -0.525 1.00 0.00 H new ATOM 0 HE1 TRP B 659 2.174 -5.046 1.455 1.00 0.00 H new ATOM 0 HE3 TRP B 659 -0.630 -5.596 -3.103 1.00 0.00 H new ATOM 0 HZ2 TRP B 659 -0.605 -4.801 1.818 1.00 0.00 H new ATOM 0 HZ3 TRP B 659 -2.730 -5.259 -1.865 1.00 0.00 H new ATOM 0 HH2 TRP B 659 -2.716 -4.858 0.563 1.00 0.00 H new ATOM 2077 N ASN B 660 4.821 -3.953 -3.223 1.00 0.00 N ATOM 2078 CA ASN B 660 5.843 -3.097 -2.633 1.00 0.00 C ATOM 2079 C ASN B 660 5.908 -1.752 -3.349 1.00 0.00 C ATOM 2080 O ASN B 660 5.798 -0.699 -2.723 1.00 0.00 O ATOM 2081 CB ASN B 660 7.209 -3.785 -2.690 1.00 0.00 C ATOM 2082 CG ASN B 660 8.237 -3.105 -1.807 1.00 0.00 C ATOM 2083 OD1 ASN B 660 8.069 -3.024 -0.590 1.00 0.00 O ATOM 2084 ND2 ASN B 660 9.308 -2.612 -2.417 1.00 0.00 N ATOM 0 H ASN B 660 5.162 -4.860 -3.540 1.00 0.00 H new ATOM 0 HA ASN B 660 5.575 -2.920 -1.591 1.00 0.00 H new ATOM 0 HB2 ASN B 660 7.102 -4.825 -2.383 1.00 0.00 H new ATOM 0 HB3 ASN B 660 7.566 -3.792 -3.720 1.00 0.00 H new ATOM 0 HD21 ASN B 660 10.033 -2.143 -1.874 1.00 0.00 H new ATOM 0 HD22 ASN B 660 9.406 -2.702 -3.428 1.00 0.00 H new ATOM 2090 N GLN B 661 6.086 -1.797 -4.666 1.00 0.00 N ATOM 2091 CA GLN B 661 6.165 -0.582 -5.467 1.00 0.00 C ATOM 2092 C GLN B 661 4.964 0.321 -5.207 1.00 0.00 C ATOM 2093 O GLN B 661 5.079 1.546 -5.233 1.00 0.00 O ATOM 2094 CB GLN B 661 6.243 -0.931 -6.954 1.00 0.00 C ATOM 2095 CG GLN B 661 7.590 -1.493 -7.378 1.00 0.00 C ATOM 2096 CD GLN B 661 8.581 -0.410 -7.757 1.00 0.00 C ATOM 2097 OE1 GLN B 661 8.423 0.261 -8.777 1.00 0.00 O ATOM 2098 NE2 GLN B 661 9.610 -0.235 -6.937 1.00 0.00 N ATOM 0 H GLN B 661 6.178 -2.661 -5.200 1.00 0.00 H new ATOM 0 HA GLN B 661 7.069 -0.045 -5.179 1.00 0.00 H new ATOM 0 HB2 GLN B 661 5.465 -1.658 -7.189 1.00 0.00 H new ATOM 0 HB3 GLN B 661 6.031 -0.037 -7.540 1.00 0.00 H new ATOM 0 HG2 GLN B 661 8.003 -2.089 -6.564 1.00 0.00 H new ATOM 0 HG3 GLN B 661 7.449 -2.164 -8.225 1.00 0.00 H new ATOM 0 HE21 GLN B 661 9.701 -0.814 -6.102 1.00 0.00 H new ATOM 0 HE22 GLN B 661 10.309 0.479 -7.142 1.00 0.00 H new ATOM 2105 N ALA B 662 3.812 -0.293 -4.956 1.00 0.00 N ATOM 2106 CA ALA B 662 2.591 0.456 -4.689 1.00 0.00 C ATOM 2107 C ALA B 662 2.625 1.086 -3.301 1.00 0.00 C ATOM 2108 O ALA B 662 2.439 2.293 -3.151 1.00 0.00 O ATOM 2109 CB ALA B 662 1.376 -0.449 -4.831 1.00 0.00 C ATOM 0 H ALA B 662 3.699 -1.306 -4.932 1.00 0.00 H new ATOM 0 HA ALA B 662 2.520 1.260 -5.422 1.00 0.00 H new ATOM 0 HB1 ALA B 662 0.471 0.123 -4.629 1.00 0.00 H new ATOM 0 HB2 ALA B 662 1.335 -0.847 -5.845 1.00 0.00 H new ATOM 0 HB3 ALA B 662 1.451 -1.273 -4.121 1.00 0.00 H new ATOM 2115 N MET B 663 2.863 0.260 -2.287 1.00 0.00 N ATOM 2116 CA MET B 663 2.921 0.737 -0.910 1.00 0.00 C ATOM 2117 C MET B 663 3.873 1.923 -0.786 1.00 0.00 C ATOM 2118 O MET B 663 3.604 2.871 -0.049 1.00 0.00 O ATOM 2119 CB MET B 663 3.368 -0.389 0.023 1.00 0.00 C ATOM 2120 CG MET B 663 2.239 -1.320 0.436 1.00 0.00 C ATOM 2121 SD MET B 663 2.187 -1.604 2.216 1.00 0.00 S ATOM 2122 CE MET B 663 0.674 -0.748 2.651 1.00 0.00 C ATOM 0 H MET B 663 3.019 -0.742 -2.393 1.00 0.00 H new ATOM 0 HA MET B 663 1.922 1.063 -0.622 1.00 0.00 H new ATOM 0 HB2 MET B 663 4.146 -0.971 -0.470 1.00 0.00 H new ATOM 0 HB3 MET B 663 3.814 0.047 0.917 1.00 0.00 H new ATOM 0 HG2 MET B 663 1.288 -0.897 0.112 1.00 0.00 H new ATOM 0 HG3 MET B 663 2.355 -2.275 -0.077 1.00 0.00 H new ATOM 0 HE1 MET B 663 0.137 -1.320 3.408 1.00 0.00 H new ATOM 0 HE2 MET B 663 0.915 0.239 3.045 1.00 0.00 H new ATOM 0 HE3 MET B 663 0.048 -0.642 1.765 1.00 0.00 H new ATOM 2130 N GLU B 664 4.984 1.863 -1.512 1.00 0.00 N ATOM 2131 CA GLU B 664 5.976 2.932 -1.481 1.00 0.00 C ATOM 2132 C GLU B 664 5.337 4.275 -1.826 1.00 0.00 C ATOM 2133 O GLU B 664 5.425 5.232 -1.056 1.00 0.00 O ATOM 2134 CB GLU B 664 7.114 2.632 -2.457 1.00 0.00 C ATOM 2135 CG GLU B 664 8.146 3.743 -2.550 1.00 0.00 C ATOM 2136 CD GLU B 664 9.251 3.432 -3.541 1.00 0.00 C ATOM 2137 OE1 GLU B 664 9.398 2.249 -3.912 1.00 0.00 O ATOM 2138 OE2 GLU B 664 9.968 4.371 -3.945 1.00 0.00 O ATOM 0 H GLU B 664 5.220 1.086 -2.129 1.00 0.00 H new ATOM 0 HA GLU B 664 6.380 2.988 -0.470 1.00 0.00 H new ATOM 0 HB2 GLU B 664 7.611 1.711 -2.151 1.00 0.00 H new ATOM 0 HB3 GLU B 664 6.694 2.454 -3.447 1.00 0.00 H new ATOM 0 HG2 GLU B 664 7.652 4.669 -2.842 1.00 0.00 H new ATOM 0 HG3 GLU B 664 8.583 3.911 -1.566 1.00 0.00 H new ATOM 2143 N ASP B 665 4.695 4.338 -2.987 1.00 0.00 N ATOM 2144 CA ASP B 665 4.041 5.562 -3.434 1.00 0.00 C ATOM 2145 C ASP B 665 2.800 5.853 -2.596 1.00 0.00 C ATOM 2146 O ASP B 665 2.408 7.009 -2.428 1.00 0.00 O ATOM 2147 CB ASP B 665 3.659 5.452 -4.911 1.00 0.00 C ATOM 2148 CG ASP B 665 3.153 6.763 -5.479 1.00 0.00 C ATOM 2149 OD1 ASP B 665 1.941 7.036 -5.352 1.00 0.00 O ATOM 2150 OD2 ASP B 665 3.968 7.517 -6.047 1.00 0.00 O ATOM 0 H ASP B 665 4.613 3.555 -3.636 1.00 0.00 H new ATOM 0 HA ASP B 665 4.744 6.386 -3.309 1.00 0.00 H new ATOM 0 HB2 ASP B 665 4.526 5.122 -5.484 1.00 0.00 H new ATOM 0 HB3 ASP B 665 2.890 4.688 -5.028 1.00 0.00 H new ATOM 2154 N LEU B 666 2.186 4.798 -2.072 1.00 0.00 N ATOM 2155 CA LEU B 666 0.988 4.940 -1.252 1.00 0.00 C ATOM 2156 C LEU B 666 1.297 5.695 0.037 1.00 0.00 C ATOM 2157 O LEU B 666 0.487 6.492 0.512 1.00 0.00 O ATOM 2158 CB LEU B 666 0.406 3.564 -0.922 1.00 0.00 C ATOM 2159 CG LEU B 666 -0.067 3.362 0.518 1.00 0.00 C ATOM 2160 CD1 LEU B 666 -1.288 4.221 0.805 1.00 0.00 C ATOM 2161 CD2 LEU B 666 -0.372 1.894 0.778 1.00 0.00 C ATOM 0 H LEU B 666 2.498 3.835 -2.200 1.00 0.00 H new ATOM 0 HA LEU B 666 0.254 5.512 -1.820 1.00 0.00 H new ATOM 0 HB2 LEU B 666 -0.436 3.379 -1.589 1.00 0.00 H new ATOM 0 HB3 LEU B 666 1.161 2.810 -1.144 1.00 0.00 H new ATOM 0 HG LEU B 666 0.734 3.671 1.190 1.00 0.00 H new ATOM 0 HD11 LEU B 666 -1.610 4.064 1.834 1.00 0.00 H new ATOM 0 HD12 LEU B 666 -1.036 5.272 0.660 1.00 0.00 H new ATOM 0 HD13 LEU B 666 -2.095 3.945 0.126 1.00 0.00 H new ATOM 0 HD21 LEU B 666 -0.707 1.769 1.808 1.00 0.00 H new ATOM 0 HD22 LEU B 666 -1.155 1.559 0.098 1.00 0.00 H new ATOM 0 HD23 LEU B 666 0.528 1.301 0.615 1.00 0.00 H new ATOM 2172 N VAL B 667 2.475 5.440 0.599 1.00 0.00 N ATOM 2173 CA VAL B 667 2.893 6.098 1.831 1.00 0.00 C ATOM 2174 C VAL B 667 3.247 7.560 1.580 1.00 0.00 C ATOM 2175 O VAL B 667 2.803 8.450 2.307 1.00 0.00 O ATOM 2176 CB VAL B 667 4.106 5.389 2.463 1.00 0.00 C ATOM 2177 CG1 VAL B 667 4.474 6.039 3.788 1.00 0.00 C ATOM 2178 CG2 VAL B 667 3.818 3.907 2.647 1.00 0.00 C ATOM 0 H VAL B 667 3.156 4.782 0.220 1.00 0.00 H new ATOM 0 HA VAL B 667 2.050 6.044 2.520 1.00 0.00 H new ATOM 0 HB VAL B 667 4.957 5.490 1.789 1.00 0.00 H new ATOM 0 HG11 VAL B 667 5.333 5.525 4.219 1.00 0.00 H new ATOM 0 HG12 VAL B 667 4.724 7.087 3.622 1.00 0.00 H new ATOM 0 HG13 VAL B 667 3.629 5.972 4.473 1.00 0.00 H new ATOM 0 HG21 VAL B 667 4.685 3.421 3.094 1.00 0.00 H new ATOM 0 HG22 VAL B 667 2.955 3.783 3.300 1.00 0.00 H new ATOM 0 HG23 VAL B 667 3.608 3.454 1.678 1.00 0.00 H new ATOM 2188 N ARG B 668 4.048 7.801 0.548 1.00 0.00 N ATOM 2189 CA ARG B 668 4.463 9.155 0.201 1.00 0.00 C ATOM 2190 C ARG B 668 3.254 10.078 0.079 1.00 0.00 C ATOM 2191 O ARG B 668 3.342 11.273 0.361 1.00 0.00 O ATOM 2192 CB ARG B 668 5.249 9.151 -1.110 1.00 0.00 C ATOM 2193 CG ARG B 668 6.697 8.715 -0.950 1.00 0.00 C ATOM 2194 CD ARG B 668 7.339 8.409 -2.294 1.00 0.00 C ATOM 2195 NE ARG B 668 7.577 9.620 -3.075 1.00 0.00 N ATOM 2196 CZ ARG B 668 8.564 10.474 -2.825 1.00 0.00 C ATOM 2197 NH1 ARG B 668 9.400 10.250 -1.821 1.00 0.00 N ATOM 2198 NH2 ARG B 668 8.716 11.554 -3.581 1.00 0.00 N ATOM 0 H ARG B 668 4.423 7.076 -0.063 1.00 0.00 H new ATOM 0 HA ARG B 668 5.105 9.527 0.999 1.00 0.00 H new ATOM 0 HB2 ARG B 668 4.754 8.487 -1.818 1.00 0.00 H new ATOM 0 HB3 ARG B 668 5.225 10.152 -1.541 1.00 0.00 H new ATOM 0 HG2 ARG B 668 7.261 9.500 -0.447 1.00 0.00 H new ATOM 0 HG3 ARG B 668 6.744 7.831 -0.314 1.00 0.00 H new ATOM 0 HD2 ARG B 668 8.284 7.889 -2.135 1.00 0.00 H new ATOM 0 HD3 ARG B 668 6.695 7.734 -2.858 1.00 0.00 H new ATOM 0 HE ARG B 668 6.951 9.821 -3.855 1.00 0.00 H new ATOM 0 HH11 ARG B 668 9.287 9.421 -1.238 1.00 0.00 H new ATOM 0 HH12 ARG B 668 10.157 10.907 -1.631 1.00 0.00 H new ATOM 0 HH21 ARG B 668 8.075 11.729 -4.355 1.00 0.00 H new ATOM 0 HH22 ARG B 668 9.474 12.209 -3.388 1.00 0.00 H new ATOM 2209 N ALA B 669 2.127 9.516 -0.346 1.00 0.00 N ATOM 2210 CA ALA B 669 0.901 10.288 -0.505 1.00 0.00 C ATOM 2211 C ALA B 669 0.470 10.913 0.818 1.00 0.00 C ATOM 2212 O ALA B 669 -0.076 12.015 0.846 1.00 0.00 O ATOM 2213 CB ALA B 669 -0.209 9.408 -1.062 1.00 0.00 C ATOM 0 H ALA B 669 2.038 8.529 -0.586 1.00 0.00 H new ATOM 0 HA ALA B 669 1.098 11.095 -1.211 1.00 0.00 H new ATOM 0 HB1 ALA B 669 -1.119 9.998 -1.175 1.00 0.00 H new ATOM 0 HB2 ALA B 669 0.092 9.014 -2.033 1.00 0.00 H new ATOM 0 HB3 ALA B 669 -0.396 8.581 -0.377 1.00 0.00 H new ATOM 2219 N TYR B 670 0.719 10.201 1.911 1.00 0.00 N ATOM 2220 CA TYR B 670 0.353 10.685 3.238 1.00 0.00 C ATOM 2221 C TYR B 670 1.436 11.599 3.802 1.00 0.00 C ATOM 2222 O TYR B 670 1.155 12.711 4.248 1.00 0.00 O ATOM 2223 CB TYR B 670 0.118 9.507 4.186 1.00 0.00 C ATOM 2224 CG TYR B 670 -0.432 9.915 5.533 1.00 0.00 C ATOM 2225 CD1 TYR B 670 0.391 10.476 6.501 1.00 0.00 C ATOM 2226 CD2 TYR B 670 -1.777 9.741 5.838 1.00 0.00 C ATOM 2227 CE1 TYR B 670 -0.108 10.850 7.735 1.00 0.00 C ATOM 2228 CE2 TYR B 670 -2.285 10.114 7.067 1.00 0.00 C ATOM 2229 CZ TYR B 670 -1.445 10.667 8.013 1.00 0.00 C ATOM 2230 OH TYR B 670 -1.947 11.039 9.239 1.00 0.00 O ATOM 0 H TYR B 670 1.172 9.287 1.905 1.00 0.00 H new ATOM 0 HA TYR B 670 -0.569 11.259 3.147 1.00 0.00 H new ATOM 0 HB2 TYR B 670 -0.574 8.807 3.717 1.00 0.00 H new ATOM 0 HB3 TYR B 670 1.059 8.976 4.333 1.00 0.00 H new ATOM 0 HD1 TYR B 670 1.439 10.623 6.286 1.00 0.00 H new ATOM 0 HD2 TYR B 670 -2.436 9.307 5.101 1.00 0.00 H new ATOM 0 HE1 TYR B 670 0.547 11.283 8.477 1.00 0.00 H new ATOM 0 HE2 TYR B 670 -3.333 9.974 7.287 1.00 0.00 H new ATOM 0 HH TYR B 670 -2.907 10.844 9.272 1.00 0.00 H new ATOM 2239 N HIS B 671 2.676 11.120 3.778 1.00 0.00 N ATOM 2240 CA HIS B 671 3.804 11.894 4.285 1.00 0.00 C ATOM 2241 C HIS B 671 3.877 13.259 3.606 1.00 0.00 C ATOM 2242 O HIS B 671 4.010 14.286 4.269 1.00 0.00 O ATOM 2243 CB HIS B 671 5.111 11.133 4.068 1.00 0.00 C ATOM 2244 CG HIS B 671 6.324 11.882 4.525 1.00 0.00 C ATOM 2245 ND1 HIS B 671 6.309 12.762 5.587 1.00 0.00 N ATOM 2246 CD2 HIS B 671 7.595 11.878 4.060 1.00 0.00 C ATOM 2247 CE1 HIS B 671 7.518 13.268 5.755 1.00 0.00 C ATOM 2248 NE2 HIS B 671 8.317 12.747 4.841 1.00 0.00 N ATOM 0 H HIS B 671 2.925 10.201 3.413 1.00 0.00 H new ATOM 0 HA HIS B 671 3.655 12.048 5.354 1.00 0.00 H new ATOM 0 HB2 HIS B 671 5.060 10.182 4.598 1.00 0.00 H new ATOM 0 HB3 HIS B 671 5.215 10.902 3.008 1.00 0.00 H new ATOM 0 HD2 HIS B 671 7.971 11.299 3.229 1.00 0.00 H new ATOM 0 HE1 HIS B 671 7.804 13.985 6.510 1.00 0.00 H new ATOM 0 HE2 HIS B 671 9.309 12.956 4.733 1.00 0.00 H new ATOM 2255 N ALA B 672 3.787 13.259 2.280 1.00 0.00 N ATOM 2256 CA ALA B 672 3.841 14.497 1.511 1.00 0.00 C ATOM 2257 C ALA B 672 2.727 15.451 1.928 1.00 0.00 C ATOM 2258 O ALA B 672 2.962 16.643 2.131 1.00 0.00 O ATOM 2259 CB ALA B 672 3.752 14.198 0.022 1.00 0.00 C ATOM 0 H ALA B 672 3.676 12.416 1.716 1.00 0.00 H new ATOM 0 HA ALA B 672 4.795 14.982 1.717 1.00 0.00 H new ATOM 0 HB1 ALA B 672 3.793 15.131 -0.540 1.00 0.00 H new ATOM 0 HB2 ALA B 672 4.586 13.560 -0.272 1.00 0.00 H new ATOM 0 HB3 ALA B 672 2.813 13.688 -0.191 1.00 0.00 H new ATOM 2265 N MET B 673 1.515 14.920 2.055 1.00 0.00 N ATOM 2266 CA MET B 673 0.366 15.726 2.448 1.00 0.00 C ATOM 2267 C MET B 673 0.643 16.470 3.751 1.00 0.00 C ATOM 2268 O MET B 673 0.231 17.617 3.921 1.00 0.00 O ATOM 2269 CB MET B 673 -0.874 14.842 2.606 1.00 0.00 C ATOM 2270 CG MET B 673 -2.116 15.608 3.034 1.00 0.00 C ATOM 2271 SD MET B 673 -2.932 14.866 4.460 1.00 0.00 S ATOM 2272 CE MET B 673 -3.191 13.195 3.871 1.00 0.00 C ATOM 0 H MET B 673 1.304 13.936 1.891 1.00 0.00 H new ATOM 0 HA MET B 673 0.183 16.460 1.663 1.00 0.00 H new ATOM 0 HB2 MET B 673 -1.075 14.340 1.660 1.00 0.00 H new ATOM 0 HB3 MET B 673 -0.665 14.065 3.341 1.00 0.00 H new ATOM 0 HG2 MET B 673 -1.841 16.635 3.272 1.00 0.00 H new ATOM 0 HG3 MET B 673 -2.817 15.651 2.200 1.00 0.00 H new ATOM 0 HE1 MET B 673 -4.260 12.995 3.801 1.00 0.00 H new ATOM 0 HE2 MET B 673 -2.736 13.081 2.887 1.00 0.00 H new ATOM 0 HE3 MET B 673 -2.735 12.490 4.565 1.00 0.00 H new ATOM 2280 N SER B 674 1.343 15.809 4.666 1.00 0.00 N ATOM 2281 CA SER B 674 1.672 16.406 5.955 1.00 0.00 C ATOM 2282 C SER B 674 2.893 17.313 5.838 1.00 0.00 C ATOM 2283 O SER B 674 3.050 18.264 6.604 1.00 0.00 O ATOM 2284 CB SER B 674 1.930 15.315 6.997 1.00 0.00 C ATOM 2285 OG SER B 674 1.011 15.408 8.071 1.00 0.00 O ATOM 0 H SER B 674 1.694 14.860 4.539 1.00 0.00 H new ATOM 0 HA SER B 674 0.822 17.009 6.275 1.00 0.00 H new ATOM 0 HB2 SER B 674 1.849 14.334 6.529 1.00 0.00 H new ATOM 0 HB3 SER B 674 2.948 15.404 7.377 1.00 0.00 H new ATOM 0 HG SER B 674 0.610 14.529 8.235 1.00 0.00 H new ATOM 2290 N SER B 675 3.756 17.010 4.873 1.00 0.00 N ATOM 2291 CA SER B 675 4.966 17.795 4.658 1.00 0.00 C ATOM 2292 C SER B 675 4.622 19.215 4.218 1.00 0.00 C ATOM 2293 O SER B 675 5.369 20.158 4.482 1.00 0.00 O ATOM 2294 CB SER B 675 5.853 17.124 3.606 1.00 0.00 C ATOM 2295 OG SER B 675 6.161 15.791 3.974 1.00 0.00 O ATOM 0 H SER B 675 3.640 16.228 4.229 1.00 0.00 H new ATOM 0 HA SER B 675 5.508 17.847 5.602 1.00 0.00 H new ATOM 0 HB2 SER B 675 5.346 17.130 2.641 1.00 0.00 H new ATOM 0 HB3 SER B 675 6.775 17.694 3.486 1.00 0.00 H new ATOM 0 HG SER B 675 5.343 15.251 3.962 1.00 0.00 H new ATOM 2300 N THR B 676 3.485 19.359 3.544 1.00 0.00 N ATOM 2301 CA THR B 676 3.041 20.663 3.067 1.00 0.00 C ATOM 2302 C THR B 676 2.125 21.338 4.081 1.00 0.00 C ATOM 2303 O THR B 676 1.546 22.390 3.807 1.00 0.00 O ATOM 2304 CB THR B 676 2.299 20.545 1.722 1.00 0.00 C ATOM 2305 OG1 THR B 676 2.250 19.175 1.308 1.00 0.00 O ATOM 2306 CG2 THR B 676 2.986 21.380 0.650 1.00 0.00 C ATOM 0 H THR B 676 2.856 18.589 3.316 1.00 0.00 H new ATOM 0 HA THR B 676 3.936 21.270 2.930 1.00 0.00 H new ATOM 0 HB THR B 676 1.284 20.920 1.858 1.00 0.00 H new ATOM 0 HG1 THR B 676 1.775 19.108 0.453 1.00 0.00 H new ATOM 0 HG21 THR B 676 2.445 21.281 -0.291 1.00 0.00 H new ATOM 0 HG22 THR B 676 2.996 22.426 0.955 1.00 0.00 H new ATOM 0 HG23 THR B 676 4.010 21.031 0.518 1.00 0.00 H new ATOM 2314 N HIS B 677 1.997 20.727 5.255 1.00 0.00 N ATOM 2315 CA HIS B 677 1.152 21.271 6.312 1.00 0.00 C ATOM 2316 C HIS B 677 1.668 22.629 6.776 1.00 0.00 C ATOM 2317 O HIS B 677 0.903 23.458 7.266 1.00 0.00 O ATOM 2318 CB HIS B 677 1.093 20.303 7.495 1.00 0.00 C ATOM 2319 CG HIS B 677 -0.007 20.610 8.464 1.00 0.00 C ATOM 2320 ND1 HIS B 677 -1.342 20.442 8.166 1.00 0.00 N ATOM 2321 CD2 HIS B 677 0.039 21.073 9.735 1.00 0.00 C ATOM 2322 CE1 HIS B 677 -2.072 20.791 9.210 1.00 0.00 C ATOM 2323 NE2 HIS B 677 -1.259 21.179 10.176 1.00 0.00 N ATOM 0 H HIS B 677 2.468 19.855 5.498 1.00 0.00 H new ATOM 0 HA HIS B 677 0.148 21.403 5.909 1.00 0.00 H new ATOM 0 HB2 HIS B 677 0.962 19.289 7.118 1.00 0.00 H new ATOM 0 HB3 HIS B 677 2.047 20.326 8.021 1.00 0.00 H new ATOM 0 HD2 HIS B 677 0.929 21.314 10.298 1.00 0.00 H new ATOM 0 HE1 HIS B 677 -3.150 20.764 9.265 1.00 0.00 H new ATOM 0 HE2 HIS B 677 -1.547 21.504 11.099 1.00 0.00 H new ATOM 2330 N GLU B 678 2.970 22.848 6.618 1.00 0.00 N ATOM 2331 CA GLU B 678 3.588 24.105 7.023 1.00 0.00 C ATOM 2332 C GLU B 678 2.993 25.277 6.248 1.00 0.00 C ATOM 2333 O GLU B 678 2.990 26.413 6.723 1.00 0.00 O ATOM 2334 CB GLU B 678 5.100 24.050 6.803 1.00 0.00 C ATOM 2335 CG GLU B 678 5.866 23.469 7.980 1.00 0.00 C ATOM 2336 CD GLU B 678 7.271 24.029 8.096 1.00 0.00 C ATOM 2337 OE1 GLU B 678 7.437 25.255 7.920 1.00 0.00 O ATOM 2338 OE2 GLU B 678 8.203 23.242 8.362 1.00 0.00 O ATOM 0 H GLU B 678 3.617 22.171 6.213 1.00 0.00 H new ATOM 0 HA GLU B 678 3.388 24.253 8.084 1.00 0.00 H new ATOM 0 HB2 GLU B 678 5.308 23.453 5.915 1.00 0.00 H new ATOM 0 HB3 GLU B 678 5.466 25.057 6.603 1.00 0.00 H new ATOM 0 HG2 GLU B 678 5.320 23.674 8.901 1.00 0.00 H new ATOM 0 HG3 GLU B 678 5.918 22.385 7.875 1.00 0.00 H new ATOM 2343 N ALA B 679 2.488 24.993 5.051 1.00 0.00 N ATOM 2344 CA ALA B 679 1.889 26.023 4.212 1.00 0.00 C ATOM 2345 C ALA B 679 0.837 26.815 4.980 1.00 0.00 C ATOM 2346 O ALA B 679 0.619 27.997 4.713 1.00 0.00 O ATOM 2347 CB ALA B 679 1.276 25.398 2.967 1.00 0.00 C ATOM 0 H ALA B 679 2.482 24.059 4.642 1.00 0.00 H new ATOM 0 HA ALA B 679 2.676 26.714 3.910 1.00 0.00 H new ATOM 0 HB1 ALA B 679 0.832 26.178 2.349 1.00 0.00 H new ATOM 0 HB2 ALA B 679 2.051 24.883 2.399 1.00 0.00 H new ATOM 0 HB3 ALA B 679 0.506 24.685 3.260 1.00 0.00 H new ATOM 2353 N ASN B 680 0.187 26.158 5.934 1.00 0.00 N ATOM 2354 CA ASN B 680 -0.843 26.801 6.741 1.00 0.00 C ATOM 2355 C ASN B 680 -0.319 28.092 7.363 1.00 0.00 C ATOM 2356 O ASN B 680 -0.931 29.152 7.227 1.00 0.00 O ATOM 2357 CB ASN B 680 -1.327 25.852 7.839 1.00 0.00 C ATOM 2358 CG ASN B 680 -2.791 26.059 8.178 1.00 0.00 C ATOM 2359 OD1 ASN B 680 -3.220 27.174 8.472 1.00 0.00 O ATOM 2360 ND2 ASN B 680 -3.565 24.980 8.136 1.00 0.00 N ATOM 0 H ASN B 680 0.355 25.179 6.168 1.00 0.00 H new ATOM 0 HA ASN B 680 -1.681 27.047 6.088 1.00 0.00 H new ATOM 0 HB2 ASN B 680 -1.173 24.822 7.519 1.00 0.00 H new ATOM 0 HB3 ASN B 680 -0.725 26.000 8.735 1.00 0.00 H new ATOM 0 HD21 ASN B 680 -4.559 25.056 8.353 1.00 0.00 H new ATOM 0 HD22 ASN B 680 -3.165 24.075 7.887 1.00 0.00 H new ATOM 2366 N THR B 681 0.817 27.995 8.046 1.00 0.00 N ATOM 2367 CA THR B 681 1.423 29.154 8.690 1.00 0.00 C ATOM 2368 C THR B 681 1.991 30.121 7.658 1.00 0.00 C ATOM 2369 O THR B 681 2.003 31.334 7.869 1.00 0.00 O ATOM 2370 CB THR B 681 2.546 28.736 9.657 1.00 0.00 C ATOM 2371 OG1 THR B 681 3.601 28.091 8.935 1.00 0.00 O ATOM 2372 CG2 THR B 681 2.014 27.799 10.732 1.00 0.00 C ATOM 0 H THR B 681 1.336 27.126 8.168 1.00 0.00 H new ATOM 0 HA THR B 681 0.634 29.651 9.254 1.00 0.00 H new ATOM 0 HB THR B 681 2.933 29.634 10.138 1.00 0.00 H new ATOM 0 HG1 THR B 681 3.220 27.553 8.210 1.00 0.00 H new ATOM 0 HG21 THR B 681 2.825 27.517 11.403 1.00 0.00 H new ATOM 0 HG22 THR B 681 1.232 28.303 11.300 1.00 0.00 H new ATOM 0 HG23 THR B 681 1.603 26.904 10.264 1.00 0.00 H new ATOM 2380 N MET B 682 2.461 29.578 6.540 1.00 0.00 N ATOM 2381 CA MET B 682 3.030 30.395 5.473 1.00 0.00 C ATOM 2382 C MET B 682 2.016 31.421 4.976 1.00 0.00 C ATOM 2383 O MET B 682 2.381 32.529 4.585 1.00 0.00 O ATOM 2384 CB MET B 682 3.488 29.510 4.313 1.00 0.00 C ATOM 2385 CG MET B 682 4.861 28.892 4.526 1.00 0.00 C ATOM 2386 SD MET B 682 5.396 27.888 3.127 1.00 0.00 S ATOM 2387 CE MET B 682 5.284 26.244 3.828 1.00 0.00 C ATOM 0 H MET B 682 2.459 28.576 6.349 1.00 0.00 H new ATOM 0 HA MET B 682 3.892 30.927 5.876 1.00 0.00 H new ATOM 0 HB2 MET B 682 2.759 28.713 4.165 1.00 0.00 H new ATOM 0 HB3 MET B 682 3.503 30.103 3.398 1.00 0.00 H new ATOM 0 HG2 MET B 682 5.589 29.685 4.699 1.00 0.00 H new ATOM 0 HG3 MET B 682 4.842 28.275 5.425 1.00 0.00 H new ATOM 0 HE1 MET B 682 6.249 25.744 3.740 1.00 0.00 H new ATOM 0 HE2 MET B 682 5.007 26.315 4.880 1.00 0.00 H new ATOM 0 HE3 MET B 682 4.528 25.670 3.292 1.00 0.00 H new ATOM 2395 N ALA B 683 0.742 31.043 4.991 1.00 0.00 N ATOM 2396 CA ALA B 683 -0.323 31.931 4.543 1.00 0.00 C ATOM 2397 C ALA B 683 -0.244 33.283 5.246 1.00 0.00 C ATOM 2398 O ALA B 683 -0.627 34.307 4.684 1.00 0.00 O ATOM 2399 CB ALA B 683 -1.682 31.289 4.784 1.00 0.00 C ATOM 0 H ALA B 683 0.423 30.128 5.309 1.00 0.00 H new ATOM 0 HA ALA B 683 -0.196 32.099 3.473 1.00 0.00 H new ATOM 0 HB1 ALA B 683 -2.468 31.963 4.445 1.00 0.00 H new ATOM 0 HB2 ALA B 683 -1.745 30.351 4.232 1.00 0.00 H new ATOM 0 HB3 ALA B 683 -1.808 31.092 5.849 1.00 0.00 H new ATOM 2405 N MET B 684 0.256 33.275 6.477 1.00 0.00 N ATOM 2406 CA MET B 684 0.385 34.502 7.255 1.00 0.00 C ATOM 2407 C MET B 684 1.136 35.569 6.466 1.00 0.00 C ATOM 2408 O MET B 684 2.142 35.282 5.817 1.00 0.00 O ATOM 2409 CB MET B 684 1.111 34.220 8.572 1.00 0.00 C ATOM 2410 CG MET B 684 0.235 33.549 9.618 1.00 0.00 C ATOM 2411 SD MET B 684 -0.348 34.698 10.879 1.00 0.00 S ATOM 2412 CE MET B 684 -0.771 33.565 12.199 1.00 0.00 C ATOM 0 H MET B 684 0.578 32.434 6.957 1.00 0.00 H new ATOM 0 HA MET B 684 -0.617 34.873 7.472 1.00 0.00 H new ATOM 0 HB2 MET B 684 1.975 33.586 8.373 1.00 0.00 H new ATOM 0 HB3 MET B 684 1.491 35.158 8.976 1.00 0.00 H new ATOM 0 HG2 MET B 684 -0.623 33.089 9.127 1.00 0.00 H new ATOM 0 HG3 MET B 684 0.797 32.746 10.096 1.00 0.00 H new ATOM 0 HE1 MET B 684 -1.149 34.127 13.053 1.00 0.00 H new ATOM 0 HE2 MET B 684 -1.538 32.872 11.852 1.00 0.00 H new ATOM 0 HE3 MET B 684 0.116 33.005 12.496 1.00 0.00 H new ATOM 2420 N MET B 685 0.641 36.801 6.526 1.00 0.00 N ATOM 2421 CA MET B 685 1.266 37.912 5.817 1.00 0.00 C ATOM 2422 C MET B 685 2.732 38.053 6.214 1.00 0.00 C ATOM 2423 O MET B 685 3.547 38.562 5.444 1.00 0.00 O ATOM 2424 CB MET B 685 0.519 39.215 6.106 1.00 0.00 C ATOM 2425 CG MET B 685 0.719 40.280 5.040 1.00 0.00 C ATOM 2426 SD MET B 685 -0.833 40.817 4.296 1.00 0.00 S ATOM 2427 CE MET B 685 -0.798 42.569 4.666 1.00 0.00 C ATOM 0 H MET B 685 -0.191 37.055 7.058 1.00 0.00 H new ATOM 0 HA MET B 685 1.215 37.703 4.748 1.00 0.00 H new ATOM 0 HB2 MET B 685 -0.546 39.001 6.199 1.00 0.00 H new ATOM 0 HB3 MET B 685 0.850 39.608 7.067 1.00 0.00 H new ATOM 0 HG2 MET B 685 1.223 41.140 5.481 1.00 0.00 H new ATOM 0 HG3 MET B 685 1.375 39.891 4.262 1.00 0.00 H new ATOM 0 HE1 MET B 685 -1.696 43.043 4.268 1.00 0.00 H new ATOM 0 HE2 MET B 685 -0.760 42.712 5.746 1.00 0.00 H new ATOM 0 HE3 MET B 685 0.083 43.020 4.209 1.00 0.00 H new ATOM 2435 N ALA B 686 3.061 37.601 7.419 1.00 0.00 N ATOM 2436 CA ALA B 686 4.428 37.676 7.917 1.00 0.00 C ATOM 2437 C ALA B 686 5.395 36.968 6.974 1.00 0.00 C ATOM 2438 O ALA B 686 6.485 37.468 6.695 1.00 0.00 O ATOM 2439 CB ALA B 686 4.516 37.078 9.313 1.00 0.00 C ATOM 0 H ALA B 686 2.398 37.178 8.069 1.00 0.00 H new ATOM 0 HA ALA B 686 4.713 38.727 7.966 1.00 0.00 H new ATOM 0 HB1 ALA B 686 5.543 37.141 9.672 1.00 0.00 H new ATOM 0 HB2 ALA B 686 3.862 37.630 9.987 1.00 0.00 H new ATOM 0 HB3 ALA B 686 4.206 36.033 9.282 1.00 0.00 H new ATOM 2445 N ARG B 687 4.990 35.799 6.487 1.00 0.00 N ATOM 2446 CA ARG B 687 5.822 35.022 5.577 1.00 0.00 C ATOM 2447 C ARG B 687 5.774 35.601 4.167 1.00 0.00 C ATOM 2448 O ARG B 687 6.753 35.532 3.423 1.00 0.00 O ATOM 2449 CB ARG B 687 5.363 33.562 5.555 1.00 0.00 C ATOM 2450 CG ARG B 687 6.454 32.575 5.936 1.00 0.00 C ATOM 2451 CD ARG B 687 6.184 31.941 7.292 1.00 0.00 C ATOM 2452 NE ARG B 687 7.178 30.926 7.630 1.00 0.00 N ATOM 2453 CZ ARG B 687 8.432 31.209 7.965 1.00 0.00 C ATOM 2454 NH1 ARG B 687 8.843 32.469 8.006 1.00 0.00 N ATOM 2455 NH2 ARG B 687 9.278 30.230 8.260 1.00 0.00 N ATOM 0 H ARG B 687 4.091 35.370 6.708 1.00 0.00 H new ATOM 0 HA ARG B 687 6.850 35.069 5.936 1.00 0.00 H new ATOM 0 HB2 ARG B 687 4.523 33.444 6.239 1.00 0.00 H new ATOM 0 HB3 ARG B 687 4.998 33.320 4.557 1.00 0.00 H new ATOM 0 HG2 ARG B 687 6.523 31.796 5.176 1.00 0.00 H new ATOM 0 HG3 ARG B 687 7.417 33.086 5.957 1.00 0.00 H new ATOM 0 HD2 ARG B 687 6.181 32.715 8.060 1.00 0.00 H new ATOM 0 HD3 ARG B 687 5.192 31.490 7.290 1.00 0.00 H new ATOM 0 HE ARG B 687 6.894 29.947 7.608 1.00 0.00 H new ATOM 0 HH11 ARG B 687 8.196 33.224 7.780 1.00 0.00 H new ATOM 0 HH12 ARG B 687 9.806 32.683 8.264 1.00 0.00 H new ATOM 0 HH21 ARG B 687 8.966 29.260 8.230 1.00 0.00 H new ATOM 0 HH22 ARG B 687 10.241 30.448 8.517 1.00 0.00 H new ATOM 2466 N ASP B 688 4.631 36.173 3.805 1.00 0.00 N ATOM 2467 CA ASP B 688 4.456 36.766 2.485 1.00 0.00 C ATOM 2468 C ASP B 688 4.288 38.279 2.586 1.00 0.00 C ATOM 2469 O ASP B 688 3.209 38.814 2.329 1.00 0.00 O ATOM 2470 CB ASP B 688 3.244 36.151 1.783 1.00 0.00 C ATOM 2471 CG ASP B 688 3.463 34.697 1.417 1.00 0.00 C ATOM 2472 OD1 ASP B 688 4.619 34.234 1.493 1.00 0.00 O ATOM 2473 OD2 ASP B 688 2.477 34.021 1.053 1.00 0.00 O ATOM 0 H ASP B 688 3.811 36.238 4.408 1.00 0.00 H new ATOM 0 HA ASP B 688 5.351 36.557 1.899 1.00 0.00 H new ATOM 0 HB2 ASP B 688 2.372 36.232 2.432 1.00 0.00 H new ATOM 0 HB3 ASP B 688 3.023 36.721 0.880 1.00 0.00 H new ATOM 2477 N THR B 689 5.362 38.965 2.966 1.00 0.00 N ATOM 2478 CA THR B 689 5.334 40.415 3.103 1.00 0.00 C ATOM 2479 C THR B 689 5.636 41.101 1.776 1.00 0.00 C ATOM 2480 O THR B 689 5.095 42.164 1.478 1.00 0.00 O ATOM 2481 CB THR B 689 6.344 40.899 4.160 1.00 0.00 C ATOM 2482 OG1 THR B 689 6.253 42.320 4.311 1.00 0.00 O ATOM 2483 CG2 THR B 689 7.763 40.515 3.768 1.00 0.00 C ATOM 0 H THR B 689 6.262 38.538 3.184 1.00 0.00 H new ATOM 0 HA THR B 689 4.327 40.681 3.424 1.00 0.00 H new ATOM 0 HB THR B 689 6.103 40.418 5.108 1.00 0.00 H new ATOM 0 HG1 THR B 689 6.897 42.619 4.986 1.00 0.00 H new ATOM 0 HG21 THR B 689 8.459 40.867 4.529 1.00 0.00 H new ATOM 0 HG22 THR B 689 7.836 39.431 3.683 1.00 0.00 H new ATOM 0 HG23 THR B 689 8.012 40.971 2.810 1.00 0.00 H new ATOM 2491 N ALA B 690 6.506 40.483 0.982 1.00 0.00 N ATOM 2492 CA ALA B 690 6.878 41.033 -0.316 1.00 0.00 C ATOM 2493 C ALA B 690 5.972 40.497 -1.420 1.00 0.00 C ATOM 2494 O ALA B 690 5.828 41.118 -2.472 1.00 0.00 O ATOM 2495 CB ALA B 690 8.334 40.715 -0.625 1.00 0.00 C ATOM 0 H ALA B 690 6.965 39.603 1.215 1.00 0.00 H new ATOM 0 HA ALA B 690 6.754 42.115 -0.274 1.00 0.00 H new ATOM 0 HB1 ALA B 690 8.599 41.131 -1.597 1.00 0.00 H new ATOM 0 HB2 ALA B 690 8.973 41.151 0.143 1.00 0.00 H new ATOM 0 HB3 ALA B 690 8.475 39.634 -0.643 1.00 0.00 H new ATOM 2501 N GLU B 691 5.365 39.341 -1.172 1.00 0.00 N ATOM 2502 CA GLU B 691 4.473 38.722 -2.146 1.00 0.00 C ATOM 2503 C GLU B 691 3.136 39.455 -2.202 1.00 0.00 C ATOM 2504 O GLU B 691 2.750 39.986 -3.243 1.00 0.00 O ATOM 2505 CB GLU B 691 4.247 37.249 -1.800 1.00 0.00 C ATOM 2506 CG GLU B 691 5.494 36.543 -1.295 1.00 0.00 C ATOM 2507 CD GLU B 691 5.662 35.159 -1.889 1.00 0.00 C ATOM 2508 OE1 GLU B 691 5.643 35.040 -3.132 1.00 0.00 O ATOM 2509 OE2 GLU B 691 5.813 34.194 -1.111 1.00 0.00 O ATOM 0 H GLU B 691 5.474 38.814 -0.305 1.00 0.00 H new ATOM 0 HA GLU B 691 4.945 38.788 -3.126 1.00 0.00 H new ATOM 0 HB2 GLU B 691 3.468 37.178 -1.041 1.00 0.00 H new ATOM 0 HB3 GLU B 691 3.879 36.729 -2.685 1.00 0.00 H new ATOM 0 HG2 GLU B 691 6.370 37.146 -1.534 1.00 0.00 H new ATOM 0 HG3 GLU B 691 5.448 36.465 -0.209 1.00 0.00 H new ATOM 2514 N ALA B 692 2.433 39.478 -1.074 1.00 0.00 N ATOM 2515 CA ALA B 692 1.140 40.145 -0.995 1.00 0.00 C ATOM 2516 C ALA B 692 1.276 41.640 -1.262 1.00 0.00 C ATOM 2517 O ALA B 692 0.322 42.294 -1.682 1.00 0.00 O ATOM 2518 CB ALA B 692 0.506 39.906 0.368 1.00 0.00 C ATOM 0 H ALA B 692 2.737 39.043 -0.203 1.00 0.00 H new ATOM 0 HA ALA B 692 0.493 39.723 -1.764 1.00 0.00 H new ATOM 0 HB1 ALA B 692 -0.459 40.410 0.414 1.00 0.00 H new ATOM 0 HB2 ALA B 692 0.365 38.836 0.521 1.00 0.00 H new ATOM 0 HB3 ALA B 692 1.158 40.301 1.147 1.00 0.00 H new ATOM 2524 N ALA B 693 2.467 42.175 -1.016 1.00 0.00 N ATOM 2525 CA ALA B 693 2.728 43.592 -1.231 1.00 0.00 C ATOM 2526 C ALA B 693 3.104 43.866 -2.683 1.00 0.00 C ATOM 2527 O ALA B 693 2.919 44.975 -3.185 1.00 0.00 O ATOM 2528 CB ALA B 693 3.829 44.074 -0.299 1.00 0.00 C ATOM 0 H ALA B 693 3.267 41.647 -0.667 1.00 0.00 H new ATOM 0 HA ALA B 693 1.814 44.142 -1.009 1.00 0.00 H new ATOM 0 HB1 ALA B 693 4.013 45.134 -0.471 1.00 0.00 H new ATOM 0 HB2 ALA B 693 3.522 43.922 0.736 1.00 0.00 H new ATOM 0 HB3 ALA B 693 4.742 43.511 -0.493 1.00 0.00 H new ATOM 2534 N LYS B 694 3.635 42.850 -3.355 1.00 0.00 N ATOM 2535 CA LYS B 694 4.037 42.980 -4.750 1.00 0.00 C ATOM 2536 C LYS B 694 2.837 43.305 -5.634 1.00 0.00 C ATOM 2537 O LYS B 694 1.704 43.366 -5.159 1.00 0.00 O ATOM 2538 CB LYS B 694 4.705 41.690 -5.232 1.00 0.00 C ATOM 2539 CG LYS B 694 6.172 41.860 -5.587 1.00 0.00 C ATOM 2540 CD LYS B 694 6.898 40.526 -5.612 1.00 0.00 C ATOM 2541 CE LYS B 694 8.055 40.504 -4.623 1.00 0.00 C ATOM 2542 NZ LYS B 694 9.227 39.756 -5.158 1.00 0.00 N ATOM 0 H LYS B 694 3.797 41.926 -2.955 1.00 0.00 H new ATOM 0 HA LYS B 694 4.751 43.800 -4.821 1.00 0.00 H new ATOM 0 HB2 LYS B 694 4.614 40.931 -4.455 1.00 0.00 H new ATOM 0 HB3 LYS B 694 4.169 41.318 -6.105 1.00 0.00 H new ATOM 0 HG2 LYS B 694 6.258 42.340 -6.562 1.00 0.00 H new ATOM 0 HG3 LYS B 694 6.648 42.521 -4.863 1.00 0.00 H new ATOM 0 HD2 LYS B 694 6.198 39.725 -5.373 1.00 0.00 H new ATOM 0 HD3 LYS B 694 7.273 40.333 -6.617 1.00 0.00 H new ATOM 0 HE2 LYS B 694 8.352 41.526 -4.389 1.00 0.00 H new ATOM 0 HE3 LYS B 694 7.727 40.046 -3.690 1.00 0.00 H new ATOM 0 HZ1 LYS B 694 9.994 39.764 -4.455 1.00 0.00 H new ATOM 0 HZ2 LYS B 694 8.950 38.774 -5.358 1.00 0.00 H new ATOM 0 HZ3 LYS B 694 9.556 40.208 -6.035 1.00 0.00 H new ATOM 2552 N TRP B 695 3.096 43.512 -6.920 1.00 0.00 N ATOM 2553 CA TRP B 695 2.036 43.829 -7.870 1.00 0.00 C ATOM 2554 C TRP B 695 2.522 43.657 -9.305 1.00 0.00 C ATOM 2555 O TRP B 695 2.081 42.755 -10.015 1.00 0.00 O ATOM 2556 CB TRP B 695 1.542 45.261 -7.655 1.00 0.00 C ATOM 2557 CG TRP B 695 0.090 45.340 -7.294 1.00 0.00 C ATOM 2558 CD1 TRP B 695 -0.460 46.030 -6.251 1.00 0.00 C ATOM 2559 CD2 TRP B 695 -0.998 44.705 -7.975 1.00 0.00 C ATOM 2560 NE1 TRP B 695 -1.824 45.862 -6.242 1.00 0.00 N ATOM 2561 CE2 TRP B 695 -2.178 45.054 -7.289 1.00 0.00 C ATOM 2562 CE3 TRP B 695 -1.091 43.878 -9.097 1.00 0.00 C ATOM 2563 CZ2 TRP B 695 -3.433 44.602 -7.691 1.00 0.00 C ATOM 2564 CZ3 TRP B 695 -2.336 43.431 -9.494 1.00 0.00 C ATOM 2565 CH2 TRP B 695 -3.494 43.794 -8.793 1.00 0.00 C ATOM 0 H TRP B 695 4.030 43.466 -7.329 1.00 0.00 H new ATOM 0 HA TRP B 695 1.211 43.137 -7.700 1.00 0.00 H new ATOM 0 HB2 TRP B 695 2.131 45.726 -6.865 1.00 0.00 H new ATOM 0 HB3 TRP B 695 1.715 45.838 -8.564 1.00 0.00 H new ATOM 0 HD1 TRP B 695 0.096 46.621 -5.538 1.00 0.00 H new ATOM 0 HE1 TRP B 695 -2.468 46.272 -5.566 1.00 0.00 H new ATOM 0 HE3 TRP B 695 -0.205 43.593 -9.644 1.00 0.00 H new ATOM 0 HZ2 TRP B 695 -4.326 44.880 -7.151 1.00 0.00 H new ATOM 0 HZ3 TRP B 695 -2.419 42.791 -10.360 1.00 0.00 H new ATOM 0 HH2 TRP B 695 -4.453 43.429 -9.129 1.00 0.00 H new ATOM 2575 N GLY B 696 3.435 44.529 -9.726 1.00 0.00 N ATOM 2576 CA GLY B 696 3.965 44.454 -11.075 1.00 0.00 C ATOM 2577 C GLY B 696 3.187 45.313 -12.052 1.00 0.00 C ATOM 2578 O GLY B 696 3.057 46.522 -11.860 1.00 0.00 O ATOM 0 H GLY B 696 3.816 45.285 -9.157 1.00 0.00 H new ATOM 0 HA2 GLY B 696 5.009 44.769 -11.070 1.00 0.00 H new ATOM 0 HA3 GLY B 696 3.946 43.418 -11.412 1.00 0.00 H new ATOM 2582 N GLY B 697 2.669 44.688 -13.105 1.00 0.00 N ATOM 2583 CA GLY B 697 1.907 45.420 -14.101 1.00 0.00 C ATOM 2584 C GLY B 697 2.667 45.588 -15.402 1.00 0.00 C ATOM 2585 O GLY B 697 3.606 46.379 -15.483 1.00 0.00 O ATOM 0 H GLY B 697 2.763 43.689 -13.286 1.00 0.00 H new ATOM 0 HA2 GLY B 697 0.971 44.896 -14.295 1.00 0.00 H new ATOM 0 HA3 GLY B 697 1.647 46.402 -13.706 1.00 0.00 H new TER 2589 GLY B 697