USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1071 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 NoAdj-H: A 19 HIS HE2 : A 19 HIS NE2 : A 93 ZNZN :(H bumps) USER MOD NoAdj-H: A 42 HIS HE2 : A 42 HIS NE2 : A 94 ZNZN :(H bumps) USER MOD NoAdj-H: A 67 HIS HE2 : A 67 HIS NE2 : A 95 ZNZN :(H bumps) USER MOD Set 1.1: A 87 LYS NZ :NH3+ -138:sc= 3.09 (180deg=0.168) USER MOD Set 1.2: B 745 SER OG : rot -35:sc= 0.922 USER MOD Set 2.1: A 41 GLN : amide:sc= 0.604 K(o=1.5,f=-2.1) USER MOD Set 2.2: A 44 LYS NZ :NH3+ -142:sc= 0.889 (180deg=0) USER MOD Single : A 1 SER N :NH3+ -124:sc= -0.0766 (180deg=-1.34) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 3 GLN : amide:sc= 1.03 K(o=1,f=0) USER MOD Single : A 5 SER OG : rot 81:sc= 0.936 USER MOD Single : A 9 SER OG : rot 75:sc= 1.26 USER MOD Single : A 11 GLN : amide:sc= -0.0846 X(o=-0.085,f=-0.085) USER MOD Single : A 13 CYS SG : rot -134:sc= 0.361 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 SER OG : rot 79:sc= 0.744 USER MOD Single : A 21 CYS SG : rot 78:sc= 0.305 USER MOD Single : A 22 GLN : amide:sc= 0.894 K(o=0.89,f=0) USER MOD Single : A 25 ASN : amide:sc= 1.3 K(o=1.3,f=-0.024) USER MOD Single : A 27 ASN : amide:sc= -0.0342 X(o=-0.034,f=-0.034) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= 1.18 K(o=1.2,f=-0.4) USER MOD Single : A 35 LYS NZ :NH3+ 151:sc= 0.733 (180deg=0.25) USER MOD Single : A 36 MET CE :methyl 172:sc= -0.206 (180deg=-0.352) USER MOD Single : A 37 LYS NZ :NH3+ 170:sc= 3.16 (180deg=2.41) USER MOD Single : A 43 THR OG1 : rot -140:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ -175:sc= 0.539 (180deg=0.522) USER MOD Single : A 49 LYS NZ :NH3+ 149:sc= -3.97! (180deg=-5.74!) USER MOD Single : A 50 THR OG1 : rot -92:sc= 0 USER MOD Single : A 51 ASN : amide:sc= 0.751 K(o=0.75,f=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= 0.792 K(o=0.79,f=-0.97) USER MOD Single : A 64 CYS SG : rot 78:sc= 0.258 USER MOD Single : A 65 CYS SG : rot 153:sc= 0.195 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -160:sc= 0.921 (180deg=0.632) USER MOD Single : A 70 HIS : no HE2:sc= 0.49 K(o=0.49,f=-1.5!) USER MOD Single : A 72 GLN : amide:sc= 0.61 K(o=0.61,f=0) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 85 LYS NZ :NH3+ -170:sc= 2.38 (180deg=1.83!) USER MOD Single : A 86 HIS : no HD1:sc= -0.0751 X(o=-0.075,f=-0.075) USER MOD Single : A 90 GLN : amide:sc= 0.881 K(o=0.88,f=-0.0069) USER MOD Single : A 91 GLN : amide:sc= 0 K(o=0,f=-0.98) USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : B 707 SER OG : rot 180:sc= -0.0431 USER MOD Single : B 708 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 709 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 710 SER OG : rot 180:sc= 0 USER MOD Single : B 713 HIS : no HE2:sc= 0.709 K(o=0.71,f=-2.9!) USER MOD Single : B 715 SER OG : rot 180:sc= 0 USER MOD Single : B 718 GLN : amide:sc= 0.975 K(o=0.97,f=-0.0018) USER MOD Single : B 719 THR OG1 : rot 180:sc= 0.0046 USER MOD Single : B 720 THR OG1 : rot 180:sc= 0.392 USER MOD Single : B 722 ASN : amide:sc= -0.0659 X(o=-0.066,f=-0.046) USER MOD Single : B 726 MET CE :methyl 176:sc= -0.0101 (180deg=-0.0374) USER MOD Single : B 727 SER OG : rot 79:sc= 1.2 USER MOD Single : B 735 SER OG : rot 73:sc= 0.797 USER MOD Single : B 740 SER OG : rot 180:sc= 0 USER MOD Single : B 746 MET CE :methyl 146:sc= -2.95! (180deg=-5.28!) USER MOD Single : B 747 MET CE :methyl -158:sc= -0.628 (180deg=-1.94!) USER MOD Single : B 748 ASN : amide:sc=-0.00344 K(o=-0.0034,f=-0.87) USER MOD Single : B 749 THR OG1 : rot 170:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 51.506 -12.407 33.637 1.00 0.00 N ATOM 2 CA SER A 1 51.074 -12.810 32.291 1.00 0.00 C ATOM 3 C SER A 1 50.713 -11.597 31.401 1.00 0.00 C ATOM 4 O SER A 1 49.543 -11.437 31.036 1.00 0.00 O ATOM 5 CB SER A 1 49.911 -13.813 32.388 1.00 0.00 C ATOM 6 OG SER A 1 50.322 -15.001 33.048 1.00 0.00 O ATOM 0 H1 SER A 1 52.450 -12.799 33.831 1.00 0.00 H new ATOM 0 H2 SER A 1 51.544 -11.369 33.693 1.00 0.00 H new ATOM 0 H3 SER A 1 50.830 -12.767 34.341 1.00 0.00 H new ATOM 0 HA SER A 1 51.915 -13.302 31.803 1.00 0.00 H new ATOM 0 HB2 SER A 1 49.079 -13.361 32.928 1.00 0.00 H new ATOM 0 HB3 SER A 1 49.549 -14.054 31.389 1.00 0.00 H new ATOM 0 HG SER A 1 49.567 -15.624 33.100 1.00 0.00 H new ATOM 12 N PRO A 2 51.678 -10.714 31.056 1.00 0.00 N ATOM 13 CA PRO A 2 51.433 -9.488 30.285 1.00 0.00 C ATOM 14 C PRO A 2 51.019 -9.771 28.832 1.00 0.00 C ATOM 15 O PRO A 2 49.837 -9.680 28.490 1.00 0.00 O ATOM 16 CB PRO A 2 52.723 -8.664 30.419 1.00 0.00 C ATOM 17 CG PRO A 2 53.814 -9.710 30.658 1.00 0.00 C ATOM 18 CD PRO A 2 53.088 -10.825 31.411 1.00 0.00 C ATOM 0 HA PRO A 2 50.580 -8.930 30.671 1.00 0.00 H new ATOM 0 HB2 PRO A 2 52.919 -8.083 29.518 1.00 0.00 H new ATOM 0 HB3 PRO A 2 52.660 -7.958 31.247 1.00 0.00 H new ATOM 0 HG2 PRO A 2 54.236 -10.070 29.720 1.00 0.00 H new ATOM 0 HG3 PRO A 2 54.638 -9.302 31.243 1.00 0.00 H new ATOM 0 HD2 PRO A 2 53.483 -11.802 31.132 1.00 0.00 H new ATOM 0 HD3 PRO A 2 53.227 -10.720 32.487 1.00 0.00 H new ATOM 26 N GLN A 3 51.968 -10.163 27.979 1.00 0.00 N ATOM 27 CA GLN A 3 51.687 -10.561 26.590 1.00 0.00 C ATOM 28 C GLN A 3 51.058 -11.962 26.554 1.00 0.00 C ATOM 29 O GLN A 3 50.270 -12.269 25.663 1.00 0.00 O ATOM 30 CB GLN A 3 52.970 -10.509 25.744 1.00 0.00 C ATOM 31 CG GLN A 3 53.395 -9.057 25.472 1.00 0.00 C ATOM 32 CD GLN A 3 54.652 -8.970 24.610 1.00 0.00 C ATOM 33 OE1 GLN A 3 55.747 -8.693 25.082 1.00 0.00 O ATOM 34 NE2 GLN A 3 54.554 -9.208 23.321 1.00 0.00 N ATOM 0 H GLN A 3 52.956 -10.215 28.228 1.00 0.00 H new ATOM 0 HA GLN A 3 50.974 -9.857 26.161 1.00 0.00 H new ATOM 0 HB2 GLN A 3 53.772 -11.035 26.262 1.00 0.00 H new ATOM 0 HB3 GLN A 3 52.807 -11.027 24.799 1.00 0.00 H new ATOM 0 HG2 GLN A 3 52.580 -8.530 24.976 1.00 0.00 H new ATOM 0 HG3 GLN A 3 53.572 -8.550 26.420 1.00 0.00 H new ATOM 0 HE21 GLN A 3 53.649 -9.440 22.913 1.00 0.00 H new ATOM 0 HE22 GLN A 3 55.383 -9.161 22.729 1.00 0.00 H new ATOM 43 N GLU A 4 51.367 -12.801 27.545 1.00 0.00 N ATOM 44 CA GLU A 4 50.847 -14.162 27.718 1.00 0.00 C ATOM 45 C GLU A 4 49.318 -14.222 27.679 1.00 0.00 C ATOM 46 O GLU A 4 48.773 -15.114 27.033 1.00 0.00 O ATOM 47 CB GLU A 4 51.368 -14.735 29.041 1.00 0.00 C ATOM 48 CG GLU A 4 52.793 -15.293 28.950 1.00 0.00 C ATOM 49 CD GLU A 4 53.814 -14.313 28.346 1.00 0.00 C ATOM 50 OE1 GLU A 4 53.943 -13.175 28.856 1.00 0.00 O ATOM 51 OE2 GLU A 4 54.467 -14.680 27.339 1.00 0.00 O ATOM 0 H GLU A 4 52.018 -12.539 28.285 1.00 0.00 H new ATOM 0 HA GLU A 4 51.202 -14.762 26.880 1.00 0.00 H new ATOM 0 HB2 GLU A 4 51.340 -13.954 29.801 1.00 0.00 H new ATOM 0 HB3 GLU A 4 50.697 -15.527 29.373 1.00 0.00 H new ATOM 0 HG2 GLU A 4 53.125 -15.577 29.949 1.00 0.00 H new ATOM 0 HG3 GLU A 4 52.778 -16.202 28.349 1.00 0.00 H new ATOM 58 N SER A 5 48.613 -13.266 28.296 1.00 0.00 N ATOM 59 CA SER A 5 47.142 -13.225 28.240 1.00 0.00 C ATOM 60 C SER A 5 46.635 -13.153 26.792 1.00 0.00 C ATOM 61 O SER A 5 45.664 -13.824 26.442 1.00 0.00 O ATOM 62 CB SER A 5 46.590 -12.043 29.048 1.00 0.00 C ATOM 63 OG SER A 5 46.867 -12.197 30.432 1.00 0.00 O ATOM 0 H SER A 5 49.033 -12.512 28.839 1.00 0.00 H new ATOM 0 HA SER A 5 46.779 -14.152 28.684 1.00 0.00 H new ATOM 0 HB2 SER A 5 47.031 -11.114 28.687 1.00 0.00 H new ATOM 0 HB3 SER A 5 45.513 -11.965 28.896 1.00 0.00 H new ATOM 0 HG SER A 5 47.788 -11.916 30.615 1.00 0.00 H new ATOM 69 N ARG A 6 47.322 -12.395 25.921 1.00 0.00 N ATOM 70 CA ARG A 6 47.012 -12.281 24.486 1.00 0.00 C ATOM 71 C ARG A 6 47.405 -13.555 23.732 1.00 0.00 C ATOM 72 O ARG A 6 46.596 -14.092 22.978 1.00 0.00 O ATOM 73 CB ARG A 6 47.716 -11.049 23.883 1.00 0.00 C ATOM 74 CG ARG A 6 47.557 -9.789 24.755 1.00 0.00 C ATOM 75 CD ARG A 6 47.809 -8.487 23.993 1.00 0.00 C ATOM 76 NE ARG A 6 49.168 -8.369 23.434 1.00 0.00 N ATOM 77 CZ ARG A 6 49.542 -7.442 22.571 1.00 0.00 C ATOM 78 NH1 ARG A 6 48.832 -6.404 22.253 1.00 0.00 N ATOM 79 NH2 ARG A 6 50.677 -7.529 21.962 1.00 0.00 N ATOM 0 H ARG A 6 48.125 -11.832 26.201 1.00 0.00 H new ATOM 0 HA ARG A 6 45.935 -12.153 24.380 1.00 0.00 H new ATOM 0 HB2 ARG A 6 48.776 -11.267 23.756 1.00 0.00 H new ATOM 0 HB3 ARG A 6 47.310 -10.853 22.891 1.00 0.00 H new ATOM 0 HG2 ARG A 6 46.550 -9.769 25.171 1.00 0.00 H new ATOM 0 HG3 ARG A 6 48.248 -9.849 25.596 1.00 0.00 H new ATOM 0 HD2 ARG A 6 47.086 -8.408 23.181 1.00 0.00 H new ATOM 0 HD3 ARG A 6 47.629 -7.646 24.663 1.00 0.00 H new ATOM 0 HE ARG A 6 49.866 -9.049 23.734 1.00 0.00 H new ATOM 0 HH11 ARG A 6 47.916 -6.262 22.680 1.00 0.00 H new ATOM 0 HH12 ARG A 6 49.189 -5.730 21.576 1.00 0.00 H new ATOM 0 HH21 ARG A 6 51.295 -8.320 22.145 1.00 0.00 H new ATOM 0 HH22 ARG A 6 50.956 -6.807 21.297 1.00 0.00 H new ATOM 93 N ARG A 7 48.620 -14.070 23.977 1.00 0.00 N ATOM 94 CA ARG A 7 49.168 -15.308 23.373 1.00 0.00 C ATOM 95 C ARG A 7 48.242 -16.504 23.577 1.00 0.00 C ATOM 96 O ARG A 7 47.896 -17.210 22.633 1.00 0.00 O ATOM 97 CB ARG A 7 50.559 -15.606 23.953 1.00 0.00 C ATOM 98 CG ARG A 7 51.560 -14.537 23.508 1.00 0.00 C ATOM 99 CD ARG A 7 52.890 -14.627 24.242 1.00 0.00 C ATOM 100 NE ARG A 7 53.766 -13.579 23.701 1.00 0.00 N ATOM 101 CZ ARG A 7 54.981 -13.213 24.035 1.00 0.00 C ATOM 102 NH1 ARG A 7 55.634 -13.687 25.054 1.00 0.00 N ATOM 103 NH2 ARG A 7 55.541 -12.304 23.295 1.00 0.00 N ATOM 0 H ARG A 7 49.274 -13.626 24.621 1.00 0.00 H new ATOM 0 HA ARG A 7 49.251 -15.141 22.299 1.00 0.00 H new ATOM 0 HB2 ARG A 7 50.508 -15.636 25.041 1.00 0.00 H new ATOM 0 HB3 ARG A 7 50.895 -16.589 23.623 1.00 0.00 H new ATOM 0 HG2 ARG A 7 51.735 -14.634 22.437 1.00 0.00 H new ATOM 0 HG3 ARG A 7 51.127 -13.550 23.672 1.00 0.00 H new ATOM 0 HD2 ARG A 7 52.746 -14.491 25.314 1.00 0.00 H new ATOM 0 HD3 ARG A 7 53.338 -15.611 24.103 1.00 0.00 H new ATOM 0 HE ARG A 7 53.360 -13.044 22.934 1.00 0.00 H new ATOM 0 HH11 ARG A 7 55.203 -14.391 25.654 1.00 0.00 H new ATOM 0 HH12 ARG A 7 56.578 -13.355 25.254 1.00 0.00 H new ATOM 0 HH21 ARG A 7 55.037 -11.912 22.500 1.00 0.00 H new ATOM 0 HH22 ARG A 7 56.485 -11.982 23.509 1.00 0.00 H new ATOM 117 N LEU A 8 47.817 -16.703 24.821 1.00 0.00 N ATOM 118 CA LEU A 8 46.914 -17.777 25.233 1.00 0.00 C ATOM 119 C LEU A 8 45.481 -17.561 24.713 1.00 0.00 C ATOM 120 O LEU A 8 44.793 -18.536 24.406 1.00 0.00 O ATOM 121 CB LEU A 8 46.996 -17.902 26.767 1.00 0.00 C ATOM 122 CG LEU A 8 48.410 -18.270 27.282 1.00 0.00 C ATOM 123 CD1 LEU A 8 48.479 -18.148 28.802 1.00 0.00 C ATOM 124 CD2 LEU A 8 48.843 -19.680 26.882 1.00 0.00 C ATOM 0 H LEU A 8 48.100 -16.103 25.596 1.00 0.00 H new ATOM 0 HA LEU A 8 47.224 -18.722 24.786 1.00 0.00 H new ATOM 0 HB2 LEU A 8 46.688 -16.958 27.218 1.00 0.00 H new ATOM 0 HB3 LEU A 8 46.288 -18.661 27.100 1.00 0.00 H new ATOM 0 HG LEU A 8 49.093 -17.562 26.812 1.00 0.00 H new ATOM 0 HD11 LEU A 8 49.480 -18.411 29.143 1.00 0.00 H new ATOM 0 HD12 LEU A 8 48.253 -17.123 29.095 1.00 0.00 H new ATOM 0 HD13 LEU A 8 47.753 -18.823 29.255 1.00 0.00 H new ATOM 0 HD21 LEU A 8 49.841 -19.878 27.272 1.00 0.00 H new ATOM 0 HD22 LEU A 8 48.142 -20.406 27.293 1.00 0.00 H new ATOM 0 HD23 LEU A 8 48.855 -19.762 25.795 1.00 0.00 H new ATOM 136 N SER A 9 45.037 -16.309 24.542 1.00 0.00 N ATOM 137 CA SER A 9 43.720 -16.000 23.956 1.00 0.00 C ATOM 138 C SER A 9 43.653 -16.371 22.466 1.00 0.00 C ATOM 139 O SER A 9 42.629 -16.888 22.016 1.00 0.00 O ATOM 140 CB SER A 9 43.353 -14.524 24.138 1.00 0.00 C ATOM 141 OG SER A 9 43.147 -14.225 25.506 1.00 0.00 O ATOM 0 H SER A 9 45.575 -15.483 24.804 1.00 0.00 H new ATOM 0 HA SER A 9 42.995 -16.609 24.495 1.00 0.00 H new ATOM 0 HB2 SER A 9 44.148 -13.894 23.739 1.00 0.00 H new ATOM 0 HB3 SER A 9 42.451 -14.296 23.571 1.00 0.00 H new ATOM 0 HG SER A 9 44.012 -14.174 25.963 1.00 0.00 H new ATOM 147 N ILE A 10 44.737 -16.177 21.704 1.00 0.00 N ATOM 148 CA ILE A 10 44.819 -16.539 20.273 1.00 0.00 C ATOM 149 C ILE A 10 44.573 -18.043 20.052 1.00 0.00 C ATOM 150 O ILE A 10 43.900 -18.429 19.093 1.00 0.00 O ATOM 151 CB ILE A 10 46.181 -16.085 19.699 1.00 0.00 C ATOM 152 CG1 ILE A 10 46.271 -14.546 19.655 1.00 0.00 C ATOM 153 CG2 ILE A 10 46.435 -16.633 18.285 1.00 0.00 C ATOM 154 CD1 ILE A 10 47.711 -14.043 19.759 1.00 0.00 C ATOM 0 H ILE A 10 45.595 -15.759 22.063 1.00 0.00 H new ATOM 0 HA ILE A 10 44.028 -16.018 19.734 1.00 0.00 H new ATOM 0 HB ILE A 10 46.942 -16.488 20.367 1.00 0.00 H new ATOM 0 HG12 ILE A 10 45.829 -14.185 18.726 1.00 0.00 H new ATOM 0 HG13 ILE A 10 45.683 -14.127 20.471 1.00 0.00 H new ATOM 0 HG21 ILE A 10 47.404 -16.285 17.928 1.00 0.00 H new ATOM 0 HG22 ILE A 10 46.428 -17.723 18.310 1.00 0.00 H new ATOM 0 HG23 ILE A 10 45.653 -16.281 17.612 1.00 0.00 H new ATOM 0 HD11 ILE A 10 47.719 -12.954 19.723 1.00 0.00 H new ATOM 0 HD12 ILE A 10 48.147 -14.378 20.700 1.00 0.00 H new ATOM 0 HD13 ILE A 10 48.295 -14.438 18.928 1.00 0.00 H new ATOM 166 N GLN A 11 45.073 -18.904 20.952 1.00 0.00 N ATOM 167 CA GLN A 11 44.879 -20.359 20.877 1.00 0.00 C ATOM 168 C GLN A 11 43.396 -20.772 20.817 1.00 0.00 C ATOM 169 O GLN A 11 43.067 -21.727 20.111 1.00 0.00 O ATOM 170 CB GLN A 11 45.570 -21.068 22.054 1.00 0.00 C ATOM 171 CG GLN A 11 47.086 -20.822 22.148 1.00 0.00 C ATOM 172 CD GLN A 11 47.829 -21.158 20.856 1.00 0.00 C ATOM 173 OE1 GLN A 11 48.354 -20.299 20.166 1.00 0.00 O ATOM 174 NE2 GLN A 11 47.893 -22.412 20.461 1.00 0.00 N ATOM 0 H GLN A 11 45.626 -18.608 21.756 1.00 0.00 H new ATOM 0 HA GLN A 11 45.339 -20.673 19.940 1.00 0.00 H new ATOM 0 HB2 GLN A 11 45.104 -20.740 22.983 1.00 0.00 H new ATOM 0 HB3 GLN A 11 45.394 -22.140 21.970 1.00 0.00 H new ATOM 0 HG2 GLN A 11 47.263 -19.777 22.401 1.00 0.00 H new ATOM 0 HG3 GLN A 11 47.495 -21.421 22.962 1.00 0.00 H new ATOM 0 HE21 GLN A 11 47.461 -23.146 21.022 1.00 0.00 H new ATOM 0 HE22 GLN A 11 48.374 -22.650 19.594 1.00 0.00 H new ATOM 183 N ARG A 12 42.493 -20.039 21.493 1.00 0.00 N ATOM 184 CA ARG A 12 41.036 -20.292 21.467 1.00 0.00 C ATOM 185 C ARG A 12 40.506 -20.269 20.032 1.00 0.00 C ATOM 186 O ARG A 12 39.777 -21.166 19.608 1.00 0.00 O ATOM 187 CB ARG A 12 40.283 -19.216 22.273 1.00 0.00 C ATOM 188 CG ARG A 12 40.793 -18.969 23.704 1.00 0.00 C ATOM 189 CD ARG A 12 40.080 -17.768 24.345 1.00 0.00 C ATOM 190 NE ARG A 12 40.271 -16.517 23.575 1.00 0.00 N ATOM 191 CZ ARG A 12 39.560 -15.407 23.661 1.00 0.00 C ATOM 192 NH1 ARG A 12 38.588 -15.275 24.521 1.00 0.00 N ATOM 193 NH2 ARG A 12 39.802 -14.395 22.878 1.00 0.00 N ATOM 0 H ARG A 12 42.754 -19.246 22.079 1.00 0.00 H new ATOM 0 HA ARG A 12 40.869 -21.275 21.908 1.00 0.00 H new ATOM 0 HB2 ARG A 12 40.333 -18.276 21.723 1.00 0.00 H new ATOM 0 HB3 ARG A 12 39.232 -19.499 22.326 1.00 0.00 H new ATOM 0 HG2 ARG A 12 40.629 -19.860 24.311 1.00 0.00 H new ATOM 0 HG3 ARG A 12 41.868 -18.790 23.685 1.00 0.00 H new ATOM 0 HD2 ARG A 12 39.014 -17.983 24.425 1.00 0.00 H new ATOM 0 HD3 ARG A 12 40.453 -17.627 25.359 1.00 0.00 H new ATOM 0 HE ARG A 12 41.038 -16.512 22.903 1.00 0.00 H new ATOM 0 HH11 ARG A 12 38.358 -16.042 25.152 1.00 0.00 H new ATOM 0 HH12 ARG A 12 38.058 -14.404 24.562 1.00 0.00 H new ATOM 0 HH21 ARG A 12 40.549 -14.453 22.186 1.00 0.00 H new ATOM 0 HH22 ARG A 12 39.244 -13.545 22.957 1.00 0.00 H new ATOM 207 N CYS A 13 40.905 -19.242 19.282 1.00 0.00 N ATOM 208 CA CYS A 13 40.509 -19.048 17.893 1.00 0.00 C ATOM 209 C CYS A 13 41.170 -20.073 16.965 1.00 0.00 C ATOM 210 O CYS A 13 40.510 -20.557 16.050 1.00 0.00 O ATOM 211 CB CYS A 13 40.806 -17.606 17.469 1.00 0.00 C ATOM 212 SG CYS A 13 39.873 -16.455 18.521 1.00 0.00 S ATOM 0 H CYS A 13 41.523 -18.510 19.632 1.00 0.00 H new ATOM 0 HA CYS A 13 39.435 -19.215 17.808 1.00 0.00 H new ATOM 0 HB2 CYS A 13 41.874 -17.405 17.551 1.00 0.00 H new ATOM 0 HB3 CYS A 13 40.534 -17.461 16.424 1.00 0.00 H new ATOM 0 HG CYS A 13 39.308 -15.550 17.779 1.00 0.00 H new ATOM 218 N ILE A 14 42.430 -20.461 17.203 1.00 0.00 N ATOM 219 CA ILE A 14 43.105 -21.502 16.405 1.00 0.00 C ATOM 220 C ILE A 14 42.344 -22.829 16.528 1.00 0.00 C ATOM 221 O ILE A 14 41.988 -23.426 15.512 1.00 0.00 O ATOM 222 CB ILE A 14 44.588 -21.625 16.818 1.00 0.00 C ATOM 223 CG1 ILE A 14 45.321 -20.355 16.341 1.00 0.00 C ATOM 224 CG2 ILE A 14 45.265 -22.874 16.220 1.00 0.00 C ATOM 225 CD1 ILE A 14 46.672 -20.113 16.999 1.00 0.00 C ATOM 0 H ILE A 14 43.008 -20.069 17.946 1.00 0.00 H new ATOM 0 HA ILE A 14 43.097 -21.219 15.352 1.00 0.00 H new ATOM 0 HB ILE A 14 44.639 -21.729 17.902 1.00 0.00 H new ATOM 0 HG12 ILE A 14 45.464 -20.419 15.262 1.00 0.00 H new ATOM 0 HG13 ILE A 14 44.682 -19.492 16.527 1.00 0.00 H new ATOM 0 HG21 ILE A 14 46.306 -22.913 16.541 1.00 0.00 H new ATOM 0 HG22 ILE A 14 44.746 -23.769 16.563 1.00 0.00 H new ATOM 0 HG23 ILE A 14 45.223 -22.825 15.132 1.00 0.00 H new ATOM 0 HD11 ILE A 14 47.112 -19.199 16.601 1.00 0.00 H new ATOM 0 HD12 ILE A 14 46.539 -20.013 18.076 1.00 0.00 H new ATOM 0 HD13 ILE A 14 47.334 -20.954 16.791 1.00 0.00 H new ATOM 237 N GLN A 15 42.027 -23.263 17.754 1.00 0.00 N ATOM 238 CA GLN A 15 41.238 -24.479 17.984 1.00 0.00 C ATOM 239 C GLN A 15 39.842 -24.381 17.344 1.00 0.00 C ATOM 240 O GLN A 15 39.389 -25.334 16.709 1.00 0.00 O ATOM 241 CB GLN A 15 41.132 -24.768 19.488 1.00 0.00 C ATOM 242 CG GLN A 15 42.489 -25.187 20.076 1.00 0.00 C ATOM 243 CD GLN A 15 42.336 -25.771 21.475 1.00 0.00 C ATOM 244 OE1 GLN A 15 42.553 -25.120 22.490 1.00 0.00 O ATOM 245 NE2 GLN A 15 41.945 -27.024 21.577 1.00 0.00 N ATOM 0 H GLN A 15 42.308 -22.784 18.610 1.00 0.00 H new ATOM 0 HA GLN A 15 41.755 -25.309 17.504 1.00 0.00 H new ATOM 0 HB2 GLN A 15 40.768 -23.881 20.006 1.00 0.00 H new ATOM 0 HB3 GLN A 15 40.401 -25.558 19.657 1.00 0.00 H new ATOM 0 HG2 GLN A 15 42.958 -25.923 19.423 1.00 0.00 H new ATOM 0 HG3 GLN A 15 43.153 -24.324 20.112 1.00 0.00 H new ATOM 0 HE21 GLN A 15 41.763 -27.571 20.736 1.00 0.00 H new ATOM 0 HE22 GLN A 15 41.824 -27.447 22.497 1.00 0.00 H new ATOM 254 N SER A 16 39.176 -23.227 17.463 1.00 0.00 N ATOM 255 CA SER A 16 37.853 -22.990 16.865 1.00 0.00 C ATOM 256 C SER A 16 37.876 -23.030 15.331 1.00 0.00 C ATOM 257 O SER A 16 36.986 -23.625 14.726 1.00 0.00 O ATOM 258 CB SER A 16 37.278 -21.649 17.324 1.00 0.00 C ATOM 259 OG SER A 16 37.073 -21.643 18.726 1.00 0.00 O ATOM 0 H SER A 16 39.540 -22.426 17.979 1.00 0.00 H new ATOM 0 HA SER A 16 37.217 -23.805 17.211 1.00 0.00 H new ATOM 0 HB2 SER A 16 37.958 -20.843 17.048 1.00 0.00 H new ATOM 0 HB3 SER A 16 36.334 -21.459 16.813 1.00 0.00 H new ATOM 0 HG SER A 16 37.927 -21.489 19.181 1.00 0.00 H new ATOM 265 N LEU A 17 38.889 -22.438 14.685 1.00 0.00 N ATOM 266 CA LEU A 17 39.032 -22.458 13.226 1.00 0.00 C ATOM 267 C LEU A 17 39.368 -23.875 12.735 1.00 0.00 C ATOM 268 O LEU A 17 38.762 -24.342 11.773 1.00 0.00 O ATOM 269 CB LEU A 17 40.083 -21.420 12.787 1.00 0.00 C ATOM 270 CG LEU A 17 40.271 -21.308 11.259 1.00 0.00 C ATOM 271 CD1 LEU A 17 38.982 -20.978 10.496 1.00 0.00 C ATOM 272 CD2 LEU A 17 41.296 -20.216 10.949 1.00 0.00 C ATOM 0 H LEU A 17 39.634 -21.931 15.162 1.00 0.00 H new ATOM 0 HA LEU A 17 38.084 -22.181 12.765 1.00 0.00 H new ATOM 0 HB2 LEU A 17 39.797 -20.444 13.178 1.00 0.00 H new ATOM 0 HB3 LEU A 17 41.040 -21.677 13.241 1.00 0.00 H new ATOM 0 HG LEU A 17 40.606 -22.291 10.927 1.00 0.00 H new ATOM 0 HD11 LEU A 17 39.196 -20.916 9.429 1.00 0.00 H new ATOM 0 HD12 LEU A 17 38.244 -21.760 10.673 1.00 0.00 H new ATOM 0 HD13 LEU A 17 38.588 -20.023 10.843 1.00 0.00 H new ATOM 0 HD21 LEU A 17 41.429 -20.137 9.870 1.00 0.00 H new ATOM 0 HD22 LEU A 17 40.942 -19.263 11.342 1.00 0.00 H new ATOM 0 HD23 LEU A 17 42.249 -20.469 11.414 1.00 0.00 H new ATOM 284 N VAL A 18 40.277 -24.586 13.415 1.00 0.00 N ATOM 285 CA VAL A 18 40.620 -25.987 13.102 1.00 0.00 C ATOM 286 C VAL A 18 39.375 -26.876 13.202 1.00 0.00 C ATOM 287 O VAL A 18 39.124 -27.684 12.303 1.00 0.00 O ATOM 288 CB VAL A 18 41.751 -26.487 14.025 1.00 0.00 C ATOM 289 CG1 VAL A 18 41.907 -28.011 13.981 1.00 0.00 C ATOM 290 CG2 VAL A 18 43.098 -25.873 13.627 1.00 0.00 C ATOM 0 H VAL A 18 40.801 -24.206 14.204 1.00 0.00 H new ATOM 0 HA VAL A 18 40.985 -26.040 12.076 1.00 0.00 H new ATOM 0 HB VAL A 18 41.470 -26.180 15.032 1.00 0.00 H new ATOM 0 HG11 VAL A 18 42.715 -28.313 14.647 1.00 0.00 H new ATOM 0 HG12 VAL A 18 40.977 -28.481 14.302 1.00 0.00 H new ATOM 0 HG13 VAL A 18 42.140 -28.324 12.963 1.00 0.00 H new ATOM 0 HG21 VAL A 18 43.877 -26.242 14.294 1.00 0.00 H new ATOM 0 HG22 VAL A 18 43.336 -26.152 12.601 1.00 0.00 H new ATOM 0 HG23 VAL A 18 43.040 -24.787 13.703 1.00 0.00 H new ATOM 300 N HIS A 19 38.569 -26.711 14.258 1.00 0.00 N ATOM 301 CA HIS A 19 37.295 -27.412 14.427 1.00 0.00 C ATOM 302 C HIS A 19 36.361 -27.088 13.248 1.00 0.00 C ATOM 303 O HIS A 19 35.913 -27.999 12.555 1.00 0.00 O ATOM 304 CB HIS A 19 36.668 -27.028 15.781 1.00 0.00 C ATOM 305 CG HIS A 19 35.288 -27.601 16.024 1.00 0.00 C ATOM 306 ND1 HIS A 19 34.957 -28.621 16.891 1.00 0.00 N ATOM 307 CD2 HIS A 19 34.117 -27.180 15.449 1.00 0.00 C ATOM 308 CE1 HIS A 19 33.626 -28.812 16.823 1.00 0.00 C ATOM 309 NE2 HIS A 19 33.064 -27.959 15.945 1.00 0.00 N ATOM 0 H HIS A 19 38.788 -26.078 15.028 1.00 0.00 H new ATOM 0 HA HIS A 19 37.460 -28.489 14.430 1.00 0.00 H new ATOM 0 HB2 HIS A 19 37.331 -27.360 16.580 1.00 0.00 H new ATOM 0 HB3 HIS A 19 36.612 -25.941 15.845 1.00 0.00 H new ATOM 0 HD1 HIS A 19 35.607 -29.140 17.481 1.00 0.00 H new ATOM 0 HD2 HIS A 19 34.022 -26.379 14.731 1.00 0.00 H new ATOM 0 HE1 HIS A 19 33.082 -29.549 17.395 1.00 0.00 H new ATOM 317 N ALA A 20 36.108 -25.803 12.972 1.00 0.00 N ATOM 318 CA ALA A 20 35.247 -25.349 11.877 1.00 0.00 C ATOM 319 C ALA A 20 35.672 -25.859 10.487 1.00 0.00 C ATOM 320 O ALA A 20 34.813 -26.141 9.649 1.00 0.00 O ATOM 321 CB ALA A 20 35.199 -23.822 11.912 1.00 0.00 C ATOM 0 H ALA A 20 36.504 -25.036 13.515 1.00 0.00 H new ATOM 0 HA ALA A 20 34.256 -25.776 12.034 1.00 0.00 H new ATOM 0 HB1 ALA A 20 34.563 -23.459 11.105 1.00 0.00 H new ATOM 0 HB2 ALA A 20 34.794 -23.493 12.869 1.00 0.00 H new ATOM 0 HB3 ALA A 20 36.206 -23.423 11.787 1.00 0.00 H new ATOM 327 N CYS A 21 36.979 -26.021 10.237 1.00 0.00 N ATOM 328 CA CYS A 21 37.511 -26.564 8.981 1.00 0.00 C ATOM 329 C CYS A 21 37.137 -28.046 8.759 1.00 0.00 C ATOM 330 O CYS A 21 37.235 -28.541 7.634 1.00 0.00 O ATOM 331 CB CYS A 21 39.034 -26.364 8.948 1.00 0.00 C ATOM 332 SG CYS A 21 39.419 -24.603 8.715 1.00 0.00 S ATOM 0 H CYS A 21 37.705 -25.775 10.910 1.00 0.00 H new ATOM 0 HA CYS A 21 37.050 -26.017 8.159 1.00 0.00 H new ATOM 0 HB2 CYS A 21 39.477 -26.723 9.877 1.00 0.00 H new ATOM 0 HB3 CYS A 21 39.470 -26.951 8.139 1.00 0.00 H new ATOM 0 HG CYS A 21 39.274 -23.974 9.844 1.00 0.00 H new ATOM 338 N GLN A 22 36.699 -28.752 9.809 1.00 0.00 N ATOM 339 CA GLN A 22 36.289 -30.165 9.782 1.00 0.00 C ATOM 340 C GLN A 22 34.789 -30.362 10.077 1.00 0.00 C ATOM 341 O GLN A 22 34.187 -31.330 9.603 1.00 0.00 O ATOM 342 CB GLN A 22 37.114 -30.933 10.827 1.00 0.00 C ATOM 343 CG GLN A 22 38.626 -30.913 10.558 1.00 0.00 C ATOM 344 CD GLN A 22 39.402 -31.389 11.781 1.00 0.00 C ATOM 345 OE1 GLN A 22 39.717 -32.561 11.946 1.00 0.00 O ATOM 346 NE2 GLN A 22 39.731 -30.493 12.686 1.00 0.00 N ATOM 0 H GLN A 22 36.617 -28.340 10.738 1.00 0.00 H new ATOM 0 HA GLN A 22 36.468 -30.542 8.775 1.00 0.00 H new ATOM 0 HB2 GLN A 22 36.924 -30.506 11.812 1.00 0.00 H new ATOM 0 HB3 GLN A 22 36.773 -31.968 10.857 1.00 0.00 H new ATOM 0 HG2 GLN A 22 38.856 -31.551 9.705 1.00 0.00 H new ATOM 0 HG3 GLN A 22 38.939 -29.903 10.294 1.00 0.00 H new ATOM 0 HE21 GLN A 22 39.471 -29.516 12.554 1.00 0.00 H new ATOM 0 HE22 GLN A 22 40.246 -30.776 13.520 1.00 0.00 H new ATOM 355 N CYS A 23 34.185 -29.461 10.858 1.00 0.00 N ATOM 356 CA CYS A 23 32.789 -29.496 11.278 1.00 0.00 C ATOM 357 C CYS A 23 31.806 -29.363 10.101 1.00 0.00 C ATOM 358 O CYS A 23 32.093 -28.718 9.085 1.00 0.00 O ATOM 359 CB CYS A 23 32.600 -28.411 12.345 1.00 0.00 C ATOM 360 SG CYS A 23 31.002 -28.605 13.181 1.00 0.00 S ATOM 0 H CYS A 23 34.683 -28.652 11.229 1.00 0.00 H new ATOM 0 HA CYS A 23 32.556 -30.472 11.704 1.00 0.00 H new ATOM 0 HB2 CYS A 23 33.407 -28.468 13.075 1.00 0.00 H new ATOM 0 HB3 CYS A 23 32.657 -27.426 11.883 1.00 0.00 H new ATOM 365 N ARG A 24 30.634 -29.991 10.240 1.00 0.00 N ATOM 366 CA ARG A 24 29.539 -30.049 9.250 1.00 0.00 C ATOM 367 C ARG A 24 28.226 -29.430 9.753 1.00 0.00 C ATOM 368 O ARG A 24 27.310 -29.216 8.958 1.00 0.00 O ATOM 369 CB ARG A 24 29.280 -31.523 8.873 1.00 0.00 C ATOM 370 CG ARG A 24 30.465 -32.344 8.323 1.00 0.00 C ATOM 371 CD ARG A 24 30.996 -31.899 6.952 1.00 0.00 C ATOM 372 NE ARG A 24 31.822 -30.683 7.053 1.00 0.00 N ATOM 373 CZ ARG A 24 32.711 -30.218 6.200 1.00 0.00 C ATOM 374 NH1 ARG A 24 32.957 -30.790 5.054 1.00 0.00 N ATOM 375 NH2 ARG A 24 33.371 -29.142 6.512 1.00 0.00 N ATOM 0 H ARG A 24 30.405 -30.503 11.092 1.00 0.00 H new ATOM 0 HA ARG A 24 29.860 -29.463 8.389 1.00 0.00 H new ATOM 0 HB2 ARG A 24 28.901 -32.034 9.758 1.00 0.00 H new ATOM 0 HB3 ARG A 24 28.484 -31.543 8.128 1.00 0.00 H new ATOM 0 HG2 ARG A 24 31.282 -32.297 9.043 1.00 0.00 H new ATOM 0 HG3 ARG A 24 30.160 -33.388 8.254 1.00 0.00 H new ATOM 0 HD2 ARG A 24 31.586 -32.703 6.512 1.00 0.00 H new ATOM 0 HD3 ARG A 24 30.158 -31.714 6.280 1.00 0.00 H new ATOM 0 HE ARG A 24 31.687 -30.127 7.897 1.00 0.00 H new ATOM 0 HH11 ARG A 24 32.451 -31.634 4.786 1.00 0.00 H new ATOM 0 HH12 ARG A 24 33.655 -30.393 4.425 1.00 0.00 H new ATOM 0 HH21 ARG A 24 33.195 -28.676 7.402 1.00 0.00 H new ATOM 0 HH22 ARG A 24 34.064 -28.764 5.867 1.00 0.00 H new ATOM 389 N ASN A 25 28.121 -29.143 11.052 1.00 0.00 N ATOM 390 CA ASN A 25 26.930 -28.562 11.677 1.00 0.00 C ATOM 391 C ASN A 25 26.664 -27.133 11.168 1.00 0.00 C ATOM 392 O ASN A 25 27.496 -26.242 11.362 1.00 0.00 O ATOM 393 CB ASN A 25 27.127 -28.531 13.203 1.00 0.00 C ATOM 394 CG ASN A 25 27.328 -29.883 13.865 1.00 0.00 C ATOM 395 OD1 ASN A 25 26.705 -30.880 13.522 1.00 0.00 O ATOM 396 ND2 ASN A 25 28.202 -29.948 14.839 1.00 0.00 N ATOM 0 H ASN A 25 28.878 -29.312 11.714 1.00 0.00 H new ATOM 0 HA ASN A 25 26.071 -29.179 11.415 1.00 0.00 H new ATOM 0 HB2 ASN A 25 27.990 -27.904 13.428 1.00 0.00 H new ATOM 0 HB3 ASN A 25 26.259 -28.051 13.654 1.00 0.00 H new ATOM 0 HD21 ASN A 25 28.368 -30.833 15.317 1.00 0.00 H new ATOM 0 HD22 ASN A 25 28.717 -29.113 15.119 1.00 0.00 H new ATOM 403 N ALA A 26 25.498 -26.888 10.562 1.00 0.00 N ATOM 404 CA ALA A 26 25.100 -25.552 10.093 1.00 0.00 C ATOM 405 C ALA A 26 24.928 -24.535 11.246 1.00 0.00 C ATOM 406 O ALA A 26 25.059 -23.327 11.042 1.00 0.00 O ATOM 407 CB ALA A 26 23.810 -25.696 9.277 1.00 0.00 C ATOM 0 H ALA A 26 24.801 -27.610 10.381 1.00 0.00 H new ATOM 0 HA ALA A 26 25.898 -25.148 9.470 1.00 0.00 H new ATOM 0 HB1 ALA A 26 23.495 -24.716 8.918 1.00 0.00 H new ATOM 0 HB2 ALA A 26 23.989 -26.354 8.426 1.00 0.00 H new ATOM 0 HB3 ALA A 26 23.027 -26.121 9.906 1.00 0.00 H new ATOM 413 N ASN A 27 24.644 -25.033 12.456 1.00 0.00 N ATOM 414 CA ASN A 27 24.424 -24.268 13.688 1.00 0.00 C ATOM 415 C ASN A 27 25.057 -24.998 14.898 1.00 0.00 C ATOM 416 O ASN A 27 24.372 -25.312 15.875 1.00 0.00 O ATOM 417 CB ASN A 27 22.909 -24.012 13.856 1.00 0.00 C ATOM 418 CG ASN A 27 22.334 -23.095 12.787 1.00 0.00 C ATOM 419 OD1 ASN A 27 22.394 -21.877 12.883 1.00 0.00 O ATOM 420 ND2 ASN A 27 21.753 -23.642 11.740 1.00 0.00 N ATOM 0 H ASN A 27 24.557 -26.038 12.609 1.00 0.00 H new ATOM 0 HA ASN A 27 24.918 -23.298 13.629 1.00 0.00 H new ATOM 0 HB2 ASN A 27 22.381 -24.965 13.830 1.00 0.00 H new ATOM 0 HB3 ASN A 27 22.728 -23.574 14.837 1.00 0.00 H new ATOM 0 HD21 ASN A 27 21.354 -23.050 11.011 1.00 0.00 H new ATOM 0 HD22 ASN A 27 21.702 -24.657 11.658 1.00 0.00 H new ATOM 427 N CYS A 28 26.360 -25.314 14.805 1.00 0.00 N ATOM 428 CA CYS A 28 27.139 -26.011 15.835 1.00 0.00 C ATOM 429 C CYS A 28 26.976 -25.377 17.234 1.00 0.00 C ATOM 430 O CYS A 28 26.796 -24.162 17.360 1.00 0.00 O ATOM 431 CB CYS A 28 28.610 -26.010 15.393 1.00 0.00 C ATOM 432 SG CYS A 28 29.532 -27.371 16.168 1.00 0.00 S ATOM 0 H CYS A 28 26.916 -25.082 13.982 1.00 0.00 H new ATOM 0 HA CYS A 28 26.769 -27.032 15.932 1.00 0.00 H new ATOM 0 HB2 CYS A 28 28.666 -26.101 14.308 1.00 0.00 H new ATOM 0 HB3 CYS A 28 29.071 -25.058 15.657 1.00 0.00 H new ATOM 437 N SER A 29 27.050 -26.179 18.299 1.00 0.00 N ATOM 438 CA SER A 29 26.897 -25.693 19.679 1.00 0.00 C ATOM 439 C SER A 29 28.003 -24.732 20.142 1.00 0.00 C ATOM 440 O SER A 29 27.801 -24.001 21.118 1.00 0.00 O ATOM 441 CB SER A 29 26.760 -26.865 20.658 1.00 0.00 C ATOM 442 OG SER A 29 27.910 -27.698 20.629 1.00 0.00 O ATOM 0 H SER A 29 27.217 -27.183 18.233 1.00 0.00 H new ATOM 0 HA SER A 29 25.979 -25.106 19.677 1.00 0.00 H new ATOM 0 HB2 SER A 29 26.610 -26.483 21.668 1.00 0.00 H new ATOM 0 HB3 SER A 29 25.877 -27.452 20.405 1.00 0.00 H new ATOM 0 HG SER A 29 27.796 -28.436 21.264 1.00 0.00 H new ATOM 448 N LEU A 30 29.143 -24.670 19.442 1.00 0.00 N ATOM 449 CA LEU A 30 30.218 -23.718 19.735 1.00 0.00 C ATOM 450 C LEU A 30 29.886 -22.344 19.116 1.00 0.00 C ATOM 451 O LEU A 30 29.577 -22.270 17.921 1.00 0.00 O ATOM 452 CB LEU A 30 31.563 -24.241 19.195 1.00 0.00 C ATOM 453 CG LEU A 30 32.262 -25.277 20.096 1.00 0.00 C ATOM 454 CD1 LEU A 30 33.533 -25.771 19.403 1.00 0.00 C ATOM 455 CD2 LEU A 30 32.674 -24.686 21.451 1.00 0.00 C ATOM 0 H LEU A 30 29.345 -25.283 18.652 1.00 0.00 H new ATOM 0 HA LEU A 30 30.304 -23.606 20.816 1.00 0.00 H new ATOM 0 HB2 LEU A 30 31.396 -24.687 18.214 1.00 0.00 H new ATOM 0 HB3 LEU A 30 32.234 -23.394 19.050 1.00 0.00 H new ATOM 0 HG LEU A 30 31.551 -26.086 20.267 1.00 0.00 H new ATOM 0 HD11 LEU A 30 34.031 -26.504 20.037 1.00 0.00 H new ATOM 0 HD12 LEU A 30 33.272 -26.232 18.450 1.00 0.00 H new ATOM 0 HD13 LEU A 30 34.202 -24.929 19.227 1.00 0.00 H new ATOM 0 HD21 LEU A 30 33.162 -25.455 22.050 1.00 0.00 H new ATOM 0 HD22 LEU A 30 33.364 -23.857 21.292 1.00 0.00 H new ATOM 0 HD23 LEU A 30 31.789 -24.326 21.975 1.00 0.00 H new ATOM 467 N PRO A 31 29.967 -21.239 19.885 1.00 0.00 N ATOM 468 CA PRO A 31 29.663 -19.899 19.379 1.00 0.00 C ATOM 469 C PRO A 31 30.642 -19.449 18.285 1.00 0.00 C ATOM 470 O PRO A 31 30.232 -18.824 17.304 1.00 0.00 O ATOM 471 CB PRO A 31 29.699 -18.983 20.609 1.00 0.00 C ATOM 472 CG PRO A 31 30.611 -19.718 21.592 1.00 0.00 C ATOM 473 CD PRO A 31 30.338 -21.185 21.292 1.00 0.00 C ATOM 0 HA PRO A 31 28.689 -19.871 18.891 1.00 0.00 H new ATOM 0 HB2 PRO A 31 30.092 -17.997 20.361 1.00 0.00 H new ATOM 0 HB3 PRO A 31 28.702 -18.834 21.025 1.00 0.00 H new ATOM 0 HG2 PRO A 31 31.659 -19.464 21.436 1.00 0.00 H new ATOM 0 HG3 PRO A 31 30.373 -19.468 22.626 1.00 0.00 H new ATOM 0 HD2 PRO A 31 31.220 -21.795 21.488 1.00 0.00 H new ATOM 0 HD3 PRO A 31 29.537 -21.571 21.923 1.00 0.00 H new ATOM 481 N SER A 32 31.931 -19.776 18.427 1.00 0.00 N ATOM 482 CA SER A 32 32.967 -19.413 17.451 1.00 0.00 C ATOM 483 C SER A 32 32.857 -20.221 16.152 1.00 0.00 C ATOM 484 O SER A 32 32.976 -19.633 15.086 1.00 0.00 O ATOM 485 CB SER A 32 34.365 -19.568 18.057 1.00 0.00 C ATOM 486 OG SER A 32 34.457 -18.873 19.293 1.00 0.00 O ATOM 0 H SER A 32 32.288 -20.302 19.225 1.00 0.00 H new ATOM 0 HA SER A 32 32.805 -18.366 17.196 1.00 0.00 H new ATOM 0 HB2 SER A 32 34.585 -20.624 18.211 1.00 0.00 H new ATOM 0 HB3 SER A 32 35.112 -19.185 17.362 1.00 0.00 H new ATOM 0 HG SER A 32 35.357 -18.985 19.665 1.00 0.00 H new ATOM 492 N CYS A 33 32.592 -21.531 16.205 1.00 0.00 N ATOM 493 CA CYS A 33 32.412 -22.414 15.039 1.00 0.00 C ATOM 494 C CYS A 33 31.413 -21.830 14.011 1.00 0.00 C ATOM 495 O CYS A 33 31.721 -21.717 12.817 1.00 0.00 O ATOM 496 CB CYS A 33 31.985 -23.792 15.587 1.00 0.00 C ATOM 497 SG CYS A 33 31.750 -25.057 14.300 1.00 0.00 S ATOM 0 H CYS A 33 32.493 -22.027 17.091 1.00 0.00 H new ATOM 0 HA CYS A 33 33.342 -22.511 14.479 1.00 0.00 H new ATOM 0 HB2 CYS A 33 32.739 -24.141 16.292 1.00 0.00 H new ATOM 0 HB3 CYS A 33 31.055 -23.678 16.145 1.00 0.00 H new ATOM 502 N GLN A 34 30.250 -21.361 14.485 1.00 0.00 N ATOM 503 CA GLN A 34 29.226 -20.701 13.658 1.00 0.00 C ATOM 504 C GLN A 34 29.774 -19.476 12.892 1.00 0.00 C ATOM 505 O GLN A 34 29.392 -19.237 11.744 1.00 0.00 O ATOM 506 CB GLN A 34 28.049 -20.247 14.542 1.00 0.00 C ATOM 507 CG GLN A 34 27.264 -21.389 15.213 1.00 0.00 C ATOM 508 CD GLN A 34 26.125 -20.872 16.100 1.00 0.00 C ATOM 509 OE1 GLN A 34 25.563 -19.801 15.901 1.00 0.00 O ATOM 510 NE2 GLN A 34 25.724 -21.602 17.117 1.00 0.00 N ATOM 0 H GLN A 34 29.989 -21.430 15.469 1.00 0.00 H new ATOM 0 HA GLN A 34 28.897 -21.436 12.923 1.00 0.00 H new ATOM 0 HB2 GLN A 34 28.431 -19.584 15.318 1.00 0.00 H new ATOM 0 HB3 GLN A 34 27.361 -19.662 13.933 1.00 0.00 H new ATOM 0 HG2 GLN A 34 26.854 -22.045 14.445 1.00 0.00 H new ATOM 0 HG3 GLN A 34 27.945 -21.990 15.815 1.00 0.00 H new ATOM 0 HE21 GLN A 34 26.171 -22.498 17.309 1.00 0.00 H new ATOM 0 HE22 GLN A 34 24.965 -21.272 17.714 1.00 0.00 H new ATOM 519 N LYS A 35 30.690 -18.715 13.507 1.00 0.00 N ATOM 520 CA LYS A 35 31.341 -17.525 12.936 1.00 0.00 C ATOM 521 C LYS A 35 32.502 -17.908 12.015 1.00 0.00 C ATOM 522 O LYS A 35 32.613 -17.376 10.913 1.00 0.00 O ATOM 523 CB LYS A 35 31.792 -16.641 14.113 1.00 0.00 C ATOM 524 CG LYS A 35 32.475 -15.330 13.707 1.00 0.00 C ATOM 525 CD LYS A 35 32.874 -14.557 14.972 1.00 0.00 C ATOM 526 CE LYS A 35 33.611 -13.277 14.580 1.00 0.00 C ATOM 527 NZ LYS A 35 34.028 -12.480 15.762 1.00 0.00 N ATOM 0 H LYS A 35 31.011 -18.919 14.453 1.00 0.00 H new ATOM 0 HA LYS A 35 30.645 -16.971 12.306 1.00 0.00 H new ATOM 0 HB2 LYS A 35 30.922 -16.406 14.727 1.00 0.00 H new ATOM 0 HB3 LYS A 35 32.478 -17.214 14.737 1.00 0.00 H new ATOM 0 HG2 LYS A 35 33.356 -15.538 13.100 1.00 0.00 H new ATOM 0 HG3 LYS A 35 31.802 -14.729 13.096 1.00 0.00 H new ATOM 0 HD2 LYS A 35 31.987 -14.313 15.556 1.00 0.00 H new ATOM 0 HD3 LYS A 35 33.511 -15.177 15.603 1.00 0.00 H new ATOM 0 HE2 LYS A 35 34.490 -13.534 13.989 1.00 0.00 H new ATOM 0 HE3 LYS A 35 32.966 -12.670 13.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 34.887 -11.941 15.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 33.266 -11.822 16.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 34.223 -13.118 16.560 1.00 0.00 H new ATOM 541 N MET A 36 33.334 -18.866 12.425 1.00 0.00 N ATOM 542 CA MET A 36 34.471 -19.379 11.654 1.00 0.00 C ATOM 543 C MET A 36 34.041 -19.922 10.288 1.00 0.00 C ATOM 544 O MET A 36 34.723 -19.691 9.288 1.00 0.00 O ATOM 545 CB MET A 36 35.195 -20.465 12.463 1.00 0.00 C ATOM 546 CG MET A 36 35.928 -19.916 13.689 1.00 0.00 C ATOM 547 SD MET A 36 37.281 -18.789 13.248 1.00 0.00 S ATOM 548 CE MET A 36 38.163 -18.699 14.821 1.00 0.00 C ATOM 0 H MET A 36 33.233 -19.322 13.332 1.00 0.00 H new ATOM 0 HA MET A 36 35.152 -18.549 11.467 1.00 0.00 H new ATOM 0 HB2 MET A 36 34.470 -21.212 12.786 1.00 0.00 H new ATOM 0 HB3 MET A 36 35.911 -20.973 11.817 1.00 0.00 H new ATOM 0 HG2 MET A 36 35.217 -19.392 14.328 1.00 0.00 H new ATOM 0 HG3 MET A 36 36.327 -20.747 14.271 1.00 0.00 H new ATOM 0 HE1 MET A 36 39.100 -18.159 14.682 1.00 0.00 H new ATOM 0 HE2 MET A 36 37.548 -18.176 15.554 1.00 0.00 H new ATOM 0 HE3 MET A 36 38.374 -19.707 15.178 1.00 0.00 H new ATOM 558 N LYS A 37 32.881 -20.588 10.222 1.00 0.00 N ATOM 559 CA LYS A 37 32.301 -21.064 8.959 1.00 0.00 C ATOM 560 C LYS A 37 31.968 -19.886 8.034 1.00 0.00 C ATOM 561 O LYS A 37 32.378 -19.905 6.877 1.00 0.00 O ATOM 562 CB LYS A 37 31.085 -21.959 9.253 1.00 0.00 C ATOM 563 CG LYS A 37 31.552 -23.345 9.737 1.00 0.00 C ATOM 564 CD LYS A 37 30.430 -24.125 10.425 1.00 0.00 C ATOM 565 CE LYS A 37 30.960 -25.505 10.822 1.00 0.00 C ATOM 566 NZ LYS A 37 30.235 -26.033 11.989 1.00 0.00 N ATOM 0 H LYS A 37 32.318 -20.812 11.042 1.00 0.00 H new ATOM 0 HA LYS A 37 33.031 -21.672 8.425 1.00 0.00 H new ATOM 0 HB2 LYS A 37 30.456 -21.493 10.012 1.00 0.00 H new ATOM 0 HB3 LYS A 37 30.476 -22.065 8.355 1.00 0.00 H new ATOM 0 HG2 LYS A 37 31.923 -23.919 8.888 1.00 0.00 H new ATOM 0 HG3 LYS A 37 32.386 -23.225 10.429 1.00 0.00 H new ATOM 0 HD2 LYS A 37 30.082 -23.587 11.306 1.00 0.00 H new ATOM 0 HD3 LYS A 37 29.576 -24.227 9.756 1.00 0.00 H new ATOM 0 HE2 LYS A 37 30.856 -26.193 9.983 1.00 0.00 H new ATOM 0 HE3 LYS A 37 32.024 -25.438 11.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 30.491 -27.030 12.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 30.490 -25.483 12.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 29.211 -25.959 11.824 1.00 0.00 H new ATOM 580 N ARG A 38 31.326 -18.815 8.524 1.00 0.00 N ATOM 581 CA ARG A 38 31.048 -17.603 7.719 1.00 0.00 C ATOM 582 C ARG A 38 32.344 -16.961 7.217 1.00 0.00 C ATOM 583 O ARG A 38 32.429 -16.572 6.055 1.00 0.00 O ATOM 584 CB ARG A 38 30.219 -16.584 8.527 1.00 0.00 C ATOM 585 CG ARG A 38 28.799 -17.054 8.880 1.00 0.00 C ATOM 586 CD ARG A 38 27.898 -17.155 7.643 1.00 0.00 C ATOM 587 NE ARG A 38 26.517 -17.522 8.013 1.00 0.00 N ATOM 588 CZ ARG A 38 25.476 -17.603 7.202 1.00 0.00 C ATOM 589 NH1 ARG A 38 25.570 -17.361 5.924 1.00 0.00 N ATOM 590 NH2 ARG A 38 24.304 -17.933 7.664 1.00 0.00 N ATOM 0 H ARG A 38 30.984 -18.758 9.483 1.00 0.00 H new ATOM 0 HA ARG A 38 30.465 -17.910 6.851 1.00 0.00 H new ATOM 0 HB2 ARG A 38 30.751 -16.352 9.450 1.00 0.00 H new ATOM 0 HB3 ARG A 38 30.150 -15.657 7.957 1.00 0.00 H new ATOM 0 HG2 ARG A 38 28.851 -18.026 9.370 1.00 0.00 H new ATOM 0 HG3 ARG A 38 28.356 -16.361 9.595 1.00 0.00 H new ATOM 0 HD2 ARG A 38 27.894 -16.202 7.115 1.00 0.00 H new ATOM 0 HD3 ARG A 38 28.302 -17.898 6.956 1.00 0.00 H new ATOM 0 HE ARG A 38 26.348 -17.735 8.996 1.00 0.00 H new ATOM 0 HH11 ARG A 38 26.469 -17.099 5.519 1.00 0.00 H new ATOM 0 HH12 ARG A 38 24.745 -17.434 5.329 1.00 0.00 H new ATOM 0 HH21 ARG A 38 24.185 -18.131 8.657 1.00 0.00 H new ATOM 0 HH22 ARG A 38 23.505 -17.993 7.032 1.00 0.00 H new ATOM 604 N VAL A 39 33.359 -16.890 8.078 1.00 0.00 N ATOM 605 CA VAL A 39 34.688 -16.340 7.767 1.00 0.00 C ATOM 606 C VAL A 39 35.389 -17.117 6.645 1.00 0.00 C ATOM 607 O VAL A 39 35.794 -16.503 5.656 1.00 0.00 O ATOM 608 CB VAL A 39 35.545 -16.295 9.047 1.00 0.00 C ATOM 609 CG1 VAL A 39 36.992 -15.901 8.796 1.00 0.00 C ATOM 610 CG2 VAL A 39 35.031 -15.245 10.028 1.00 0.00 C ATOM 0 H VAL A 39 33.282 -17.222 9.040 1.00 0.00 H new ATOM 0 HA VAL A 39 34.557 -15.324 7.396 1.00 0.00 H new ATOM 0 HB VAL A 39 35.480 -17.311 9.437 1.00 0.00 H new ATOM 0 HG11 VAL A 39 37.535 -15.890 9.741 1.00 0.00 H new ATOM 0 HG12 VAL A 39 37.453 -16.621 8.121 1.00 0.00 H new ATOM 0 HG13 VAL A 39 37.026 -14.909 8.346 1.00 0.00 H new ATOM 0 HG21 VAL A 39 35.659 -15.241 10.919 1.00 0.00 H new ATOM 0 HG22 VAL A 39 35.062 -14.262 9.558 1.00 0.00 H new ATOM 0 HG23 VAL A 39 34.005 -15.481 10.309 1.00 0.00 H new ATOM 620 N VAL A 40 35.517 -18.450 6.741 1.00 0.00 N ATOM 621 CA VAL A 40 36.158 -19.234 5.666 1.00 0.00 C ATOM 622 C VAL A 40 35.333 -19.170 4.374 1.00 0.00 C ATOM 623 O VAL A 40 35.908 -18.988 3.304 1.00 0.00 O ATOM 624 CB VAL A 40 36.493 -20.682 6.085 1.00 0.00 C ATOM 625 CG1 VAL A 40 35.297 -21.637 6.121 1.00 0.00 C ATOM 626 CG2 VAL A 40 37.546 -21.267 5.135 1.00 0.00 C ATOM 0 H VAL A 40 35.193 -19.002 7.535 1.00 0.00 H new ATOM 0 HA VAL A 40 37.122 -18.767 5.465 1.00 0.00 H new ATOM 0 HB VAL A 40 36.861 -20.602 7.108 1.00 0.00 H new ATOM 0 HG11 VAL A 40 35.632 -22.628 6.426 1.00 0.00 H new ATOM 0 HG12 VAL A 40 34.559 -21.269 6.833 1.00 0.00 H new ATOM 0 HG13 VAL A 40 34.848 -21.695 5.130 1.00 0.00 H new ATOM 0 HG21 VAL A 40 37.779 -22.289 5.435 1.00 0.00 H new ATOM 0 HG22 VAL A 40 37.157 -21.267 4.117 1.00 0.00 H new ATOM 0 HG23 VAL A 40 38.451 -20.661 5.178 1.00 0.00 H new ATOM 636 N GLN A 41 33.996 -19.256 4.449 1.00 0.00 N ATOM 637 CA GLN A 41 33.102 -19.134 3.286 1.00 0.00 C ATOM 638 C GLN A 41 33.278 -17.789 2.569 1.00 0.00 C ATOM 639 O GLN A 41 33.312 -17.761 1.338 1.00 0.00 O ATOM 640 CB GLN A 41 31.641 -19.319 3.706 1.00 0.00 C ATOM 641 CG GLN A 41 31.276 -20.779 4.057 1.00 0.00 C ATOM 642 CD GLN A 41 31.491 -21.769 2.914 1.00 0.00 C ATOM 643 OE1 GLN A 41 32.401 -22.590 2.935 1.00 0.00 O ATOM 644 NE2 GLN A 41 30.684 -21.734 1.875 1.00 0.00 N ATOM 0 H GLN A 41 33.500 -19.414 5.326 1.00 0.00 H new ATOM 0 HA GLN A 41 33.374 -19.924 2.586 1.00 0.00 H new ATOM 0 HB2 GLN A 41 31.437 -18.685 4.569 1.00 0.00 H new ATOM 0 HB3 GLN A 41 30.994 -18.976 2.899 1.00 0.00 H new ATOM 0 HG2 GLN A 41 31.872 -21.095 4.914 1.00 0.00 H new ATOM 0 HG3 GLN A 41 30.231 -20.817 4.364 1.00 0.00 H new ATOM 0 HE21 GLN A 41 29.922 -21.056 1.843 1.00 0.00 H new ATOM 0 HE22 GLN A 41 30.820 -22.385 1.101 1.00 0.00 H new ATOM 653 N HIS A 42 33.443 -16.689 3.317 1.00 0.00 N ATOM 654 CA HIS A 42 33.758 -15.384 2.724 1.00 0.00 C ATOM 655 C HIS A 42 35.065 -15.483 1.911 1.00 0.00 C ATOM 656 O HIS A 42 35.067 -15.222 0.707 1.00 0.00 O ATOM 657 CB HIS A 42 33.847 -14.276 3.802 1.00 0.00 C ATOM 658 CG HIS A 42 34.703 -13.106 3.362 1.00 0.00 C ATOM 659 ND1 HIS A 42 34.378 -12.183 2.392 1.00 0.00 N ATOM 660 CD2 HIS A 42 36.059 -13.010 3.560 1.00 0.00 C ATOM 661 CE1 HIS A 42 35.517 -11.591 1.985 1.00 0.00 C ATOM 662 NE2 HIS A 42 36.574 -12.076 2.655 1.00 0.00 N ATOM 0 H HIS A 42 33.363 -16.678 4.334 1.00 0.00 H new ATOM 0 HA HIS A 42 32.947 -15.105 2.051 1.00 0.00 H new ATOM 0 HB2 HIS A 42 32.844 -13.920 4.036 1.00 0.00 H new ATOM 0 HB3 HIS A 42 34.258 -14.698 4.719 1.00 0.00 H new ATOM 0 HD1 HIS A 42 33.440 -11.983 2.044 1.00 0.00 H new ATOM 0 HD2 HIS A 42 36.631 -13.562 4.291 1.00 0.00 H new ATOM 0 HE1 HIS A 42 35.572 -10.829 1.222 1.00 0.00 H new ATOM 670 N THR A 43 36.168 -15.890 2.550 1.00 0.00 N ATOM 671 CA THR A 43 37.495 -15.977 1.919 1.00 0.00 C ATOM 672 C THR A 43 37.518 -16.908 0.704 1.00 0.00 C ATOM 673 O THR A 43 38.146 -16.590 -0.308 1.00 0.00 O ATOM 674 CB THR A 43 38.535 -16.403 2.962 1.00 0.00 C ATOM 675 OG1 THR A 43 38.686 -15.380 3.919 1.00 0.00 O ATOM 676 CG2 THR A 43 39.911 -16.678 2.365 1.00 0.00 C ATOM 0 H THR A 43 36.167 -16.172 3.530 1.00 0.00 H new ATOM 0 HA THR A 43 37.745 -14.986 1.541 1.00 0.00 H new ATOM 0 HB THR A 43 38.163 -17.328 3.403 1.00 0.00 H new ATOM 0 HG1 THR A 43 39.633 -15.289 4.154 1.00 0.00 H new ATOM 0 HG21 THR A 43 40.599 -16.975 3.157 1.00 0.00 H new ATOM 0 HG22 THR A 43 39.835 -17.480 1.631 1.00 0.00 H new ATOM 0 HG23 THR A 43 40.284 -15.776 1.880 1.00 0.00 H new ATOM 684 N LYS A 44 36.787 -18.028 0.772 1.00 0.00 N ATOM 685 CA LYS A 44 36.614 -19.028 -0.297 1.00 0.00 C ATOM 686 C LYS A 44 36.048 -18.453 -1.609 1.00 0.00 C ATOM 687 O LYS A 44 36.177 -19.098 -2.650 1.00 0.00 O ATOM 688 CB LYS A 44 35.695 -20.148 0.230 1.00 0.00 C ATOM 689 CG LYS A 44 36.413 -21.275 0.984 1.00 0.00 C ATOM 690 CD LYS A 44 35.334 -22.169 1.612 1.00 0.00 C ATOM 691 CE LYS A 44 35.880 -23.421 2.300 1.00 0.00 C ATOM 692 NZ LYS A 44 34.757 -24.302 2.718 1.00 0.00 N ATOM 0 H LYS A 44 36.272 -18.277 1.617 1.00 0.00 H new ATOM 0 HA LYS A 44 37.604 -19.408 -0.549 1.00 0.00 H new ATOM 0 HB2 LYS A 44 34.951 -19.705 0.892 1.00 0.00 H new ATOM 0 HB3 LYS A 44 35.155 -20.581 -0.612 1.00 0.00 H new ATOM 0 HG2 LYS A 44 37.041 -21.851 0.305 1.00 0.00 H new ATOM 0 HG3 LYS A 44 37.067 -20.866 1.753 1.00 0.00 H new ATOM 0 HD2 LYS A 44 34.772 -21.584 2.340 1.00 0.00 H new ATOM 0 HD3 LYS A 44 34.632 -22.472 0.835 1.00 0.00 H new ATOM 0 HE2 LYS A 44 36.542 -23.959 1.622 1.00 0.00 H new ATOM 0 HE3 LYS A 44 36.474 -23.139 3.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 34.977 -24.731 3.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 33.886 -23.740 2.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 34.622 -25.052 2.010 1.00 0.00 H new ATOM 706 N GLY A 45 35.437 -17.262 -1.576 1.00 0.00 N ATOM 707 CA GLY A 45 34.846 -16.587 -2.740 1.00 0.00 C ATOM 708 C GLY A 45 35.178 -15.094 -2.877 1.00 0.00 C ATOM 709 O GLY A 45 34.681 -14.461 -3.813 1.00 0.00 O ATOM 0 H GLY A 45 35.337 -16.725 -0.714 1.00 0.00 H new ATOM 0 HA2 GLY A 45 35.178 -17.100 -3.643 1.00 0.00 H new ATOM 0 HA3 GLY A 45 33.763 -16.698 -2.691 1.00 0.00 H new ATOM 713 N CYS A 46 36.014 -14.523 -2.000 1.00 0.00 N ATOM 714 CA CYS A 46 36.410 -13.120 -2.026 1.00 0.00 C ATOM 715 C CYS A 46 37.229 -12.775 -3.284 1.00 0.00 C ATOM 716 O CYS A 46 37.782 -13.643 -3.972 1.00 0.00 O ATOM 717 CB CYS A 46 37.107 -12.849 -0.685 1.00 0.00 C ATOM 718 SG CYS A 46 37.798 -11.164 -0.519 1.00 0.00 S ATOM 0 H CYS A 46 36.442 -15.043 -1.234 1.00 0.00 H new ATOM 0 HA CYS A 46 35.556 -12.448 -2.115 1.00 0.00 H new ATOM 0 HB2 CYS A 46 36.394 -13.017 0.122 1.00 0.00 H new ATOM 0 HB3 CYS A 46 37.912 -13.573 -0.555 1.00 0.00 H new ATOM 723 N LYS A 47 37.296 -11.476 -3.570 1.00 0.00 N ATOM 724 CA LYS A 47 37.997 -10.853 -4.703 1.00 0.00 C ATOM 725 C LYS A 47 38.855 -9.660 -4.256 1.00 0.00 C ATOM 726 O LYS A 47 39.408 -8.957 -5.105 1.00 0.00 O ATOM 727 CB LYS A 47 36.968 -10.448 -5.784 1.00 0.00 C ATOM 728 CG LYS A 47 36.145 -11.616 -6.356 1.00 0.00 C ATOM 729 CD LYS A 47 36.997 -12.602 -7.174 1.00 0.00 C ATOM 730 CE LYS A 47 36.224 -13.877 -7.531 1.00 0.00 C ATOM 731 NZ LYS A 47 36.037 -14.761 -6.350 1.00 0.00 N ATOM 0 H LYS A 47 36.834 -10.782 -2.982 1.00 0.00 H new ATOM 0 HA LYS A 47 38.687 -11.580 -5.131 1.00 0.00 H new ATOM 0 HB2 LYS A 47 36.284 -9.713 -5.359 1.00 0.00 H new ATOM 0 HB3 LYS A 47 37.495 -9.957 -6.602 1.00 0.00 H new ATOM 0 HG2 LYS A 47 35.664 -12.151 -5.537 1.00 0.00 H new ATOM 0 HG3 LYS A 47 35.350 -11.219 -6.987 1.00 0.00 H new ATOM 0 HD2 LYS A 47 37.335 -12.115 -8.089 1.00 0.00 H new ATOM 0 HD3 LYS A 47 37.889 -12.867 -6.606 1.00 0.00 H new ATOM 0 HE2 LYS A 47 35.251 -13.608 -7.941 1.00 0.00 H new ATOM 0 HE3 LYS A 47 36.759 -14.420 -8.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 35.586 -15.649 -6.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 36.962 -14.970 -5.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 35.432 -14.284 -5.651 1.00 0.00 H new ATOM 745 N ARG A 48 38.980 -9.429 -2.939 1.00 0.00 N ATOM 746 CA ARG A 48 39.753 -8.321 -2.362 1.00 0.00 C ATOM 747 C ARG A 48 41.133 -8.780 -1.870 1.00 0.00 C ATOM 748 O ARG A 48 42.135 -8.297 -2.395 1.00 0.00 O ATOM 749 CB ARG A 48 38.944 -7.709 -1.207 1.00 0.00 C ATOM 750 CG ARG A 48 37.572 -7.134 -1.556 1.00 0.00 C ATOM 751 CD ARG A 48 36.881 -6.521 -0.326 1.00 0.00 C ATOM 752 NE ARG A 48 36.711 -7.492 0.778 1.00 0.00 N ATOM 753 CZ ARG A 48 35.677 -7.660 1.576 1.00 0.00 C ATOM 754 NH1 ARG A 48 34.555 -7.007 1.462 1.00 0.00 N ATOM 755 NH2 ARG A 48 35.769 -8.512 2.541 1.00 0.00 N ATOM 0 H ARG A 48 38.538 -10.019 -2.234 1.00 0.00 H new ATOM 0 HA ARG A 48 39.928 -7.574 -3.136 1.00 0.00 H new ATOM 0 HB2 ARG A 48 38.807 -8.476 -0.444 1.00 0.00 H new ATOM 0 HB3 ARG A 48 39.541 -6.915 -0.757 1.00 0.00 H new ATOM 0 HG2 ARG A 48 37.682 -6.373 -2.328 1.00 0.00 H new ATOM 0 HG3 ARG A 48 36.943 -7.921 -1.972 1.00 0.00 H new ATOM 0 HD2 ARG A 48 37.466 -5.673 0.029 1.00 0.00 H new ATOM 0 HD3 ARG A 48 35.904 -6.135 -0.618 1.00 0.00 H new ATOM 0 HE ARG A 48 37.501 -8.115 0.943 1.00 0.00 H new ATOM 0 HH11 ARG A 48 34.440 -6.317 0.720 1.00 0.00 H new ATOM 0 HH12 ARG A 48 33.792 -7.186 2.115 1.00 0.00 H new ATOM 0 HH21 ARG A 48 36.631 -9.040 2.674 1.00 0.00 H new ATOM 0 HH22 ARG A 48 34.979 -8.657 3.170 1.00 0.00 H new ATOM 769 N LYS A 49 41.181 -9.697 -0.886 1.00 0.00 N ATOM 770 CA LYS A 49 42.387 -10.202 -0.180 1.00 0.00 C ATOM 771 C LYS A 49 43.381 -9.117 0.294 1.00 0.00 C ATOM 772 O LYS A 49 43.135 -7.914 0.177 1.00 0.00 O ATOM 773 CB LYS A 49 43.027 -11.469 -0.824 1.00 0.00 C ATOM 774 CG LYS A 49 42.920 -11.714 -2.341 1.00 0.00 C ATOM 775 CD LYS A 49 41.935 -12.839 -2.715 1.00 0.00 C ATOM 776 CE LYS A 49 40.483 -12.553 -2.324 1.00 0.00 C ATOM 777 NZ LYS A 49 40.173 -12.890 -0.917 1.00 0.00 N ATOM 0 H LYS A 49 40.329 -10.136 -0.536 1.00 0.00 H new ATOM 0 HA LYS A 49 41.994 -10.574 0.766 1.00 0.00 H new ATOM 0 HB2 LYS A 49 44.088 -11.456 -0.574 1.00 0.00 H new ATOM 0 HB3 LYS A 49 42.593 -12.337 -0.327 1.00 0.00 H new ATOM 0 HG2 LYS A 49 42.607 -10.791 -2.829 1.00 0.00 H new ATOM 0 HG3 LYS A 49 43.907 -11.962 -2.731 1.00 0.00 H new ATOM 0 HD2 LYS A 49 41.984 -13.008 -3.791 1.00 0.00 H new ATOM 0 HD3 LYS A 49 42.255 -13.763 -2.233 1.00 0.00 H new ATOM 0 HE2 LYS A 49 40.271 -11.497 -2.491 1.00 0.00 H new ATOM 0 HE3 LYS A 49 39.821 -13.119 -2.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 39.437 -12.247 -0.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 39.832 -13.871 -0.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 41.031 -12.789 -0.339 1.00 0.00 H new ATOM 791 N THR A 50 44.514 -9.529 0.868 1.00 0.00 N ATOM 792 CA THR A 50 45.579 -8.645 1.385 1.00 0.00 C ATOM 793 C THR A 50 46.152 -7.699 0.320 1.00 0.00 C ATOM 794 O THR A 50 46.589 -6.595 0.649 1.00 0.00 O ATOM 795 CB THR A 50 46.724 -9.474 1.995 1.00 0.00 C ATOM 796 OG1 THR A 50 47.223 -10.382 1.039 1.00 0.00 O ATOM 797 CG2 THR A 50 46.259 -10.301 3.192 1.00 0.00 C ATOM 0 H THR A 50 44.729 -10.518 0.993 1.00 0.00 H new ATOM 0 HA THR A 50 45.110 -8.028 2.152 1.00 0.00 H new ATOM 0 HB THR A 50 47.486 -8.763 2.314 1.00 0.00 H new ATOM 0 HG1 THR A 50 46.748 -11.236 1.120 1.00 0.00 H new ATOM 0 HG21 THR A 50 47.100 -10.870 3.590 1.00 0.00 H new ATOM 0 HG22 THR A 50 45.872 -9.637 3.965 1.00 0.00 H new ATOM 0 HG23 THR A 50 45.473 -10.988 2.877 1.00 0.00 H new ATOM 805 N ASN A 51 46.132 -8.103 -0.958 1.00 0.00 N ATOM 806 CA ASN A 51 46.621 -7.308 -2.092 1.00 0.00 C ATOM 807 C ASN A 51 45.683 -6.149 -2.488 1.00 0.00 C ATOM 808 O ASN A 51 46.158 -5.130 -2.996 1.00 0.00 O ATOM 809 CB ASN A 51 46.859 -8.248 -3.287 1.00 0.00 C ATOM 810 CG ASN A 51 47.872 -9.330 -2.959 1.00 0.00 C ATOM 811 OD1 ASN A 51 47.542 -10.499 -2.818 1.00 0.00 O ATOM 812 ND2 ASN A 51 49.129 -8.973 -2.827 1.00 0.00 N ATOM 0 H ASN A 51 45.767 -9.013 -1.238 1.00 0.00 H new ATOM 0 HA ASN A 51 47.552 -6.833 -1.783 1.00 0.00 H new ATOM 0 HB2 ASN A 51 45.916 -8.710 -3.580 1.00 0.00 H new ATOM 0 HB3 ASN A 51 47.209 -7.669 -4.141 1.00 0.00 H new ATOM 0 HD21 ASN A 51 49.837 -9.673 -2.605 1.00 0.00 H new ATOM 0 HD22 ASN A 51 49.397 -7.996 -2.946 1.00 0.00 H new ATOM 819 N GLY A 52 44.372 -6.284 -2.257 1.00 0.00 N ATOM 820 CA GLY A 52 43.363 -5.263 -2.577 1.00 0.00 C ATOM 821 C GLY A 52 42.949 -4.417 -1.367 1.00 0.00 C ATOM 822 O GLY A 52 42.650 -3.231 -1.529 1.00 0.00 O ATOM 0 H GLY A 52 43.973 -7.122 -1.834 1.00 0.00 H new ATOM 0 HA2 GLY A 52 43.755 -4.606 -3.353 1.00 0.00 H new ATOM 0 HA3 GLY A 52 42.480 -5.752 -2.989 1.00 0.00 H new ATOM 826 N GLY A 53 42.963 -4.997 -0.160 1.00 0.00 N ATOM 827 CA GLY A 53 42.657 -4.305 1.102 1.00 0.00 C ATOM 828 C GLY A 53 41.653 -5.002 2.031 1.00 0.00 C ATOM 829 O GLY A 53 41.224 -4.378 3.005 1.00 0.00 O ATOM 0 H GLY A 53 43.192 -5.982 -0.029 1.00 0.00 H new ATOM 0 HA2 GLY A 53 43.589 -4.163 1.649 1.00 0.00 H new ATOM 0 HA3 GLY A 53 42.272 -3.313 0.864 1.00 0.00 H new ATOM 833 N CYS A 54 41.252 -6.249 1.753 1.00 0.00 N ATOM 834 CA CYS A 54 40.283 -6.995 2.556 1.00 0.00 C ATOM 835 C CYS A 54 40.676 -7.114 4.044 1.00 0.00 C ATOM 836 O CYS A 54 41.752 -7.653 4.349 1.00 0.00 O ATOM 837 CB CYS A 54 40.163 -8.389 1.956 1.00 0.00 C ATOM 838 SG CYS A 54 38.664 -9.211 2.541 1.00 0.00 S ATOM 0 H CYS A 54 41.599 -6.774 0.950 1.00 0.00 H new ATOM 0 HA CYS A 54 39.339 -6.451 2.532 1.00 0.00 H new ATOM 0 HB2 CYS A 54 40.146 -8.322 0.868 1.00 0.00 H new ATOM 0 HB3 CYS A 54 41.037 -8.982 2.225 1.00 0.00 H new ATOM 843 N PRO A 55 39.836 -6.647 4.988 1.00 0.00 N ATOM 844 CA PRO A 55 40.128 -6.782 6.405 1.00 0.00 C ATOM 845 C PRO A 55 39.867 -8.215 6.897 1.00 0.00 C ATOM 846 O PRO A 55 40.510 -8.635 7.857 1.00 0.00 O ATOM 847 CB PRO A 55 39.200 -5.778 7.095 1.00 0.00 C ATOM 848 CG PRO A 55 37.970 -5.759 6.187 1.00 0.00 C ATOM 849 CD PRO A 55 38.555 -5.983 4.789 1.00 0.00 C ATOM 0 HA PRO A 55 41.177 -6.585 6.625 1.00 0.00 H new ATOM 0 HB2 PRO A 55 38.948 -6.092 8.108 1.00 0.00 H new ATOM 0 HB3 PRO A 55 39.659 -4.792 7.172 1.00 0.00 H new ATOM 0 HG2 PRO A 55 37.261 -6.542 6.456 1.00 0.00 H new ATOM 0 HG3 PRO A 55 37.437 -4.810 6.252 1.00 0.00 H new ATOM 0 HD2 PRO A 55 37.889 -6.596 4.182 1.00 0.00 H new ATOM 0 HD3 PRO A 55 38.684 -5.036 4.264 1.00 0.00 H new ATOM 857 N VAL A 56 38.960 -8.971 6.259 1.00 0.00 N ATOM 858 CA VAL A 56 38.629 -10.347 6.662 1.00 0.00 C ATOM 859 C VAL A 56 39.756 -11.304 6.285 1.00 0.00 C ATOM 860 O VAL A 56 40.325 -11.894 7.204 1.00 0.00 O ATOM 861 CB VAL A 56 37.277 -10.836 6.111 1.00 0.00 C ATOM 862 CG1 VAL A 56 36.905 -12.187 6.742 1.00 0.00 C ATOM 863 CG2 VAL A 56 36.131 -9.869 6.431 1.00 0.00 C ATOM 0 H VAL A 56 38.435 -8.645 5.448 1.00 0.00 H new ATOM 0 HA VAL A 56 38.524 -10.335 7.747 1.00 0.00 H new ATOM 0 HB VAL A 56 37.400 -10.912 5.031 1.00 0.00 H new ATOM 0 HG11 VAL A 56 35.947 -12.523 6.345 1.00 0.00 H new ATOM 0 HG12 VAL A 56 37.674 -12.923 6.506 1.00 0.00 H new ATOM 0 HG13 VAL A 56 36.830 -12.075 7.824 1.00 0.00 H new ATOM 0 HG21 VAL A 56 35.200 -10.260 6.021 1.00 0.00 H new ATOM 0 HG22 VAL A 56 36.035 -9.763 7.512 1.00 0.00 H new ATOM 0 HG23 VAL A 56 36.342 -8.895 5.988 1.00 0.00 H new ATOM 873 N CYS A 57 40.131 -11.424 5.003 1.00 0.00 N ATOM 874 CA CYS A 57 41.246 -12.261 4.542 1.00 0.00 C ATOM 875 C CYS A 57 42.493 -12.050 5.414 1.00 0.00 C ATOM 876 O CYS A 57 43.009 -13.004 5.997 1.00 0.00 O ATOM 877 CB CYS A 57 41.521 -11.937 3.067 1.00 0.00 C ATOM 878 SG CYS A 57 40.135 -12.427 1.986 1.00 0.00 S ATOM 0 H CYS A 57 39.658 -10.933 4.244 1.00 0.00 H new ATOM 0 HA CYS A 57 40.980 -13.314 4.633 1.00 0.00 H new ATOM 0 HB2 CYS A 57 41.704 -10.868 2.959 1.00 0.00 H new ATOM 0 HB3 CYS A 57 42.428 -12.449 2.747 1.00 0.00 H new ATOM 883 N LYS A 58 42.954 -10.801 5.570 1.00 0.00 N ATOM 884 CA LYS A 58 44.096 -10.441 6.404 1.00 0.00 C ATOM 885 C LYS A 58 43.981 -10.919 7.864 1.00 0.00 C ATOM 886 O LYS A 58 44.998 -11.264 8.469 1.00 0.00 O ATOM 887 CB LYS A 58 44.289 -8.922 6.277 1.00 0.00 C ATOM 888 CG LYS A 58 45.738 -8.552 6.574 1.00 0.00 C ATOM 889 CD LYS A 58 46.073 -7.133 6.092 1.00 0.00 C ATOM 890 CE LYS A 58 47.495 -6.746 6.516 1.00 0.00 C ATOM 891 NZ LYS A 58 47.831 -5.357 6.103 1.00 0.00 N ATOM 0 H LYS A 58 42.529 -9.998 5.106 1.00 0.00 H new ATOM 0 HA LYS A 58 44.983 -10.964 6.048 1.00 0.00 H new ATOM 0 HB2 LYS A 58 44.021 -8.596 5.272 1.00 0.00 H new ATOM 0 HB3 LYS A 58 43.624 -8.404 6.968 1.00 0.00 H new ATOM 0 HG2 LYS A 58 45.919 -8.624 7.646 1.00 0.00 H new ATOM 0 HG3 LYS A 58 46.403 -9.267 6.089 1.00 0.00 H new ATOM 0 HD2 LYS A 58 45.983 -7.080 5.007 1.00 0.00 H new ATOM 0 HD3 LYS A 58 45.357 -6.423 6.506 1.00 0.00 H new ATOM 0 HE2 LYS A 58 47.590 -6.838 7.598 1.00 0.00 H new ATOM 0 HE3 LYS A 58 48.209 -7.441 6.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 48.799 -5.129 6.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 47.764 -5.277 5.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 47.165 -4.692 6.546 1.00 0.00 H new ATOM 905 N GLN A 59 42.765 -11.008 8.413 1.00 0.00 N ATOM 906 CA GLN A 59 42.516 -11.522 9.762 1.00 0.00 C ATOM 907 C GLN A 59 42.739 -13.042 9.827 1.00 0.00 C ATOM 908 O GLN A 59 43.439 -13.496 10.735 1.00 0.00 O ATOM 909 CB GLN A 59 41.098 -11.147 10.242 1.00 0.00 C ATOM 910 CG GLN A 59 41.048 -10.803 11.743 1.00 0.00 C ATOM 911 CD GLN A 59 41.632 -9.425 12.084 1.00 0.00 C ATOM 912 OE1 GLN A 59 42.292 -8.767 11.294 1.00 0.00 O ATOM 913 NE2 GLN A 59 41.404 -8.913 13.274 1.00 0.00 N ATOM 0 H GLN A 59 41.916 -10.721 7.926 1.00 0.00 H new ATOM 0 HA GLN A 59 43.233 -11.053 10.436 1.00 0.00 H new ATOM 0 HB2 GLN A 59 40.738 -10.294 9.666 1.00 0.00 H new ATOM 0 HB3 GLN A 59 40.420 -11.976 10.041 1.00 0.00 H new ATOM 0 HG2 GLN A 59 40.012 -10.842 12.080 1.00 0.00 H new ATOM 0 HG3 GLN A 59 41.593 -11.566 12.299 1.00 0.00 H new ATOM 0 HE21 GLN A 59 40.857 -9.436 13.958 1.00 0.00 H new ATOM 0 HE22 GLN A 59 41.775 -7.993 13.513 1.00 0.00 H new ATOM 922 N LEU A 60 42.225 -13.824 8.858 1.00 0.00 N ATOM 923 CA LEU A 60 42.497 -15.273 8.794 1.00 0.00 C ATOM 924 C LEU A 60 43.994 -15.492 8.611 1.00 0.00 C ATOM 925 O LEU A 60 44.581 -16.315 9.299 1.00 0.00 O ATOM 926 CB LEU A 60 41.847 -16.010 7.603 1.00 0.00 C ATOM 927 CG LEU A 60 40.326 -16.173 7.569 1.00 0.00 C ATOM 928 CD1 LEU A 60 39.669 -14.858 7.180 1.00 0.00 C ATOM 929 CD2 LEU A 60 39.975 -17.237 6.524 1.00 0.00 C ATOM 0 H LEU A 60 41.622 -13.478 8.112 1.00 0.00 H new ATOM 0 HA LEU A 60 42.084 -15.668 9.722 1.00 0.00 H new ATOM 0 HB2 LEU A 60 42.142 -15.488 6.693 1.00 0.00 H new ATOM 0 HB3 LEU A 60 42.285 -17.007 7.555 1.00 0.00 H new ATOM 0 HG LEU A 60 39.968 -16.471 8.554 1.00 0.00 H new ATOM 0 HD11 LEU A 60 38.587 -14.984 7.159 1.00 0.00 H new ATOM 0 HD12 LEU A 60 39.930 -14.091 7.909 1.00 0.00 H new ATOM 0 HD13 LEU A 60 40.018 -14.555 6.193 1.00 0.00 H new ATOM 0 HD21 LEU A 60 38.893 -17.367 6.486 1.00 0.00 H new ATOM 0 HD22 LEU A 60 40.337 -16.920 5.546 1.00 0.00 H new ATOM 0 HD23 LEU A 60 40.444 -18.183 6.796 1.00 0.00 H new ATOM 941 N ILE A 61 44.598 -14.767 7.671 1.00 0.00 N ATOM 942 CA ILE A 61 46.017 -14.854 7.316 1.00 0.00 C ATOM 943 C ILE A 61 46.929 -14.671 8.533 1.00 0.00 C ATOM 944 O ILE A 61 47.839 -15.481 8.705 1.00 0.00 O ATOM 945 CB ILE A 61 46.282 -13.895 6.135 1.00 0.00 C ATOM 946 CG1 ILE A 61 45.631 -14.419 4.842 1.00 0.00 C ATOM 947 CG2 ILE A 61 47.754 -13.602 5.805 1.00 0.00 C ATOM 948 CD1 ILE A 61 46.136 -15.797 4.425 1.00 0.00 C ATOM 0 H ILE A 61 44.095 -14.076 7.114 1.00 0.00 H new ATOM 0 HA ILE A 61 46.270 -15.858 6.975 1.00 0.00 H new ATOM 0 HB ILE A 61 45.842 -12.962 6.486 1.00 0.00 H new ATOM 0 HG12 ILE A 61 44.551 -14.462 4.980 1.00 0.00 H new ATOM 0 HG13 ILE A 61 45.821 -13.711 4.035 1.00 0.00 H new ATOM 0 HG21 ILE A 61 47.808 -12.917 4.959 1.00 0.00 H new ATOM 0 HG22 ILE A 61 48.237 -13.148 6.670 1.00 0.00 H new ATOM 0 HG23 ILE A 61 48.262 -14.532 5.552 1.00 0.00 H new ATOM 0 HD11 ILE A 61 45.636 -16.105 3.507 1.00 0.00 H new ATOM 0 HD12 ILE A 61 47.212 -15.754 4.255 1.00 0.00 H new ATOM 0 HD13 ILE A 61 45.921 -16.517 5.214 1.00 0.00 H new ATOM 960 N ALA A 62 46.668 -13.706 9.424 1.00 0.00 N ATOM 961 CA ALA A 62 47.434 -13.570 10.670 1.00 0.00 C ATOM 962 C ALA A 62 47.281 -14.831 11.540 1.00 0.00 C ATOM 963 O ALA A 62 48.264 -15.457 11.944 1.00 0.00 O ATOM 964 CB ALA A 62 46.954 -12.322 11.435 1.00 0.00 C ATOM 0 H ALA A 62 45.933 -13.009 9.306 1.00 0.00 H new ATOM 0 HA ALA A 62 48.491 -13.455 10.428 1.00 0.00 H new ATOM 0 HB1 ALA A 62 47.522 -12.221 12.360 1.00 0.00 H new ATOM 0 HB2 ALA A 62 47.105 -11.436 10.818 1.00 0.00 H new ATOM 0 HB3 ALA A 62 45.895 -12.424 11.670 1.00 0.00 H new ATOM 970 N LEU A 63 46.029 -15.215 11.794 1.00 0.00 N ATOM 971 CA LEU A 63 45.642 -16.364 12.618 1.00 0.00 C ATOM 972 C LEU A 63 46.276 -17.679 12.120 1.00 0.00 C ATOM 973 O LEU A 63 46.829 -18.457 12.900 1.00 0.00 O ATOM 974 CB LEU A 63 44.098 -16.394 12.641 1.00 0.00 C ATOM 975 CG LEU A 63 43.492 -16.715 14.013 1.00 0.00 C ATOM 976 CD1 LEU A 63 42.033 -16.256 14.051 1.00 0.00 C ATOM 977 CD2 LEU A 63 43.544 -18.205 14.311 1.00 0.00 C ATOM 0 H LEU A 63 45.224 -14.715 11.417 1.00 0.00 H new ATOM 0 HA LEU A 63 46.021 -16.261 13.635 1.00 0.00 H new ATOM 0 HB2 LEU A 63 43.723 -15.426 12.309 1.00 0.00 H new ATOM 0 HB3 LEU A 63 43.750 -17.135 11.921 1.00 0.00 H new ATOM 0 HG LEU A 63 44.078 -16.189 14.766 1.00 0.00 H new ATOM 0 HD11 LEU A 63 41.605 -16.485 15.027 1.00 0.00 H new ATOM 0 HD12 LEU A 63 41.985 -15.181 13.877 1.00 0.00 H new ATOM 0 HD13 LEU A 63 41.468 -16.774 13.276 1.00 0.00 H new ATOM 0 HD21 LEU A 63 43.106 -18.396 15.291 1.00 0.00 H new ATOM 0 HD22 LEU A 63 42.982 -18.748 13.551 1.00 0.00 H new ATOM 0 HD23 LEU A 63 44.581 -18.541 14.305 1.00 0.00 H new ATOM 989 N CYS A 64 46.247 -17.893 10.804 1.00 0.00 N ATOM 990 CA CYS A 64 46.843 -19.035 10.124 1.00 0.00 C ATOM 991 C CYS A 64 48.375 -18.971 10.175 1.00 0.00 C ATOM 992 O CYS A 64 48.988 -20.005 10.409 1.00 0.00 O ATOM 993 CB CYS A 64 46.334 -19.115 8.678 1.00 0.00 C ATOM 994 SG CYS A 64 44.541 -19.406 8.649 1.00 0.00 S ATOM 0 H CYS A 64 45.789 -17.248 10.161 1.00 0.00 H new ATOM 0 HA CYS A 64 46.540 -19.944 10.643 1.00 0.00 H new ATOM 0 HB2 CYS A 64 46.566 -18.189 8.153 1.00 0.00 H new ATOM 0 HB3 CYS A 64 46.847 -19.918 8.150 1.00 0.00 H new ATOM 0 HG CYS A 64 43.917 -18.293 8.897 1.00 0.00 H new ATOM 1000 N CYS A 65 49.009 -17.798 10.024 1.00 0.00 N ATOM 1001 CA CYS A 65 50.466 -17.652 10.156 1.00 0.00 C ATOM 1002 C CYS A 65 50.942 -18.068 11.555 1.00 0.00 C ATOM 1003 O CYS A 65 51.891 -18.841 11.667 1.00 0.00 O ATOM 1004 CB CYS A 65 50.908 -16.222 9.828 1.00 0.00 C ATOM 1005 SG CYS A 65 50.872 -15.934 8.039 1.00 0.00 S ATOM 0 H CYS A 65 48.527 -16.926 9.807 1.00 0.00 H new ATOM 0 HA CYS A 65 50.933 -18.322 9.434 1.00 0.00 H new ATOM 0 HB2 CYS A 65 50.253 -15.510 10.329 1.00 0.00 H new ATOM 0 HB3 CYS A 65 51.915 -16.051 10.209 1.00 0.00 H new ATOM 0 HG CYS A 65 50.679 -14.669 7.807 1.00 0.00 H new ATOM 1011 N TYR A 66 50.267 -17.612 12.616 1.00 0.00 N ATOM 1012 CA TYR A 66 50.595 -17.962 14.006 1.00 0.00 C ATOM 1013 C TYR A 66 50.673 -19.485 14.226 1.00 0.00 C ATOM 1014 O TYR A 66 51.588 -19.990 14.881 1.00 0.00 O ATOM 1015 CB TYR A 66 49.545 -17.327 14.925 1.00 0.00 C ATOM 1016 CG TYR A 66 50.017 -17.045 16.336 1.00 0.00 C ATOM 1017 CD1 TYR A 66 50.702 -15.847 16.603 1.00 0.00 C ATOM 1018 CD2 TYR A 66 49.692 -17.917 17.393 1.00 0.00 C ATOM 1019 CE1 TYR A 66 50.967 -15.465 17.930 1.00 0.00 C ATOM 1020 CE2 TYR A 66 49.990 -17.558 18.721 1.00 0.00 C ATOM 1021 CZ TYR A 66 50.614 -16.323 18.993 1.00 0.00 C ATOM 1022 OH TYR A 66 50.872 -15.961 20.278 1.00 0.00 O ATOM 0 H TYR A 66 49.469 -16.983 12.535 1.00 0.00 H new ATOM 0 HA TYR A 66 51.586 -17.573 14.241 1.00 0.00 H new ATOM 0 HB2 TYR A 66 49.209 -16.392 14.477 1.00 0.00 H new ATOM 0 HB3 TYR A 66 48.679 -17.987 14.973 1.00 0.00 H new ATOM 0 HD1 TYR A 66 51.026 -15.218 15.787 1.00 0.00 H new ATOM 0 HD2 TYR A 66 49.213 -18.862 17.184 1.00 0.00 H new ATOM 0 HE1 TYR A 66 51.440 -14.516 18.135 1.00 0.00 H new ATOM 0 HE2 TYR A 66 49.741 -18.228 19.531 1.00 0.00 H new ATOM 0 HH TYR A 66 50.564 -16.666 20.885 1.00 0.00 H new ATOM 1032 N HIS A 67 49.738 -20.226 13.624 1.00 0.00 N ATOM 1033 CA HIS A 67 49.700 -21.686 13.652 1.00 0.00 C ATOM 1034 C HIS A 67 50.748 -22.299 12.690 1.00 0.00 C ATOM 1035 O HIS A 67 51.588 -23.095 13.116 1.00 0.00 O ATOM 1036 CB HIS A 67 48.261 -22.129 13.329 1.00 0.00 C ATOM 1037 CG HIS A 67 48.126 -23.620 13.169 1.00 0.00 C ATOM 1038 ND1 HIS A 67 48.094 -24.563 14.175 1.00 0.00 N ATOM 1039 CD2 HIS A 67 48.194 -24.294 11.980 1.00 0.00 C ATOM 1040 CE1 HIS A 67 48.189 -25.779 13.604 1.00 0.00 C ATOM 1041 NE2 HIS A 67 48.269 -25.663 12.269 1.00 0.00 N ATOM 0 H HIS A 67 48.970 -19.815 13.092 1.00 0.00 H new ATOM 0 HA HIS A 67 49.970 -22.054 14.642 1.00 0.00 H new ATOM 0 HB2 HIS A 67 47.596 -21.793 14.125 1.00 0.00 H new ATOM 0 HB3 HIS A 67 47.933 -21.640 12.412 1.00 0.00 H new ATOM 0 HD1 HIS A 67 48.013 -24.373 15.174 1.00 0.00 H new ATOM 0 HD2 HIS A 67 48.190 -23.850 10.995 1.00 0.00 H new ATOM 0 HE1 HIS A 67 48.199 -26.715 14.143 1.00 0.00 H new ATOM 1049 N ALA A 68 50.746 -21.909 11.409 1.00 0.00 N ATOM 1050 CA ALA A 68 51.639 -22.407 10.359 1.00 0.00 C ATOM 1051 C ALA A 68 53.144 -22.235 10.639 1.00 0.00 C ATOM 1052 O ALA A 68 53.933 -23.064 10.180 1.00 0.00 O ATOM 1053 CB ALA A 68 51.240 -21.763 9.032 1.00 0.00 C ATOM 0 H ALA A 68 50.092 -21.207 11.063 1.00 0.00 H new ATOM 0 HA ALA A 68 51.507 -23.488 10.322 1.00 0.00 H new ATOM 0 HB1 ALA A 68 51.896 -22.124 8.240 1.00 0.00 H new ATOM 0 HB2 ALA A 68 50.209 -22.025 8.796 1.00 0.00 H new ATOM 0 HB3 ALA A 68 51.330 -20.680 9.112 1.00 0.00 H new ATOM 1059 N LYS A 69 53.565 -21.218 11.412 1.00 0.00 N ATOM 1060 CA LYS A 69 54.977 -21.060 11.825 1.00 0.00 C ATOM 1061 C LYS A 69 55.472 -22.313 12.560 1.00 0.00 C ATOM 1062 O LYS A 69 56.612 -22.739 12.368 1.00 0.00 O ATOM 1063 CB LYS A 69 55.163 -19.853 12.765 1.00 0.00 C ATOM 1064 CG LYS A 69 55.190 -18.459 12.115 1.00 0.00 C ATOM 1065 CD LYS A 69 55.411 -17.370 13.188 1.00 0.00 C ATOM 1066 CE LYS A 69 56.895 -17.241 13.571 1.00 0.00 C ATOM 1067 NZ LYS A 69 57.623 -16.236 12.747 1.00 0.00 N ATOM 0 H LYS A 69 52.946 -20.488 11.766 1.00 0.00 H new ATOM 0 HA LYS A 69 55.553 -20.902 10.913 1.00 0.00 H new ATOM 0 HB2 LYS A 69 54.358 -19.869 13.500 1.00 0.00 H new ATOM 0 HB3 LYS A 69 56.096 -19.990 13.312 1.00 0.00 H new ATOM 0 HG2 LYS A 69 55.985 -18.413 11.371 1.00 0.00 H new ATOM 0 HG3 LYS A 69 54.252 -18.277 11.590 1.00 0.00 H new ATOM 0 HD2 LYS A 69 55.047 -16.413 12.815 1.00 0.00 H new ATOM 0 HD3 LYS A 69 54.826 -17.610 14.076 1.00 0.00 H new ATOM 0 HE2 LYS A 69 56.971 -16.964 14.623 1.00 0.00 H new ATOM 0 HE3 LYS A 69 57.379 -18.212 13.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 58.645 -16.420 12.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 57.308 -16.304 11.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 57.425 -15.281 13.109 1.00 0.00 H new ATOM 1081 N HIS A 70 54.606 -22.904 13.383 1.00 0.00 N ATOM 1082 CA HIS A 70 54.860 -24.111 14.167 1.00 0.00 C ATOM 1083 C HIS A 70 54.489 -25.411 13.424 1.00 0.00 C ATOM 1084 O HIS A 70 55.172 -26.428 13.589 1.00 0.00 O ATOM 1085 CB HIS A 70 54.070 -23.992 15.483 1.00 0.00 C ATOM 1086 CG HIS A 70 54.373 -22.730 16.260 1.00 0.00 C ATOM 1087 ND1 HIS A 70 53.662 -21.546 16.229 1.00 0.00 N ATOM 1088 CD2 HIS A 70 55.433 -22.536 17.106 1.00 0.00 C ATOM 1089 CE1 HIS A 70 54.277 -20.666 17.038 1.00 0.00 C ATOM 1090 NE2 HIS A 70 55.366 -21.225 17.598 1.00 0.00 N ATOM 0 H HIS A 70 53.665 -22.537 13.527 1.00 0.00 H new ATOM 0 HA HIS A 70 55.931 -24.181 14.356 1.00 0.00 H new ATOM 0 HB2 HIS A 70 53.003 -24.024 15.261 1.00 0.00 H new ATOM 0 HB3 HIS A 70 54.292 -24.856 16.109 1.00 0.00 H new ATOM 0 HD1 HIS A 70 52.817 -21.370 15.686 1.00 0.00 H new ATOM 0 HD2 HIS A 70 56.189 -23.267 17.351 1.00 0.00 H new ATOM 0 HE1 HIS A 70 53.944 -19.654 17.214 1.00 0.00 H new ATOM 1098 N CYS A 71 53.417 -25.389 12.620 1.00 0.00 N ATOM 1099 CA CYS A 71 52.905 -26.560 11.898 1.00 0.00 C ATOM 1100 C CYS A 71 53.877 -27.096 10.830 1.00 0.00 C ATOM 1101 O CYS A 71 54.574 -26.339 10.146 1.00 0.00 O ATOM 1102 CB CYS A 71 51.545 -26.240 11.273 1.00 0.00 C ATOM 1103 SG CYS A 71 50.655 -27.793 10.930 1.00 0.00 S ATOM 0 H CYS A 71 52.873 -24.543 12.451 1.00 0.00 H new ATOM 0 HA CYS A 71 52.795 -27.356 12.635 1.00 0.00 H new ATOM 0 HB2 CYS A 71 50.961 -25.615 11.948 1.00 0.00 H new ATOM 0 HB3 CYS A 71 51.680 -25.674 10.351 1.00 0.00 H new ATOM 1108 N GLN A 72 53.912 -28.421 10.682 1.00 0.00 N ATOM 1109 CA GLN A 72 54.791 -29.149 9.757 1.00 0.00 C ATOM 1110 C GLN A 72 54.066 -30.275 8.985 1.00 0.00 C ATOM 1111 O GLN A 72 54.689 -30.967 8.177 1.00 0.00 O ATOM 1112 CB GLN A 72 55.981 -29.703 10.572 1.00 0.00 C ATOM 1113 CG GLN A 72 56.944 -28.615 11.090 1.00 0.00 C ATOM 1114 CD GLN A 72 57.679 -29.051 12.355 1.00 0.00 C ATOM 1115 OE1 GLN A 72 58.573 -29.890 12.337 1.00 0.00 O ATOM 1116 NE2 GLN A 72 57.331 -28.503 13.502 1.00 0.00 N ATOM 0 H GLN A 72 53.308 -29.042 11.221 1.00 0.00 H new ATOM 0 HA GLN A 72 55.138 -28.458 8.989 1.00 0.00 H new ATOM 0 HB2 GLN A 72 55.596 -30.268 11.421 1.00 0.00 H new ATOM 0 HB3 GLN A 72 56.540 -30.403 9.951 1.00 0.00 H new ATOM 0 HG2 GLN A 72 57.671 -28.376 10.314 1.00 0.00 H new ATOM 0 HG3 GLN A 72 56.383 -27.703 11.294 1.00 0.00 H new ATOM 0 HE21 GLN A 72 56.589 -27.804 13.529 1.00 0.00 H new ATOM 0 HE22 GLN A 72 57.804 -28.778 14.363 1.00 0.00 H new ATOM 1125 N GLU A 73 52.760 -30.473 9.201 1.00 0.00 N ATOM 1126 CA GLU A 73 51.960 -31.510 8.526 1.00 0.00 C ATOM 1127 C GLU A 73 51.465 -31.055 7.139 1.00 0.00 C ATOM 1128 O GLU A 73 51.201 -29.874 6.897 1.00 0.00 O ATOM 1129 CB GLU A 73 50.798 -31.909 9.453 1.00 0.00 C ATOM 1130 CG GLU A 73 49.941 -33.106 9.016 1.00 0.00 C ATOM 1131 CD GLU A 73 50.776 -34.361 8.707 1.00 0.00 C ATOM 1132 OE1 GLU A 73 51.033 -35.176 9.625 1.00 0.00 O ATOM 1133 OE2 GLU A 73 51.179 -34.521 7.530 1.00 0.00 O ATOM 0 H GLU A 73 52.219 -29.911 9.858 1.00 0.00 H new ATOM 0 HA GLU A 73 52.588 -32.381 8.337 1.00 0.00 H new ATOM 0 HB2 GLU A 73 51.210 -32.128 10.438 1.00 0.00 H new ATOM 0 HB3 GLU A 73 50.142 -31.046 9.566 1.00 0.00 H new ATOM 0 HG2 GLU A 73 49.223 -33.338 9.802 1.00 0.00 H new ATOM 0 HG3 GLU A 73 49.367 -32.831 8.131 1.00 0.00 H new ATOM 1140 N ASN A 74 51.307 -32.016 6.228 1.00 0.00 N ATOM 1141 CA ASN A 74 50.879 -31.815 4.832 1.00 0.00 C ATOM 1142 C ASN A 74 49.384 -32.118 4.589 1.00 0.00 C ATOM 1143 O ASN A 74 48.877 -31.955 3.477 1.00 0.00 O ATOM 1144 CB ASN A 74 51.778 -32.680 3.927 1.00 0.00 C ATOM 1145 CG ASN A 74 53.249 -32.305 4.026 1.00 0.00 C ATOM 1146 OD1 ASN A 74 53.651 -31.180 3.762 1.00 0.00 O ATOM 1147 ND2 ASN A 74 54.105 -33.229 4.406 1.00 0.00 N ATOM 0 H ASN A 74 51.479 -32.998 6.446 1.00 0.00 H new ATOM 0 HA ASN A 74 50.990 -30.758 4.592 1.00 0.00 H new ATOM 0 HB2 ASN A 74 51.656 -33.729 4.197 1.00 0.00 H new ATOM 0 HB3 ASN A 74 51.450 -32.577 2.892 1.00 0.00 H new ATOM 0 HD21 ASN A 74 55.098 -33.006 4.479 1.00 0.00 H new ATOM 0 HD22 ASN A 74 53.776 -34.169 4.628 1.00 0.00 H new ATOM 1154 N LYS A 75 48.689 -32.584 5.633 1.00 0.00 N ATOM 1155 CA LYS A 75 47.274 -33.000 5.664 1.00 0.00 C ATOM 1156 C LYS A 75 46.408 -32.152 6.619 1.00 0.00 C ATOM 1157 O LYS A 75 45.257 -32.505 6.884 1.00 0.00 O ATOM 1158 CB LYS A 75 47.233 -34.486 6.073 1.00 0.00 C ATOM 1159 CG LYS A 75 48.081 -35.404 5.173 1.00 0.00 C ATOM 1160 CD LYS A 75 48.256 -36.781 5.819 1.00 0.00 C ATOM 1161 CE LYS A 75 49.303 -37.565 5.022 1.00 0.00 C ATOM 1162 NZ LYS A 75 49.535 -38.916 5.596 1.00 0.00 N ATOM 0 H LYS A 75 49.129 -32.690 6.547 1.00 0.00 H new ATOM 0 HA LYS A 75 46.847 -32.848 4.673 1.00 0.00 H new ATOM 0 HB2 LYS A 75 47.581 -34.579 7.102 1.00 0.00 H new ATOM 0 HB3 LYS A 75 46.199 -34.830 6.054 1.00 0.00 H new ATOM 0 HG2 LYS A 75 47.602 -35.511 4.200 1.00 0.00 H new ATOM 0 HG3 LYS A 75 49.057 -34.951 5.000 1.00 0.00 H new ATOM 0 HD2 LYS A 75 48.572 -36.675 6.857 1.00 0.00 H new ATOM 0 HD3 LYS A 75 47.307 -37.318 5.828 1.00 0.00 H new ATOM 0 HE2 LYS A 75 48.975 -37.661 3.987 1.00 0.00 H new ATOM 0 HE3 LYS A 75 50.241 -37.010 5.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 50.250 -39.416 5.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 49.872 -38.824 6.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 48.646 -39.455 5.585 1.00 0.00 H new ATOM 1176 N CYS A 76 46.963 -31.056 7.148 1.00 0.00 N ATOM 1177 CA CYS A 76 46.318 -30.127 8.084 1.00 0.00 C ATOM 1178 C CYS A 76 44.958 -29.617 7.523 1.00 0.00 C ATOM 1179 O CYS A 76 44.887 -29.292 6.331 1.00 0.00 O ATOM 1180 CB CYS A 76 47.339 -29.004 8.361 1.00 0.00 C ATOM 1181 SG CYS A 76 47.096 -28.244 9.996 1.00 0.00 S ATOM 0 H CYS A 76 47.919 -30.779 6.925 1.00 0.00 H new ATOM 0 HA CYS A 76 46.056 -30.613 9.024 1.00 0.00 H new ATOM 0 HB2 CYS A 76 48.349 -29.409 8.297 1.00 0.00 H new ATOM 0 HB3 CYS A 76 47.253 -28.239 7.590 1.00 0.00 H new ATOM 1186 N PRO A 77 43.861 -29.568 8.311 1.00 0.00 N ATOM 1187 CA PRO A 77 42.534 -29.195 7.811 1.00 0.00 C ATOM 1188 C PRO A 77 42.363 -27.719 7.414 1.00 0.00 C ATOM 1189 O PRO A 77 41.513 -27.418 6.573 1.00 0.00 O ATOM 1190 CB PRO A 77 41.559 -29.584 8.927 1.00 0.00 C ATOM 1191 CG PRO A 77 42.407 -29.483 10.192 1.00 0.00 C ATOM 1192 CD PRO A 77 43.783 -29.943 9.715 1.00 0.00 C ATOM 0 HA PRO A 77 42.352 -29.718 6.872 1.00 0.00 H new ATOM 0 HB2 PRO A 77 40.702 -28.912 8.964 1.00 0.00 H new ATOM 0 HB3 PRO A 77 41.168 -30.592 8.785 1.00 0.00 H new ATOM 0 HG2 PRO A 77 42.433 -28.465 10.581 1.00 0.00 H new ATOM 0 HG3 PRO A 77 42.022 -30.119 10.989 1.00 0.00 H new ATOM 0 HD2 PRO A 77 44.576 -29.467 10.292 1.00 0.00 H new ATOM 0 HD3 PRO A 77 43.900 -31.019 9.839 1.00 0.00 H new ATOM 1200 N VAL A 78 43.141 -26.791 7.984 1.00 0.00 N ATOM 1201 CA VAL A 78 43.071 -25.356 7.659 1.00 0.00 C ATOM 1202 C VAL A 78 43.654 -25.132 6.251 1.00 0.00 C ATOM 1203 O VAL A 78 44.803 -25.516 6.017 1.00 0.00 O ATOM 1204 CB VAL A 78 43.822 -24.521 8.714 1.00 0.00 C ATOM 1205 CG1 VAL A 78 43.761 -23.022 8.400 1.00 0.00 C ATOM 1206 CG2 VAL A 78 43.214 -24.717 10.112 1.00 0.00 C ATOM 0 H VAL A 78 43.843 -27.014 8.690 1.00 0.00 H new ATOM 0 HA VAL A 78 42.031 -25.029 7.669 1.00 0.00 H new ATOM 0 HB VAL A 78 44.856 -24.867 8.692 1.00 0.00 H new ATOM 0 HG11 VAL A 78 44.302 -22.467 9.167 1.00 0.00 H new ATOM 0 HG12 VAL A 78 44.217 -22.835 7.428 1.00 0.00 H new ATOM 0 HG13 VAL A 78 42.721 -22.696 8.382 1.00 0.00 H new ATOM 0 HG21 VAL A 78 43.764 -24.116 10.836 1.00 0.00 H new ATOM 0 HG22 VAL A 78 42.169 -24.406 10.101 1.00 0.00 H new ATOM 0 HG23 VAL A 78 43.277 -25.769 10.392 1.00 0.00 H new ATOM 1216 N PRO A 79 42.916 -24.528 5.294 1.00 0.00 N ATOM 1217 CA PRO A 79 43.395 -24.380 3.914 1.00 0.00 C ATOM 1218 C PRO A 79 44.646 -23.499 3.773 1.00 0.00 C ATOM 1219 O PRO A 79 45.534 -23.810 2.978 1.00 0.00 O ATOM 1220 CB PRO A 79 42.203 -23.830 3.120 1.00 0.00 C ATOM 1221 CG PRO A 79 41.330 -23.150 4.175 1.00 0.00 C ATOM 1222 CD PRO A 79 41.563 -24.002 5.422 1.00 0.00 C ATOM 0 HA PRO A 79 43.730 -25.344 3.531 1.00 0.00 H new ATOM 0 HB2 PRO A 79 42.526 -23.124 2.355 1.00 0.00 H new ATOM 0 HB3 PRO A 79 41.663 -24.627 2.610 1.00 0.00 H new ATOM 0 HG2 PRO A 79 41.625 -22.113 4.335 1.00 0.00 H new ATOM 0 HG3 PRO A 79 40.280 -23.141 3.884 1.00 0.00 H new ATOM 0 HD2 PRO A 79 41.459 -23.406 6.328 1.00 0.00 H new ATOM 0 HD3 PRO A 79 40.834 -24.809 5.486 1.00 0.00 H new ATOM 1230 N PHE A 80 44.741 -22.410 4.542 1.00 0.00 N ATOM 1231 CA PHE A 80 45.887 -21.499 4.476 1.00 0.00 C ATOM 1232 C PHE A 80 47.121 -21.946 5.255 1.00 0.00 C ATOM 1233 O PHE A 80 48.213 -21.495 4.916 1.00 0.00 O ATOM 1234 CB PHE A 80 45.471 -20.089 4.899 1.00 0.00 C ATOM 1235 CG PHE A 80 44.953 -19.321 3.712 1.00 0.00 C ATOM 1236 CD1 PHE A 80 45.863 -18.690 2.842 1.00 0.00 C ATOM 1237 CD2 PHE A 80 43.580 -19.327 3.425 1.00 0.00 C ATOM 1238 CE1 PHE A 80 45.386 -18.032 1.695 1.00 0.00 C ATOM 1239 CE2 PHE A 80 43.104 -18.676 2.274 1.00 0.00 C ATOM 1240 CZ PHE A 80 44.006 -18.023 1.412 1.00 0.00 C ATOM 0 H PHE A 80 44.032 -22.137 5.222 1.00 0.00 H new ATOM 0 HA PHE A 80 46.195 -21.508 3.431 1.00 0.00 H new ATOM 0 HB2 PHE A 80 44.702 -20.145 5.669 1.00 0.00 H new ATOM 0 HB3 PHE A 80 46.322 -19.567 5.336 1.00 0.00 H new ATOM 0 HD1 PHE A 80 46.922 -18.711 3.055 1.00 0.00 H new ATOM 0 HD2 PHE A 80 42.891 -19.830 4.087 1.00 0.00 H new ATOM 0 HE1 PHE A 80 46.077 -17.534 1.031 1.00 0.00 H new ATOM 0 HE2 PHE A 80 42.047 -18.677 2.051 1.00 0.00 H new ATOM 0 HZ PHE A 80 43.639 -17.515 0.533 1.00 0.00 H new ATOM 1250 N CYS A 81 46.992 -22.838 6.239 1.00 0.00 N ATOM 1251 CA CYS A 81 48.129 -23.335 7.012 1.00 0.00 C ATOM 1252 C CYS A 81 49.194 -23.936 6.072 1.00 0.00 C ATOM 1253 O CYS A 81 50.379 -23.592 6.114 1.00 0.00 O ATOM 1254 CB CYS A 81 47.564 -24.341 8.021 1.00 0.00 C ATOM 1255 SG CYS A 81 48.866 -25.248 8.883 1.00 0.00 S ATOM 0 H CYS A 81 46.096 -23.235 6.521 1.00 0.00 H new ATOM 0 HA CYS A 81 48.642 -22.540 7.552 1.00 0.00 H new ATOM 0 HB2 CYS A 81 46.947 -23.815 8.749 1.00 0.00 H new ATOM 0 HB3 CYS A 81 46.914 -25.046 7.503 1.00 0.00 H new ATOM 1260 N LEU A 82 48.717 -24.770 5.146 1.00 0.00 N ATOM 1261 CA LEU A 82 49.475 -25.413 4.076 1.00 0.00 C ATOM 1262 C LEU A 82 50.146 -24.358 3.179 1.00 0.00 C ATOM 1263 O LEU A 82 51.369 -24.338 3.047 1.00 0.00 O ATOM 1264 CB LEU A 82 48.493 -26.287 3.276 1.00 0.00 C ATOM 1265 CG LEU A 82 47.762 -27.354 4.125 1.00 0.00 C ATOM 1266 CD1 LEU A 82 46.326 -27.481 3.626 1.00 0.00 C ATOM 1267 CD2 LEU A 82 48.477 -28.702 4.072 1.00 0.00 C ATOM 0 H LEU A 82 47.731 -25.029 5.124 1.00 0.00 H new ATOM 0 HA LEU A 82 50.274 -26.031 4.486 1.00 0.00 H new ATOM 0 HB2 LEU A 82 47.751 -25.643 2.804 1.00 0.00 H new ATOM 0 HB3 LEU A 82 49.037 -26.786 2.475 1.00 0.00 H new ATOM 0 HG LEU A 82 47.763 -27.037 5.168 1.00 0.00 H new ATOM 0 HD11 LEU A 82 45.800 -28.231 4.217 1.00 0.00 H new ATOM 0 HD12 LEU A 82 45.820 -26.521 3.725 1.00 0.00 H new ATOM 0 HD13 LEU A 82 46.330 -27.782 2.579 1.00 0.00 H new ATOM 0 HD21 LEU A 82 47.934 -29.426 4.680 1.00 0.00 H new ATOM 0 HD22 LEU A 82 48.517 -29.052 3.041 1.00 0.00 H new ATOM 0 HD23 LEU A 82 49.491 -28.592 4.457 1.00 0.00 H new ATOM 1279 N ASN A 83 49.352 -23.449 2.600 1.00 0.00 N ATOM 1280 CA ASN A 83 49.824 -22.371 1.722 1.00 0.00 C ATOM 1281 C ASN A 83 50.925 -21.516 2.375 1.00 0.00 C ATOM 1282 O ASN A 83 51.918 -21.170 1.732 1.00 0.00 O ATOM 1283 CB ASN A 83 48.635 -21.495 1.305 1.00 0.00 C ATOM 1284 CG ASN A 83 47.655 -22.186 0.370 1.00 0.00 C ATOM 1285 OD1 ASN A 83 47.749 -23.359 0.030 1.00 0.00 O ATOM 1286 ND2 ASN A 83 46.661 -21.459 -0.076 1.00 0.00 N ATOM 0 H ASN A 83 48.341 -23.442 2.732 1.00 0.00 H new ATOM 0 HA ASN A 83 50.271 -22.831 0.841 1.00 0.00 H new ATOM 0 HB2 ASN A 83 48.102 -21.174 2.200 1.00 0.00 H new ATOM 0 HB3 ASN A 83 49.013 -20.596 0.819 1.00 0.00 H new ATOM 0 HD21 ASN A 83 45.970 -21.870 -0.703 1.00 0.00 H new ATOM 0 HD22 ASN A 83 46.578 -20.482 0.204 1.00 0.00 H new ATOM 1293 N ILE A 84 50.755 -21.183 3.659 1.00 0.00 N ATOM 1294 CA ILE A 84 51.702 -20.382 4.431 1.00 0.00 C ATOM 1295 C ILE A 84 52.961 -21.187 4.754 1.00 0.00 C ATOM 1296 O ILE A 84 54.047 -20.733 4.396 1.00 0.00 O ATOM 1297 CB ILE A 84 51.001 -19.807 5.682 1.00 0.00 C ATOM 1298 CG1 ILE A 84 49.882 -18.825 5.266 1.00 0.00 C ATOM 1299 CG2 ILE A 84 51.963 -19.080 6.641 1.00 0.00 C ATOM 1300 CD1 ILE A 84 48.860 -18.586 6.374 1.00 0.00 C ATOM 0 H ILE A 84 49.938 -21.470 4.198 1.00 0.00 H new ATOM 0 HA ILE A 84 52.038 -19.533 3.836 1.00 0.00 H new ATOM 0 HB ILE A 84 50.588 -20.664 6.214 1.00 0.00 H new ATOM 0 HG12 ILE A 84 50.329 -17.873 4.979 1.00 0.00 H new ATOM 0 HG13 ILE A 84 49.371 -19.215 4.386 1.00 0.00 H new ATOM 0 HG21 ILE A 84 51.405 -18.701 7.498 1.00 0.00 H new ATOM 0 HG22 ILE A 84 52.728 -19.776 6.985 1.00 0.00 H new ATOM 0 HG23 ILE A 84 52.437 -18.248 6.120 1.00 0.00 H new ATOM 0 HD11 ILE A 84 48.099 -17.888 6.023 1.00 0.00 H new ATOM 0 HD12 ILE A 84 48.389 -19.531 6.644 1.00 0.00 H new ATOM 0 HD13 ILE A 84 49.361 -18.168 7.247 1.00 0.00 H new ATOM 1312 N LYS A 85 52.874 -22.377 5.373 1.00 0.00 N ATOM 1313 CA LYS A 85 54.077 -23.172 5.694 1.00 0.00 C ATOM 1314 C LYS A 85 54.908 -23.486 4.447 1.00 0.00 C ATOM 1315 O LYS A 85 56.130 -23.392 4.502 1.00 0.00 O ATOM 1316 CB LYS A 85 53.755 -24.401 6.569 1.00 0.00 C ATOM 1317 CG LYS A 85 53.319 -25.664 5.804 1.00 0.00 C ATOM 1318 CD LYS A 85 52.774 -26.768 6.723 1.00 0.00 C ATOM 1319 CE LYS A 85 51.417 -26.329 7.272 1.00 0.00 C ATOM 1320 NZ LYS A 85 50.724 -27.362 8.057 1.00 0.00 N ATOM 0 H LYS A 85 51.995 -22.808 5.659 1.00 0.00 H new ATOM 0 HA LYS A 85 54.721 -22.551 6.317 1.00 0.00 H new ATOM 0 HB2 LYS A 85 54.636 -24.643 7.163 1.00 0.00 H new ATOM 0 HB3 LYS A 85 52.964 -24.130 7.268 1.00 0.00 H new ATOM 0 HG2 LYS A 85 52.553 -25.395 5.076 1.00 0.00 H new ATOM 0 HG3 LYS A 85 54.169 -26.053 5.243 1.00 0.00 H new ATOM 0 HD2 LYS A 85 52.673 -27.702 6.171 1.00 0.00 H new ATOM 0 HD3 LYS A 85 53.469 -26.955 7.541 1.00 0.00 H new ATOM 0 HE2 LYS A 85 51.558 -25.447 7.897 1.00 0.00 H new ATOM 0 HE3 LYS A 85 50.779 -26.032 6.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 49.749 -27.056 8.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 50.707 -28.253 7.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 51.225 -27.509 8.956 1.00 0.00 H new ATOM 1334 N HIS A 86 54.275 -23.761 3.304 1.00 0.00 N ATOM 1335 CA HIS A 86 54.981 -23.992 2.037 1.00 0.00 C ATOM 1336 C HIS A 86 55.889 -22.819 1.630 1.00 0.00 C ATOM 1337 O HIS A 86 56.958 -23.059 1.067 1.00 0.00 O ATOM 1338 CB HIS A 86 53.967 -24.261 0.916 1.00 0.00 C ATOM 1339 CG HIS A 86 53.199 -25.565 0.986 1.00 0.00 C ATOM 1340 ND1 HIS A 86 52.226 -25.961 0.095 1.00 0.00 N ATOM 1341 CD2 HIS A 86 53.304 -26.562 1.923 1.00 0.00 C ATOM 1342 CE1 HIS A 86 51.755 -27.158 0.484 1.00 0.00 C ATOM 1343 NE2 HIS A 86 52.386 -27.570 1.597 1.00 0.00 N ATOM 0 H HIS A 86 53.260 -23.830 3.228 1.00 0.00 H new ATOM 0 HA HIS A 86 55.623 -24.860 2.191 1.00 0.00 H new ATOM 0 HB2 HIS A 86 53.247 -23.443 0.906 1.00 0.00 H new ATOM 0 HB3 HIS A 86 54.497 -24.230 -0.036 1.00 0.00 H new ATOM 0 HD2 HIS A 86 53.978 -26.569 2.767 1.00 0.00 H new ATOM 0 HE1 HIS A 86 50.979 -27.711 -0.025 1.00 0.00 H new ATOM 0 HE2 HIS A 86 52.228 -28.442 2.103 1.00 0.00 H new ATOM 1351 N LYS A 87 55.504 -21.572 1.941 1.00 0.00 N ATOM 1352 CA LYS A 87 56.312 -20.366 1.691 1.00 0.00 C ATOM 1353 C LYS A 87 57.300 -20.103 2.835 1.00 0.00 C ATOM 1354 O LYS A 87 58.470 -19.825 2.578 1.00 0.00 O ATOM 1355 CB LYS A 87 55.396 -19.142 1.508 1.00 0.00 C ATOM 1356 CG LYS A 87 54.664 -19.136 0.154 1.00 0.00 C ATOM 1357 CD LYS A 87 53.719 -17.930 -0.024 1.00 0.00 C ATOM 1358 CE LYS A 87 54.394 -16.558 0.144 1.00 0.00 C ATOM 1359 NZ LYS A 87 55.222 -16.173 -1.027 1.00 0.00 N ATOM 0 H LYS A 87 54.607 -21.369 2.381 1.00 0.00 H new ATOM 0 HA LYS A 87 56.884 -20.535 0.779 1.00 0.00 H new ATOM 0 HB2 LYS A 87 54.661 -19.122 2.312 1.00 0.00 H new ATOM 0 HB3 LYS A 87 55.991 -18.233 1.597 1.00 0.00 H new ATOM 0 HG2 LYS A 87 55.401 -19.133 -0.649 1.00 0.00 H new ATOM 0 HG3 LYS A 87 54.089 -20.057 0.056 1.00 0.00 H new ATOM 0 HD2 LYS A 87 53.270 -17.980 -1.016 1.00 0.00 H new ATOM 0 HD3 LYS A 87 52.907 -18.012 0.698 1.00 0.00 H new ATOM 0 HE2 LYS A 87 53.628 -15.800 0.306 1.00 0.00 H new ATOM 0 HE3 LYS A 87 55.020 -16.574 1.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 56.112 -15.747 -0.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 55.432 -17.018 -1.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 54.703 -15.484 -1.608 1.00 0.00 H new ATOM 1373 N LEU A 88 56.853 -20.207 4.091 1.00 0.00 N ATOM 1374 CA LEU A 88 57.694 -19.943 5.273 1.00 0.00 C ATOM 1375 C LEU A 88 58.897 -20.899 5.399 1.00 0.00 C ATOM 1376 O LEU A 88 59.997 -20.457 5.728 1.00 0.00 O ATOM 1377 CB LEU A 88 56.836 -19.950 6.556 1.00 0.00 C ATOM 1378 CG LEU A 88 56.249 -18.577 6.948 1.00 0.00 C ATOM 1379 CD1 LEU A 88 55.343 -17.960 5.875 1.00 0.00 C ATOM 1380 CD2 LEU A 88 55.468 -18.728 8.259 1.00 0.00 C ATOM 0 H LEU A 88 55.897 -20.477 4.322 1.00 0.00 H new ATOM 0 HA LEU A 88 58.122 -18.950 5.135 1.00 0.00 H new ATOM 0 HB2 LEU A 88 56.016 -20.656 6.424 1.00 0.00 H new ATOM 0 HB3 LEU A 88 57.445 -20.319 7.382 1.00 0.00 H new ATOM 0 HG LEU A 88 57.090 -17.893 7.063 1.00 0.00 H new ATOM 0 HD11 LEU A 88 54.969 -16.997 6.224 1.00 0.00 H new ATOM 0 HD12 LEU A 88 55.912 -17.817 4.956 1.00 0.00 H new ATOM 0 HD13 LEU A 88 54.503 -18.627 5.681 1.00 0.00 H new ATOM 0 HD21 LEU A 88 55.049 -17.764 8.546 1.00 0.00 H new ATOM 0 HD22 LEU A 88 54.661 -19.448 8.121 1.00 0.00 H new ATOM 0 HD23 LEU A 88 56.138 -19.080 9.043 1.00 0.00 H new ATOM 1392 N ARG A 89 58.719 -22.197 5.115 1.00 0.00 N ATOM 1393 CA ARG A 89 59.778 -23.231 5.184 1.00 0.00 C ATOM 1394 C ARG A 89 60.946 -23.006 4.218 1.00 0.00 C ATOM 1395 O ARG A 89 62.032 -23.545 4.435 1.00 0.00 O ATOM 1396 CB ARG A 89 59.147 -24.623 4.979 1.00 0.00 C ATOM 1397 CG ARG A 89 58.185 -24.989 6.120 1.00 0.00 C ATOM 1398 CD ARG A 89 58.881 -25.353 7.436 1.00 0.00 C ATOM 1399 NE ARG A 89 57.896 -25.424 8.537 1.00 0.00 N ATOM 1400 CZ ARG A 89 57.846 -24.666 9.619 1.00 0.00 C ATOM 1401 NH1 ARG A 89 58.757 -23.787 9.923 1.00 0.00 N ATOM 1402 NH2 ARG A 89 56.850 -24.762 10.442 1.00 0.00 N ATOM 0 H ARG A 89 57.816 -22.572 4.824 1.00 0.00 H new ATOM 0 HA ARG A 89 60.222 -23.160 6.177 1.00 0.00 H new ATOM 0 HB2 ARG A 89 58.610 -24.642 4.031 1.00 0.00 H new ATOM 0 HB3 ARG A 89 59.935 -25.373 4.914 1.00 0.00 H new ATOM 0 HG2 ARG A 89 57.513 -24.149 6.297 1.00 0.00 H new ATOM 0 HG3 ARG A 89 57.567 -25.830 5.804 1.00 0.00 H new ATOM 0 HD2 ARG A 89 59.390 -26.311 7.333 1.00 0.00 H new ATOM 0 HD3 ARG A 89 59.644 -24.610 7.669 1.00 0.00 H new ATOM 0 HE ARG A 89 57.173 -26.139 8.452 1.00 0.00 H new ATOM 0 HH11 ARG A 89 59.563 -23.655 9.312 1.00 0.00 H new ATOM 0 HH12 ARG A 89 58.665 -23.230 10.772 1.00 0.00 H new ATOM 0 HH21 ARG A 89 56.098 -25.426 10.257 1.00 0.00 H new ATOM 0 HH22 ARG A 89 56.818 -24.174 11.275 1.00 0.00 H new ATOM 1416 N GLN A 90 60.743 -22.193 3.180 1.00 0.00 N ATOM 1417 CA GLN A 90 61.793 -21.825 2.212 1.00 0.00 C ATOM 1418 C GLN A 90 62.810 -20.814 2.781 1.00 0.00 C ATOM 1419 O GLN A 90 63.934 -20.721 2.282 1.00 0.00 O ATOM 1420 CB GLN A 90 61.188 -21.220 0.929 1.00 0.00 C ATOM 1421 CG GLN A 90 60.035 -22.014 0.298 1.00 0.00 C ATOM 1422 CD GLN A 90 60.346 -23.487 0.031 1.00 0.00 C ATOM 1423 OE1 GLN A 90 61.445 -23.878 -0.347 1.00 0.00 O ATOM 1424 NE2 GLN A 90 59.382 -24.363 0.216 1.00 0.00 N ATOM 0 H GLN A 90 59.839 -21.764 2.981 1.00 0.00 H new ATOM 0 HA GLN A 90 62.312 -22.756 1.987 1.00 0.00 H new ATOM 0 HB2 GLN A 90 60.831 -20.215 1.156 1.00 0.00 H new ATOM 0 HB3 GLN A 90 61.981 -21.117 0.189 1.00 0.00 H new ATOM 0 HG2 GLN A 90 59.167 -21.953 0.955 1.00 0.00 H new ATOM 0 HG3 GLN A 90 59.757 -21.539 -0.643 1.00 0.00 H new ATOM 0 HE21 GLN A 90 58.463 -24.051 0.530 1.00 0.00 H new ATOM 0 HE22 GLN A 90 59.554 -25.354 0.045 1.00 0.00 H new ATOM 1433 N GLN A 91 62.426 -20.043 3.807 1.00 0.00 N ATOM 1434 CA GLN A 91 63.267 -19.016 4.434 1.00 0.00 C ATOM 1435 C GLN A 91 64.379 -19.619 5.316 1.00 0.00 C ATOM 1436 O GLN A 91 64.273 -20.750 5.799 1.00 0.00 O ATOM 1437 CB GLN A 91 62.382 -18.051 5.247 1.00 0.00 C ATOM 1438 CG GLN A 91 61.313 -17.359 4.383 1.00 0.00 C ATOM 1439 CD GLN A 91 60.498 -16.352 5.189 1.00 0.00 C ATOM 1440 OE1 GLN A 91 59.556 -16.691 5.892 1.00 0.00 O ATOM 1441 NE2 GLN A 91 60.831 -15.078 5.135 1.00 0.00 N ATOM 0 H GLN A 91 61.502 -20.118 4.233 1.00 0.00 H new ATOM 0 HA GLN A 91 63.771 -18.467 3.639 1.00 0.00 H new ATOM 0 HB2 GLN A 91 61.894 -18.602 6.051 1.00 0.00 H new ATOM 0 HB3 GLN A 91 63.011 -17.294 5.715 1.00 0.00 H new ATOM 0 HG2 GLN A 91 61.794 -16.851 3.547 1.00 0.00 H new ATOM 0 HG3 GLN A 91 60.646 -18.110 3.959 1.00 0.00 H new ATOM 0 HE21 GLN A 91 61.614 -14.780 4.553 1.00 0.00 H new ATOM 0 HE22 GLN A 91 60.306 -14.390 5.675 1.00 0.00 H new ATOM 1450 N GLN A 92 65.447 -18.846 5.546 1.00 0.00 N ATOM 1451 CA GLN A 92 66.621 -19.224 6.352 1.00 0.00 C ATOM 1452 C GLN A 92 67.126 -18.044 7.200 1.00 0.00 C ATOM 1453 O GLN A 92 67.160 -16.893 6.743 1.00 0.00 O ATOM 1454 CB GLN A 92 67.755 -19.738 5.441 1.00 0.00 C ATOM 1455 CG GLN A 92 67.402 -21.032 4.685 1.00 0.00 C ATOM 1456 CD GLN A 92 68.584 -21.608 3.899 1.00 0.00 C ATOM 1457 OE1 GLN A 92 69.443 -20.904 3.380 1.00 0.00 O ATOM 1458 NE2 GLN A 92 68.682 -22.916 3.777 1.00 0.00 N ATOM 0 H GLN A 92 65.523 -17.904 5.163 1.00 0.00 H new ATOM 0 HA GLN A 92 66.313 -20.021 7.029 1.00 0.00 H new ATOM 0 HB2 GLN A 92 68.008 -18.963 4.718 1.00 0.00 H new ATOM 0 HB3 GLN A 92 68.645 -19.912 6.046 1.00 0.00 H new ATOM 0 HG2 GLN A 92 67.049 -21.778 5.397 1.00 0.00 H new ATOM 0 HG3 GLN A 92 66.579 -20.832 3.999 1.00 0.00 H new ATOM 0 HE21 GLN A 92 67.979 -23.522 4.200 1.00 0.00 H new ATOM 0 HE22 GLN A 92 69.461 -23.323 3.259 1.00 0.00 H new TER 1467 GLN A 92 ATOM 1468 N GLY B 706 48.645 12.692 7.991 1.00 0.00 N ATOM 1469 CA GLY B 706 47.515 11.849 8.396 1.00 0.00 C ATOM 1470 C GLY B 706 47.000 10.891 7.309 1.00 0.00 C ATOM 1471 O GLY B 706 46.051 10.139 7.551 1.00 0.00 O ATOM 0 HA2 GLY B 706 47.811 11.263 9.266 1.00 0.00 H new ATOM 0 HA3 GLY B 706 46.694 12.493 8.711 1.00 0.00 H new ATOM 1475 N SER B 707 47.611 10.907 6.120 1.00 0.00 N ATOM 1476 CA SER B 707 47.271 10.061 4.963 1.00 0.00 C ATOM 1477 C SER B 707 48.483 9.836 4.042 1.00 0.00 C ATOM 1478 O SER B 707 49.516 10.501 4.170 1.00 0.00 O ATOM 1479 CB SER B 707 46.118 10.708 4.177 1.00 0.00 C ATOM 1480 OG SER B 707 45.613 9.818 3.191 1.00 0.00 O ATOM 0 H SER B 707 48.390 11.536 5.926 1.00 0.00 H new ATOM 0 HA SER B 707 46.962 9.085 5.336 1.00 0.00 H new ATOM 0 HB2 SER B 707 45.318 10.989 4.862 1.00 0.00 H new ATOM 0 HB3 SER B 707 46.467 11.624 3.701 1.00 0.00 H new ATOM 0 HG SER B 707 44.880 10.250 2.705 1.00 0.00 H new ATOM 1486 N HIS B 708 48.342 8.908 3.092 1.00 0.00 N ATOM 1487 CA HIS B 708 49.350 8.521 2.095 1.00 0.00 C ATOM 1488 C HIS B 708 48.776 8.474 0.659 1.00 0.00 C ATOM 1489 O HIS B 708 49.417 7.951 -0.257 1.00 0.00 O ATOM 1490 CB HIS B 708 49.966 7.170 2.510 1.00 0.00 C ATOM 1491 CG HIS B 708 50.558 7.163 3.900 1.00 0.00 C ATOM 1492 ND1 HIS B 708 50.061 6.493 4.997 1.00 0.00 N ATOM 1493 CD2 HIS B 708 51.684 7.826 4.312 1.00 0.00 C ATOM 1494 CE1 HIS B 708 50.865 6.744 6.044 1.00 0.00 C ATOM 1495 NE2 HIS B 708 51.874 7.555 5.675 1.00 0.00 N ATOM 0 H HIS B 708 47.477 8.377 2.990 1.00 0.00 H new ATOM 0 HA HIS B 708 50.129 9.283 2.072 1.00 0.00 H new ATOM 0 HB2 HIS B 708 49.198 6.399 2.450 1.00 0.00 H new ATOM 0 HB3 HIS B 708 50.743 6.902 1.794 1.00 0.00 H new ATOM 0 HD2 HIS B 708 52.315 8.449 3.695 1.00 0.00 H new ATOM 0 HE1 HIS B 708 50.722 6.351 7.040 1.00 0.00 H new ATOM 0 HE2 HIS B 708 52.627 7.903 6.269 1.00 0.00 H new ATOM 1503 N MET B 709 47.569 9.017 0.450 1.00 0.00 N ATOM 1504 CA MET B 709 46.854 9.064 -0.836 1.00 0.00 C ATOM 1505 C MET B 709 46.002 10.344 -0.982 1.00 0.00 C ATOM 1506 O MET B 709 45.942 11.173 -0.068 1.00 0.00 O ATOM 1507 CB MET B 709 46.036 7.766 -1.017 1.00 0.00 C ATOM 1508 CG MET B 709 44.985 7.479 0.067 1.00 0.00 C ATOM 1509 SD MET B 709 43.503 8.525 0.036 1.00 0.00 S ATOM 1510 CE MET B 709 42.591 7.801 1.425 1.00 0.00 C ATOM 0 H MET B 709 47.040 9.455 1.204 1.00 0.00 H new ATOM 0 HA MET B 709 47.582 9.117 -1.645 1.00 0.00 H new ATOM 0 HB2 MET B 709 45.532 7.809 -1.982 1.00 0.00 H new ATOM 0 HB3 MET B 709 46.729 6.925 -1.056 1.00 0.00 H new ATOM 0 HG2 MET B 709 44.673 6.439 -0.024 1.00 0.00 H new ATOM 0 HG3 MET B 709 45.460 7.585 1.042 1.00 0.00 H new ATOM 0 HE1 MET B 709 41.644 8.326 1.552 1.00 0.00 H new ATOM 0 HE2 MET B 709 42.397 6.748 1.223 1.00 0.00 H new ATOM 0 HE3 MET B 709 43.182 7.893 2.336 1.00 0.00 H new ATOM 1520 N SER B 710 45.361 10.519 -2.145 1.00 0.00 N ATOM 1521 CA SER B 710 44.544 11.697 -2.503 1.00 0.00 C ATOM 1522 C SER B 710 43.131 11.372 -3.023 1.00 0.00 C ATOM 1523 O SER B 710 42.395 12.268 -3.442 1.00 0.00 O ATOM 1524 CB SER B 710 45.313 12.534 -3.534 1.00 0.00 C ATOM 1525 OG SER B 710 45.603 11.768 -4.698 1.00 0.00 O ATOM 0 H SER B 710 45.395 9.824 -2.891 1.00 0.00 H new ATOM 0 HA SER B 710 44.380 12.254 -1.580 1.00 0.00 H new ATOM 0 HB2 SER B 710 44.725 13.410 -3.808 1.00 0.00 H new ATOM 0 HB3 SER B 710 46.241 12.898 -3.093 1.00 0.00 H new ATOM 0 HG SER B 710 46.092 12.323 -5.341 1.00 0.00 H new ATOM 1531 N GLU B 711 42.727 10.099 -2.987 1.00 0.00 N ATOM 1532 CA GLU B 711 41.406 9.615 -3.408 1.00 0.00 C ATOM 1533 C GLU B 711 40.270 10.249 -2.575 1.00 0.00 C ATOM 1534 O GLU B 711 40.273 10.184 -1.343 1.00 0.00 O ATOM 1535 CB GLU B 711 41.406 8.080 -3.309 1.00 0.00 C ATOM 1536 CG GLU B 711 40.089 7.470 -3.792 1.00 0.00 C ATOM 1537 CD GLU B 711 40.172 5.932 -3.830 1.00 0.00 C ATOM 1538 OE1 GLU B 711 39.959 5.281 -2.778 1.00 0.00 O ATOM 1539 OE2 GLU B 711 40.462 5.363 -4.912 1.00 0.00 O ATOM 0 H GLU B 711 43.332 9.349 -2.652 1.00 0.00 H new ATOM 0 HA GLU B 711 41.216 9.914 -4.439 1.00 0.00 H new ATOM 0 HB2 GLU B 711 42.229 7.679 -3.901 1.00 0.00 H new ATOM 0 HB3 GLU B 711 41.584 7.784 -2.275 1.00 0.00 H new ATOM 0 HG2 GLU B 711 39.278 7.777 -3.132 1.00 0.00 H new ATOM 0 HG3 GLU B 711 39.852 7.849 -4.786 1.00 0.00 H new ATOM 1546 N VAL B 712 39.293 10.877 -3.244 1.00 0.00 N ATOM 1547 CA VAL B 712 38.160 11.572 -2.591 1.00 0.00 C ATOM 1548 C VAL B 712 37.175 10.660 -1.852 1.00 0.00 C ATOM 1549 O VAL B 712 36.599 11.066 -0.841 1.00 0.00 O ATOM 1550 CB VAL B 712 37.403 12.492 -3.573 1.00 0.00 C ATOM 1551 CG1 VAL B 712 38.282 13.679 -3.987 1.00 0.00 C ATOM 1552 CG2 VAL B 712 36.923 11.776 -4.844 1.00 0.00 C ATOM 0 H VAL B 712 39.261 10.921 -4.263 1.00 0.00 H new ATOM 0 HA VAL B 712 38.637 12.179 -1.821 1.00 0.00 H new ATOM 0 HB VAL B 712 36.520 12.831 -3.031 1.00 0.00 H new ATOM 0 HG11 VAL B 712 37.731 14.316 -4.679 1.00 0.00 H new ATOM 0 HG12 VAL B 712 38.555 14.255 -3.103 1.00 0.00 H new ATOM 0 HG13 VAL B 712 39.185 13.311 -4.473 1.00 0.00 H new ATOM 0 HG21 VAL B 712 36.400 12.485 -5.486 1.00 0.00 H new ATOM 0 HG22 VAL B 712 37.781 11.368 -5.378 1.00 0.00 H new ATOM 0 HG23 VAL B 712 36.247 10.966 -4.572 1.00 0.00 H new ATOM 1562 N HIS B 713 37.009 9.431 -2.335 1.00 0.00 N ATOM 1563 CA HIS B 713 36.166 8.361 -1.788 1.00 0.00 C ATOM 1564 C HIS B 713 36.369 7.044 -2.574 1.00 0.00 C ATOM 1565 O HIS B 713 36.759 7.097 -3.748 1.00 0.00 O ATOM 1566 CB HIS B 713 34.670 8.751 -1.821 1.00 0.00 C ATOM 1567 CG HIS B 713 34.108 9.062 -3.190 1.00 0.00 C ATOM 1568 ND1 HIS B 713 33.852 8.162 -4.202 1.00 0.00 N ATOM 1569 CD2 HIS B 713 33.706 10.293 -3.639 1.00 0.00 C ATOM 1570 CE1 HIS B 713 33.329 8.832 -5.241 1.00 0.00 C ATOM 1571 NE2 HIS B 713 33.216 10.141 -4.945 1.00 0.00 N ATOM 0 H HIS B 713 37.494 9.131 -3.181 1.00 0.00 H new ATOM 0 HA HIS B 713 36.467 8.212 -0.751 1.00 0.00 H new ATOM 0 HB2 HIS B 713 34.091 7.937 -1.386 1.00 0.00 H new ATOM 0 HB3 HIS B 713 34.525 9.622 -1.182 1.00 0.00 H new ATOM 0 HD1 HIS B 713 34.030 7.158 -4.167 1.00 0.00 H new ATOM 0 HD2 HIS B 713 33.757 11.218 -3.084 1.00 0.00 H new ATOM 0 HE1 HIS B 713 33.040 8.385 -6.181 1.00 0.00 H new ATOM 1579 N PRO B 714 36.088 5.866 -1.979 1.00 0.00 N ATOM 1580 CA PRO B 714 36.171 4.568 -2.656 1.00 0.00 C ATOM 1581 C PRO B 714 35.198 4.392 -3.836 1.00 0.00 C ATOM 1582 O PRO B 714 34.439 5.294 -4.206 1.00 0.00 O ATOM 1583 CB PRO B 714 35.874 3.512 -1.583 1.00 0.00 C ATOM 1584 CG PRO B 714 36.144 4.247 -0.274 1.00 0.00 C ATOM 1585 CD PRO B 714 35.676 5.659 -0.598 1.00 0.00 C ATOM 0 HA PRO B 714 37.162 4.475 -3.099 1.00 0.00 H new ATOM 0 HB2 PRO B 714 34.844 3.160 -1.641 1.00 0.00 H new ATOM 0 HB3 PRO B 714 36.516 2.638 -1.692 1.00 0.00 H new ATOM 0 HG2 PRO B 714 35.589 3.815 0.558 1.00 0.00 H new ATOM 0 HG3 PRO B 714 37.199 4.220 -0.002 1.00 0.00 H new ATOM 0 HD2 PRO B 714 34.596 5.756 -0.486 1.00 0.00 H new ATOM 0 HD3 PRO B 714 36.132 6.392 0.067 1.00 0.00 H new ATOM 1593 N SER B 715 35.202 3.178 -4.393 1.00 0.00 N ATOM 1594 CA SER B 715 34.365 2.756 -5.534 1.00 0.00 C ATOM 1595 C SER B 715 33.563 1.461 -5.306 1.00 0.00 C ATOM 1596 O SER B 715 32.689 1.132 -6.114 1.00 0.00 O ATOM 1597 CB SER B 715 35.244 2.615 -6.783 1.00 0.00 C ATOM 1598 OG SER B 715 36.250 1.631 -6.575 1.00 0.00 O ATOM 0 H SER B 715 35.808 2.431 -4.054 1.00 0.00 H new ATOM 0 HA SER B 715 33.617 3.538 -5.663 1.00 0.00 H new ATOM 0 HB2 SER B 715 34.628 2.339 -7.639 1.00 0.00 H new ATOM 0 HB3 SER B 715 35.707 3.573 -7.019 1.00 0.00 H new ATOM 0 HG SER B 715 36.801 1.551 -7.381 1.00 0.00 H new ATOM 1604 N ARG B 716 33.821 0.732 -4.207 1.00 0.00 N ATOM 1605 CA ARG B 716 33.146 -0.522 -3.821 1.00 0.00 C ATOM 1606 C ARG B 716 33.216 -0.734 -2.303 1.00 0.00 C ATOM 1607 O ARG B 716 34.243 -0.450 -1.683 1.00 0.00 O ATOM 1608 CB ARG B 716 33.830 -1.687 -4.575 1.00 0.00 C ATOM 1609 CG ARG B 716 33.254 -3.093 -4.325 1.00 0.00 C ATOM 1610 CD ARG B 716 31.795 -3.248 -4.777 1.00 0.00 C ATOM 1611 NE ARG B 716 31.333 -4.641 -4.612 1.00 0.00 N ATOM 1612 CZ ARG B 716 30.100 -5.092 -4.764 1.00 0.00 C ATOM 1613 NH1 ARG B 716 29.105 -4.308 -5.071 1.00 0.00 N ATOM 1614 NH2 ARG B 716 29.841 -6.358 -4.612 1.00 0.00 N ATOM 0 H ARG B 716 34.535 1.011 -3.534 1.00 0.00 H new ATOM 0 HA ARG B 716 32.091 -0.476 -4.089 1.00 0.00 H new ATOM 0 HB2 ARG B 716 33.777 -1.481 -5.644 1.00 0.00 H new ATOM 0 HB3 ARG B 716 34.886 -1.697 -4.304 1.00 0.00 H new ATOM 0 HG2 ARG B 716 33.868 -3.826 -4.848 1.00 0.00 H new ATOM 0 HG3 ARG B 716 33.322 -3.321 -3.261 1.00 0.00 H new ATOM 0 HD2 ARG B 716 31.158 -2.579 -4.198 1.00 0.00 H new ATOM 0 HD3 ARG B 716 31.701 -2.952 -5.822 1.00 0.00 H new ATOM 0 HE ARG B 716 32.041 -5.328 -4.353 1.00 0.00 H new ATOM 0 HH11 ARG B 716 29.264 -3.309 -5.202 1.00 0.00 H new ATOM 0 HH12 ARG B 716 28.167 -4.693 -5.180 1.00 0.00 H new ATOM 0 HH21 ARG B 716 30.591 -7.007 -4.374 1.00 0.00 H new ATOM 0 HH22 ARG B 716 28.888 -6.701 -4.730 1.00 0.00 H new ATOM 1628 N LEU B 717 32.134 -1.255 -1.721 1.00 0.00 N ATOM 1629 CA LEU B 717 31.992 -1.593 -0.297 1.00 0.00 C ATOM 1630 C LEU B 717 30.939 -2.696 -0.091 1.00 0.00 C ATOM 1631 O LEU B 717 30.008 -2.821 -0.890 1.00 0.00 O ATOM 1632 CB LEU B 717 31.705 -0.341 0.558 1.00 0.00 C ATOM 1633 CG LEU B 717 30.281 0.248 0.510 1.00 0.00 C ATOM 1634 CD1 LEU B 717 30.220 1.452 1.447 1.00 0.00 C ATOM 1635 CD2 LEU B 717 29.878 0.710 -0.889 1.00 0.00 C ATOM 0 H LEU B 717 31.289 -1.464 -2.253 1.00 0.00 H new ATOM 0 HA LEU B 717 32.945 -1.993 0.049 1.00 0.00 H new ATOM 0 HB2 LEU B 717 31.933 -0.584 1.596 1.00 0.00 H new ATOM 0 HB3 LEU B 717 32.402 0.440 0.253 1.00 0.00 H new ATOM 0 HG LEU B 717 29.592 -0.541 0.812 1.00 0.00 H new ATOM 0 HD11 LEU B 717 29.218 1.880 1.424 1.00 0.00 H new ATOM 0 HD12 LEU B 717 30.456 1.135 2.463 1.00 0.00 H new ATOM 0 HD13 LEU B 717 30.942 2.202 1.124 1.00 0.00 H new ATOM 0 HD21 LEU B 717 28.866 1.115 -0.861 1.00 0.00 H new ATOM 0 HD22 LEU B 717 30.568 1.481 -1.230 1.00 0.00 H new ATOM 0 HD23 LEU B 717 29.911 -0.136 -1.575 1.00 0.00 H new ATOM 1647 N GLN B 718 31.077 -3.482 0.979 1.00 0.00 N ATOM 1648 CA GLN B 718 30.181 -4.586 1.371 1.00 0.00 C ATOM 1649 C GLN B 718 30.165 -4.760 2.904 1.00 0.00 C ATOM 1650 O GLN B 718 31.070 -4.303 3.605 1.00 0.00 O ATOM 1651 CB GLN B 718 30.656 -5.910 0.726 1.00 0.00 C ATOM 1652 CG GLN B 718 30.447 -6.046 -0.792 1.00 0.00 C ATOM 1653 CD GLN B 718 28.971 -6.131 -1.186 1.00 0.00 C ATOM 1654 OE1 GLN B 718 28.375 -7.198 -1.241 1.00 0.00 O ATOM 1655 NE2 GLN B 718 28.322 -5.023 -1.470 1.00 0.00 N ATOM 0 H GLN B 718 31.853 -3.365 1.631 1.00 0.00 H new ATOM 0 HA GLN B 718 29.176 -4.342 1.025 1.00 0.00 H new ATOM 0 HB2 GLN B 718 31.719 -6.030 0.936 1.00 0.00 H new ATOM 0 HB3 GLN B 718 30.138 -6.734 1.217 1.00 0.00 H new ATOM 0 HG2 GLN B 718 30.903 -5.193 -1.294 1.00 0.00 H new ATOM 0 HG3 GLN B 718 30.964 -6.938 -1.146 1.00 0.00 H new ATOM 0 HE21 GLN B 718 28.804 -4.125 -1.429 1.00 0.00 H new ATOM 0 HE22 GLN B 718 27.337 -5.062 -1.731 1.00 0.00 H new ATOM 1664 N THR B 719 29.154 -5.463 3.426 1.00 0.00 N ATOM 1665 CA THR B 719 28.989 -5.787 4.862 1.00 0.00 C ATOM 1666 C THR B 719 29.969 -6.858 5.375 1.00 0.00 C ATOM 1667 O THR B 719 30.033 -7.128 6.577 1.00 0.00 O ATOM 1668 CB THR B 719 27.552 -6.258 5.146 1.00 0.00 C ATOM 1669 OG1 THR B 719 27.197 -7.297 4.253 1.00 0.00 O ATOM 1670 CG2 THR B 719 26.539 -5.125 4.967 1.00 0.00 C ATOM 0 H THR B 719 28.400 -5.837 2.849 1.00 0.00 H new ATOM 0 HA THR B 719 29.209 -4.862 5.395 1.00 0.00 H new ATOM 0 HB THR B 719 27.529 -6.604 6.179 1.00 0.00 H new ATOM 0 HG1 THR B 719 26.282 -7.592 4.442 1.00 0.00 H new ATOM 0 HG21 THR B 719 25.536 -5.497 5.176 1.00 0.00 H new ATOM 0 HG22 THR B 719 26.776 -4.313 5.655 1.00 0.00 H new ATOM 0 HG23 THR B 719 26.583 -4.757 3.942 1.00 0.00 H new ATOM 1678 N THR B 720 30.749 -7.475 4.483 1.00 0.00 N ATOM 1679 CA THR B 720 31.768 -8.502 4.761 1.00 0.00 C ATOM 1680 C THR B 720 33.055 -7.910 5.351 1.00 0.00 C ATOM 1681 O THR B 720 34.142 -8.068 4.800 1.00 0.00 O ATOM 1682 CB THR B 720 32.055 -9.336 3.497 1.00 0.00 C ATOM 1683 OG1 THR B 720 32.210 -8.493 2.368 1.00 0.00 O ATOM 1684 CG2 THR B 720 30.904 -10.298 3.211 1.00 0.00 C ATOM 0 H THR B 720 30.686 -7.261 3.488 1.00 0.00 H new ATOM 0 HA THR B 720 31.361 -9.165 5.525 1.00 0.00 H new ATOM 0 HB THR B 720 32.973 -9.895 3.678 1.00 0.00 H new ATOM 0 HG1 THR B 720 32.393 -9.039 1.575 1.00 0.00 H new ATOM 0 HG21 THR B 720 31.128 -10.877 2.315 1.00 0.00 H new ATOM 0 HG22 THR B 720 30.776 -10.974 4.057 1.00 0.00 H new ATOM 0 HG23 THR B 720 29.986 -9.731 3.057 1.00 0.00 H new ATOM 1692 N ASP B 721 32.937 -7.196 6.473 1.00 0.00 N ATOM 1693 CA ASP B 721 34.049 -6.558 7.200 1.00 0.00 C ATOM 1694 C ASP B 721 33.968 -6.694 8.734 1.00 0.00 C ATOM 1695 O ASP B 721 34.788 -6.113 9.448 1.00 0.00 O ATOM 1696 CB ASP B 721 34.202 -5.086 6.782 1.00 0.00 C ATOM 1697 CG ASP B 721 33.149 -4.126 7.375 1.00 0.00 C ATOM 1698 OD1 ASP B 721 31.993 -4.537 7.635 1.00 0.00 O ATOM 1699 OD2 ASP B 721 33.480 -2.931 7.574 1.00 0.00 O ATOM 0 H ASP B 721 32.034 -7.038 6.920 1.00 0.00 H new ATOM 0 HA ASP B 721 34.943 -7.109 6.910 1.00 0.00 H new ATOM 0 HB2 ASP B 721 35.193 -4.741 7.077 1.00 0.00 H new ATOM 0 HB3 ASP B 721 34.155 -5.026 5.695 1.00 0.00 H new ATOM 1704 N ASN B 722 33.001 -7.464 9.250 1.00 0.00 N ATOM 1705 CA ASN B 722 32.799 -7.686 10.690 1.00 0.00 C ATOM 1706 C ASN B 722 32.786 -9.171 11.102 1.00 0.00 C ATOM 1707 O ASN B 722 32.718 -9.484 12.291 1.00 0.00 O ATOM 1708 CB ASN B 722 31.536 -6.936 11.121 1.00 0.00 C ATOM 1709 CG ASN B 722 31.428 -6.762 12.630 1.00 0.00 C ATOM 1710 OD1 ASN B 722 30.469 -7.180 13.264 1.00 0.00 O ATOM 1711 ND2 ASN B 722 32.403 -6.131 13.250 1.00 0.00 N ATOM 0 H ASN B 722 32.325 -7.959 8.669 1.00 0.00 H new ATOM 0 HA ASN B 722 33.662 -7.286 11.223 1.00 0.00 H new ATOM 0 HB2 ASN B 722 31.524 -5.955 10.647 1.00 0.00 H new ATOM 0 HB3 ASN B 722 30.660 -7.475 10.760 1.00 0.00 H new ATOM 0 HD21 ASN B 722 32.359 -5.991 14.259 1.00 0.00 H new ATOM 0 HD22 ASN B 722 33.203 -5.783 12.721 1.00 0.00 H new ATOM 1718 N LEU B 723 32.935 -10.090 10.138 1.00 0.00 N ATOM 1719 CA LEU B 723 33.104 -11.528 10.387 1.00 0.00 C ATOM 1720 C LEU B 723 34.394 -11.823 11.188 1.00 0.00 C ATOM 1721 O LEU B 723 34.541 -12.913 11.728 1.00 0.00 O ATOM 1722 CB LEU B 723 33.104 -12.274 9.033 1.00 0.00 C ATOM 1723 CG LEU B 723 31.844 -12.115 8.162 1.00 0.00 C ATOM 1724 CD1 LEU B 723 31.990 -12.968 6.902 1.00 0.00 C ATOM 1725 CD2 LEU B 723 30.578 -12.552 8.899 1.00 0.00 C ATOM 0 H LEU B 723 32.942 -9.851 9.146 1.00 0.00 H new ATOM 0 HA LEU B 723 32.273 -11.881 10.997 1.00 0.00 H new ATOM 0 HB2 LEU B 723 33.963 -11.933 8.456 1.00 0.00 H new ATOM 0 HB3 LEU B 723 33.252 -13.336 9.228 1.00 0.00 H new ATOM 0 HG LEU B 723 31.749 -11.058 7.913 1.00 0.00 H new ATOM 0 HD11 LEU B 723 31.100 -12.858 6.283 1.00 0.00 H new ATOM 0 HD12 LEU B 723 32.865 -12.641 6.341 1.00 0.00 H new ATOM 0 HD13 LEU B 723 32.109 -14.014 7.183 1.00 0.00 H new ATOM 0 HD21 LEU B 723 29.714 -12.423 8.247 1.00 0.00 H new ATOM 0 HD22 LEU B 723 30.665 -13.601 9.182 1.00 0.00 H new ATOM 0 HD23 LEU B 723 30.450 -11.944 9.795 1.00 0.00 H new ATOM 1737 N LEU B 724 35.303 -10.841 11.274 1.00 0.00 N ATOM 1738 CA LEU B 724 36.627 -10.857 11.923 1.00 0.00 C ATOM 1739 C LEU B 724 36.754 -11.828 13.128 1.00 0.00 C ATOM 1740 O LEU B 724 36.214 -11.536 14.200 1.00 0.00 O ATOM 1741 CB LEU B 724 37.037 -9.410 12.282 1.00 0.00 C ATOM 1742 CG LEU B 724 36.932 -8.368 11.142 1.00 0.00 C ATOM 1743 CD1 LEU B 724 37.607 -7.066 11.567 1.00 0.00 C ATOM 1744 CD2 LEU B 724 37.590 -8.848 9.846 1.00 0.00 C ATOM 0 H LEU B 724 35.115 -9.931 10.853 1.00 0.00 H new ATOM 0 HA LEU B 724 37.330 -11.267 11.198 1.00 0.00 H new ATOM 0 HB2 LEU B 724 36.416 -9.074 13.112 1.00 0.00 H new ATOM 0 HB3 LEU B 724 38.067 -9.424 12.640 1.00 0.00 H new ATOM 0 HG LEU B 724 35.869 -8.216 10.952 1.00 0.00 H new ATOM 0 HD11 LEU B 724 37.530 -6.336 10.761 1.00 0.00 H new ATOM 0 HD12 LEU B 724 37.116 -6.675 12.458 1.00 0.00 H new ATOM 0 HD13 LEU B 724 38.658 -7.256 11.786 1.00 0.00 H new ATOM 0 HD21 LEU B 724 37.488 -8.080 9.080 1.00 0.00 H new ATOM 0 HD22 LEU B 724 38.647 -9.043 10.025 1.00 0.00 H new ATOM 0 HD23 LEU B 724 37.104 -9.764 9.509 1.00 0.00 H new ATOM 1756 N PRO B 725 37.441 -12.985 12.984 1.00 0.00 N ATOM 1757 CA PRO B 725 37.562 -14.020 14.024 1.00 0.00 C ATOM 1758 C PRO B 725 38.550 -13.721 15.169 1.00 0.00 C ATOM 1759 O PRO B 725 38.703 -14.550 16.068 1.00 0.00 O ATOM 1760 CB PRO B 725 38.012 -15.272 13.259 1.00 0.00 C ATOM 1761 CG PRO B 725 38.894 -14.692 12.160 1.00 0.00 C ATOM 1762 CD PRO B 725 38.114 -13.441 11.770 1.00 0.00 C ATOM 0 HA PRO B 725 36.607 -14.111 14.542 1.00 0.00 H new ATOM 0 HB2 PRO B 725 38.563 -15.962 13.899 1.00 0.00 H new ATOM 0 HB3 PRO B 725 37.165 -15.823 12.850 1.00 0.00 H new ATOM 0 HG2 PRO B 725 39.895 -14.455 12.520 1.00 0.00 H new ATOM 0 HG3 PRO B 725 39.011 -15.380 11.323 1.00 0.00 H new ATOM 0 HD2 PRO B 725 38.781 -12.671 11.382 1.00 0.00 H new ATOM 0 HD3 PRO B 725 37.392 -13.662 10.984 1.00 0.00 H new ATOM 1770 N MET B 726 39.240 -12.577 15.148 1.00 0.00 N ATOM 1771 CA MET B 726 40.261 -12.211 16.141 1.00 0.00 C ATOM 1772 C MET B 726 40.240 -10.710 16.456 1.00 0.00 C ATOM 1773 O MET B 726 39.973 -9.887 15.577 1.00 0.00 O ATOM 1774 CB MET B 726 41.608 -12.681 15.583 1.00 0.00 C ATOM 1775 CG MET B 726 42.793 -12.473 16.521 1.00 0.00 C ATOM 1776 SD MET B 726 44.275 -13.425 16.088 1.00 0.00 S ATOM 1777 CE MET B 726 44.572 -12.871 14.386 1.00 0.00 C ATOM 0 H MET B 726 39.104 -11.866 14.430 1.00 0.00 H new ATOM 0 HA MET B 726 40.065 -12.696 17.097 1.00 0.00 H new ATOM 0 HB2 MET B 726 41.536 -13.741 15.340 1.00 0.00 H new ATOM 0 HB3 MET B 726 41.804 -12.153 14.650 1.00 0.00 H new ATOM 0 HG2 MET B 726 43.048 -11.413 16.533 1.00 0.00 H new ATOM 0 HG3 MET B 726 42.489 -12.739 17.533 1.00 0.00 H new ATOM 0 HE1 MET B 726 45.493 -13.319 14.013 1.00 0.00 H new ATOM 0 HE2 MET B 726 43.739 -13.176 13.753 1.00 0.00 H new ATOM 0 HE3 MET B 726 44.663 -11.785 14.367 1.00 0.00 H new ATOM 1787 N SER B 727 40.510 -10.370 17.717 1.00 0.00 N ATOM 1788 CA SER B 727 40.477 -9.002 18.267 1.00 0.00 C ATOM 1789 C SER B 727 41.739 -8.187 17.935 1.00 0.00 C ATOM 1790 O SER B 727 42.785 -8.789 17.687 1.00 0.00 O ATOM 1791 CB SER B 727 40.349 -9.056 19.801 1.00 0.00 C ATOM 1792 OG SER B 727 39.413 -10.029 20.234 1.00 0.00 O ATOM 0 H SER B 727 40.769 -11.065 18.417 1.00 0.00 H new ATOM 0 HA SER B 727 39.619 -8.513 17.807 1.00 0.00 H new ATOM 0 HB2 SER B 727 41.324 -9.276 20.236 1.00 0.00 H new ATOM 0 HB3 SER B 727 40.048 -8.076 20.172 1.00 0.00 H new ATOM 0 HG SER B 727 39.823 -10.918 20.194 1.00 0.00 H new ATOM 1798 N PRO B 728 41.706 -6.836 17.969 1.00 0.00 N ATOM 1799 CA PRO B 728 42.885 -5.993 17.719 1.00 0.00 C ATOM 1800 C PRO B 728 44.103 -6.328 18.599 1.00 0.00 C ATOM 1801 O PRO B 728 45.230 -6.360 18.108 1.00 0.00 O ATOM 1802 CB PRO B 728 42.420 -4.548 17.956 1.00 0.00 C ATOM 1803 CG PRO B 728 40.912 -4.611 17.724 1.00 0.00 C ATOM 1804 CD PRO B 728 40.542 -6.000 18.236 1.00 0.00 C ATOM 0 HA PRO B 728 43.240 -6.163 16.703 1.00 0.00 H new ATOM 0 HB2 PRO B 728 42.656 -4.212 18.966 1.00 0.00 H new ATOM 0 HB3 PRO B 728 42.902 -3.854 17.268 1.00 0.00 H new ATOM 0 HG2 PRO B 728 40.387 -3.827 18.270 1.00 0.00 H new ATOM 0 HG3 PRO B 728 40.661 -4.489 16.670 1.00 0.00 H new ATOM 0 HD2 PRO B 728 40.311 -5.977 19.301 1.00 0.00 H new ATOM 0 HD3 PRO B 728 39.658 -6.384 17.726 1.00 0.00 H new ATOM 1812 N GLU B 729 43.894 -6.605 19.892 1.00 0.00 N ATOM 1813 CA GLU B 729 44.962 -6.975 20.840 1.00 0.00 C ATOM 1814 C GLU B 729 45.605 -8.330 20.496 1.00 0.00 C ATOM 1815 O GLU B 729 46.825 -8.488 20.561 1.00 0.00 O ATOM 1816 CB GLU B 729 44.381 -7.033 22.263 1.00 0.00 C ATOM 1817 CG GLU B 729 44.129 -5.646 22.874 1.00 0.00 C ATOM 1818 CD GLU B 729 45.423 -4.826 23.058 1.00 0.00 C ATOM 1819 OE1 GLU B 729 46.489 -5.418 23.360 1.00 0.00 O ATOM 1820 OE2 GLU B 729 45.380 -3.581 22.903 1.00 0.00 O ATOM 0 H GLU B 729 42.968 -6.579 20.319 1.00 0.00 H new ATOM 0 HA GLU B 729 45.741 -6.215 20.773 1.00 0.00 H new ATOM 0 HB2 GLU B 729 43.444 -7.589 22.243 1.00 0.00 H new ATOM 0 HB3 GLU B 729 45.066 -7.586 22.905 1.00 0.00 H new ATOM 0 HG2 GLU B 729 43.442 -5.092 22.234 1.00 0.00 H new ATOM 0 HG3 GLU B 729 43.639 -5.764 23.841 1.00 0.00 H new ATOM 1827 N GLU B 730 44.789 -9.302 20.087 1.00 0.00 N ATOM 1828 CA GLU B 730 45.241 -10.625 19.653 1.00 0.00 C ATOM 1829 C GLU B 730 46.007 -10.488 18.326 1.00 0.00 C ATOM 1830 O GLU B 730 47.140 -10.950 18.205 1.00 0.00 O ATOM 1831 CB GLU B 730 44.019 -11.545 19.500 1.00 0.00 C ATOM 1832 CG GLU B 730 43.291 -11.823 20.821 1.00 0.00 C ATOM 1833 CD GLU B 730 42.010 -12.651 20.603 1.00 0.00 C ATOM 1834 OE1 GLU B 730 41.088 -12.161 19.906 1.00 0.00 O ATOM 1835 OE2 GLU B 730 41.898 -13.764 21.171 1.00 0.00 O ATOM 0 H GLU B 730 43.776 -9.190 20.047 1.00 0.00 H new ATOM 0 HA GLU B 730 45.913 -11.062 20.391 1.00 0.00 H new ATOM 0 HB2 GLU B 730 43.319 -11.092 18.797 1.00 0.00 H new ATOM 0 HB3 GLU B 730 44.340 -12.492 19.065 1.00 0.00 H new ATOM 0 HG2 GLU B 730 43.958 -12.356 21.499 1.00 0.00 H new ATOM 0 HG3 GLU B 730 43.036 -10.879 21.302 1.00 0.00 H new ATOM 1842 N PHE B 731 45.426 -9.785 17.349 1.00 0.00 N ATOM 1843 CA PHE B 731 46.048 -9.495 16.050 1.00 0.00 C ATOM 1844 C PHE B 731 47.408 -8.781 16.192 1.00 0.00 C ATOM 1845 O PHE B 731 48.349 -9.108 15.467 1.00 0.00 O ATOM 1846 CB PHE B 731 45.061 -8.683 15.196 1.00 0.00 C ATOM 1847 CG PHE B 731 45.553 -8.358 13.796 1.00 0.00 C ATOM 1848 CD1 PHE B 731 46.307 -7.191 13.566 1.00 0.00 C ATOM 1849 CD2 PHE B 731 45.254 -9.214 12.717 1.00 0.00 C ATOM 1850 CE1 PHE B 731 46.768 -6.889 12.271 1.00 0.00 C ATOM 1851 CE2 PHE B 731 45.707 -8.907 11.422 1.00 0.00 C ATOM 1852 CZ PHE B 731 46.468 -7.747 11.199 1.00 0.00 C ATOM 0 H PHE B 731 44.489 -9.392 17.440 1.00 0.00 H new ATOM 0 HA PHE B 731 46.267 -10.439 15.550 1.00 0.00 H new ATOM 0 HB2 PHE B 731 44.126 -9.238 15.118 1.00 0.00 H new ATOM 0 HB3 PHE B 731 44.836 -7.750 15.713 1.00 0.00 H new ATOM 0 HD1 PHE B 731 46.532 -6.525 14.386 1.00 0.00 H new ATOM 0 HD2 PHE B 731 44.674 -10.110 12.886 1.00 0.00 H new ATOM 0 HE1 PHE B 731 47.353 -5.997 12.101 1.00 0.00 H new ATOM 0 HE2 PHE B 731 45.470 -9.563 10.598 1.00 0.00 H new ATOM 0 HZ PHE B 731 46.822 -7.515 10.205 1.00 0.00 H new ATOM 1862 N ASP B 732 47.551 -7.842 17.136 1.00 0.00 N ATOM 1863 CA ASP B 732 48.820 -7.155 17.415 1.00 0.00 C ATOM 1864 C ASP B 732 49.893 -8.141 17.914 1.00 0.00 C ATOM 1865 O ASP B 732 51.019 -8.136 17.419 1.00 0.00 O ATOM 1866 CB ASP B 732 48.590 -6.033 18.439 1.00 0.00 C ATOM 1867 CG ASP B 732 49.901 -5.343 18.843 1.00 0.00 C ATOM 1868 OD1 ASP B 732 50.440 -4.533 18.057 1.00 0.00 O ATOM 1869 OD2 ASP B 732 50.399 -5.609 19.965 1.00 0.00 O ATOM 0 H ASP B 732 46.783 -7.535 17.733 1.00 0.00 H new ATOM 0 HA ASP B 732 49.187 -6.718 16.487 1.00 0.00 H new ATOM 0 HB2 ASP B 732 47.906 -5.295 18.020 1.00 0.00 H new ATOM 0 HB3 ASP B 732 48.109 -6.445 19.326 1.00 0.00 H new ATOM 1874 N GLU B 733 49.551 -9.029 18.851 1.00 0.00 N ATOM 1875 CA GLU B 733 50.470 -10.064 19.344 1.00 0.00 C ATOM 1876 C GLU B 733 50.834 -11.077 18.246 1.00 0.00 C ATOM 1877 O GLU B 733 51.981 -11.518 18.179 1.00 0.00 O ATOM 1878 CB GLU B 733 49.852 -10.746 20.573 1.00 0.00 C ATOM 1879 CG GLU B 733 50.792 -11.704 21.318 1.00 0.00 C ATOM 1880 CD GLU B 733 52.075 -11.031 21.837 1.00 0.00 C ATOM 1881 OE1 GLU B 733 52.005 -9.881 22.329 1.00 0.00 O ATOM 1882 OE2 GLU B 733 53.161 -11.654 21.798 1.00 0.00 O ATOM 0 H GLU B 733 48.631 -9.053 19.290 1.00 0.00 H new ATOM 0 HA GLU B 733 51.407 -9.592 19.639 1.00 0.00 H new ATOM 0 HB2 GLU B 733 49.516 -9.976 21.267 1.00 0.00 H new ATOM 0 HB3 GLU B 733 48.967 -11.299 20.258 1.00 0.00 H new ATOM 0 HG2 GLU B 733 50.257 -12.143 22.160 1.00 0.00 H new ATOM 0 HG3 GLU B 733 51.065 -12.522 20.652 1.00 0.00 H new ATOM 1889 N VAL B 734 49.907 -11.394 17.334 1.00 0.00 N ATOM 1890 CA VAL B 734 50.189 -12.253 16.180 1.00 0.00 C ATOM 1891 C VAL B 734 51.180 -11.544 15.254 1.00 0.00 C ATOM 1892 O VAL B 734 52.189 -12.132 14.864 1.00 0.00 O ATOM 1893 CB VAL B 734 48.901 -12.635 15.423 1.00 0.00 C ATOM 1894 CG1 VAL B 734 49.221 -13.325 14.099 1.00 0.00 C ATOM 1895 CG2 VAL B 734 47.983 -13.585 16.205 1.00 0.00 C ATOM 0 H VAL B 734 48.943 -11.063 17.376 1.00 0.00 H new ATOM 0 HA VAL B 734 50.630 -13.183 16.538 1.00 0.00 H new ATOM 0 HB VAL B 734 48.386 -11.687 15.270 1.00 0.00 H new ATOM 0 HG11 VAL B 734 48.293 -13.582 13.589 1.00 0.00 H new ATOM 0 HG12 VAL B 734 49.806 -12.653 13.471 1.00 0.00 H new ATOM 0 HG13 VAL B 734 49.793 -14.233 14.291 1.00 0.00 H new ATOM 0 HG21 VAL B 734 47.098 -13.808 15.609 1.00 0.00 H new ATOM 0 HG22 VAL B 734 48.517 -14.510 16.423 1.00 0.00 H new ATOM 0 HG23 VAL B 734 47.681 -13.112 17.139 1.00 0.00 H new ATOM 1905 N SER B 735 50.934 -10.269 14.938 1.00 0.00 N ATOM 1906 CA SER B 735 51.800 -9.448 14.080 1.00 0.00 C ATOM 1907 C SER B 735 53.243 -9.368 14.591 1.00 0.00 C ATOM 1908 O SER B 735 54.174 -9.383 13.783 1.00 0.00 O ATOM 1909 CB SER B 735 51.232 -8.031 13.926 1.00 0.00 C ATOM 1910 OG SER B 735 49.948 -8.058 13.326 1.00 0.00 O ATOM 0 H SER B 735 50.113 -9.767 15.277 1.00 0.00 H new ATOM 0 HA SER B 735 51.821 -9.944 13.109 1.00 0.00 H new ATOM 0 HB2 SER B 735 51.170 -7.553 14.903 1.00 0.00 H new ATOM 0 HB3 SER B 735 51.908 -7.429 13.319 1.00 0.00 H new ATOM 0 HG SER B 735 49.292 -8.392 13.973 1.00 0.00 H new ATOM 1916 N ARG B 736 53.452 -9.330 15.917 1.00 0.00 N ATOM 1917 CA ARG B 736 54.801 -9.297 16.528 1.00 0.00 C ATOM 1918 C ARG B 736 55.612 -10.560 16.226 1.00 0.00 C ATOM 1919 O ARG B 736 56.801 -10.469 15.918 1.00 0.00 O ATOM 1920 CB ARG B 736 54.697 -9.113 18.051 1.00 0.00 C ATOM 1921 CG ARG B 736 54.239 -7.700 18.432 1.00 0.00 C ATOM 1922 CD ARG B 736 53.881 -7.637 19.919 1.00 0.00 C ATOM 1923 NE ARG B 736 53.138 -6.395 20.211 1.00 0.00 N ATOM 1924 CZ ARG B 736 53.494 -5.369 20.959 1.00 0.00 C ATOM 1925 NH1 ARG B 736 54.640 -5.293 21.574 1.00 0.00 N ATOM 1926 NH2 ARG B 736 52.655 -4.387 21.090 1.00 0.00 N ATOM 0 H ARG B 736 52.694 -9.321 16.600 1.00 0.00 H new ATOM 0 HA ARG B 736 55.324 -8.450 16.084 1.00 0.00 H new ATOM 0 HB2 ARG B 736 53.996 -9.842 18.457 1.00 0.00 H new ATOM 0 HB3 ARG B 736 55.666 -9.315 18.507 1.00 0.00 H new ATOM 0 HG2 ARG B 736 55.030 -6.983 18.211 1.00 0.00 H new ATOM 0 HG3 ARG B 736 53.375 -7.417 17.831 1.00 0.00 H new ATOM 0 HD2 ARG B 736 53.278 -8.503 20.193 1.00 0.00 H new ATOM 0 HD3 ARG B 736 54.789 -7.677 20.521 1.00 0.00 H new ATOM 0 HE ARG B 736 52.220 -6.320 19.772 1.00 0.00 H new ATOM 0 HH11 ARG B 736 55.315 -6.053 21.490 1.00 0.00 H new ATOM 0 HH12 ARG B 736 54.862 -4.474 22.140 1.00 0.00 H new ATOM 0 HH21 ARG B 736 51.750 -4.423 20.621 1.00 0.00 H new ATOM 0 HH22 ARG B 736 52.901 -3.579 21.662 1.00 0.00 H new ATOM 1940 N ILE B 737 54.976 -11.730 16.315 1.00 0.00 N ATOM 1941 CA ILE B 737 55.619 -13.037 16.081 1.00 0.00 C ATOM 1942 C ILE B 737 55.744 -13.363 14.587 1.00 0.00 C ATOM 1943 O ILE B 737 56.778 -13.863 14.139 1.00 0.00 O ATOM 1944 CB ILE B 737 54.846 -14.146 16.828 1.00 0.00 C ATOM 1945 CG1 ILE B 737 54.780 -13.796 18.333 1.00 0.00 C ATOM 1946 CG2 ILE B 737 55.494 -15.526 16.598 1.00 0.00 C ATOM 1947 CD1 ILE B 737 54.275 -14.921 19.234 1.00 0.00 C ATOM 0 H ILE B 737 53.987 -11.804 16.554 1.00 0.00 H new ATOM 0 HA ILE B 737 56.634 -12.984 16.475 1.00 0.00 H new ATOM 0 HB ILE B 737 53.831 -14.203 16.435 1.00 0.00 H new ATOM 0 HG12 ILE B 737 55.775 -13.502 18.667 1.00 0.00 H new ATOM 0 HG13 ILE B 737 54.132 -12.929 18.461 1.00 0.00 H new ATOM 0 HG21 ILE B 737 54.929 -16.287 17.136 1.00 0.00 H new ATOM 0 HG22 ILE B 737 55.491 -15.756 15.533 1.00 0.00 H new ATOM 0 HG23 ILE B 737 56.521 -15.511 16.963 1.00 0.00 H new ATOM 0 HD11 ILE B 737 54.264 -14.581 20.269 1.00 0.00 H new ATOM 0 HD12 ILE B 737 53.266 -15.202 18.934 1.00 0.00 H new ATOM 0 HD13 ILE B 737 54.934 -15.784 19.143 1.00 0.00 H new ATOM 1959 N VAL B 738 54.702 -13.092 13.796 1.00 0.00 N ATOM 1960 CA VAL B 738 54.703 -13.349 12.343 1.00 0.00 C ATOM 1961 C VAL B 738 55.647 -12.393 11.608 1.00 0.00 C ATOM 1962 O VAL B 738 56.252 -12.776 10.608 1.00 0.00 O ATOM 1963 CB VAL B 738 53.270 -13.298 11.775 1.00 0.00 C ATOM 1964 CG1 VAL B 738 53.246 -13.579 10.268 1.00 0.00 C ATOM 1965 CG2 VAL B 738 52.396 -14.373 12.438 1.00 0.00 C ATOM 0 H VAL B 738 53.831 -12.688 14.140 1.00 0.00 H new ATOM 0 HA VAL B 738 55.083 -14.357 12.178 1.00 0.00 H new ATOM 0 HB VAL B 738 52.893 -12.295 11.975 1.00 0.00 H new ATOM 0 HG11 VAL B 738 52.219 -13.534 9.906 1.00 0.00 H new ATOM 0 HG12 VAL B 738 53.847 -12.832 9.749 1.00 0.00 H new ATOM 0 HG13 VAL B 738 53.655 -14.571 10.076 1.00 0.00 H new ATOM 0 HG21 VAL B 738 51.387 -14.326 12.028 1.00 0.00 H new ATOM 0 HG22 VAL B 738 52.821 -15.358 12.244 1.00 0.00 H new ATOM 0 HG23 VAL B 738 52.359 -14.199 13.513 1.00 0.00 H new ATOM 1975 N GLY B 739 55.808 -11.165 12.110 1.00 0.00 N ATOM 1976 CA GLY B 739 56.701 -10.135 11.550 1.00 0.00 C ATOM 1977 C GLY B 739 56.513 -9.855 10.050 1.00 0.00 C ATOM 1978 O GLY B 739 57.459 -9.451 9.372 1.00 0.00 O ATOM 0 H GLY B 739 55.309 -10.847 12.941 1.00 0.00 H new ATOM 0 HA2 GLY B 739 56.548 -9.206 12.099 1.00 0.00 H new ATOM 0 HA3 GLY B 739 57.734 -10.440 11.720 1.00 0.00 H new ATOM 1982 N SER B 740 55.302 -10.088 9.530 1.00 0.00 N ATOM 1983 CA SER B 740 54.895 -9.919 8.124 1.00 0.00 C ATOM 1984 C SER B 740 55.795 -10.617 7.075 1.00 0.00 C ATOM 1985 O SER B 740 55.883 -10.138 5.944 1.00 0.00 O ATOM 1986 CB SER B 740 54.683 -8.430 7.805 1.00 0.00 C ATOM 1987 OG SER B 740 53.757 -7.846 8.712 1.00 0.00 O ATOM 0 H SER B 740 54.532 -10.419 10.111 1.00 0.00 H new ATOM 0 HA SER B 740 53.947 -10.450 8.033 1.00 0.00 H new ATOM 0 HB2 SER B 740 55.635 -7.902 7.861 1.00 0.00 H new ATOM 0 HB3 SER B 740 54.317 -8.321 6.784 1.00 0.00 H new ATOM 0 HG SER B 740 53.638 -6.898 8.493 1.00 0.00 H new ATOM 1993 N VAL B 741 56.450 -11.736 7.437 1.00 0.00 N ATOM 1994 CA VAL B 741 57.391 -12.559 6.623 1.00 0.00 C ATOM 1995 C VAL B 741 57.281 -12.415 5.092 1.00 0.00 C ATOM 1996 O VAL B 741 58.189 -11.879 4.458 1.00 0.00 O ATOM 1997 CB VAL B 741 57.348 -14.053 7.039 1.00 0.00 C ATOM 1998 CG1 VAL B 741 58.303 -14.310 8.208 1.00 0.00 C ATOM 1999 CG2 VAL B 741 55.952 -14.581 7.431 1.00 0.00 C ATOM 0 H VAL B 741 56.333 -12.125 8.373 1.00 0.00 H new ATOM 0 HA VAL B 741 58.366 -12.134 6.862 1.00 0.00 H new ATOM 0 HB VAL B 741 57.651 -14.595 6.143 1.00 0.00 H new ATOM 0 HG11 VAL B 741 58.261 -15.363 8.488 1.00 0.00 H new ATOM 0 HG12 VAL B 741 59.320 -14.054 7.910 1.00 0.00 H new ATOM 0 HG13 VAL B 741 58.009 -13.696 9.060 1.00 0.00 H new ATOM 0 HG21 VAL B 741 56.025 -15.633 7.706 1.00 0.00 H new ATOM 0 HG22 VAL B 741 55.572 -14.010 8.278 1.00 0.00 H new ATOM 0 HG23 VAL B 741 55.272 -14.473 6.586 1.00 0.00 H new ATOM 2009 N GLU B 742 56.161 -12.848 4.508 1.00 0.00 N ATOM 2010 CA GLU B 742 55.795 -12.733 3.075 1.00 0.00 C ATOM 2011 C GLU B 742 54.262 -12.552 2.958 1.00 0.00 C ATOM 2012 O GLU B 742 53.614 -12.970 2.001 1.00 0.00 O ATOM 2013 CB GLU B 742 56.260 -13.973 2.285 1.00 0.00 C ATOM 2014 CG GLU B 742 57.785 -14.080 2.141 1.00 0.00 C ATOM 2015 CD GLU B 742 58.203 -15.180 1.146 1.00 0.00 C ATOM 2016 OE1 GLU B 742 57.600 -15.275 0.048 1.00 0.00 O ATOM 2017 OE2 GLU B 742 59.151 -15.944 1.447 1.00 0.00 O ATOM 0 H GLU B 742 55.434 -13.319 5.047 1.00 0.00 H new ATOM 0 HA GLU B 742 56.296 -11.865 2.646 1.00 0.00 H new ATOM 0 HB2 GLU B 742 55.888 -14.869 2.781 1.00 0.00 H new ATOM 0 HB3 GLU B 742 55.811 -13.949 1.292 1.00 0.00 H new ATOM 0 HG2 GLU B 742 58.184 -13.122 1.809 1.00 0.00 H new ATOM 0 HG3 GLU B 742 58.226 -14.288 3.116 1.00 0.00 H new ATOM 2024 N PHE B 743 53.685 -11.985 4.016 1.00 0.00 N ATOM 2025 CA PHE B 743 52.265 -11.829 4.329 1.00 0.00 C ATOM 2026 C PHE B 743 51.319 -11.389 3.195 1.00 0.00 C ATOM 2027 O PHE B 743 50.205 -11.897 3.081 1.00 0.00 O ATOM 2028 CB PHE B 743 52.218 -10.901 5.543 1.00 0.00 C ATOM 2029 CG PHE B 743 51.038 -11.096 6.456 1.00 0.00 C ATOM 2030 CD1 PHE B 743 50.811 -12.346 7.071 1.00 0.00 C ATOM 2031 CD2 PHE B 743 50.200 -10.001 6.731 1.00 0.00 C ATOM 2032 CE1 PHE B 743 49.746 -12.486 7.972 1.00 0.00 C ATOM 2033 CE2 PHE B 743 49.138 -10.145 7.636 1.00 0.00 C ATOM 2034 CZ PHE B 743 48.917 -11.384 8.259 1.00 0.00 C ATOM 0 H PHE B 743 54.262 -11.581 4.753 1.00 0.00 H new ATOM 0 HA PHE B 743 51.854 -12.819 4.525 1.00 0.00 H new ATOM 0 HB2 PHE B 743 53.131 -11.040 6.122 1.00 0.00 H new ATOM 0 HB3 PHE B 743 52.218 -9.869 5.191 1.00 0.00 H new ATOM 0 HD1 PHE B 743 51.452 -13.187 6.850 1.00 0.00 H new ATOM 0 HD2 PHE B 743 50.374 -9.051 6.247 1.00 0.00 H new ATOM 0 HE1 PHE B 743 49.561 -13.439 8.446 1.00 0.00 H new ATOM 0 HE2 PHE B 743 48.493 -9.306 7.853 1.00 0.00 H new ATOM 0 HZ PHE B 743 48.105 -11.493 8.963 1.00 0.00 H new ATOM 2044 N ASP B 744 51.754 -10.488 2.316 1.00 0.00 N ATOM 2045 CA ASP B 744 50.988 -10.028 1.145 1.00 0.00 C ATOM 2046 C ASP B 744 51.107 -10.969 -0.084 1.00 0.00 C ATOM 2047 O ASP B 744 50.786 -10.590 -1.211 1.00 0.00 O ATOM 2048 CB ASP B 744 51.360 -8.571 0.832 1.00 0.00 C ATOM 2049 CG ASP B 744 52.787 -8.406 0.277 1.00 0.00 C ATOM 2050 OD1 ASP B 744 53.758 -8.791 0.973 1.00 0.00 O ATOM 2051 OD2 ASP B 744 52.947 -7.857 -0.840 1.00 0.00 O ATOM 0 H ASP B 744 52.669 -10.044 2.394 1.00 0.00 H new ATOM 0 HA ASP B 744 49.928 -10.066 1.398 1.00 0.00 H new ATOM 0 HB2 ASP B 744 50.649 -8.170 0.109 1.00 0.00 H new ATOM 0 HB3 ASP B 744 51.261 -7.976 1.740 1.00 0.00 H new ATOM 2056 N SER B 745 51.589 -12.199 0.122 1.00 0.00 N ATOM 2057 CA SER B 745 51.808 -13.240 -0.898 1.00 0.00 C ATOM 2058 C SER B 745 51.268 -14.627 -0.479 1.00 0.00 C ATOM 2059 O SER B 745 51.425 -15.605 -1.214 1.00 0.00 O ATOM 2060 CB SER B 745 53.315 -13.277 -1.217 1.00 0.00 C ATOM 2061 OG SER B 745 53.636 -14.080 -2.343 1.00 0.00 O ATOM 0 H SER B 745 51.853 -12.516 1.055 1.00 0.00 H new ATOM 0 HA SER B 745 51.240 -12.986 -1.793 1.00 0.00 H new ATOM 0 HB2 SER B 745 53.666 -12.260 -1.394 1.00 0.00 H new ATOM 0 HB3 SER B 745 53.853 -13.653 -0.347 1.00 0.00 H new ATOM 0 HG SER B 745 53.037 -14.855 -2.374 1.00 0.00 H new ATOM 2067 N MET B 746 50.606 -14.755 0.683 1.00 0.00 N ATOM 2068 CA MET B 746 50.069 -16.041 1.180 1.00 0.00 C ATOM 2069 C MET B 746 49.084 -16.718 0.207 1.00 0.00 C ATOM 2070 O MET B 746 49.026 -17.945 0.144 1.00 0.00 O ATOM 2071 CB MET B 746 49.411 -15.894 2.563 1.00 0.00 C ATOM 2072 CG MET B 746 50.283 -15.285 3.676 1.00 0.00 C ATOM 2073 SD MET B 746 52.094 -15.289 3.483 1.00 0.00 S ATOM 2074 CE MET B 746 52.507 -17.042 3.439 1.00 0.00 C ATOM 0 H MET B 746 50.426 -13.970 1.309 1.00 0.00 H new ATOM 0 HA MET B 746 50.940 -16.691 1.265 1.00 0.00 H new ATOM 0 HB2 MET B 746 48.519 -15.278 2.453 1.00 0.00 H new ATOM 0 HB3 MET B 746 49.079 -16.880 2.890 1.00 0.00 H new ATOM 0 HG2 MET B 746 49.969 -14.250 3.810 1.00 0.00 H new ATOM 0 HG3 MET B 746 50.050 -15.811 4.601 1.00 0.00 H new ATOM 0 HE1 MET B 746 53.354 -17.200 2.771 1.00 0.00 H new ATOM 0 HE2 MET B 746 52.768 -17.380 4.442 1.00 0.00 H new ATOM 0 HE3 MET B 746 51.649 -17.609 3.077 1.00 0.00 H new ATOM 2084 N MET B 747 48.331 -15.932 -0.571 1.00 0.00 N ATOM 2085 CA MET B 747 47.374 -16.418 -1.577 1.00 0.00 C ATOM 2086 C MET B 747 48.038 -16.918 -2.879 1.00 0.00 C ATOM 2087 O MET B 747 47.373 -17.571 -3.686 1.00 0.00 O ATOM 2088 CB MET B 747 46.369 -15.300 -1.926 1.00 0.00 C ATOM 2089 CG MET B 747 45.399 -14.946 -0.790 1.00 0.00 C ATOM 2090 SD MET B 747 46.051 -13.906 0.547 1.00 0.00 S ATOM 2091 CE MET B 747 44.582 -13.860 1.609 1.00 0.00 C ATOM 0 H MET B 747 48.370 -14.914 -0.519 1.00 0.00 H new ATOM 0 HA MET B 747 46.872 -17.274 -1.126 1.00 0.00 H new ATOM 0 HB2 MET B 747 46.923 -14.404 -2.208 1.00 0.00 H new ATOM 0 HB3 MET B 747 45.792 -15.606 -2.799 1.00 0.00 H new ATOM 0 HG2 MET B 747 44.537 -14.440 -1.225 1.00 0.00 H new ATOM 0 HG3 MET B 747 45.036 -15.875 -0.351 1.00 0.00 H new ATOM 0 HE1 MET B 747 44.631 -12.987 2.260 1.00 0.00 H new ATOM 0 HE2 MET B 747 43.687 -13.800 0.990 1.00 0.00 H new ATOM 0 HE3 MET B 747 44.544 -14.764 2.216 1.00 0.00 H new ATOM 2101 N ASN B 748 49.324 -16.617 -3.111 1.00 0.00 N ATOM 2102 CA ASN B 748 50.041 -16.975 -4.344 1.00 0.00 C ATOM 2103 C ASN B 748 50.798 -18.324 -4.272 1.00 0.00 C ATOM 2104 O ASN B 748 51.099 -18.914 -5.307 1.00 0.00 O ATOM 2105 CB ASN B 748 50.973 -15.795 -4.692 1.00 0.00 C ATOM 2106 CG ASN B 748 51.400 -15.747 -6.154 1.00 0.00 C ATOM 2107 OD1 ASN B 748 50.754 -16.266 -7.054 1.00 0.00 O ATOM 2108 ND2 ASN B 748 52.494 -15.081 -6.449 1.00 0.00 N ATOM 0 H ASN B 748 49.903 -16.112 -2.440 1.00 0.00 H new ATOM 0 HA ASN B 748 49.313 -17.140 -5.138 1.00 0.00 H new ATOM 0 HB2 ASN B 748 50.468 -14.862 -4.442 1.00 0.00 H new ATOM 0 HB3 ASN B 748 51.864 -15.853 -4.067 1.00 0.00 H new ATOM 0 HD21 ASN B 748 52.796 -15.001 -7.420 1.00 0.00 H new ATOM 0 HD22 ASN B 748 53.041 -14.644 -5.707 1.00 0.00 H new ATOM 2115 N THR B 749 51.074 -18.829 -3.060 1.00 0.00 N ATOM 2116 CA THR B 749 51.756 -20.112 -2.757 1.00 0.00 C ATOM 2117 C THR B 749 52.958 -20.453 -3.665 1.00 0.00 C ATOM 2118 O THR B 749 53.008 -21.493 -4.326 1.00 0.00 O ATOM 2119 CB THR B 749 50.764 -21.285 -2.632 1.00 0.00 C ATOM 2120 OG1 THR B 749 49.607 -20.890 -1.925 1.00 0.00 O ATOM 2121 CG2 THR B 749 51.368 -22.435 -1.822 1.00 0.00 C ATOM 0 H THR B 749 50.815 -18.329 -2.210 1.00 0.00 H new ATOM 0 HA THR B 749 52.204 -19.950 -1.777 1.00 0.00 H new ATOM 0 HB THR B 749 50.529 -21.596 -3.650 1.00 0.00 H new ATOM 0 HG1 THR B 749 48.926 -21.591 -1.994 1.00 0.00 H new ATOM 0 HG21 THR B 749 50.646 -23.248 -1.750 1.00 0.00 H new ATOM 0 HG22 THR B 749 52.271 -22.794 -2.317 1.00 0.00 H new ATOM 0 HG23 THR B 749 51.618 -22.083 -0.821 1.00 0.00 H new ATOM 2129 N VAL B 750 53.949 -19.558 -3.680 1.00 0.00 N ATOM 2130 CA VAL B 750 55.222 -19.667 -4.433 1.00 0.00 C ATOM 2131 C VAL B 750 56.385 -19.033 -3.663 1.00 0.00 C ATOM 2132 O VAL B 750 56.179 -18.104 -2.869 1.00 0.00 O ATOM 2133 CB VAL B 750 55.160 -19.037 -5.843 1.00 0.00 C ATOM 2134 CG1 VAL B 750 54.321 -19.868 -6.818 1.00 0.00 C ATOM 2135 CG2 VAL B 750 54.635 -17.597 -5.844 1.00 0.00 C ATOM 0 H VAL B 750 53.892 -18.692 -3.144 1.00 0.00 H new ATOM 0 HA VAL B 750 55.389 -20.738 -4.550 1.00 0.00 H new ATOM 0 HB VAL B 750 56.197 -19.024 -6.178 1.00 0.00 H new ATOM 0 HG11 VAL B 750 54.309 -19.382 -7.794 1.00 0.00 H new ATOM 0 HG12 VAL B 750 54.754 -20.864 -6.914 1.00 0.00 H new ATOM 0 HG13 VAL B 750 53.301 -19.951 -6.442 1.00 0.00 H new ATOM 0 HG21 VAL B 750 54.618 -17.217 -6.865 1.00 0.00 H new ATOM 0 HG22 VAL B 750 53.626 -17.577 -5.432 1.00 0.00 H new ATOM 0 HG23 VAL B 750 55.287 -16.971 -5.235 1.00 0.00 H new TER 2145 VAL B 750 HETATM 2146 ZN ZN A 93 31.416 -27.220 14.925 1.00 0.00 ZN HETATM 2147 ZN ZN A 94 38.221 -11.254 1.706 1.00 0.00 ZN HETATM 2148 ZN ZN A 95 48.683 -26.739 10.562 1.00 0.00 ZN