USER MOD reduce.3.24.130724 H: found=0, std=0, add=1428, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1422 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 55 LYS NZ :NH3+ 160:sc= 0.464 (180deg=0) USER MOD Set 1.2: B 59 THR OG1 : rot 79:sc= 0.459 USER MOD Set 2.1: B 57 MET CE :methyl -173:sc= -1.63 (180deg=-1.77) USER MOD Set 2.2: B 68 CYS SG : rot -160:sc= -0.164 USER MOD Set 3.1: B 33 LYS NZ :NH3+ -157:sc= -1.14 (180deg=-0.337) USER MOD Set 3.2: B 50 GLN : amide:sc= -0.201 X(o=-1.3,f=-1.7!) USER MOD Set 4.1: B 41 SER OG : rot 180:sc= 0 USER MOD Set 4.2: B 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 5.1: A 85 HIS : no HE2:sc= -7.85! C(o=-22!,f=-35!) USER MOD Set 5.2: B 15 HIS : no HE2:sc= -5.15! C(o=-22!,f=-24!) USER MOD Set 5.3: B 25 HIS : no HD1:sc= -8.57! C(o=-22!,f=-25!) USER MOD Set 6.1: A 55 LYS NZ :NH3+ 174:sc= 0.469 (180deg=0) USER MOD Set 6.2: A 59 THR OG1 : rot -130:sc= 0.43 USER MOD Set 7.1: A 57 MET CE :methyl -175:sc= -1.64 (180deg=-1.87) USER MOD Set 7.2: A 68 CYS SG : rot -160:sc= -0.191 USER MOD Set 8.1: A 41 SER OG : rot 180:sc= 0 USER MOD Set 8.2: A 42 HIS : no HD1:sc= 0 X(o=0,f=-0.023) USER MOD Set 9.1: A 33 LYS NZ :NH3+ -156:sc= -1.16 (180deg=-0.326) USER MOD Set 9.2: A 50 GLN : amide:sc= -0.168 X(o=-1.3,f=-1.7!) USER MOD Set10.1: A 15 HIS : no HE2:sc= -5.27! C(o=-22!,f=-25!) USER MOD Set10.2: A 25 HIS : no HD1:sc= -8.7! C(o=-22!,f=-25!) USER MOD Set10.3: B 85 HIS : no HE2:sc= -8.28! C(o=-22!,f=-36!) USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 0 MET N :NH3+ -171:sc= -2.48! (180deg=-2.79!) USER MOD Single : A 1 SER OG : rot 180:sc= 0.00386 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 MET CE :methyl -167:sc= -0.0244 (180deg=-0.138) USER MOD Single : A 16 GLN : amide:sc= -0.209 K(o=-0.21,f=-2.5!) USER MOD Single : A 17 TYR OH : rot 98:sc= 0.791 USER MOD Single : A 18 SER OG : rot -112:sc= -0.279 USER MOD Single : A 24 LYS NZ :NH3+ -150:sc= -0.156 (180deg=-0.738) USER MOD Single : A 26 LYS NZ :NH3+ 147:sc= -0.964 (180deg=-1.47) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 70:sc= -1.44 USER MOD Single : A 37 ASN : amide:sc= -0.714! K(o=-0.71!,f=-1.3) USER MOD Single : A 38 ASN : amide:sc= -4 K(o=-4,f=-9.6!) USER MOD Single : A 48 LYS NZ :NH3+ 166:sc=-0.00666 (180deg=-0.249) USER MOD Single : A 71 GLN : amide:sc= -0.0526 X(o=-0.053,f=0) USER MOD Single : A 74 MET CE :methyl -161:sc= -0.865 (180deg=-1.72) USER MOD Single : A 78 SER OG : rot -156:sc= 0.383 USER MOD Single : A 79 MET CE :methyl 173:sc= -0.122 (180deg=-0.157) USER MOD Single : A 81 THR OG1 : rot -32:sc= -2.01! USER MOD Single : A 82 THR OG1 : rot -87:sc= -0.789 USER MOD Single : A 84 CYS SG : rot -26:sc= 0.479 USER MOD Single : A 90 HIS : no HD1:sc= -0.031 X(o=-0.031,f=0) USER MOD Single : B 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 0 MET N :NH3+ -171:sc= -2.37! (180deg=-2.8!) USER MOD Single : B 1 SER OG : rot 180:sc= 0.00147 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 MET CE :methyl -166:sc=-0.00336 (180deg=-0.0891) USER MOD Single : B 16 GLN : amide:sc= -0.178 K(o=-0.18,f=-2.5!) USER MOD Single : B 17 TYR OH : rot 98:sc= 0.772 USER MOD Single : B 18 SER OG : rot -119:sc= -0.336 USER MOD Single : B 24 LYS NZ :NH3+ -152:sc= -0.135 (180deg=-0.767) USER MOD Single : B 26 LYS NZ :NH3+ 151:sc= -0.9 (180deg=-1.61) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 SER OG : rot -128:sc= -1.43 USER MOD Single : B 37 ASN : amide:sc= -0.694! K(o=-0.69!,f=-1.2) USER MOD Single : B 38 ASN : amide:sc= -4.08 K(o=-4.1,f=-9.8!) USER MOD Single : B 48 LYS NZ :NH3+ 166:sc= -0.0136 (180deg=-0.23) USER MOD Single : B 71 GLN : amide:sc= -0.065 X(o=-0.065,f=0) USER MOD Single : B 74 MET CE :methyl -160:sc= -0.762 (180deg=-1.73) USER MOD Single : B 78 SER OG : rot -148:sc= 0.415 USER MOD Single : B 79 MET CE :methyl 173:sc= -0.141 (180deg=-0.172) USER MOD Single : B 81 THR OG1 : rot -22:sc= -2.24! USER MOD Single : B 82 THR OG1 : rot -86:sc= -0.829 USER MOD Single : B 84 CYS SG : rot -27:sc= 0.511 USER MOD Single : B 90 HIS : no HD1:sc= -0.0441 X(o=-0.044,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 -7.918 7.735 13.309 1.00 0.00 N ATOM 2 CA MET A 0 -7.529 7.127 14.613 1.00 0.00 C ATOM 3 C MET A 0 -7.944 5.655 14.635 1.00 0.00 C ATOM 4 O MET A 0 -8.083 5.057 15.683 1.00 0.00 O ATOM 5 CB MET A 0 -8.231 7.873 15.753 1.00 0.00 C ATOM 6 CG MET A 0 -9.700 8.105 15.392 1.00 0.00 C ATOM 7 SD MET A 0 -10.636 8.485 16.895 1.00 0.00 S ATOM 8 CE MET A 0 -10.207 10.240 17.000 1.00 0.00 C ATOM 0 H1 MET A 0 -7.504 8.686 13.232 1.00 0.00 H new ATOM 0 H2 MET A 0 -7.568 7.141 12.531 1.00 0.00 H new ATOM 0 H3 MET A 0 -8.954 7.803 13.253 1.00 0.00 H new ATOM 0 HA MET A 0 -6.449 7.201 14.740 1.00 0.00 H new ATOM 0 HB2 MET A 0 -8.160 7.296 16.675 1.00 0.00 H new ATOM 0 HB3 MET A 0 -7.736 8.827 15.935 1.00 0.00 H new ATOM 0 HG2 MET A 0 -9.786 8.926 14.680 1.00 0.00 H new ATOM 0 HG3 MET A 0 -10.111 7.219 14.908 1.00 0.00 H new ATOM 0 HE1 MET A 0 -10.688 10.681 17.873 1.00 0.00 H new ATOM 0 HE2 MET A 0 -9.126 10.346 17.089 1.00 0.00 H new ATOM 0 HE3 MET A 0 -10.548 10.752 16.101 1.00 0.00 H new ATOM 20 N SER A 1 -8.143 5.065 13.481 1.00 0.00 N ATOM 21 CA SER A 1 -8.556 3.627 13.419 1.00 0.00 C ATOM 22 C SER A 1 -7.386 2.769 12.935 1.00 0.00 C ATOM 23 O SER A 1 -6.269 3.230 12.806 1.00 0.00 O ATOM 24 CB SER A 1 -9.715 3.476 12.437 1.00 0.00 C ATOM 25 OG SER A 1 -9.403 4.165 11.233 1.00 0.00 O ATOM 0 H SER A 1 -8.037 5.520 12.574 1.00 0.00 H new ATOM 0 HA SER A 1 -8.861 3.302 14.414 1.00 0.00 H new ATOM 0 HB2 SER A 1 -9.896 2.421 12.230 1.00 0.00 H new ATOM 0 HB3 SER A 1 -10.630 3.877 12.872 1.00 0.00 H new ATOM 0 HG SER A 1 -10.144 4.069 10.599 1.00 0.00 H new ATOM 31 N GLU A 2 -7.646 1.520 12.663 1.00 0.00 N ATOM 32 CA GLU A 2 -6.570 0.610 12.179 1.00 0.00 C ATOM 33 C GLU A 2 -5.880 1.240 10.970 1.00 0.00 C ATOM 34 O GLU A 2 -4.787 0.861 10.598 1.00 0.00 O ATOM 35 CB GLU A 2 -7.192 -0.727 11.774 1.00 0.00 C ATOM 36 CG GLU A 2 -7.696 -1.450 13.024 1.00 0.00 C ATOM 37 CD GLU A 2 -8.526 -2.667 12.612 1.00 0.00 C ATOM 38 OE1 GLU A 2 -7.968 -3.559 11.993 1.00 0.00 O ATOM 39 OE2 GLU A 2 -9.704 -2.689 12.925 1.00 0.00 O ATOM 0 H GLU A 2 -8.565 1.088 12.756 1.00 0.00 H new ATOM 0 HA GLU A 2 -5.837 0.449 12.970 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -8.015 -0.562 11.079 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -6.456 -1.342 11.256 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -6.853 -1.763 13.640 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -8.299 -0.774 13.630 1.00 0.00 H new ATOM 46 N LEU A 3 -6.520 2.188 10.343 1.00 0.00 N ATOM 47 CA LEU A 3 -5.915 2.832 9.142 1.00 0.00 C ATOM 48 C LEU A 3 -4.975 3.962 9.568 1.00 0.00 C ATOM 49 O LEU A 3 -4.040 4.293 8.869 1.00 0.00 O ATOM 50 CB LEU A 3 -7.021 3.424 8.262 1.00 0.00 C ATOM 51 CG LEU A 3 -7.860 2.312 7.610 1.00 0.00 C ATOM 52 CD1 LEU A 3 -6.995 1.463 6.660 1.00 0.00 C ATOM 53 CD2 LEU A 3 -8.484 1.422 8.695 1.00 0.00 C ATOM 0 H LEU A 3 -7.437 2.545 10.610 1.00 0.00 H new ATOM 0 HA LEU A 3 -5.356 2.078 8.587 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -7.665 4.065 8.863 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -6.579 4.052 7.489 1.00 0.00 H new ATOM 0 HG LEU A 3 -8.656 2.775 7.027 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -7.608 0.682 6.210 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -6.584 2.099 5.876 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -6.180 1.006 7.221 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -9.077 0.637 8.225 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -7.693 0.970 9.294 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -9.126 2.026 9.337 1.00 0.00 H new ATOM 65 N GLU A 4 -5.205 4.561 10.704 1.00 0.00 N ATOM 66 CA GLU A 4 -4.308 5.667 11.148 1.00 0.00 C ATOM 67 C GLU A 4 -3.022 5.071 11.714 1.00 0.00 C ATOM 68 O GLU A 4 -1.980 5.698 11.717 1.00 0.00 O ATOM 69 CB GLU A 4 -5.009 6.504 12.224 1.00 0.00 C ATOM 70 CG GLU A 4 -4.156 7.738 12.555 1.00 0.00 C ATOM 71 CD GLU A 4 -5.020 8.784 13.266 1.00 0.00 C ATOM 72 OE1 GLU A 4 -5.979 9.238 12.665 1.00 0.00 O ATOM 73 OE2 GLU A 4 -4.706 9.112 14.398 1.00 0.00 O ATOM 0 H GLU A 4 -5.969 4.335 11.341 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.071 6.309 10.299 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -5.994 6.814 11.874 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -5.164 5.905 13.121 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -3.317 7.453 13.189 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -3.736 8.158 11.641 1.00 0.00 H new ATOM 80 N LYS A 5 -3.087 3.859 12.184 1.00 0.00 N ATOM 81 CA LYS A 5 -1.874 3.208 12.744 1.00 0.00 C ATOM 82 C LYS A 5 -0.967 2.800 11.589 1.00 0.00 C ATOM 83 O LYS A 5 0.211 3.093 11.572 1.00 0.00 O ATOM 84 CB LYS A 5 -2.282 1.961 13.533 1.00 0.00 C ATOM 85 CG LYS A 5 -3.349 2.339 14.569 1.00 0.00 C ATOM 86 CD LYS A 5 -3.976 1.073 15.184 1.00 0.00 C ATOM 87 CE LYS A 5 -5.391 1.388 15.678 1.00 0.00 C ATOM 88 NZ LYS A 5 -6.012 0.155 16.237 1.00 0.00 N ATOM 0 H LYS A 5 -3.932 3.289 12.204 1.00 0.00 H new ATOM 0 HA LYS A 5 -1.352 3.898 13.407 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -2.670 1.200 12.856 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -1.412 1.531 14.031 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -2.902 2.949 15.354 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -4.124 2.944 14.098 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -4.008 0.274 14.443 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -3.362 0.716 16.011 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -5.356 2.167 16.440 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -5.996 1.772 14.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -6.973 0.371 16.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -6.059 -0.576 15.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -5.439 -0.193 17.032 1.00 0.00 H new ATOM 102 N ALA A 6 -1.514 2.119 10.620 1.00 0.00 N ATOM 103 CA ALA A 6 -0.687 1.683 9.460 1.00 0.00 C ATOM 104 C ALA A 6 -0.091 2.895 8.753 1.00 0.00 C ATOM 105 O ALA A 6 1.103 2.983 8.549 1.00 0.00 O ATOM 106 CB ALA A 6 -1.560 0.908 8.476 1.00 0.00 C ATOM 0 H ALA A 6 -2.496 1.846 10.581 1.00 0.00 H new ATOM 0 HA ALA A 6 0.121 1.046 9.822 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -0.956 0.589 7.627 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -1.979 0.033 8.973 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -2.369 1.548 8.125 1.00 0.00 H new ATOM 112 N MET A 7 -0.913 3.822 8.363 1.00 0.00 N ATOM 113 CA MET A 7 -0.395 5.023 7.653 1.00 0.00 C ATOM 114 C MET A 7 0.694 5.696 8.492 1.00 0.00 C ATOM 115 O MET A 7 1.665 6.197 7.970 1.00 0.00 O ATOM 116 CB MET A 7 -1.542 6.016 7.412 1.00 0.00 C ATOM 117 CG MET A 7 -2.492 5.489 6.325 1.00 0.00 C ATOM 118 SD MET A 7 -3.397 6.884 5.596 1.00 0.00 S ATOM 119 CE MET A 7 -5.078 6.367 6.030 1.00 0.00 C ATOM 0 H MET A 7 -1.923 3.802 8.504 1.00 0.00 H new ATOM 0 HA MET A 7 0.027 4.715 6.696 1.00 0.00 H new ATOM 0 HB2 MET A 7 -2.093 6.175 8.339 1.00 0.00 H new ATOM 0 HB3 MET A 7 -1.137 6.982 7.112 1.00 0.00 H new ATOM 0 HG2 MET A 7 -1.927 4.964 5.555 1.00 0.00 H new ATOM 0 HG3 MET A 7 -3.191 4.770 6.753 1.00 0.00 H new ATOM 0 HE1 MET A 7 -5.798 6.968 5.475 1.00 0.00 H new ATOM 0 HE2 MET A 7 -5.212 5.315 5.777 1.00 0.00 H new ATOM 0 HE3 MET A 7 -5.237 6.506 7.099 1.00 0.00 H new ATOM 129 N VAL A 8 0.548 5.711 9.787 1.00 0.00 N ATOM 130 CA VAL A 8 1.589 6.357 10.641 1.00 0.00 C ATOM 131 C VAL A 8 2.835 5.467 10.655 1.00 0.00 C ATOM 132 O VAL A 8 3.947 5.924 10.480 1.00 0.00 O ATOM 133 CB VAL A 8 1.031 6.528 12.071 1.00 0.00 C ATOM 134 CG1 VAL A 8 2.173 6.624 13.094 1.00 0.00 C ATOM 135 CG2 VAL A 8 0.184 7.804 12.140 1.00 0.00 C ATOM 0 H VAL A 8 -0.241 5.307 10.291 1.00 0.00 H new ATOM 0 HA VAL A 8 1.855 7.338 10.247 1.00 0.00 H new ATOM 0 HB VAL A 8 0.419 5.658 12.309 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.756 6.744 14.094 1.00 0.00 H new ATOM 0 HG12 VAL A 8 2.772 5.714 13.057 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.802 7.482 12.858 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.210 7.925 13.149 1.00 0.00 H new ATOM 0 HG22 VAL A 8 0.802 8.665 11.886 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -0.643 7.730 11.434 1.00 0.00 H new ATOM 145 N ALA A 9 2.644 4.204 10.873 1.00 0.00 N ATOM 146 CA ALA A 9 3.798 3.271 10.916 1.00 0.00 C ATOM 147 C ALA A 9 4.611 3.386 9.621 1.00 0.00 C ATOM 148 O ALA A 9 5.825 3.283 9.626 1.00 0.00 O ATOM 149 CB ALA A 9 3.275 1.843 11.071 1.00 0.00 C ATOM 0 H ALA A 9 1.732 3.772 11.025 1.00 0.00 H new ATOM 0 HA ALA A 9 4.441 3.523 11.759 1.00 0.00 H new ATOM 0 HB1 ALA A 9 4.115 1.149 11.104 1.00 0.00 H new ATOM 0 HB2 ALA A 9 2.703 1.763 11.995 1.00 0.00 H new ATOM 0 HB3 ALA A 9 2.634 1.597 10.225 1.00 0.00 H new ATOM 155 N LEU A 10 3.958 3.584 8.506 1.00 0.00 N ATOM 156 CA LEU A 10 4.704 3.681 7.217 1.00 0.00 C ATOM 157 C LEU A 10 5.319 5.075 7.037 1.00 0.00 C ATOM 158 O LEU A 10 6.469 5.190 6.706 1.00 0.00 O ATOM 159 CB LEU A 10 3.742 3.369 6.056 1.00 0.00 C ATOM 160 CG LEU A 10 3.728 1.858 5.766 1.00 0.00 C ATOM 161 CD1 LEU A 10 3.513 1.066 7.067 1.00 0.00 C ATOM 162 CD2 LEU A 10 2.589 1.548 4.789 1.00 0.00 C ATOM 0 H LEU A 10 2.945 3.682 8.432 1.00 0.00 H new ATOM 0 HA LEU A 10 5.520 2.958 7.226 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.737 3.707 6.307 1.00 0.00 H new ATOM 0 HB3 LEU A 10 4.049 3.915 5.164 1.00 0.00 H new ATOM 0 HG LEU A 10 4.685 1.568 5.332 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.505 -0.001 6.846 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.321 1.286 7.765 1.00 0.00 H new ATOM 0 HD13 LEU A 10 2.560 1.351 7.513 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.572 0.479 4.578 1.00 0.00 H new ATOM 0 HD22 LEU A 10 1.639 1.846 5.232 1.00 0.00 H new ATOM 0 HD23 LEU A 10 2.745 2.099 3.861 1.00 0.00 H new ATOM 174 N ILE A 11 4.571 6.128 7.226 1.00 0.00 N ATOM 175 CA ILE A 11 5.137 7.503 7.022 1.00 0.00 C ATOM 176 C ILE A 11 6.525 7.592 7.666 1.00 0.00 C ATOM 177 O ILE A 11 7.378 8.335 7.222 1.00 0.00 O ATOM 178 CB ILE A 11 4.198 8.541 7.655 1.00 0.00 C ATOM 179 CG1 ILE A 11 2.969 8.711 6.760 1.00 0.00 C ATOM 180 CG2 ILE A 11 4.910 9.895 7.786 1.00 0.00 C ATOM 181 CD1 ILE A 11 1.890 9.495 7.510 1.00 0.00 C ATOM 0 H ILE A 11 3.592 6.101 7.513 1.00 0.00 H new ATOM 0 HA ILE A 11 5.228 7.704 5.955 1.00 0.00 H new ATOM 0 HB ILE A 11 3.903 8.196 8.646 1.00 0.00 H new ATOM 0 HG12 ILE A 11 3.243 9.235 5.845 1.00 0.00 H new ATOM 0 HG13 ILE A 11 2.584 7.735 6.465 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.232 10.620 8.236 1.00 0.00 H new ATOM 0 HG22 ILE A 11 5.792 9.783 8.416 1.00 0.00 H new ATOM 0 HG23 ILE A 11 5.212 10.244 6.799 1.00 0.00 H new ATOM 0 HD11 ILE A 11 1.016 9.614 6.870 1.00 0.00 H new ATOM 0 HD12 ILE A 11 1.608 8.953 8.413 1.00 0.00 H new ATOM 0 HD13 ILE A 11 2.277 10.477 7.783 1.00 0.00 H new ATOM 193 N ASP A 12 6.762 6.835 8.696 1.00 0.00 N ATOM 194 CA ASP A 12 8.100 6.873 9.349 1.00 0.00 C ATOM 195 C ASP A 12 9.084 6.038 8.525 1.00 0.00 C ATOM 196 O ASP A 12 10.160 6.484 8.178 1.00 0.00 O ATOM 197 CB ASP A 12 7.998 6.299 10.765 1.00 0.00 C ATOM 198 CG ASP A 12 9.295 6.579 11.527 1.00 0.00 C ATOM 199 OD1 ASP A 12 10.257 6.985 10.894 1.00 0.00 O ATOM 200 OD2 ASP A 12 9.306 6.383 12.731 1.00 0.00 O ATOM 0 H ASP A 12 6.090 6.192 9.115 1.00 0.00 H new ATOM 0 HA ASP A 12 8.451 7.903 9.406 1.00 0.00 H new ATOM 0 HB2 ASP A 12 7.153 6.745 11.289 1.00 0.00 H new ATOM 0 HB3 ASP A 12 7.815 5.225 10.721 1.00 0.00 H new ATOM 205 N VAL A 13 8.713 4.832 8.209 1.00 0.00 N ATOM 206 CA VAL A 13 9.603 3.949 7.402 1.00 0.00 C ATOM 207 C VAL A 13 9.592 4.420 5.942 1.00 0.00 C ATOM 208 O VAL A 13 10.538 4.227 5.205 1.00 0.00 O ATOM 209 CB VAL A 13 9.085 2.509 7.515 1.00 0.00 C ATOM 210 CG1 VAL A 13 10.000 1.540 6.765 1.00 0.00 C ATOM 211 CG2 VAL A 13 9.050 2.128 8.995 1.00 0.00 C ATOM 0 H VAL A 13 7.822 4.414 8.477 1.00 0.00 H new ATOM 0 HA VAL A 13 10.629 3.992 7.769 1.00 0.00 H new ATOM 0 HB VAL A 13 8.090 2.448 7.075 1.00 0.00 H new ATOM 0 HG11 VAL A 13 9.612 0.526 6.860 1.00 0.00 H new ATOM 0 HG12 VAL A 13 10.038 1.817 5.711 1.00 0.00 H new ATOM 0 HG13 VAL A 13 11.003 1.586 7.188 1.00 0.00 H new ATOM 0 HG21 VAL A 13 8.684 1.107 9.099 1.00 0.00 H new ATOM 0 HG22 VAL A 13 10.054 2.198 9.413 1.00 0.00 H new ATOM 0 HG23 VAL A 13 8.386 2.807 9.530 1.00 0.00 H new ATOM 221 N PHE A 14 8.523 5.039 5.534 1.00 0.00 N ATOM 222 CA PHE A 14 8.433 5.532 4.130 1.00 0.00 C ATOM 223 C PHE A 14 9.336 6.764 3.953 1.00 0.00 C ATOM 224 O PHE A 14 10.032 6.895 2.967 1.00 0.00 O ATOM 225 CB PHE A 14 6.964 5.868 3.804 1.00 0.00 C ATOM 226 CG PHE A 14 6.861 6.866 2.666 1.00 0.00 C ATOM 227 CD1 PHE A 14 7.716 6.773 1.561 1.00 0.00 C ATOM 228 CD2 PHE A 14 5.906 7.889 2.728 1.00 0.00 C ATOM 229 CE1 PHE A 14 7.615 7.704 0.520 1.00 0.00 C ATOM 230 CE2 PHE A 14 5.807 8.817 1.689 1.00 0.00 C ATOM 231 CZ PHE A 14 6.662 8.727 0.585 1.00 0.00 C ATOM 0 H PHE A 14 7.704 5.227 6.112 1.00 0.00 H new ATOM 0 HA PHE A 14 8.775 4.760 3.440 1.00 0.00 H new ATOM 0 HB2 PHE A 14 6.431 4.955 3.538 1.00 0.00 H new ATOM 0 HB3 PHE A 14 6.477 6.274 4.691 1.00 0.00 H new ATOM 0 HD1 PHE A 14 8.452 5.984 1.512 1.00 0.00 H new ATOM 0 HD2 PHE A 14 5.246 7.960 3.580 1.00 0.00 H new ATOM 0 HE1 PHE A 14 8.273 7.633 -0.334 1.00 0.00 H new ATOM 0 HE2 PHE A 14 5.070 9.605 1.738 1.00 0.00 H new ATOM 0 HZ PHE A 14 6.587 9.447 -0.217 1.00 0.00 H new ATOM 241 N HIS A 15 9.322 7.674 4.886 1.00 0.00 N ATOM 242 CA HIS A 15 10.166 8.898 4.742 1.00 0.00 C ATOM 243 C HIS A 15 11.636 8.588 5.084 1.00 0.00 C ATOM 244 O HIS A 15 12.543 9.174 4.529 1.00 0.00 O ATOM 245 CB HIS A 15 9.623 9.992 5.683 1.00 0.00 C ATOM 246 CG HIS A 15 9.868 11.366 5.103 1.00 0.00 C ATOM 247 ND1 HIS A 15 9.217 12.491 5.584 1.00 0.00 N ATOM 248 CD2 HIS A 15 10.670 11.809 4.077 1.00 0.00 C ATOM 249 CE1 HIS A 15 9.632 13.544 4.857 1.00 0.00 C ATOM 250 NE2 HIS A 15 10.517 13.184 3.924 1.00 0.00 N ATOM 0 H HIS A 15 8.766 7.626 5.740 1.00 0.00 H new ATOM 0 HA HIS A 15 10.125 9.244 3.709 1.00 0.00 H new ATOM 0 HB2 HIS A 15 8.555 9.844 5.842 1.00 0.00 H new ATOM 0 HB3 HIS A 15 10.105 9.912 6.658 1.00 0.00 H new ATOM 0 HD1 HIS A 15 8.545 12.516 6.351 1.00 0.00 H new ATOM 0 HD2 HIS A 15 11.319 11.185 3.481 1.00 0.00 H new ATOM 0 HE1 HIS A 15 9.291 14.557 5.009 1.00 0.00 H new ATOM 258 N GLN A 16 11.878 7.690 6.000 1.00 0.00 N ATOM 259 CA GLN A 16 13.289 7.370 6.382 1.00 0.00 C ATOM 260 C GLN A 16 14.020 6.675 5.227 1.00 0.00 C ATOM 261 O GLN A 16 15.187 6.921 4.979 1.00 0.00 O ATOM 262 CB GLN A 16 13.281 6.447 7.604 1.00 0.00 C ATOM 263 CG GLN A 16 12.903 7.251 8.850 1.00 0.00 C ATOM 264 CD GLN A 16 14.080 8.138 9.258 1.00 0.00 C ATOM 265 OE1 GLN A 16 15.154 8.038 8.698 1.00 0.00 O ATOM 266 NE2 GLN A 16 13.923 9.010 10.216 1.00 0.00 N ATOM 0 H GLN A 16 11.163 7.163 6.501 1.00 0.00 H new ATOM 0 HA GLN A 16 13.809 8.299 6.614 1.00 0.00 H new ATOM 0 HB2 GLN A 16 12.571 5.634 7.454 1.00 0.00 H new ATOM 0 HB3 GLN A 16 14.263 5.992 7.736 1.00 0.00 H new ATOM 0 HG2 GLN A 16 12.024 7.864 8.648 1.00 0.00 H new ATOM 0 HG3 GLN A 16 12.641 6.577 9.666 1.00 0.00 H new ATOM 0 HE21 GLN A 16 13.022 9.094 10.686 1.00 0.00 H new ATOM 0 HE22 GLN A 16 14.701 9.607 10.495 1.00 0.00 H new ATOM 275 N TYR A 17 13.349 5.826 4.503 1.00 0.00 N ATOM 276 CA TYR A 17 14.018 5.134 3.361 1.00 0.00 C ATOM 277 C TYR A 17 13.911 6.020 2.126 1.00 0.00 C ATOM 278 O TYR A 17 14.902 6.369 1.516 1.00 0.00 O ATOM 279 CB TYR A 17 13.346 3.774 3.116 1.00 0.00 C ATOM 280 CG TYR A 17 13.909 2.761 4.091 1.00 0.00 C ATOM 281 CD1 TYR A 17 13.473 2.752 5.421 1.00 0.00 C ATOM 282 CD2 TYR A 17 14.881 1.845 3.667 1.00 0.00 C ATOM 283 CE1 TYR A 17 14.007 1.827 6.328 1.00 0.00 C ATOM 284 CE2 TYR A 17 15.413 0.919 4.573 1.00 0.00 C ATOM 285 CZ TYR A 17 14.977 0.912 5.903 1.00 0.00 C ATOM 286 OH TYR A 17 15.506 0.003 6.797 1.00 0.00 O ATOM 0 H TYR A 17 12.370 5.580 4.649 1.00 0.00 H new ATOM 0 HA TYR A 17 15.070 4.958 3.587 1.00 0.00 H new ATOM 0 HB2 TYR A 17 12.267 3.859 3.243 1.00 0.00 H new ATOM 0 HB3 TYR A 17 13.521 3.447 2.091 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.725 3.458 5.748 1.00 0.00 H new ATOM 0 HD2 TYR A 17 15.220 1.853 2.642 1.00 0.00 H new ATOM 0 HE1 TYR A 17 13.670 1.820 7.354 1.00 0.00 H new ATOM 0 HE2 TYR A 17 16.159 0.211 4.246 1.00 0.00 H new ATOM 0 HH TYR A 17 15.051 -0.859 6.695 1.00 0.00 H new ATOM 296 N SER A 18 12.727 6.414 1.766 1.00 0.00 N ATOM 297 CA SER A 18 12.582 7.305 0.590 1.00 0.00 C ATOM 298 C SER A 18 13.452 8.539 0.819 1.00 0.00 C ATOM 299 O SER A 18 13.833 9.231 -0.104 1.00 0.00 O ATOM 300 CB SER A 18 11.121 7.723 0.452 1.00 0.00 C ATOM 301 OG SER A 18 10.849 8.781 1.361 1.00 0.00 O ATOM 0 H SER A 18 11.857 6.159 2.233 1.00 0.00 H new ATOM 0 HA SER A 18 12.892 6.792 -0.320 1.00 0.00 H new ATOM 0 HB2 SER A 18 10.917 8.044 -0.570 1.00 0.00 H new ATOM 0 HB3 SER A 18 10.467 6.875 0.656 1.00 0.00 H new ATOM 0 HG SER A 18 10.244 8.462 2.063 1.00 0.00 H new ATOM 307 N GLY A 19 13.765 8.813 2.059 1.00 0.00 N ATOM 308 CA GLY A 19 14.611 10.000 2.394 1.00 0.00 C ATOM 309 C GLY A 19 16.065 9.563 2.615 1.00 0.00 C ATOM 310 O GLY A 19 16.919 10.371 2.918 1.00 0.00 O ATOM 0 H GLY A 19 13.468 8.260 2.863 1.00 0.00 H new ATOM 0 HA2 GLY A 19 14.561 10.732 1.588 1.00 0.00 H new ATOM 0 HA3 GLY A 19 14.229 10.488 3.291 1.00 0.00 H new ATOM 314 N ARG A 20 16.362 8.299 2.455 1.00 0.00 N ATOM 315 CA ARG A 20 17.768 7.835 2.645 1.00 0.00 C ATOM 316 C ARG A 20 18.648 8.428 1.544 1.00 0.00 C ATOM 317 O ARG A 20 19.714 8.950 1.801 1.00 0.00 O ATOM 318 CB ARG A 20 17.810 6.304 2.562 1.00 0.00 C ATOM 319 CG ARG A 20 19.240 5.791 2.778 1.00 0.00 C ATOM 320 CD ARG A 20 19.272 4.283 2.536 1.00 0.00 C ATOM 321 NE ARG A 20 18.322 3.609 3.466 1.00 0.00 N ATOM 322 CZ ARG A 20 18.660 3.397 4.709 1.00 0.00 C ATOM 323 NH1 ARG A 20 19.837 3.767 5.139 1.00 0.00 N ATOM 324 NH2 ARG A 20 17.823 2.815 5.522 1.00 0.00 N ATOM 0 H ARG A 20 15.694 7.571 2.202 1.00 0.00 H new ATOM 0 HA ARG A 20 18.134 8.159 3.619 1.00 0.00 H new ATOM 0 HB2 ARG A 20 17.147 5.875 3.313 1.00 0.00 H new ATOM 0 HB3 ARG A 20 17.443 5.977 1.589 1.00 0.00 H new ATOM 0 HG2 ARG A 20 19.927 6.295 2.099 1.00 0.00 H new ATOM 0 HG3 ARG A 20 19.571 6.016 3.792 1.00 0.00 H new ATOM 0 HD2 ARG A 20 19.003 4.064 1.503 1.00 0.00 H new ATOM 0 HD3 ARG A 20 20.281 3.901 2.690 1.00 0.00 H new ATOM 0 HE ARG A 20 17.406 3.313 3.130 1.00 0.00 H new ATOM 0 HH11 ARG A 20 20.492 4.222 4.503 1.00 0.00 H new ATOM 0 HH12 ARG A 20 20.100 3.601 6.110 1.00 0.00 H new ATOM 0 HH21 ARG A 20 16.904 2.525 5.187 1.00 0.00 H new ATOM 0 HH22 ARG A 20 18.087 2.649 6.493 1.00 0.00 H new ATOM 338 N GLU A 21 18.206 8.352 0.319 1.00 0.00 N ATOM 339 CA GLU A 21 19.013 8.911 -0.803 1.00 0.00 C ATOM 340 C GLU A 21 18.082 9.291 -1.959 1.00 0.00 C ATOM 341 O GLU A 21 17.032 8.707 -2.141 1.00 0.00 O ATOM 342 CB GLU A 21 20.027 7.859 -1.273 1.00 0.00 C ATOM 343 CG GLU A 21 19.388 6.468 -1.213 1.00 0.00 C ATOM 344 CD GLU A 21 20.223 5.484 -2.037 1.00 0.00 C ATOM 345 OE1 GLU A 21 20.241 5.622 -3.249 1.00 0.00 O ATOM 346 OE2 GLU A 21 20.832 4.611 -1.441 1.00 0.00 O ATOM 0 H GLU A 21 17.320 7.927 0.046 1.00 0.00 H new ATOM 0 HA GLU A 21 19.547 9.799 -0.466 1.00 0.00 H new ATOM 0 HB2 GLU A 21 20.349 8.079 -2.291 1.00 0.00 H new ATOM 0 HB3 GLU A 21 20.916 7.889 -0.643 1.00 0.00 H new ATOM 0 HG2 GLU A 21 19.325 6.130 -0.179 1.00 0.00 H new ATOM 0 HG3 GLU A 21 18.369 6.508 -1.598 1.00 0.00 H new ATOM 353 N GLY A 22 18.463 10.271 -2.742 1.00 0.00 N ATOM 354 CA GLY A 22 17.609 10.699 -3.894 1.00 0.00 C ATOM 355 C GLY A 22 16.821 11.950 -3.516 1.00 0.00 C ATOM 356 O GLY A 22 17.165 12.660 -2.592 1.00 0.00 O ATOM 0 H GLY A 22 19.332 10.794 -2.632 1.00 0.00 H new ATOM 0 HA2 GLY A 22 18.232 10.900 -4.766 1.00 0.00 H new ATOM 0 HA3 GLY A 22 16.925 9.896 -4.169 1.00 0.00 H new ATOM 360 N ASP A 23 15.759 12.221 -4.224 1.00 0.00 N ATOM 361 CA ASP A 23 14.939 13.422 -3.909 1.00 0.00 C ATOM 362 C ASP A 23 14.634 13.441 -2.412 1.00 0.00 C ATOM 363 O ASP A 23 15.414 13.932 -1.620 1.00 0.00 O ATOM 364 CB ASP A 23 13.629 13.368 -4.699 1.00 0.00 C ATOM 365 CG ASP A 23 12.762 14.576 -4.337 1.00 0.00 C ATOM 366 OD1 ASP A 23 12.314 14.641 -3.204 1.00 0.00 O ATOM 367 OD2 ASP A 23 12.561 15.415 -5.200 1.00 0.00 O ATOM 0 H ASP A 23 15.424 11.661 -5.008 1.00 0.00 H new ATOM 0 HA ASP A 23 15.487 14.324 -4.183 1.00 0.00 H new ATOM 0 HB2 ASP A 23 13.837 13.365 -5.769 1.00 0.00 H new ATOM 0 HB3 ASP A 23 13.095 12.444 -4.475 1.00 0.00 H new ATOM 372 N LYS A 24 13.511 12.906 -2.017 1.00 0.00 N ATOM 373 CA LYS A 24 13.167 12.899 -0.569 1.00 0.00 C ATOM 374 C LYS A 24 11.913 12.048 -0.337 1.00 0.00 C ATOM 375 O LYS A 24 11.536 11.784 0.788 1.00 0.00 O ATOM 376 CB LYS A 24 12.901 14.342 -0.111 1.00 0.00 C ATOM 377 CG LYS A 24 12.963 14.445 1.423 1.00 0.00 C ATOM 378 CD LYS A 24 14.420 14.378 1.919 1.00 0.00 C ATOM 379 CE LYS A 24 14.522 15.023 3.304 1.00 0.00 C ATOM 380 NZ LYS A 24 14.287 16.490 3.185 1.00 0.00 N ATOM 0 H LYS A 24 12.820 12.476 -2.632 1.00 0.00 H new ATOM 0 HA LYS A 24 13.994 12.476 0.001 1.00 0.00 H new ATOM 0 HB2 LYS A 24 13.637 15.012 -0.556 1.00 0.00 H new ATOM 0 HB3 LYS A 24 11.922 14.666 -0.463 1.00 0.00 H new ATOM 0 HG2 LYS A 24 12.507 15.380 1.748 1.00 0.00 H new ATOM 0 HG3 LYS A 24 12.385 13.636 1.870 1.00 0.00 H new ATOM 0 HD2 LYS A 24 14.752 13.341 1.965 1.00 0.00 H new ATOM 0 HD3 LYS A 24 15.077 14.892 1.218 1.00 0.00 H new ATOM 0 HE2 LYS A 24 13.790 14.580 3.979 1.00 0.00 H new ATOM 0 HE3 LYS A 24 15.506 14.835 3.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 14.819 16.988 3.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 14.605 16.818 2.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 13.272 16.689 3.295 1.00 0.00 H new ATOM 394 N HIS A 25 11.243 11.624 -1.385 1.00 0.00 N ATOM 395 CA HIS A 25 10.001 10.811 -1.188 1.00 0.00 C ATOM 396 C HIS A 25 9.879 9.718 -2.252 1.00 0.00 C ATOM 397 O HIS A 25 8.789 9.368 -2.660 1.00 0.00 O ATOM 398 CB HIS A 25 8.785 11.742 -1.251 1.00 0.00 C ATOM 399 CG HIS A 25 9.121 13.042 -0.572 1.00 0.00 C ATOM 400 ND1 HIS A 25 9.498 13.107 0.763 1.00 0.00 N ATOM 401 CD2 HIS A 25 9.149 14.336 -1.033 1.00 0.00 C ATOM 402 CE1 HIS A 25 9.737 14.399 1.056 1.00 0.00 C ATOM 403 NE2 HIS A 25 9.539 15.186 -0.003 1.00 0.00 N ATOM 0 H HIS A 25 11.499 11.804 -2.356 1.00 0.00 H new ATOM 0 HA HIS A 25 10.050 10.322 -0.215 1.00 0.00 H new ATOM 0 HB2 HIS A 25 8.503 11.922 -2.288 1.00 0.00 H new ATOM 0 HB3 HIS A 25 7.929 11.275 -0.765 1.00 0.00 H new ATOM 0 HD2 HIS A 25 8.906 14.645 -2.039 1.00 0.00 H new ATOM 0 HE1 HIS A 25 10.050 14.754 2.027 1.00 0.00 H new ATOM 0 HE2 HIS A 25 9.650 16.199 -0.048 1.00 0.00 H new ATOM 411 N LYS A 26 10.974 9.147 -2.681 1.00 0.00 N ATOM 412 CA LYS A 26 10.915 8.044 -3.686 1.00 0.00 C ATOM 413 C LYS A 26 11.879 6.956 -3.227 1.00 0.00 C ATOM 414 O LYS A 26 12.900 7.237 -2.631 1.00 0.00 O ATOM 415 CB LYS A 26 11.334 8.564 -5.062 1.00 0.00 C ATOM 416 CG LYS A 26 10.216 9.440 -5.638 1.00 0.00 C ATOM 417 CD LYS A 26 10.758 10.276 -6.801 1.00 0.00 C ATOM 418 CE LYS A 26 11.446 9.364 -7.818 1.00 0.00 C ATOM 419 NZ LYS A 26 10.592 8.171 -8.079 1.00 0.00 N ATOM 0 H LYS A 26 11.914 9.399 -2.376 1.00 0.00 H new ATOM 0 HA LYS A 26 9.901 7.653 -3.766 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.256 9.139 -4.980 1.00 0.00 H new ATOM 0 HB3 LYS A 26 11.538 7.729 -5.732 1.00 0.00 H new ATOM 0 HG2 LYS A 26 9.392 8.815 -5.981 1.00 0.00 H new ATOM 0 HG3 LYS A 26 9.818 10.094 -4.862 1.00 0.00 H new ATOM 0 HD2 LYS A 26 9.944 10.821 -7.279 1.00 0.00 H new ATOM 0 HD3 LYS A 26 11.464 11.019 -6.429 1.00 0.00 H new ATOM 0 HE2 LYS A 26 11.623 9.907 -8.746 1.00 0.00 H new ATOM 0 HE3 LYS A 26 12.420 9.051 -7.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 10.711 7.868 -9.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 10.873 7.397 -7.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 9.595 8.414 -7.909 1.00 0.00 H new ATOM 433 N LEU A 27 11.560 5.715 -3.480 1.00 0.00 N ATOM 434 CA LEU A 27 12.462 4.608 -3.033 1.00 0.00 C ATOM 435 C LEU A 27 13.411 4.199 -4.164 1.00 0.00 C ATOM 436 O LEU A 27 13.036 4.066 -5.313 1.00 0.00 O ATOM 437 CB LEU A 27 11.627 3.378 -2.604 1.00 0.00 C ATOM 438 CG LEU A 27 11.214 3.465 -1.108 1.00 0.00 C ATOM 439 CD1 LEU A 27 9.900 4.238 -0.962 1.00 0.00 C ATOM 440 CD2 LEU A 27 11.038 2.052 -0.551 1.00 0.00 C ATOM 0 H LEU A 27 10.719 5.418 -3.974 1.00 0.00 H new ATOM 0 HA LEU A 27 13.046 4.967 -2.185 1.00 0.00 H new ATOM 0 HB2 LEU A 27 10.734 3.308 -3.226 1.00 0.00 H new ATOM 0 HB3 LEU A 27 12.204 2.469 -2.771 1.00 0.00 H new ATOM 0 HG LEU A 27 11.993 3.989 -0.554 1.00 0.00 H new ATOM 0 HD11 LEU A 27 9.624 4.290 0.091 1.00 0.00 H new ATOM 0 HD12 LEU A 27 10.026 5.247 -1.355 1.00 0.00 H new ATOM 0 HD13 LEU A 27 9.114 3.727 -1.518 1.00 0.00 H new ATOM 0 HD21 LEU A 27 10.748 2.108 0.498 1.00 0.00 H new ATOM 0 HD22 LEU A 27 10.263 1.533 -1.114 1.00 0.00 H new ATOM 0 HD23 LEU A 27 11.978 1.506 -0.639 1.00 0.00 H new ATOM 452 N LYS A 28 14.637 3.968 -3.799 1.00 0.00 N ATOM 453 CA LYS A 28 15.680 3.521 -4.775 1.00 0.00 C ATOM 454 C LYS A 28 16.013 2.057 -4.493 1.00 0.00 C ATOM 455 O LYS A 28 15.810 1.580 -3.397 1.00 0.00 O ATOM 456 CB LYS A 28 16.944 4.359 -4.593 1.00 0.00 C ATOM 457 CG LYS A 28 16.700 5.775 -5.109 1.00 0.00 C ATOM 458 CD LYS A 28 17.985 6.594 -4.961 1.00 0.00 C ATOM 459 CE LYS A 28 17.863 7.906 -5.743 1.00 0.00 C ATOM 460 NZ LYS A 28 18.280 7.683 -7.156 1.00 0.00 N ATOM 0 H LYS A 28 14.974 4.071 -2.842 1.00 0.00 H new ATOM 0 HA LYS A 28 15.309 3.639 -5.793 1.00 0.00 H new ATOM 0 HB2 LYS A 28 17.224 4.388 -3.540 1.00 0.00 H new ATOM 0 HB3 LYS A 28 17.775 3.903 -5.131 1.00 0.00 H new ATOM 0 HG2 LYS A 28 16.392 5.746 -6.154 1.00 0.00 H new ATOM 0 HG3 LYS A 28 15.890 6.244 -4.551 1.00 0.00 H new ATOM 0 HD2 LYS A 28 18.173 6.805 -3.908 1.00 0.00 H new ATOM 0 HD3 LYS A 28 18.836 6.020 -5.328 1.00 0.00 H new ATOM 0 HE2 LYS A 28 16.835 8.268 -5.709 1.00 0.00 H new ATOM 0 HE3 LYS A 28 18.487 8.674 -5.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 18.197 8.573 -7.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 19.267 7.356 -7.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 17.667 6.963 -7.589 1.00 0.00 H new ATOM 474 N LYS A 29 16.521 1.333 -5.461 1.00 0.00 N ATOM 475 CA LYS A 29 16.864 -0.103 -5.215 1.00 0.00 C ATOM 476 C LYS A 29 17.596 -0.224 -3.873 1.00 0.00 C ATOM 477 O LYS A 29 17.254 -1.039 -3.038 1.00 0.00 O ATOM 478 CB LYS A 29 17.781 -0.617 -6.332 1.00 0.00 C ATOM 479 CG LYS A 29 16.988 -0.785 -7.634 1.00 0.00 C ATOM 480 CD LYS A 29 17.787 -1.651 -8.614 1.00 0.00 C ATOM 481 CE LYS A 29 19.113 -0.964 -8.947 1.00 0.00 C ATOM 482 NZ LYS A 29 19.710 -1.599 -10.156 1.00 0.00 N ATOM 0 H LYS A 29 16.712 1.671 -6.404 1.00 0.00 H new ATOM 0 HA LYS A 29 15.948 -0.694 -5.196 1.00 0.00 H new ATOM 0 HB2 LYS A 29 18.604 0.081 -6.487 1.00 0.00 H new ATOM 0 HB3 LYS A 29 18.222 -1.570 -6.041 1.00 0.00 H new ATOM 0 HG2 LYS A 29 16.023 -1.248 -7.427 1.00 0.00 H new ATOM 0 HG3 LYS A 29 16.785 0.190 -8.077 1.00 0.00 H new ATOM 0 HD2 LYS A 29 17.974 -2.632 -8.178 1.00 0.00 H new ATOM 0 HD3 LYS A 29 17.211 -1.812 -9.525 1.00 0.00 H new ATOM 0 HE2 LYS A 29 18.950 0.099 -9.124 1.00 0.00 H new ATOM 0 HE3 LYS A 29 19.799 -1.045 -8.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 20.611 -1.133 -10.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 19.879 -2.608 -9.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 19.057 -1.499 -10.959 1.00 0.00 H new ATOM 496 N SER A 30 18.592 0.590 -3.661 1.00 0.00 N ATOM 497 CA SER A 30 19.342 0.538 -2.373 1.00 0.00 C ATOM 498 C SER A 30 18.344 0.566 -1.212 1.00 0.00 C ATOM 499 O SER A 30 18.673 0.242 -0.096 1.00 0.00 O ATOM 500 CB SER A 30 20.280 1.748 -2.281 1.00 0.00 C ATOM 501 OG SER A 30 19.649 2.876 -2.872 1.00 0.00 O ATOM 0 H SER A 30 18.921 1.291 -4.325 1.00 0.00 H new ATOM 0 HA SER A 30 19.932 -0.377 -2.324 1.00 0.00 H new ATOM 0 HB2 SER A 30 20.522 1.957 -1.239 1.00 0.00 H new ATOM 0 HB3 SER A 30 21.220 1.534 -2.790 1.00 0.00 H new ATOM 0 HG SER A 30 18.904 3.167 -2.306 1.00 0.00 H new ATOM 507 N GLU A 31 17.120 0.940 -1.478 1.00 0.00 N ATOM 508 CA GLU A 31 16.079 0.979 -0.400 1.00 0.00 C ATOM 509 C GLU A 31 15.183 -0.251 -0.512 1.00 0.00 C ATOM 510 O GLU A 31 14.898 -0.918 0.457 1.00 0.00 O ATOM 511 CB GLU A 31 15.227 2.242 -0.549 1.00 0.00 C ATOM 512 CG GLU A 31 16.140 3.468 -0.614 1.00 0.00 C ATOM 513 CD GLU A 31 15.287 4.730 -0.760 1.00 0.00 C ATOM 514 OE1 GLU A 31 14.225 4.775 -0.161 1.00 0.00 O ATOM 515 OE2 GLU A 31 15.709 5.628 -1.469 1.00 0.00 O ATOM 0 H GLU A 31 16.791 1.223 -2.401 1.00 0.00 H new ATOM 0 HA GLU A 31 16.570 0.987 0.573 1.00 0.00 H new ATOM 0 HB2 GLU A 31 14.619 2.179 -1.452 1.00 0.00 H new ATOM 0 HB3 GLU A 31 14.540 2.331 0.292 1.00 0.00 H new ATOM 0 HG2 GLU A 31 16.749 3.530 0.288 1.00 0.00 H new ATOM 0 HG3 GLU A 31 16.826 3.380 -1.456 1.00 0.00 H new ATOM 522 N LEU A 32 14.726 -0.543 -1.689 1.00 0.00 N ATOM 523 CA LEU A 32 13.833 -1.707 -1.882 1.00 0.00 C ATOM 524 C LEU A 32 14.568 -2.997 -1.523 1.00 0.00 C ATOM 525 O LEU A 32 13.996 -3.898 -0.949 1.00 0.00 O ATOM 526 CB LEU A 32 13.358 -1.684 -3.340 1.00 0.00 C ATOM 527 CG LEU A 32 12.543 -2.926 -3.696 1.00 0.00 C ATOM 528 CD1 LEU A 32 11.242 -2.977 -2.902 1.00 0.00 C ATOM 529 CD2 LEU A 32 12.204 -2.874 -5.189 1.00 0.00 C ATOM 0 H LEU A 32 14.936 -0.017 -2.537 1.00 0.00 H new ATOM 0 HA LEU A 32 12.964 -1.659 -1.226 1.00 0.00 H new ATOM 0 HB2 LEU A 32 12.754 -0.793 -3.510 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.222 -1.615 -4.002 1.00 0.00 H new ATOM 0 HG LEU A 32 13.132 -3.811 -3.456 1.00 0.00 H new ATOM 0 HD11 LEU A 32 10.683 -3.872 -3.176 1.00 0.00 H new ATOM 0 HD12 LEU A 32 11.467 -3.003 -1.836 1.00 0.00 H new ATOM 0 HD13 LEU A 32 10.644 -2.093 -3.125 1.00 0.00 H new ATOM 0 HD21 LEU A 32 11.622 -3.754 -5.461 1.00 0.00 H new ATOM 0 HD22 LEU A 32 11.623 -1.976 -5.399 1.00 0.00 H new ATOM 0 HD23 LEU A 32 13.125 -2.855 -5.771 1.00 0.00 H new ATOM 541 N LYS A 33 15.828 -3.094 -1.815 1.00 0.00 N ATOM 542 CA LYS A 33 16.569 -4.328 -1.435 1.00 0.00 C ATOM 543 C LYS A 33 16.993 -4.198 0.032 1.00 0.00 C ATOM 544 O LYS A 33 17.013 -5.158 0.774 1.00 0.00 O ATOM 545 CB LYS A 33 17.801 -4.486 -2.343 1.00 0.00 C ATOM 546 CG LYS A 33 18.687 -5.665 -1.863 1.00 0.00 C ATOM 547 CD LYS A 33 19.870 -5.142 -1.030 1.00 0.00 C ATOM 548 CE LYS A 33 21.014 -4.713 -1.953 1.00 0.00 C ATOM 549 NZ LYS A 33 21.672 -5.923 -2.520 1.00 0.00 N ATOM 0 H LYS A 33 16.377 -2.381 -2.296 1.00 0.00 H new ATOM 0 HA LYS A 33 15.939 -5.209 -1.556 1.00 0.00 H new ATOM 0 HB2 LYS A 33 17.482 -4.659 -3.371 1.00 0.00 H new ATOM 0 HB3 LYS A 33 18.382 -3.564 -2.341 1.00 0.00 H new ATOM 0 HG2 LYS A 33 18.092 -6.356 -1.267 1.00 0.00 H new ATOM 0 HG3 LYS A 33 19.058 -6.223 -2.723 1.00 0.00 H new ATOM 0 HD2 LYS A 33 19.550 -4.298 -0.419 1.00 0.00 H new ATOM 0 HD3 LYS A 33 20.215 -5.918 -0.347 1.00 0.00 H new ATOM 0 HE2 LYS A 33 20.631 -4.083 -2.756 1.00 0.00 H new ATOM 0 HE3 LYS A 33 21.739 -4.117 -1.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 22.648 -5.691 -2.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 21.685 -6.678 -1.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 21.144 -6.246 -3.356 1.00 0.00 H new ATOM 563 N GLU A 34 17.350 -3.009 0.442 1.00 0.00 N ATOM 564 CA GLU A 34 17.797 -2.816 1.861 1.00 0.00 C ATOM 565 C GLU A 34 16.588 -2.794 2.791 1.00 0.00 C ATOM 566 O GLU A 34 16.662 -3.210 3.931 1.00 0.00 O ATOM 567 CB GLU A 34 18.565 -1.504 2.004 1.00 0.00 C ATOM 568 CG GLU A 34 19.169 -1.419 3.408 1.00 0.00 C ATOM 569 CD GLU A 34 20.137 -0.235 3.477 1.00 0.00 C ATOM 570 OE1 GLU A 34 20.026 0.644 2.638 1.00 0.00 O ATOM 571 OE2 GLU A 34 20.969 -0.226 4.368 1.00 0.00 O ATOM 0 H GLU A 34 17.353 -2.168 -0.135 1.00 0.00 H new ATOM 0 HA GLU A 34 18.451 -3.645 2.131 1.00 0.00 H new ATOM 0 HB2 GLU A 34 19.353 -1.447 1.253 1.00 0.00 H new ATOM 0 HB3 GLU A 34 17.899 -0.659 1.831 1.00 0.00 H new ATOM 0 HG2 GLU A 34 18.378 -1.300 4.149 1.00 0.00 H new ATOM 0 HG3 GLU A 34 19.693 -2.345 3.647 1.00 0.00 H new ATOM 578 N LEU A 35 15.470 -2.330 2.313 1.00 0.00 N ATOM 579 CA LEU A 35 14.253 -2.301 3.165 1.00 0.00 C ATOM 580 C LEU A 35 13.760 -3.738 3.336 1.00 0.00 C ATOM 581 O LEU A 35 13.183 -4.096 4.342 1.00 0.00 O ATOM 582 CB LEU A 35 13.180 -1.441 2.477 1.00 0.00 C ATOM 583 CG LEU A 35 11.910 -1.343 3.351 1.00 0.00 C ATOM 584 CD1 LEU A 35 12.080 -0.250 4.410 1.00 0.00 C ATOM 585 CD2 LEU A 35 10.707 -0.997 2.466 1.00 0.00 C ATOM 0 H LEU A 35 15.347 -1.969 1.367 1.00 0.00 H new ATOM 0 HA LEU A 35 14.469 -1.871 4.143 1.00 0.00 H new ATOM 0 HB2 LEU A 35 13.574 -0.443 2.288 1.00 0.00 H new ATOM 0 HB3 LEU A 35 12.928 -1.873 1.509 1.00 0.00 H new ATOM 0 HG LEU A 35 11.748 -2.301 3.845 1.00 0.00 H new ATOM 0 HD11 LEU A 35 11.178 -0.191 5.020 1.00 0.00 H new ATOM 0 HD12 LEU A 35 12.933 -0.489 5.046 1.00 0.00 H new ATOM 0 HD13 LEU A 35 12.250 0.708 3.920 1.00 0.00 H new ATOM 0 HD21 LEU A 35 9.810 -0.928 3.082 1.00 0.00 H new ATOM 0 HD22 LEU A 35 10.882 -0.042 1.971 1.00 0.00 H new ATOM 0 HD23 LEU A 35 10.572 -1.775 1.715 1.00 0.00 H new ATOM 597 N ILE A 36 13.993 -4.567 2.360 1.00 0.00 N ATOM 598 CA ILE A 36 13.547 -5.981 2.461 1.00 0.00 C ATOM 599 C ILE A 36 14.492 -6.748 3.392 1.00 0.00 C ATOM 600 O ILE A 36 14.066 -7.575 4.174 1.00 0.00 O ATOM 601 CB ILE A 36 13.545 -6.606 1.063 1.00 0.00 C ATOM 602 CG1 ILE A 36 12.389 -6.008 0.254 1.00 0.00 C ATOM 603 CG2 ILE A 36 13.346 -8.116 1.169 1.00 0.00 C ATOM 604 CD1 ILE A 36 12.547 -6.369 -1.226 1.00 0.00 C ATOM 0 H ILE A 36 14.475 -4.325 1.494 1.00 0.00 H new ATOM 0 HA ILE A 36 12.539 -6.028 2.872 1.00 0.00 H new ATOM 0 HB ILE A 36 14.497 -6.401 0.573 1.00 0.00 H new ATOM 0 HG12 ILE A 36 11.438 -6.385 0.630 1.00 0.00 H new ATOM 0 HG13 ILE A 36 12.372 -4.925 0.373 1.00 0.00 H new ATOM 0 HG21 ILE A 36 13.346 -8.554 0.171 1.00 0.00 H new ATOM 0 HG22 ILE A 36 14.156 -8.550 1.755 1.00 0.00 H new ATOM 0 HG23 ILE A 36 12.394 -8.324 1.657 1.00 0.00 H new ATOM 0 HD11 ILE A 36 11.722 -5.941 -1.795 1.00 0.00 H new ATOM 0 HD12 ILE A 36 13.490 -5.970 -1.599 1.00 0.00 H new ATOM 0 HD13 ILE A 36 12.541 -7.453 -1.339 1.00 0.00 H new ATOM 616 N ASN A 37 15.769 -6.482 3.321 1.00 0.00 N ATOM 617 CA ASN A 37 16.732 -7.200 4.211 1.00 0.00 C ATOM 618 C ASN A 37 16.783 -6.536 5.594 1.00 0.00 C ATOM 619 O ASN A 37 17.168 -7.149 6.569 1.00 0.00 O ATOM 620 CB ASN A 37 18.128 -7.172 3.582 1.00 0.00 C ATOM 621 CG ASN A 37 19.011 -8.227 4.252 1.00 0.00 C ATOM 622 OD1 ASN A 37 19.595 -9.060 3.585 1.00 0.00 O ATOM 623 ND2 ASN A 37 19.132 -8.229 5.552 1.00 0.00 N ATOM 0 H ASN A 37 16.188 -5.801 2.688 1.00 0.00 H new ATOM 0 HA ASN A 37 16.399 -8.231 4.327 1.00 0.00 H new ATOM 0 HB2 ASN A 37 18.060 -7.366 2.512 1.00 0.00 H new ATOM 0 HB3 ASN A 37 18.572 -6.183 3.699 1.00 0.00 H new ATOM 0 HD21 ASN A 37 19.716 -8.929 6.009 1.00 0.00 H new ATOM 0 HD22 ASN A 37 18.642 -7.530 6.111 1.00 0.00 H new ATOM 630 N ASN A 38 16.441 -5.275 5.684 1.00 0.00 N ATOM 631 CA ASN A 38 16.515 -4.572 7.010 1.00 0.00 C ATOM 632 C ASN A 38 15.154 -4.580 7.718 1.00 0.00 C ATOM 633 O ASN A 38 15.075 -4.821 8.907 1.00 0.00 O ATOM 634 CB ASN A 38 16.949 -3.122 6.783 1.00 0.00 C ATOM 635 CG ASN A 38 18.314 -3.100 6.089 1.00 0.00 C ATOM 636 OD1 ASN A 38 18.584 -3.913 5.227 1.00 0.00 O ATOM 637 ND2 ASN A 38 19.193 -2.197 6.432 1.00 0.00 N ATOM 0 H ASN A 38 16.116 -4.702 4.905 1.00 0.00 H new ATOM 0 HA ASN A 38 17.236 -5.096 7.638 1.00 0.00 H new ATOM 0 HB2 ASN A 38 16.211 -2.601 6.173 1.00 0.00 H new ATOM 0 HB3 ASN A 38 17.005 -2.595 7.735 1.00 0.00 H new ATOM 0 HD21 ASN A 38 20.105 -2.174 5.976 1.00 0.00 H new ATOM 0 HD22 ASN A 38 18.967 -1.514 7.155 1.00 0.00 H new ATOM 644 N GLU A 39 14.088 -4.306 7.012 1.00 0.00 N ATOM 645 CA GLU A 39 12.735 -4.279 7.664 1.00 0.00 C ATOM 646 C GLU A 39 11.997 -5.599 7.400 1.00 0.00 C ATOM 647 O GLU A 39 11.785 -6.389 8.298 1.00 0.00 O ATOM 648 CB GLU A 39 11.933 -3.089 7.091 1.00 0.00 C ATOM 649 CG GLU A 39 12.082 -1.853 7.995 1.00 0.00 C ATOM 650 CD GLU A 39 13.557 -1.636 8.342 1.00 0.00 C ATOM 651 OE1 GLU A 39 14.394 -1.957 7.513 1.00 0.00 O ATOM 652 OE2 GLU A 39 13.825 -1.156 9.432 1.00 0.00 O ATOM 0 H GLU A 39 14.091 -4.099 6.013 1.00 0.00 H new ATOM 0 HA GLU A 39 12.844 -4.160 8.742 1.00 0.00 H new ATOM 0 HB2 GLU A 39 12.285 -2.856 6.086 1.00 0.00 H new ATOM 0 HB3 GLU A 39 10.881 -3.360 7.006 1.00 0.00 H new ATOM 0 HG2 GLU A 39 11.685 -0.972 7.490 1.00 0.00 H new ATOM 0 HG3 GLU A 39 11.501 -1.987 8.907 1.00 0.00 H new ATOM 659 N LEU A 40 11.594 -5.840 6.183 1.00 0.00 N ATOM 660 CA LEU A 40 10.861 -7.106 5.888 1.00 0.00 C ATOM 661 C LEU A 40 11.850 -8.280 5.899 1.00 0.00 C ATOM 662 O LEU A 40 11.757 -9.178 5.092 1.00 0.00 O ATOM 663 CB LEU A 40 10.172 -7.017 4.506 1.00 0.00 C ATOM 664 CG LEU A 40 9.808 -5.566 4.158 1.00 0.00 C ATOM 665 CD1 LEU A 40 9.092 -5.546 2.807 1.00 0.00 C ATOM 666 CD2 LEU A 40 8.876 -4.975 5.223 1.00 0.00 C ATOM 0 H LEU A 40 11.738 -5.221 5.385 1.00 0.00 H new ATOM 0 HA LEU A 40 10.097 -7.262 6.650 1.00 0.00 H new ATOM 0 HB2 LEU A 40 10.834 -7.422 3.740 1.00 0.00 H new ATOM 0 HB3 LEU A 40 9.271 -7.631 4.506 1.00 0.00 H new ATOM 0 HG LEU A 40 10.721 -4.972 4.117 1.00 0.00 H new ATOM 0 HD11 LEU A 40 8.829 -4.520 2.550 1.00 0.00 H new ATOM 0 HD12 LEU A 40 9.750 -5.955 2.040 1.00 0.00 H new ATOM 0 HD13 LEU A 40 8.186 -6.149 2.866 1.00 0.00 H new ATOM 0 HD21 LEU A 40 8.629 -3.947 4.960 1.00 0.00 H new ATOM 0 HD22 LEU A 40 7.962 -5.566 5.275 1.00 0.00 H new ATOM 0 HD23 LEU A 40 9.374 -4.992 6.192 1.00 0.00 H new ATOM 678 N SER A 41 12.799 -8.286 6.800 1.00 0.00 N ATOM 679 CA SER A 41 13.788 -9.410 6.840 1.00 0.00 C ATOM 680 C SER A 41 13.312 -10.498 7.810 1.00 0.00 C ATOM 681 O SER A 41 13.751 -11.630 7.743 1.00 0.00 O ATOM 682 CB SER A 41 15.149 -8.860 7.300 1.00 0.00 C ATOM 683 OG SER A 41 15.500 -9.417 8.563 1.00 0.00 O ATOM 0 H SER A 41 12.933 -7.565 7.508 1.00 0.00 H new ATOM 0 HA SER A 41 13.882 -9.848 5.846 1.00 0.00 H new ATOM 0 HB2 SER A 41 15.915 -9.100 6.563 1.00 0.00 H new ATOM 0 HB3 SER A 41 15.105 -7.773 7.372 1.00 0.00 H new ATOM 0 HG SER A 41 16.368 -9.062 8.847 1.00 0.00 H new ATOM 689 N HIS A 42 12.419 -10.177 8.708 1.00 0.00 N ATOM 690 CA HIS A 42 11.922 -11.206 9.669 1.00 0.00 C ATOM 691 C HIS A 42 10.677 -11.869 9.085 1.00 0.00 C ATOM 692 O HIS A 42 10.300 -12.957 9.471 1.00 0.00 O ATOM 693 CB HIS A 42 11.564 -10.537 10.999 1.00 0.00 C ATOM 694 CG HIS A 42 12.673 -9.608 11.408 1.00 0.00 C ATOM 695 ND1 HIS A 42 14.003 -10.004 11.425 1.00 0.00 N ATOM 696 CD2 HIS A 42 12.666 -8.299 11.822 1.00 0.00 C ATOM 697 CE1 HIS A 42 14.735 -8.951 11.836 1.00 0.00 C ATOM 698 NE2 HIS A 42 13.967 -7.891 12.090 1.00 0.00 N ATOM 0 H HIS A 42 12.012 -9.248 8.818 1.00 0.00 H new ATOM 0 HA HIS A 42 12.696 -11.954 9.839 1.00 0.00 H new ATOM 0 HB2 HIS A 42 10.630 -9.984 10.900 1.00 0.00 H new ATOM 0 HB3 HIS A 42 11.407 -11.293 11.768 1.00 0.00 H new ATOM 0 HD2 HIS A 42 11.786 -7.682 11.924 1.00 0.00 H new ATOM 0 HE1 HIS A 42 15.809 -8.964 11.946 1.00 0.00 H new ATOM 0 HE2 HIS A 42 14.271 -6.973 12.413 1.00 0.00 H new ATOM 707 N PHE A 43 10.039 -11.211 8.147 1.00 0.00 N ATOM 708 CA PHE A 43 8.808 -11.777 7.509 1.00 0.00 C ATOM 709 C PHE A 43 9.147 -12.197 6.076 1.00 0.00 C ATOM 710 O PHE A 43 8.709 -13.228 5.607 1.00 0.00 O ATOM 711 CB PHE A 43 7.698 -10.691 7.519 1.00 0.00 C ATOM 712 CG PHE A 43 6.428 -11.228 8.154 1.00 0.00 C ATOM 713 CD1 PHE A 43 5.654 -12.175 7.474 1.00 0.00 C ATOM 714 CD2 PHE A 43 6.029 -10.780 9.421 1.00 0.00 C ATOM 715 CE1 PHE A 43 4.482 -12.673 8.057 1.00 0.00 C ATOM 716 CE2 PHE A 43 4.858 -11.277 10.004 1.00 0.00 C ATOM 717 CZ PHE A 43 4.085 -12.224 9.322 1.00 0.00 C ATOM 0 H PHE A 43 10.321 -10.297 7.793 1.00 0.00 H new ATOM 0 HA PHE A 43 8.451 -12.650 8.056 1.00 0.00 H new ATOM 0 HB2 PHE A 43 8.044 -9.816 8.069 1.00 0.00 H new ATOM 0 HB3 PHE A 43 7.491 -10.366 6.499 1.00 0.00 H new ATOM 0 HD1 PHE A 43 5.961 -12.522 6.498 1.00 0.00 H new ATOM 0 HD2 PHE A 43 6.626 -10.050 9.948 1.00 0.00 H new ATOM 0 HE1 PHE A 43 3.885 -13.403 7.531 1.00 0.00 H new ATOM 0 HE2 PHE A 43 4.551 -10.930 10.980 1.00 0.00 H new ATOM 0 HZ PHE A 43 3.182 -12.608 9.772 1.00 0.00 H new ATOM 727 N LEU A 44 9.934 -11.410 5.384 1.00 0.00 N ATOM 728 CA LEU A 44 10.317 -11.766 3.982 1.00 0.00 C ATOM 729 C LEU A 44 11.740 -12.334 3.997 1.00 0.00 C ATOM 730 O LEU A 44 12.611 -11.841 4.685 1.00 0.00 O ATOM 731 CB LEU A 44 10.244 -10.500 3.093 1.00 0.00 C ATOM 732 CG LEU A 44 9.749 -10.849 1.674 1.00 0.00 C ATOM 733 CD1 LEU A 44 8.296 -11.376 1.713 1.00 0.00 C ATOM 734 CD2 LEU A 44 9.821 -9.586 0.804 1.00 0.00 C ATOM 0 H LEU A 44 10.328 -10.535 5.730 1.00 0.00 H new ATOM 0 HA LEU A 44 9.635 -12.513 3.576 1.00 0.00 H new ATOM 0 HB2 LEU A 44 9.573 -9.771 3.547 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.228 -10.035 3.035 1.00 0.00 H new ATOM 0 HG LEU A 44 10.382 -11.632 1.256 1.00 0.00 H new ATOM 0 HD11 LEU A 44 7.969 -11.615 0.701 1.00 0.00 H new ATOM 0 HD12 LEU A 44 8.251 -12.273 2.331 1.00 0.00 H new ATOM 0 HD13 LEU A 44 7.643 -10.612 2.134 1.00 0.00 H new ATOM 0 HD21 LEU A 44 9.474 -9.818 -0.203 1.00 0.00 H new ATOM 0 HD22 LEU A 44 9.189 -8.810 1.236 1.00 0.00 H new ATOM 0 HD23 LEU A 44 10.851 -9.233 0.760 1.00 0.00 H new ATOM 746 N GLU A 45 11.976 -13.376 3.250 1.00 0.00 N ATOM 747 CA GLU A 45 13.338 -13.988 3.228 1.00 0.00 C ATOM 748 C GLU A 45 14.389 -12.892 3.036 1.00 0.00 C ATOM 749 O GLU A 45 14.259 -12.032 2.187 1.00 0.00 O ATOM 750 CB GLU A 45 13.428 -14.988 2.071 1.00 0.00 C ATOM 751 CG GLU A 45 12.650 -16.257 2.427 1.00 0.00 C ATOM 752 CD GLU A 45 12.602 -17.184 1.212 1.00 0.00 C ATOM 753 OE1 GLU A 45 13.600 -17.833 0.945 1.00 0.00 O ATOM 754 OE2 GLU A 45 11.566 -17.230 0.566 1.00 0.00 O ATOM 0 H GLU A 45 11.286 -13.832 2.653 1.00 0.00 H new ATOM 0 HA GLU A 45 13.519 -14.503 4.171 1.00 0.00 H new ATOM 0 HB2 GLU A 45 13.023 -14.544 1.161 1.00 0.00 H new ATOM 0 HB3 GLU A 45 14.471 -15.233 1.869 1.00 0.00 H new ATOM 0 HG2 GLU A 45 13.126 -16.764 3.266 1.00 0.00 H new ATOM 0 HG3 GLU A 45 11.639 -16.000 2.742 1.00 0.00 H new ATOM 761 N GLU A 46 15.428 -12.915 3.827 1.00 0.00 N ATOM 762 CA GLU A 46 16.488 -11.874 3.709 1.00 0.00 C ATOM 763 C GLU A 46 17.026 -11.839 2.277 1.00 0.00 C ATOM 764 O GLU A 46 18.026 -12.449 1.959 1.00 0.00 O ATOM 765 CB GLU A 46 17.629 -12.189 4.690 1.00 0.00 C ATOM 766 CG GLU A 46 18.195 -13.605 4.430 1.00 0.00 C ATOM 767 CD GLU A 46 18.700 -14.221 5.740 1.00 0.00 C ATOM 768 OE1 GLU A 46 17.888 -14.424 6.628 1.00 0.00 O ATOM 769 OE2 GLU A 46 19.889 -14.478 5.831 1.00 0.00 O ATOM 0 H GLU A 46 15.588 -13.613 4.553 1.00 0.00 H new ATOM 0 HA GLU A 46 16.064 -10.899 3.951 1.00 0.00 H new ATOM 0 HB2 GLU A 46 18.422 -11.449 4.583 1.00 0.00 H new ATOM 0 HB3 GLU A 46 17.264 -12.120 5.715 1.00 0.00 H new ATOM 0 HG2 GLU A 46 17.423 -14.239 3.995 1.00 0.00 H new ATOM 0 HG3 GLU A 46 19.009 -13.552 3.707 1.00 0.00 H new ATOM 776 N ILE A 47 16.374 -11.121 1.407 1.00 0.00 N ATOM 777 CA ILE A 47 16.858 -11.046 0.003 1.00 0.00 C ATOM 778 C ILE A 47 18.311 -10.550 0.012 1.00 0.00 C ATOM 779 O ILE A 47 18.615 -9.499 0.542 1.00 0.00 O ATOM 780 CB ILE A 47 15.940 -10.085 -0.792 1.00 0.00 C ATOM 781 CG1 ILE A 47 14.726 -10.874 -1.325 1.00 0.00 C ATOM 782 CG2 ILE A 47 16.699 -9.442 -1.963 1.00 0.00 C ATOM 783 CD1 ILE A 47 13.708 -9.943 -2.012 1.00 0.00 C ATOM 0 H ILE A 47 15.530 -10.585 1.607 1.00 0.00 H new ATOM 0 HA ILE A 47 16.827 -12.025 -0.476 1.00 0.00 H new ATOM 0 HB ILE A 47 15.605 -9.288 -0.128 1.00 0.00 H new ATOM 0 HG12 ILE A 47 15.064 -11.631 -2.033 1.00 0.00 H new ATOM 0 HG13 ILE A 47 14.242 -11.400 -0.502 1.00 0.00 H new ATOM 0 HG21 ILE A 47 16.032 -8.772 -2.505 1.00 0.00 H new ATOM 0 HG22 ILE A 47 17.548 -8.877 -1.579 1.00 0.00 H new ATOM 0 HG23 ILE A 47 17.056 -10.221 -2.637 1.00 0.00 H new ATOM 0 HD11 ILE A 47 12.865 -10.531 -2.376 1.00 0.00 H new ATOM 0 HD12 ILE A 47 13.352 -9.202 -1.296 1.00 0.00 H new ATOM 0 HD13 ILE A 47 14.186 -9.437 -2.850 1.00 0.00 H new ATOM 795 N LYS A 48 19.205 -11.308 -0.576 1.00 0.00 N ATOM 796 CA LYS A 48 20.649 -10.911 -0.621 1.00 0.00 C ATOM 797 C LYS A 48 21.047 -10.662 -2.076 1.00 0.00 C ATOM 798 O LYS A 48 22.054 -10.043 -2.358 1.00 0.00 O ATOM 799 CB LYS A 48 21.504 -12.045 -0.044 1.00 0.00 C ATOM 800 CG LYS A 48 22.910 -11.523 0.265 1.00 0.00 C ATOM 801 CD LYS A 48 23.801 -12.685 0.709 1.00 0.00 C ATOM 802 CE LYS A 48 25.236 -12.188 0.897 1.00 0.00 C ATOM 803 NZ LYS A 48 25.288 -11.239 2.045 1.00 0.00 N ATOM 0 H LYS A 48 18.993 -12.195 -1.032 1.00 0.00 H new ATOM 0 HA LYS A 48 20.806 -10.006 -0.035 1.00 0.00 H new ATOM 0 HB2 LYS A 48 21.043 -12.436 0.863 1.00 0.00 H new ATOM 0 HB3 LYS A 48 21.559 -12.870 -0.755 1.00 0.00 H new ATOM 0 HG2 LYS A 48 23.333 -11.043 -0.618 1.00 0.00 H new ATOM 0 HG3 LYS A 48 22.864 -10.766 1.048 1.00 0.00 H new ATOM 0 HD2 LYS A 48 23.427 -13.108 1.641 1.00 0.00 H new ATOM 0 HD3 LYS A 48 23.776 -13.481 -0.035 1.00 0.00 H new ATOM 0 HE2 LYS A 48 25.903 -13.031 1.078 1.00 0.00 H new ATOM 0 HE3 LYS A 48 25.583 -11.696 -0.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 26.278 -11.086 2.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 24.863 -10.332 1.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 24.760 -11.636 2.848 1.00 0.00 H new ATOM 817 N GLU A 49 20.251 -11.131 -3.002 1.00 0.00 N ATOM 818 CA GLU A 49 20.559 -10.919 -4.449 1.00 0.00 C ATOM 819 C GLU A 49 19.715 -9.752 -4.962 1.00 0.00 C ATOM 820 O GLU A 49 18.645 -9.482 -4.456 1.00 0.00 O ATOM 821 CB GLU A 49 20.215 -12.186 -5.236 1.00 0.00 C ATOM 822 CG GLU A 49 21.140 -13.327 -4.803 1.00 0.00 C ATOM 823 CD GLU A 49 20.718 -14.622 -5.501 1.00 0.00 C ATOM 824 OE1 GLU A 49 20.383 -14.557 -6.673 1.00 0.00 O ATOM 825 OE2 GLU A 49 20.736 -15.655 -4.852 1.00 0.00 O ATOM 0 H GLU A 49 19.396 -11.655 -2.817 1.00 0.00 H new ATOM 0 HA GLU A 49 21.618 -10.697 -4.577 1.00 0.00 H new ATOM 0 HB2 GLU A 49 19.175 -12.462 -5.063 1.00 0.00 H new ATOM 0 HB3 GLU A 49 20.323 -12.003 -6.305 1.00 0.00 H new ATOM 0 HG2 GLU A 49 22.173 -13.087 -5.054 1.00 0.00 H new ATOM 0 HG3 GLU A 49 21.096 -13.454 -3.721 1.00 0.00 H new ATOM 832 N GLN A 50 20.186 -9.052 -5.957 1.00 0.00 N ATOM 833 CA GLN A 50 19.411 -7.894 -6.497 1.00 0.00 C ATOM 834 C GLN A 50 18.539 -8.355 -7.668 1.00 0.00 C ATOM 835 O GLN A 50 17.495 -7.794 -7.937 1.00 0.00 O ATOM 836 CB GLN A 50 20.386 -6.821 -6.985 1.00 0.00 C ATOM 837 CG GLN A 50 21.224 -6.322 -5.806 1.00 0.00 C ATOM 838 CD GLN A 50 22.334 -5.402 -6.320 1.00 0.00 C ATOM 839 OE1 GLN A 50 22.416 -5.132 -7.502 1.00 0.00 O ATOM 840 NE2 GLN A 50 23.196 -4.906 -5.476 1.00 0.00 N ATOM 0 H GLN A 50 21.076 -9.231 -6.422 1.00 0.00 H new ATOM 0 HA GLN A 50 18.774 -7.487 -5.712 1.00 0.00 H new ATOM 0 HB2 GLN A 50 21.035 -7.229 -7.760 1.00 0.00 H new ATOM 0 HB3 GLN A 50 19.838 -5.992 -7.432 1.00 0.00 H new ATOM 0 HG2 GLN A 50 20.592 -5.786 -5.098 1.00 0.00 H new ATOM 0 HG3 GLN A 50 21.657 -7.167 -5.270 1.00 0.00 H new ATOM 0 HE21 GLN A 50 23.127 -5.133 -4.484 1.00 0.00 H new ATOM 0 HE22 GLN A 50 23.939 -4.291 -5.808 1.00 0.00 H new ATOM 849 N GLU A 51 18.965 -9.364 -8.374 1.00 0.00 N ATOM 850 CA GLU A 51 18.175 -9.853 -9.534 1.00 0.00 C ATOM 851 C GLU A 51 16.717 -10.027 -9.136 1.00 0.00 C ATOM 852 O GLU A 51 15.825 -9.852 -9.943 1.00 0.00 O ATOM 853 CB GLU A 51 18.739 -11.188 -10.021 1.00 0.00 C ATOM 854 CG GLU A 51 20.257 -11.076 -10.182 1.00 0.00 C ATOM 855 CD GLU A 51 20.791 -12.337 -10.863 1.00 0.00 C ATOM 856 OE1 GLU A 51 20.086 -12.880 -11.697 1.00 0.00 O ATOM 857 OE2 GLU A 51 21.897 -12.738 -10.538 1.00 0.00 O ATOM 0 H GLU A 51 19.831 -9.873 -8.195 1.00 0.00 H new ATOM 0 HA GLU A 51 18.239 -9.121 -10.339 1.00 0.00 H new ATOM 0 HB2 GLU A 51 18.496 -11.978 -9.310 1.00 0.00 H new ATOM 0 HB3 GLU A 51 18.282 -11.462 -10.972 1.00 0.00 H new ATOM 0 HG2 GLU A 51 20.507 -10.196 -10.775 1.00 0.00 H new ATOM 0 HG3 GLU A 51 20.729 -10.948 -9.208 1.00 0.00 H new ATOM 864 N VAL A 52 16.452 -10.350 -7.905 1.00 0.00 N ATOM 865 CA VAL A 52 15.036 -10.502 -7.489 1.00 0.00 C ATOM 866 C VAL A 52 14.443 -9.116 -7.346 1.00 0.00 C ATOM 867 O VAL A 52 13.310 -8.871 -7.705 1.00 0.00 O ATOM 868 CB VAL A 52 14.951 -11.253 -6.161 1.00 0.00 C ATOM 869 CG1 VAL A 52 15.642 -10.436 -5.071 1.00 0.00 C ATOM 870 CG2 VAL A 52 13.481 -11.457 -5.789 1.00 0.00 C ATOM 0 H VAL A 52 17.146 -10.514 -7.176 1.00 0.00 H new ATOM 0 HA VAL A 52 14.483 -11.075 -8.233 1.00 0.00 H new ATOM 0 HB VAL A 52 15.442 -12.221 -6.256 1.00 0.00 H new ATOM 0 HG11 VAL A 52 15.582 -10.970 -4.123 1.00 0.00 H new ATOM 0 HG12 VAL A 52 16.688 -10.285 -5.337 1.00 0.00 H new ATOM 0 HG13 VAL A 52 15.149 -9.469 -4.974 1.00 0.00 H new ATOM 0 HG21 VAL A 52 13.416 -11.993 -4.842 1.00 0.00 H new ATOM 0 HG22 VAL A 52 12.992 -10.488 -5.692 1.00 0.00 H new ATOM 0 HG23 VAL A 52 12.986 -12.036 -6.568 1.00 0.00 H new ATOM 880 N VAL A 53 15.211 -8.196 -6.848 1.00 0.00 N ATOM 881 CA VAL A 53 14.693 -6.818 -6.715 1.00 0.00 C ATOM 882 C VAL A 53 14.511 -6.282 -8.129 1.00 0.00 C ATOM 883 O VAL A 53 13.712 -5.401 -8.382 1.00 0.00 O ATOM 884 CB VAL A 53 15.657 -5.959 -5.844 1.00 0.00 C ATOM 885 CG1 VAL A 53 16.517 -5.008 -6.684 1.00 0.00 C ATOM 886 CG2 VAL A 53 14.840 -5.129 -4.855 1.00 0.00 C ATOM 0 H VAL A 53 16.169 -8.339 -6.529 1.00 0.00 H new ATOM 0 HA VAL A 53 13.734 -6.786 -6.197 1.00 0.00 H new ATOM 0 HB VAL A 53 16.324 -6.648 -5.326 1.00 0.00 H new ATOM 0 HG11 VAL A 53 17.171 -4.433 -6.028 1.00 0.00 H new ATOM 0 HG12 VAL A 53 17.122 -5.586 -7.383 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.871 -4.328 -7.239 1.00 0.00 H new ATOM 0 HG21 VAL A 53 15.512 -4.526 -4.244 1.00 0.00 H new ATOM 0 HG22 VAL A 53 14.162 -4.474 -5.402 1.00 0.00 H new ATOM 0 HG23 VAL A 53 14.262 -5.793 -4.212 1.00 0.00 H new ATOM 896 N ASP A 54 15.226 -6.847 -9.061 1.00 0.00 N ATOM 897 CA ASP A 54 15.073 -6.417 -10.472 1.00 0.00 C ATOM 898 C ASP A 54 13.780 -7.037 -10.992 1.00 0.00 C ATOM 899 O ASP A 54 13.100 -6.485 -11.834 1.00 0.00 O ATOM 900 CB ASP A 54 16.260 -6.915 -11.301 1.00 0.00 C ATOM 901 CG ASP A 54 16.150 -6.370 -12.727 1.00 0.00 C ATOM 902 OD1 ASP A 54 15.071 -5.933 -13.093 1.00 0.00 O ATOM 903 OD2 ASP A 54 17.147 -6.403 -13.431 1.00 0.00 O ATOM 0 H ASP A 54 15.909 -7.588 -8.903 1.00 0.00 H new ATOM 0 HA ASP A 54 15.040 -5.330 -10.546 1.00 0.00 H new ATOM 0 HB2 ASP A 54 17.196 -6.590 -10.847 1.00 0.00 H new ATOM 0 HB3 ASP A 54 16.275 -8.005 -11.317 1.00 0.00 H new ATOM 908 N LYS A 55 13.437 -8.190 -10.475 1.00 0.00 N ATOM 909 CA LYS A 55 12.181 -8.874 -10.908 1.00 0.00 C ATOM 910 C LYS A 55 10.998 -8.288 -10.115 1.00 0.00 C ATOM 911 O LYS A 55 10.015 -7.868 -10.693 1.00 0.00 O ATOM 912 CB LYS A 55 12.359 -10.412 -10.703 1.00 0.00 C ATOM 913 CG LYS A 55 11.175 -11.096 -9.975 1.00 0.00 C ATOM 914 CD LYS A 55 9.938 -11.139 -10.879 1.00 0.00 C ATOM 915 CE LYS A 55 8.824 -11.915 -10.176 1.00 0.00 C ATOM 916 NZ LYS A 55 7.606 -11.921 -11.034 1.00 0.00 N ATOM 0 H LYS A 55 13.976 -8.689 -9.768 1.00 0.00 H new ATOM 0 HA LYS A 55 11.971 -8.709 -11.965 1.00 0.00 H new ATOM 0 HB2 LYS A 55 12.494 -10.884 -11.676 1.00 0.00 H new ATOM 0 HB3 LYS A 55 13.272 -10.588 -10.134 1.00 0.00 H new ATOM 0 HG2 LYS A 55 11.455 -12.109 -9.685 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.943 -10.554 -9.058 1.00 0.00 H new ATOM 0 HD2 LYS A 55 9.604 -10.127 -11.106 1.00 0.00 H new ATOM 0 HD3 LYS A 55 10.184 -11.614 -11.829 1.00 0.00 H new ATOM 0 HE2 LYS A 55 9.147 -12.937 -9.978 1.00 0.00 H new ATOM 0 HE3 LYS A 55 8.601 -11.458 -9.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 6.882 -12.532 -10.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 7.236 -10.953 -11.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 7.849 -12.282 -11.979 1.00 0.00 H new ATOM 930 N VAL A 56 11.074 -8.251 -8.806 1.00 0.00 N ATOM 931 CA VAL A 56 9.943 -7.690 -8.007 1.00 0.00 C ATOM 932 C VAL A 56 9.506 -6.363 -8.632 1.00 0.00 C ATOM 933 O VAL A 56 8.331 -6.092 -8.789 1.00 0.00 O ATOM 934 CB VAL A 56 10.393 -7.514 -6.543 1.00 0.00 C ATOM 935 CG1 VAL A 56 11.072 -6.158 -6.335 1.00 0.00 C ATOM 936 CG2 VAL A 56 9.183 -7.616 -5.606 1.00 0.00 C ATOM 0 H VAL A 56 11.868 -8.584 -8.260 1.00 0.00 H new ATOM 0 HA VAL A 56 9.089 -8.367 -8.014 1.00 0.00 H new ATOM 0 HB VAL A 56 11.108 -8.305 -6.316 1.00 0.00 H new ATOM 0 HG11 VAL A 56 11.379 -6.061 -5.294 1.00 0.00 H new ATOM 0 HG12 VAL A 56 11.948 -6.087 -6.980 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.373 -5.359 -6.583 1.00 0.00 H new ATOM 0 HG21 VAL A 56 9.510 -7.490 -4.574 1.00 0.00 H new ATOM 0 HG22 VAL A 56 8.463 -6.837 -5.856 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.715 -8.593 -5.722 1.00 0.00 H new ATOM 946 N MET A 57 10.447 -5.548 -9.013 1.00 0.00 N ATOM 947 CA MET A 57 10.088 -4.255 -9.656 1.00 0.00 C ATOM 948 C MET A 57 9.384 -4.543 -10.982 1.00 0.00 C ATOM 949 O MET A 57 8.524 -3.808 -11.415 1.00 0.00 O ATOM 950 CB MET A 57 11.353 -3.444 -9.923 1.00 0.00 C ATOM 951 CG MET A 57 11.925 -2.949 -8.597 1.00 0.00 C ATOM 952 SD MET A 57 13.604 -2.321 -8.873 1.00 0.00 S ATOM 953 CE MET A 57 13.359 -0.664 -8.189 1.00 0.00 C ATOM 0 H MET A 57 11.447 -5.720 -8.908 1.00 0.00 H new ATOM 0 HA MET A 57 9.430 -3.688 -8.998 1.00 0.00 H new ATOM 0 HB2 MET A 57 12.089 -4.057 -10.443 1.00 0.00 H new ATOM 0 HB3 MET A 57 11.126 -2.599 -10.573 1.00 0.00 H new ATOM 0 HG2 MET A 57 11.292 -2.163 -8.185 1.00 0.00 H new ATOM 0 HG3 MET A 57 11.942 -3.760 -7.869 1.00 0.00 H new ATOM 0 HE1 MET A 57 14.260 -0.070 -8.342 1.00 0.00 H new ATOM 0 HE2 MET A 57 12.519 -0.184 -8.691 1.00 0.00 H new ATOM 0 HE3 MET A 57 13.150 -0.738 -7.122 1.00 0.00 H new ATOM 963 N GLU A 58 9.745 -5.616 -11.629 1.00 0.00 N ATOM 964 CA GLU A 58 9.096 -5.958 -12.925 1.00 0.00 C ATOM 965 C GLU A 58 7.601 -6.166 -12.693 1.00 0.00 C ATOM 966 O GLU A 58 6.782 -5.887 -13.546 1.00 0.00 O ATOM 967 CB GLU A 58 9.719 -7.245 -13.479 1.00 0.00 C ATOM 968 CG GLU A 58 9.431 -7.364 -14.978 1.00 0.00 C ATOM 969 CD GLU A 58 10.201 -8.557 -15.549 1.00 0.00 C ATOM 970 OE1 GLU A 58 11.419 -8.535 -15.488 1.00 0.00 O ATOM 971 OE2 GLU A 58 9.558 -9.474 -16.036 1.00 0.00 O ATOM 0 H GLU A 58 10.462 -6.271 -11.316 1.00 0.00 H new ATOM 0 HA GLU A 58 9.244 -5.150 -13.641 1.00 0.00 H new ATOM 0 HB2 GLU A 58 10.795 -7.241 -13.306 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.315 -8.110 -12.953 1.00 0.00 H new ATOM 0 HG2 GLU A 58 8.362 -7.493 -15.145 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.725 -6.448 -15.490 1.00 0.00 H new ATOM 978 N THR A 59 7.243 -6.652 -11.537 1.00 0.00 N ATOM 979 CA THR A 59 5.803 -6.879 -11.234 1.00 0.00 C ATOM 980 C THR A 59 5.214 -5.623 -10.596 1.00 0.00 C ATOM 981 O THR A 59 4.055 -5.309 -10.778 1.00 0.00 O ATOM 982 CB THR A 59 5.666 -8.048 -10.261 1.00 0.00 C ATOM 983 OG1 THR A 59 6.249 -9.210 -10.834 1.00 0.00 O ATOM 984 CG2 THR A 59 4.185 -8.298 -9.982 1.00 0.00 C ATOM 0 H THR A 59 7.888 -6.902 -10.787 1.00 0.00 H new ATOM 0 HA THR A 59 5.270 -7.106 -12.157 1.00 0.00 H new ATOM 0 HB THR A 59 6.177 -7.813 -9.327 1.00 0.00 H new ATOM 0 HG1 THR A 59 5.619 -9.958 -10.770 1.00 0.00 H new ATOM 0 HG21 THR A 59 4.081 -9.132 -9.288 1.00 0.00 H new ATOM 0 HG22 THR A 59 3.741 -7.404 -9.544 1.00 0.00 H new ATOM 0 HG23 THR A 59 3.674 -8.537 -10.915 1.00 0.00 H new ATOM 992 N LEU A 60 5.999 -4.904 -9.837 1.00 0.00 N ATOM 993 CA LEU A 60 5.467 -3.669 -9.176 1.00 0.00 C ATOM 994 C LEU A 60 5.647 -2.457 -10.095 1.00 0.00 C ATOM 995 O LEU A 60 4.750 -1.648 -10.238 1.00 0.00 O ATOM 996 CB LEU A 60 6.214 -3.431 -7.851 1.00 0.00 C ATOM 997 CG LEU A 60 5.524 -4.173 -6.696 1.00 0.00 C ATOM 998 CD1 LEU A 60 4.113 -3.590 -6.431 1.00 0.00 C ATOM 999 CD2 LEU A 60 5.425 -5.667 -7.034 1.00 0.00 C ATOM 0 H LEU A 60 6.979 -5.114 -9.645 1.00 0.00 H new ATOM 0 HA LEU A 60 4.404 -3.804 -8.976 1.00 0.00 H new ATOM 0 HB2 LEU A 60 7.245 -3.771 -7.943 1.00 0.00 H new ATOM 0 HB3 LEU A 60 6.249 -2.363 -7.634 1.00 0.00 H new ATOM 0 HG LEU A 60 6.118 -4.044 -5.791 1.00 0.00 H new ATOM 0 HD11 LEU A 60 3.644 -4.131 -5.609 1.00 0.00 H new ATOM 0 HD12 LEU A 60 4.198 -2.535 -6.169 1.00 0.00 H new ATOM 0 HD13 LEU A 60 3.503 -3.693 -7.328 1.00 0.00 H new ATOM 0 HD21 LEU A 60 4.936 -6.194 -6.215 1.00 0.00 H new ATOM 0 HD22 LEU A 60 4.844 -5.796 -7.947 1.00 0.00 H new ATOM 0 HD23 LEU A 60 6.426 -6.074 -7.181 1.00 0.00 H new ATOM 1011 N ASP A 61 6.781 -2.307 -10.721 1.00 0.00 N ATOM 1012 CA ASP A 61 6.984 -1.136 -11.623 1.00 0.00 C ATOM 1013 C ASP A 61 5.893 -1.105 -12.683 1.00 0.00 C ATOM 1014 O ASP A 61 5.973 -1.755 -13.707 1.00 0.00 O ATOM 1015 CB ASP A 61 8.355 -1.253 -12.279 1.00 0.00 C ATOM 1016 CG ASP A 61 8.749 0.089 -12.898 1.00 0.00 C ATOM 1017 OD1 ASP A 61 7.988 1.033 -12.754 1.00 0.00 O ATOM 1018 OD2 ASP A 61 9.803 0.150 -13.508 1.00 0.00 O ATOM 0 H ASP A 61 7.575 -2.943 -10.648 1.00 0.00 H new ATOM 0 HA ASP A 61 6.933 -0.211 -11.049 1.00 0.00 H new ATOM 0 HB2 ASP A 61 9.097 -1.555 -11.540 1.00 0.00 H new ATOM 0 HB3 ASP A 61 8.336 -2.027 -13.047 1.00 0.00 H new ATOM 1023 N GLU A 62 4.873 -0.339 -12.432 1.00 0.00 N ATOM 1024 CA GLU A 62 3.749 -0.230 -13.403 1.00 0.00 C ATOM 1025 C GLU A 62 4.043 0.916 -14.358 1.00 0.00 C ATOM 1026 O GLU A 62 3.764 0.845 -15.539 1.00 0.00 O ATOM 1027 CB GLU A 62 2.439 0.036 -12.657 1.00 0.00 C ATOM 1028 CG GLU A 62 2.564 1.317 -11.830 1.00 0.00 C ATOM 1029 CD GLU A 62 1.396 1.404 -10.846 1.00 0.00 C ATOM 1030 OE1 GLU A 62 1.336 0.573 -9.956 1.00 0.00 O ATOM 1031 OE2 GLU A 62 0.582 2.299 -11.000 1.00 0.00 O ATOM 0 H GLU A 62 4.767 0.223 -11.587 1.00 0.00 H new ATOM 0 HA GLU A 62 3.648 -1.161 -13.960 1.00 0.00 H new ATOM 0 HB2 GLU A 62 1.618 0.130 -13.368 1.00 0.00 H new ATOM 0 HB3 GLU A 62 2.203 -0.806 -12.006 1.00 0.00 H new ATOM 0 HG2 GLU A 62 3.510 1.323 -11.289 1.00 0.00 H new ATOM 0 HG3 GLU A 62 2.567 2.187 -12.486 1.00 0.00 H new ATOM 1038 N ASP A 63 4.629 1.966 -13.861 1.00 0.00 N ATOM 1039 CA ASP A 63 4.965 3.109 -14.745 1.00 0.00 C ATOM 1040 C ASP A 63 6.276 2.786 -15.455 1.00 0.00 C ATOM 1041 O ASP A 63 6.744 3.538 -16.286 1.00 0.00 O ATOM 1042 CB ASP A 63 5.133 4.379 -13.908 1.00 0.00 C ATOM 1043 CG ASP A 63 6.037 4.086 -12.709 1.00 0.00 C ATOM 1044 OD1 ASP A 63 6.465 2.952 -12.578 1.00 0.00 O ATOM 1045 OD2 ASP A 63 6.285 5.002 -11.942 1.00 0.00 O ATOM 0 H ASP A 63 4.889 2.081 -12.881 1.00 0.00 H new ATOM 0 HA ASP A 63 4.169 3.272 -15.471 1.00 0.00 H new ATOM 0 HB2 ASP A 63 5.565 5.174 -14.517 1.00 0.00 H new ATOM 0 HB3 ASP A 63 4.160 4.733 -13.566 1.00 0.00 H new ATOM 1050 N GLY A 64 6.879 1.670 -15.131 1.00 0.00 N ATOM 1051 CA GLY A 64 8.163 1.319 -15.794 1.00 0.00 C ATOM 1052 C GLY A 64 9.193 2.382 -15.431 1.00 0.00 C ATOM 1053 O GLY A 64 9.908 2.882 -16.276 1.00 0.00 O ATOM 0 H GLY A 64 6.540 0.997 -14.444 1.00 0.00 H new ATOM 0 HA2 GLY A 64 8.502 0.335 -15.470 1.00 0.00 H new ATOM 0 HA3 GLY A 64 8.032 1.270 -16.875 1.00 0.00 H new ATOM 1057 N ASP A 65 9.261 2.746 -14.176 1.00 0.00 N ATOM 1058 CA ASP A 65 10.233 3.798 -13.750 1.00 0.00 C ATOM 1059 C ASP A 65 11.470 3.138 -13.154 1.00 0.00 C ATOM 1060 O ASP A 65 12.439 3.795 -12.830 1.00 0.00 O ATOM 1061 CB ASP A 65 9.581 4.689 -12.692 1.00 0.00 C ATOM 1062 CG ASP A 65 9.155 3.834 -11.497 1.00 0.00 C ATOM 1063 OD1 ASP A 65 9.387 2.638 -11.536 1.00 0.00 O ATOM 1064 OD2 ASP A 65 8.604 4.392 -10.561 1.00 0.00 O ATOM 0 H ASP A 65 8.685 2.360 -13.428 1.00 0.00 H new ATOM 0 HA ASP A 65 10.520 4.398 -14.614 1.00 0.00 H new ATOM 0 HB2 ASP A 65 10.280 5.460 -12.370 1.00 0.00 H new ATOM 0 HB3 ASP A 65 8.716 5.200 -13.114 1.00 0.00 H new ATOM 1069 N GLY A 66 11.449 1.846 -12.995 1.00 0.00 N ATOM 1070 CA GLY A 66 12.634 1.166 -12.405 1.00 0.00 C ATOM 1071 C GLY A 66 12.768 1.604 -10.953 1.00 0.00 C ATOM 1072 O GLY A 66 13.641 1.164 -10.234 1.00 0.00 O ATOM 0 H GLY A 66 10.671 1.236 -13.245 1.00 0.00 H new ATOM 0 HA2 GLY A 66 12.519 0.084 -12.465 1.00 0.00 H new ATOM 0 HA3 GLY A 66 13.535 1.422 -12.963 1.00 0.00 H new ATOM 1076 N GLU A 67 11.887 2.467 -10.520 1.00 0.00 N ATOM 1077 CA GLU A 67 11.902 2.955 -9.110 1.00 0.00 C ATOM 1078 C GLU A 67 10.534 2.638 -8.512 1.00 0.00 C ATOM 1079 O GLU A 67 9.665 2.136 -9.195 1.00 0.00 O ATOM 1080 CB GLU A 67 12.147 4.472 -9.087 1.00 0.00 C ATOM 1081 CG GLU A 67 13.650 4.761 -9.171 1.00 0.00 C ATOM 1082 CD GLU A 67 14.191 4.292 -10.522 1.00 0.00 C ATOM 1083 OE1 GLU A 67 14.005 5.007 -11.493 1.00 0.00 O ATOM 1084 OE2 GLU A 67 14.785 3.227 -10.563 1.00 0.00 O ATOM 0 H GLU A 67 11.143 2.861 -11.096 1.00 0.00 H new ATOM 0 HA GLU A 67 12.696 2.474 -8.538 1.00 0.00 H new ATOM 0 HB2 GLU A 67 11.630 4.945 -9.922 1.00 0.00 H new ATOM 0 HB3 GLU A 67 11.736 4.901 -8.173 1.00 0.00 H new ATOM 0 HG2 GLU A 67 13.832 5.828 -9.046 1.00 0.00 H new ATOM 0 HG3 GLU A 67 14.174 4.252 -8.362 1.00 0.00 H new ATOM 1091 N CYS A 68 10.330 2.916 -7.250 1.00 0.00 N ATOM 1092 CA CYS A 68 9.006 2.616 -6.614 1.00 0.00 C ATOM 1093 C CYS A 68 8.462 3.859 -5.907 1.00 0.00 C ATOM 1094 O CYS A 68 8.695 4.057 -4.730 1.00 0.00 O ATOM 1095 CB CYS A 68 9.187 1.496 -5.586 1.00 0.00 C ATOM 1096 SG CYS A 68 9.864 0.030 -6.401 1.00 0.00 S ATOM 0 H CYS A 68 11.021 3.338 -6.630 1.00 0.00 H new ATOM 0 HA CYS A 68 8.302 2.310 -7.387 1.00 0.00 H new ATOM 0 HB2 CYS A 68 9.856 1.824 -4.790 1.00 0.00 H new ATOM 0 HB3 CYS A 68 8.231 1.257 -5.121 1.00 0.00 H new ATOM 0 HG CYS A 68 9.631 -1.019 -5.670 1.00 0.00 H new ATOM 1102 N ASP A 69 7.745 4.700 -6.609 1.00 0.00 N ATOM 1103 CA ASP A 69 7.184 5.923 -5.962 1.00 0.00 C ATOM 1104 C ASP A 69 6.412 5.503 -4.704 1.00 0.00 C ATOM 1105 O ASP A 69 6.440 4.356 -4.316 1.00 0.00 O ATOM 1106 CB ASP A 69 6.251 6.628 -6.952 1.00 0.00 C ATOM 1107 CG ASP A 69 5.679 7.895 -6.316 1.00 0.00 C ATOM 1108 OD1 ASP A 69 6.460 8.759 -5.955 1.00 0.00 O ATOM 1109 OD2 ASP A 69 4.468 7.980 -6.204 1.00 0.00 O ATOM 0 H ASP A 69 7.525 4.592 -7.599 1.00 0.00 H new ATOM 0 HA ASP A 69 7.983 6.609 -5.680 1.00 0.00 H new ATOM 0 HB2 ASP A 69 6.796 6.881 -7.861 1.00 0.00 H new ATOM 0 HB3 ASP A 69 5.441 5.959 -7.242 1.00 0.00 H new ATOM 1114 N PHE A 70 5.730 6.405 -4.051 1.00 0.00 N ATOM 1115 CA PHE A 70 4.986 6.028 -2.810 1.00 0.00 C ATOM 1116 C PHE A 70 3.712 5.235 -3.143 1.00 0.00 C ATOM 1117 O PHE A 70 3.253 4.426 -2.361 1.00 0.00 O ATOM 1118 CB PHE A 70 4.613 7.312 -2.044 1.00 0.00 C ATOM 1119 CG PHE A 70 4.385 8.453 -3.017 1.00 0.00 C ATOM 1120 CD1 PHE A 70 3.225 8.492 -3.803 1.00 0.00 C ATOM 1121 CD2 PHE A 70 5.334 9.478 -3.128 1.00 0.00 C ATOM 1122 CE1 PHE A 70 3.018 9.550 -4.697 1.00 0.00 C ATOM 1123 CE2 PHE A 70 5.126 10.535 -4.022 1.00 0.00 C ATOM 1124 CZ PHE A 70 3.969 10.570 -4.806 1.00 0.00 C ATOM 0 H PHE A 70 5.655 7.386 -4.321 1.00 0.00 H new ATOM 0 HA PHE A 70 5.625 5.393 -2.197 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.713 7.143 -1.452 1.00 0.00 H new ATOM 0 HB3 PHE A 70 5.409 7.573 -1.346 1.00 0.00 H new ATOM 0 HD1 PHE A 70 2.490 7.705 -3.719 1.00 0.00 H new ATOM 0 HD2 PHE A 70 6.228 9.452 -2.522 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.124 9.578 -5.302 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.859 11.323 -4.106 1.00 0.00 H new ATOM 0 HZ PHE A 70 3.809 11.385 -5.496 1.00 0.00 H new ATOM 1134 N GLN A 71 3.121 5.484 -4.272 1.00 0.00 N ATOM 1135 CA GLN A 71 1.863 4.783 -4.636 1.00 0.00 C ATOM 1136 C GLN A 71 2.134 3.310 -4.947 1.00 0.00 C ATOM 1137 O GLN A 71 1.379 2.429 -4.575 1.00 0.00 O ATOM 1138 CB GLN A 71 1.259 5.469 -5.864 1.00 0.00 C ATOM 1139 CG GLN A 71 -0.050 4.784 -6.231 1.00 0.00 C ATOM 1140 CD GLN A 71 -0.813 5.642 -7.242 1.00 0.00 C ATOM 1141 OE1 GLN A 71 -1.085 5.205 -8.345 1.00 0.00 O ATOM 1142 NE2 GLN A 71 -1.171 6.853 -6.913 1.00 0.00 N ATOM 0 H GLN A 71 3.459 6.150 -4.967 1.00 0.00 H new ATOM 0 HA GLN A 71 1.169 4.830 -3.797 1.00 0.00 H new ATOM 0 HB2 GLN A 71 1.084 6.525 -5.656 1.00 0.00 H new ATOM 0 HB3 GLN A 71 1.955 5.420 -6.701 1.00 0.00 H new ATOM 0 HG2 GLN A 71 0.149 3.799 -6.652 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -0.656 4.632 -5.337 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -0.943 7.219 -5.989 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -1.679 7.434 -7.580 1.00 0.00 H new ATOM 1151 N GLU A 72 3.216 3.027 -5.605 1.00 0.00 N ATOM 1152 CA GLU A 72 3.546 1.614 -5.936 1.00 0.00 C ATOM 1153 C GLU A 72 4.367 1.012 -4.797 1.00 0.00 C ATOM 1154 O GLU A 72 4.235 -0.148 -4.469 1.00 0.00 O ATOM 1155 CB GLU A 72 4.340 1.617 -7.248 1.00 0.00 C ATOM 1156 CG GLU A 72 4.884 0.223 -7.589 1.00 0.00 C ATOM 1157 CD GLU A 72 5.791 0.342 -8.806 1.00 0.00 C ATOM 1158 OE1 GLU A 72 5.355 0.917 -9.789 1.00 0.00 O ATOM 1159 OE2 GLU A 72 6.911 -0.136 -8.730 1.00 0.00 O ATOM 0 H GLU A 72 3.893 3.716 -5.932 1.00 0.00 H new ATOM 0 HA GLU A 72 2.646 1.012 -6.057 1.00 0.00 H new ATOM 0 HB2 GLU A 72 3.701 1.966 -8.059 1.00 0.00 H new ATOM 0 HB3 GLU A 72 5.168 2.321 -7.170 1.00 0.00 H new ATOM 0 HG2 GLU A 72 5.437 -0.185 -6.743 1.00 0.00 H new ATOM 0 HG3 GLU A 72 4.063 -0.464 -7.794 1.00 0.00 H new ATOM 1166 N PHE A 73 5.213 1.787 -4.191 1.00 0.00 N ATOM 1167 CA PHE A 73 6.031 1.244 -3.076 1.00 0.00 C ATOM 1168 C PHE A 73 5.109 0.610 -2.047 1.00 0.00 C ATOM 1169 O PHE A 73 5.345 -0.481 -1.573 1.00 0.00 O ATOM 1170 CB PHE A 73 6.829 2.383 -2.439 1.00 0.00 C ATOM 1171 CG PHE A 73 7.369 1.991 -1.077 1.00 0.00 C ATOM 1172 CD1 PHE A 73 7.972 0.740 -0.878 1.00 0.00 C ATOM 1173 CD2 PHE A 73 7.278 2.897 -0.013 1.00 0.00 C ATOM 1174 CE1 PHE A 73 8.481 0.405 0.381 1.00 0.00 C ATOM 1175 CE2 PHE A 73 7.790 2.561 1.240 1.00 0.00 C ATOM 1176 CZ PHE A 73 8.391 1.316 1.438 1.00 0.00 C ATOM 0 H PHE A 73 5.375 2.769 -4.416 1.00 0.00 H new ATOM 0 HA PHE A 73 6.723 0.489 -3.449 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.656 2.659 -3.093 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.193 3.263 -2.340 1.00 0.00 H new ATOM 0 HD1 PHE A 73 8.043 0.037 -1.695 1.00 0.00 H new ATOM 0 HD2 PHE A 73 6.810 3.859 -0.163 1.00 0.00 H new ATOM 0 HE1 PHE A 73 8.944 -0.558 0.537 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.722 3.264 2.057 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.787 1.056 2.409 1.00 0.00 H new ATOM 1186 N MET A 74 4.046 1.262 -1.702 1.00 0.00 N ATOM 1187 CA MET A 74 3.132 0.640 -0.723 1.00 0.00 C ATOM 1188 C MET A 74 2.622 -0.642 -1.375 1.00 0.00 C ATOM 1189 O MET A 74 2.530 -1.684 -0.757 1.00 0.00 O ATOM 1190 CB MET A 74 1.971 1.610 -0.409 1.00 0.00 C ATOM 1191 CG MET A 74 1.516 1.493 1.071 1.00 0.00 C ATOM 1192 SD MET A 74 -0.296 1.539 1.162 1.00 0.00 S ATOM 1193 CE MET A 74 -0.433 2.096 2.875 1.00 0.00 C ATOM 0 H MET A 74 3.773 2.182 -2.048 1.00 0.00 H new ATOM 0 HA MET A 74 3.629 0.418 0.221 1.00 0.00 H new ATOM 0 HB2 MET A 74 2.285 2.633 -0.614 1.00 0.00 H new ATOM 0 HB3 MET A 74 1.129 1.397 -1.068 1.00 0.00 H new ATOM 0 HG2 MET A 74 1.888 0.564 1.503 1.00 0.00 H new ATOM 0 HG3 MET A 74 1.940 2.309 1.657 1.00 0.00 H new ATOM 0 HE1 MET A 74 -1.432 1.875 3.251 1.00 0.00 H new ATOM 0 HE2 MET A 74 0.307 1.579 3.486 1.00 0.00 H new ATOM 0 HE3 MET A 74 -0.257 3.171 2.923 1.00 0.00 H new ATOM 1203 N ALA A 75 2.282 -0.552 -2.630 1.00 0.00 N ATOM 1204 CA ALA A 75 1.764 -1.760 -3.340 1.00 0.00 C ATOM 1205 C ALA A 75 2.733 -2.929 -3.137 1.00 0.00 C ATOM 1206 O ALA A 75 2.367 -4.078 -3.284 1.00 0.00 O ATOM 1207 CB ALA A 75 1.608 -1.452 -4.830 1.00 0.00 C ATOM 0 H ALA A 75 2.339 0.297 -3.193 1.00 0.00 H new ATOM 0 HA ALA A 75 0.790 -2.034 -2.933 1.00 0.00 H new ATOM 0 HB1 ALA A 75 1.230 -2.334 -5.346 1.00 0.00 H new ATOM 0 HB2 ALA A 75 0.907 -0.628 -4.960 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.576 -1.174 -5.247 1.00 0.00 H new ATOM 1213 N PHE A 76 3.959 -2.654 -2.784 1.00 0.00 N ATOM 1214 CA PHE A 76 4.916 -3.779 -2.561 1.00 0.00 C ATOM 1215 C PHE A 76 4.581 -4.438 -1.221 1.00 0.00 C ATOM 1216 O PHE A 76 4.383 -5.633 -1.146 1.00 0.00 O ATOM 1217 CB PHE A 76 6.365 -3.270 -2.571 1.00 0.00 C ATOM 1218 CG PHE A 76 7.314 -4.350 -2.083 1.00 0.00 C ATOM 1219 CD1 PHE A 76 7.304 -5.626 -2.670 1.00 0.00 C ATOM 1220 CD2 PHE A 76 8.212 -4.071 -1.042 1.00 0.00 C ATOM 1221 CE1 PHE A 76 8.187 -6.614 -2.214 1.00 0.00 C ATOM 1222 CE2 PHE A 76 9.091 -5.059 -0.590 1.00 0.00 C ATOM 1223 CZ PHE A 76 9.078 -6.331 -1.175 1.00 0.00 C ATOM 0 H PHE A 76 4.336 -1.717 -2.642 1.00 0.00 H new ATOM 0 HA PHE A 76 4.822 -4.509 -3.365 1.00 0.00 H new ATOM 0 HB2 PHE A 76 6.642 -2.964 -3.580 1.00 0.00 H new ATOM 0 HB3 PHE A 76 6.451 -2.389 -1.936 1.00 0.00 H new ATOM 0 HD1 PHE A 76 6.616 -5.846 -3.473 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.224 -3.091 -0.589 1.00 0.00 H new ATOM 0 HE1 PHE A 76 8.179 -7.595 -2.666 1.00 0.00 H new ATOM 0 HE2 PHE A 76 9.781 -4.841 0.212 1.00 0.00 H new ATOM 0 HZ PHE A 76 9.757 -7.094 -0.823 1.00 0.00 H new ATOM 1233 N VAL A 77 4.482 -3.671 -0.166 1.00 0.00 N ATOM 1234 CA VAL A 77 4.125 -4.281 1.151 1.00 0.00 C ATOM 1235 C VAL A 77 2.816 -5.066 0.987 1.00 0.00 C ATOM 1236 O VAL A 77 2.605 -6.092 1.592 1.00 0.00 O ATOM 1237 CB VAL A 77 3.927 -3.180 2.198 1.00 0.00 C ATOM 1238 CG1 VAL A 77 3.380 -3.791 3.488 1.00 0.00 C ATOM 1239 CG2 VAL A 77 5.264 -2.504 2.501 1.00 0.00 C ATOM 0 H VAL A 77 4.631 -2.662 -0.157 1.00 0.00 H new ATOM 0 HA VAL A 77 4.926 -4.944 1.479 1.00 0.00 H new ATOM 0 HB VAL A 77 3.224 -2.444 1.808 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.240 -3.006 4.231 1.00 0.00 H new ATOM 0 HG12 VAL A 77 2.424 -4.274 3.285 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.086 -4.529 3.869 1.00 0.00 H new ATOM 0 HG21 VAL A 77 5.116 -1.722 3.246 1.00 0.00 H new ATOM 0 HG22 VAL A 77 5.967 -3.243 2.885 1.00 0.00 H new ATOM 0 HG23 VAL A 77 5.664 -2.064 1.588 1.00 0.00 H new ATOM 1249 N SER A 78 1.938 -4.582 0.164 1.00 0.00 N ATOM 1250 CA SER A 78 0.650 -5.286 -0.061 1.00 0.00 C ATOM 1251 C SER A 78 0.943 -6.613 -0.745 1.00 0.00 C ATOM 1252 O SER A 78 0.224 -7.581 -0.606 1.00 0.00 O ATOM 1253 CB SER A 78 -0.236 -4.433 -0.969 1.00 0.00 C ATOM 1254 OG SER A 78 -1.594 -4.820 -0.804 1.00 0.00 O ATOM 0 H SER A 78 2.057 -3.720 -0.369 1.00 0.00 H new ATOM 0 HA SER A 78 0.139 -5.456 0.887 1.00 0.00 H new ATOM 0 HB2 SER A 78 -0.115 -3.377 -0.726 1.00 0.00 H new ATOM 0 HB3 SER A 78 0.065 -4.557 -2.009 1.00 0.00 H new ATOM 0 HG SER A 78 -2.103 -4.578 -1.606 1.00 0.00 H new ATOM 1260 N MET A 79 2.001 -6.647 -1.494 1.00 0.00 N ATOM 1261 CA MET A 79 2.378 -7.891 -2.217 1.00 0.00 C ATOM 1262 C MET A 79 2.990 -8.898 -1.247 1.00 0.00 C ATOM 1263 O MET A 79 2.838 -10.093 -1.405 1.00 0.00 O ATOM 1264 CB MET A 79 3.401 -7.551 -3.302 1.00 0.00 C ATOM 1265 CG MET A 79 3.595 -8.748 -4.241 1.00 0.00 C ATOM 1266 SD MET A 79 5.234 -8.641 -5.001 1.00 0.00 S ATOM 1267 CE MET A 79 4.783 -9.302 -6.622 1.00 0.00 C ATOM 0 H MET A 79 2.631 -5.858 -1.640 1.00 0.00 H new ATOM 0 HA MET A 79 1.486 -8.327 -2.667 1.00 0.00 H new ATOM 0 HB2 MET A 79 3.064 -6.684 -3.871 1.00 0.00 H new ATOM 0 HB3 MET A 79 4.352 -7.281 -2.843 1.00 0.00 H new ATOM 0 HG2 MET A 79 3.497 -9.681 -3.686 1.00 0.00 H new ATOM 0 HG3 MET A 79 2.823 -8.752 -5.010 1.00 0.00 H new ATOM 0 HE1 MET A 79 5.631 -9.210 -7.301 1.00 0.00 H new ATOM 0 HE2 MET A 79 4.509 -10.353 -6.523 1.00 0.00 H new ATOM 0 HE3 MET A 79 3.937 -8.743 -7.020 1.00 0.00 H new ATOM 1277 N VAL A 80 3.658 -8.431 -0.228 1.00 0.00 N ATOM 1278 CA VAL A 80 4.246 -9.369 0.759 1.00 0.00 C ATOM 1279 C VAL A 80 3.165 -9.623 1.786 1.00 0.00 C ATOM 1280 O VAL A 80 3.058 -10.694 2.349 1.00 0.00 O ATOM 1281 CB VAL A 80 5.524 -8.775 1.407 1.00 0.00 C ATOM 1282 CG1 VAL A 80 6.267 -7.919 0.382 1.00 0.00 C ATOM 1283 CG2 VAL A 80 5.189 -7.907 2.629 1.00 0.00 C ATOM 0 H VAL A 80 3.820 -7.442 -0.040 1.00 0.00 H new ATOM 0 HA VAL A 80 4.561 -10.299 0.286 1.00 0.00 H new ATOM 0 HB VAL A 80 6.147 -9.607 1.735 1.00 0.00 H new ATOM 0 HG11 VAL A 80 7.165 -7.502 0.838 1.00 0.00 H new ATOM 0 HG12 VAL A 80 6.547 -8.535 -0.472 1.00 0.00 H new ATOM 0 HG13 VAL A 80 5.620 -7.108 0.048 1.00 0.00 H new ATOM 0 HG21 VAL A 80 6.110 -7.509 3.056 1.00 0.00 H new ATOM 0 HG22 VAL A 80 4.544 -7.083 2.324 1.00 0.00 H new ATOM 0 HG23 VAL A 80 4.675 -8.513 3.376 1.00 0.00 H new ATOM 1293 N THR A 81 2.332 -8.642 2.013 1.00 0.00 N ATOM 1294 CA THR A 81 1.234 -8.842 2.980 1.00 0.00 C ATOM 1295 C THR A 81 0.253 -9.823 2.369 1.00 0.00 C ATOM 1296 O THR A 81 -0.320 -10.651 3.048 1.00 0.00 O ATOM 1297 CB THR A 81 0.511 -7.522 3.238 1.00 0.00 C ATOM 1298 OG1 THR A 81 1.450 -6.527 3.605 1.00 0.00 O ATOM 1299 CG2 THR A 81 -0.505 -7.710 4.362 1.00 0.00 C ATOM 0 H THR A 81 2.370 -7.723 1.572 1.00 0.00 H new ATOM 0 HA THR A 81 1.634 -9.216 3.923 1.00 0.00 H new ATOM 0 HB THR A 81 -0.006 -7.209 2.331 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.194 -6.942 4.090 1.00 0.00 H new ATOM 0 HG21 THR A 81 -1.022 -6.768 4.547 1.00 0.00 H new ATOM 0 HG22 THR A 81 -1.230 -8.471 4.074 1.00 0.00 H new ATOM 0 HG23 THR A 81 0.010 -8.025 5.269 1.00 0.00 H new ATOM 1307 N THR A 82 0.028 -9.723 1.084 1.00 0.00 N ATOM 1308 CA THR A 82 -0.943 -10.636 0.429 1.00 0.00 C ATOM 1309 C THR A 82 -0.458 -12.081 0.501 1.00 0.00 C ATOM 1310 O THR A 82 -1.237 -12.984 0.731 1.00 0.00 O ATOM 1311 CB THR A 82 -1.103 -10.208 -1.029 1.00 0.00 C ATOM 1312 OG1 THR A 82 0.175 -9.913 -1.574 1.00 0.00 O ATOM 1313 CG2 THR A 82 -1.996 -8.956 -1.103 1.00 0.00 C ATOM 0 H THR A 82 0.476 -9.048 0.465 1.00 0.00 H new ATOM 0 HA THR A 82 -1.902 -10.578 0.944 1.00 0.00 H new ATOM 0 HB THR A 82 -1.565 -11.015 -1.598 1.00 0.00 H new ATOM 0 HG1 THR A 82 0.400 -8.977 -1.392 1.00 0.00 H new ATOM 0 HG21 THR A 82 -2.110 -8.651 -2.143 1.00 0.00 H new ATOM 0 HG22 THR A 82 -2.976 -9.182 -0.682 1.00 0.00 H new ATOM 0 HG23 THR A 82 -1.536 -8.147 -0.536 1.00 0.00 H new ATOM 1321 N ALA A 83 0.811 -12.329 0.320 1.00 0.00 N ATOM 1322 CA ALA A 83 1.294 -13.730 0.399 1.00 0.00 C ATOM 1323 C ALA A 83 1.012 -14.260 1.801 1.00 0.00 C ATOM 1324 O ALA A 83 0.738 -15.427 1.995 1.00 0.00 O ATOM 1325 CB ALA A 83 2.801 -13.770 0.127 1.00 0.00 C ATOM 0 H ALA A 83 1.525 -11.628 0.123 1.00 0.00 H new ATOM 0 HA ALA A 83 0.784 -14.345 -0.343 1.00 0.00 H new ATOM 0 HB1 ALA A 83 3.154 -14.800 0.185 1.00 0.00 H new ATOM 0 HB2 ALA A 83 3.002 -13.373 -0.868 1.00 0.00 H new ATOM 0 HB3 ALA A 83 3.321 -13.165 0.870 1.00 0.00 H new ATOM 1331 N CYS A 84 1.076 -13.401 2.783 1.00 0.00 N ATOM 1332 CA CYS A 84 0.805 -13.853 4.179 1.00 0.00 C ATOM 1333 C CYS A 84 -0.706 -13.989 4.385 1.00 0.00 C ATOM 1334 O CYS A 84 -1.160 -14.663 5.287 1.00 0.00 O ATOM 1335 CB CYS A 84 1.366 -12.830 5.168 1.00 0.00 C ATOM 1336 SG CYS A 84 1.003 -13.363 6.859 1.00 0.00 S ATOM 0 H CYS A 84 1.303 -12.412 2.681 1.00 0.00 H new ATOM 0 HA CYS A 84 1.284 -14.817 4.348 1.00 0.00 H new ATOM 0 HB2 CYS A 84 2.443 -12.728 5.031 1.00 0.00 H new ATOM 0 HB3 CYS A 84 0.927 -11.850 4.982 1.00 0.00 H new ATOM 0 HG CYS A 84 -0.054 -14.120 6.858 1.00 0.00 H new ATOM 1342 N HIS A 85 -1.487 -13.351 3.556 1.00 0.00 N ATOM 1343 CA HIS A 85 -2.971 -13.440 3.703 1.00 0.00 C ATOM 1344 C HIS A 85 -3.483 -14.677 2.963 1.00 0.00 C ATOM 1345 O HIS A 85 -4.382 -15.353 3.421 1.00 0.00 O ATOM 1346 CB HIS A 85 -3.614 -12.187 3.103 1.00 0.00 C ATOM 1347 CG HIS A 85 -5.113 -12.345 3.065 1.00 0.00 C ATOM 1348 ND1 HIS A 85 -5.884 -11.799 2.052 1.00 0.00 N ATOM 1349 CD2 HIS A 85 -5.995 -12.977 3.908 1.00 0.00 C ATOM 1350 CE1 HIS A 85 -7.169 -12.101 2.310 1.00 0.00 C ATOM 1351 NE2 HIS A 85 -7.294 -12.821 3.429 1.00 0.00 N ATOM 0 H HIS A 85 -1.163 -12.771 2.782 1.00 0.00 H new ATOM 0 HA HIS A 85 -3.230 -13.515 4.759 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -3.347 -11.312 3.696 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -3.232 -12.019 2.096 1.00 0.00 H new ATOM 0 HD1 HIS A 85 -5.539 -11.264 1.254 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -5.723 -13.513 4.805 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -7.999 -11.798 1.689 1.00 0.00 H new ATOM 1359 N GLU A 86 -2.924 -14.980 1.824 1.00 0.00 N ATOM 1360 CA GLU A 86 -3.396 -16.178 1.069 1.00 0.00 C ATOM 1361 C GLU A 86 -2.827 -17.446 1.712 1.00 0.00 C ATOM 1362 O GLU A 86 -3.385 -18.518 1.591 1.00 0.00 O ATOM 1363 CB GLU A 86 -2.941 -16.078 -0.392 1.00 0.00 C ATOM 1364 CG GLU A 86 -1.431 -16.318 -0.487 1.00 0.00 C ATOM 1365 CD GLU A 86 -0.919 -15.842 -1.848 1.00 0.00 C ATOM 1366 OE1 GLU A 86 -1.161 -14.694 -2.181 1.00 0.00 O ATOM 1367 OE2 GLU A 86 -0.294 -16.634 -2.533 1.00 0.00 O ATOM 0 H GLU A 86 -2.167 -14.456 1.385 1.00 0.00 H new ATOM 0 HA GLU A 86 -4.485 -16.222 1.099 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -3.473 -16.811 -0.998 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.187 -15.094 -0.792 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -0.917 -15.785 0.313 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -1.212 -17.378 -0.355 1.00 0.00 H new ATOM 1374 N PHE A 87 -1.721 -17.332 2.395 1.00 0.00 N ATOM 1375 CA PHE A 87 -1.123 -18.531 3.044 1.00 0.00 C ATOM 1376 C PHE A 87 -2.005 -18.964 4.218 1.00 0.00 C ATOM 1377 O PHE A 87 -2.237 -20.137 4.436 1.00 0.00 O ATOM 1378 CB PHE A 87 0.278 -18.185 3.557 1.00 0.00 C ATOM 1379 CG PHE A 87 1.023 -19.454 3.898 1.00 0.00 C ATOM 1380 CD1 PHE A 87 1.613 -20.212 2.880 1.00 0.00 C ATOM 1381 CD2 PHE A 87 1.127 -19.871 5.231 1.00 0.00 C ATOM 1382 CE1 PHE A 87 2.306 -21.387 3.194 1.00 0.00 C ATOM 1383 CE2 PHE A 87 1.819 -21.047 5.545 1.00 0.00 C ATOM 1384 CZ PHE A 87 2.409 -21.804 4.527 1.00 0.00 C ATOM 0 H PHE A 87 -1.207 -16.462 2.531 1.00 0.00 H new ATOM 0 HA PHE A 87 -1.055 -19.344 2.321 1.00 0.00 H new ATOM 0 HB2 PHE A 87 0.825 -17.623 2.800 1.00 0.00 H new ATOM 0 HB3 PHE A 87 0.206 -17.546 4.437 1.00 0.00 H new ATOM 0 HD1 PHE A 87 1.534 -19.890 1.852 1.00 0.00 H new ATOM 0 HD2 PHE A 87 0.673 -19.285 6.017 1.00 0.00 H new ATOM 0 HE1 PHE A 87 2.761 -21.972 2.408 1.00 0.00 H new ATOM 0 HE2 PHE A 87 1.897 -21.370 6.573 1.00 0.00 H new ATOM 0 HZ PHE A 87 2.944 -22.710 4.769 1.00 0.00 H new ATOM 1394 N PHE A 88 -2.494 -18.023 4.978 1.00 0.00 N ATOM 1395 CA PHE A 88 -3.357 -18.371 6.144 1.00 0.00 C ATOM 1396 C PHE A 88 -4.581 -19.169 5.678 1.00 0.00 C ATOM 1397 O PHE A 88 -4.733 -20.330 6.001 1.00 0.00 O ATOM 1398 CB PHE A 88 -3.824 -17.086 6.831 1.00 0.00 C ATOM 1399 CG PHE A 88 -4.619 -17.433 8.069 1.00 0.00 C ATOM 1400 CD1 PHE A 88 -3.955 -17.802 9.245 1.00 0.00 C ATOM 1401 CD2 PHE A 88 -6.019 -17.382 8.042 1.00 0.00 C ATOM 1402 CE1 PHE A 88 -4.690 -18.121 10.393 1.00 0.00 C ATOM 1403 CE2 PHE A 88 -6.753 -17.701 9.192 1.00 0.00 C ATOM 1404 CZ PHE A 88 -6.089 -18.070 10.367 1.00 0.00 C ATOM 0 H PHE A 88 -2.333 -17.025 4.842 1.00 0.00 H new ATOM 0 HA PHE A 88 -2.781 -18.978 6.843 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -2.964 -16.472 7.099 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -4.435 -16.497 6.147 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -2.876 -17.841 9.267 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.532 -17.097 7.135 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -4.177 -18.407 11.300 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -7.832 -17.662 9.171 1.00 0.00 H new ATOM 0 HZ PHE A 88 -6.655 -18.315 11.253 1.00 0.00 H new ATOM 1414 N GLU A 89 -5.464 -18.553 4.937 1.00 0.00 N ATOM 1415 CA GLU A 89 -6.684 -19.277 4.475 1.00 0.00 C ATOM 1416 C GLU A 89 -6.322 -20.303 3.398 1.00 0.00 C ATOM 1417 O GLU A 89 -7.165 -20.738 2.639 1.00 0.00 O ATOM 1418 CB GLU A 89 -7.701 -18.278 3.912 1.00 0.00 C ATOM 1419 CG GLU A 89 -7.001 -17.287 2.979 1.00 0.00 C ATOM 1420 CD GLU A 89 -8.047 -16.399 2.301 1.00 0.00 C ATOM 1421 OE1 GLU A 89 -9.005 -16.941 1.774 1.00 0.00 O ATOM 1422 OE2 GLU A 89 -7.876 -15.190 2.324 1.00 0.00 O ATOM 0 H GLU A 89 -5.393 -17.582 4.632 1.00 0.00 H new ATOM 0 HA GLU A 89 -7.121 -19.799 5.326 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -8.483 -18.809 3.370 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -8.186 -17.742 4.728 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.298 -16.674 3.543 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -6.423 -17.825 2.228 1.00 0.00 H new ATOM 1429 N HIS A 90 -5.085 -20.708 3.328 1.00 0.00 N ATOM 1430 CA HIS A 90 -4.702 -21.719 2.302 1.00 0.00 C ATOM 1431 C HIS A 90 -5.374 -23.052 2.641 1.00 0.00 C ATOM 1432 O HIS A 90 -4.931 -23.776 3.511 1.00 0.00 O ATOM 1433 CB HIS A 90 -3.183 -21.904 2.294 1.00 0.00 C ATOM 1434 CG HIS A 90 -2.813 -22.941 1.269 1.00 0.00 C ATOM 1435 ND1 HIS A 90 -1.748 -23.814 1.448 1.00 0.00 N ATOM 1436 CD2 HIS A 90 -3.358 -23.259 0.048 1.00 0.00 C ATOM 1437 CE1 HIS A 90 -1.686 -24.608 0.362 1.00 0.00 C ATOM 1438 NE2 HIS A 90 -2.644 -24.310 -0.518 1.00 0.00 N ATOM 0 H HIS A 90 -4.328 -20.386 3.931 1.00 0.00 H new ATOM 0 HA HIS A 90 -5.025 -21.378 1.318 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -2.691 -20.958 2.065 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -2.838 -22.212 3.281 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -4.209 -22.769 -0.402 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -0.953 -25.388 0.221 1.00 0.00 H new ATOM 0 HE2 HIS A 90 -2.817 -24.759 -1.417 1.00 0.00 H new ATOM 1447 N GLU A 91 -6.435 -23.382 1.959 1.00 0.00 N ATOM 1448 CA GLU A 91 -7.131 -24.670 2.239 1.00 0.00 C ATOM 1449 C GLU A 91 -6.251 -25.833 1.774 1.00 0.00 C ATOM 1450 O GLU A 91 -5.385 -26.236 2.532 1.00 0.00 O ATOM 1451 CB GLU A 91 -8.464 -24.705 1.487 1.00 0.00 C ATOM 1452 CG GLU A 91 -9.250 -25.955 1.893 1.00 0.00 C ATOM 1453 CD GLU A 91 -10.554 -26.019 1.093 1.00 0.00 C ATOM 1454 OE1 GLU A 91 -10.678 -25.269 0.139 1.00 0.00 O ATOM 1455 OE2 GLU A 91 -11.405 -26.816 1.450 1.00 0.00 O ATOM 1456 OXT GLU A 91 -6.460 -26.302 0.667 1.00 0.00 O ATOM 0 H GLU A 91 -6.851 -22.816 1.220 1.00 0.00 H new ATOM 0 HA GLU A 91 -7.317 -24.759 3.309 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -9.044 -23.810 1.712 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -8.286 -24.708 0.412 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -8.654 -26.849 1.709 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -9.467 -25.931 2.961 1.00 0.00 H new TER 1463 GLU A 91 ATOM 1464 N MET B 0 7.839 -8.063 13.162 1.00 0.00 N ATOM 1465 CA MET B 0 7.437 -7.492 14.478 1.00 0.00 C ATOM 1466 C MET B 0 7.850 -6.021 14.543 1.00 0.00 C ATOM 1467 O MET B 0 7.980 -5.454 15.610 1.00 0.00 O ATOM 1468 CB MET B 0 8.128 -8.267 15.605 1.00 0.00 C ATOM 1469 CG MET B 0 9.599 -8.499 15.246 1.00 0.00 C ATOM 1470 SD MET B 0 10.524 -8.921 16.743 1.00 0.00 S ATOM 1471 CE MET B 0 10.083 -10.676 16.800 1.00 0.00 C ATOM 0 H1 MET B 0 7.427 -9.012 13.055 1.00 0.00 H new ATOM 0 H2 MET B 0 7.495 -7.448 12.397 1.00 0.00 H new ATOM 0 H3 MET B 0 8.876 -8.128 13.114 1.00 0.00 H new ATOM 0 HA MET B 0 6.356 -7.572 14.593 1.00 0.00 H new ATOM 0 HB2 MET B 0 8.055 -7.711 16.540 1.00 0.00 H new ATOM 0 HB3 MET B 0 7.627 -9.222 15.763 1.00 0.00 H new ATOM 0 HG2 MET B 0 9.684 -9.302 14.514 1.00 0.00 H new ATOM 0 HG3 MET B 0 10.018 -7.604 14.787 1.00 0.00 H new ATOM 0 HE1 MET B 0 10.556 -11.142 17.664 1.00 0.00 H new ATOM 0 HE2 MET B 0 9.001 -10.777 16.880 1.00 0.00 H new ATOM 0 HE3 MET B 0 10.426 -11.167 15.890 1.00 0.00 H new ATOM 1483 N SER B 1 8.063 -5.402 13.409 1.00 0.00 N ATOM 1484 CA SER B 1 8.475 -3.963 13.389 1.00 0.00 C ATOM 1485 C SER B 1 7.310 -3.092 12.921 1.00 0.00 C ATOM 1486 O SER B 1 6.195 -3.548 12.769 1.00 0.00 O ATOM 1487 CB SER B 1 9.642 -3.788 12.420 1.00 0.00 C ATOM 1488 OG SER B 1 9.334 -4.438 11.194 1.00 0.00 O ATOM 0 H SER B 1 7.969 -5.834 12.490 1.00 0.00 H new ATOM 0 HA SER B 1 8.771 -3.663 14.394 1.00 0.00 H new ATOM 0 HB2 SER B 1 9.830 -2.728 12.246 1.00 0.00 H new ATOM 0 HB3 SER B 1 10.552 -4.207 12.849 1.00 0.00 H new ATOM 0 HG SER B 1 10.080 -4.327 10.568 1.00 0.00 H new ATOM 1494 N GLU B 2 7.574 -1.837 12.686 1.00 0.00 N ATOM 1495 CA GLU B 2 6.504 -0.912 12.219 1.00 0.00 C ATOM 1496 C GLU B 2 5.823 -1.507 10.990 1.00 0.00 C ATOM 1497 O GLU B 2 4.733 -1.116 10.620 1.00 0.00 O ATOM 1498 CB GLU B 2 7.137 0.431 11.853 1.00 0.00 C ATOM 1499 CG GLU B 2 7.627 1.122 13.125 1.00 0.00 C ATOM 1500 CD GLU B 2 8.458 2.350 12.752 1.00 0.00 C ATOM 1501 OE1 GLU B 2 7.902 3.257 12.154 1.00 0.00 O ATOM 1502 OE2 GLU B 2 9.635 2.365 13.073 1.00 0.00 O ATOM 0 H GLU B 2 8.493 -1.409 12.798 1.00 0.00 H new ATOM 0 HA GLU B 2 5.765 -0.769 13.007 1.00 0.00 H new ATOM 0 HB2 GLU B 2 7.968 0.279 11.165 1.00 0.00 H new ATOM 0 HB3 GLU B 2 6.410 1.061 11.340 1.00 0.00 H new ATOM 0 HG2 GLU B 2 6.778 1.418 13.741 1.00 0.00 H new ATOM 0 HG3 GLU B 2 8.226 0.431 13.719 1.00 0.00 H new ATOM 1509 N LEU B 3 6.465 -2.440 10.341 1.00 0.00 N ATOM 1510 CA LEU B 3 5.867 -3.049 9.118 1.00 0.00 C ATOM 1511 C LEU B 3 4.921 -4.189 9.506 1.00 0.00 C ATOM 1512 O LEU B 3 3.992 -4.497 8.794 1.00 0.00 O ATOM 1513 CB LEU B 3 6.977 -3.618 8.227 1.00 0.00 C ATOM 1514 CG LEU B 3 7.822 -2.488 7.614 1.00 0.00 C ATOM 1515 CD1 LEU B 3 6.964 -1.608 6.684 1.00 0.00 C ATOM 1516 CD2 LEU B 3 8.433 -1.630 8.731 1.00 0.00 C ATOM 0 H LEU B 3 7.379 -2.807 10.605 1.00 0.00 H new ATOM 0 HA LEU B 3 5.314 -2.278 8.582 1.00 0.00 H new ATOM 0 HB2 LEU B 3 7.616 -4.279 8.813 1.00 0.00 H new ATOM 0 HB3 LEU B 3 6.538 -4.221 7.432 1.00 0.00 H new ATOM 0 HG LEU B 3 8.622 -2.935 7.024 1.00 0.00 H new ATOM 0 HD11 LEU B 3 7.581 -0.815 6.261 1.00 0.00 H new ATOM 0 HD12 LEU B 3 6.557 -2.219 5.879 1.00 0.00 H new ATOM 0 HD13 LEU B 3 6.146 -1.166 7.253 1.00 0.00 H new ATOM 0 HD21 LEU B 3 9.030 -0.831 8.291 1.00 0.00 H new ATOM 0 HD22 LEU B 3 7.635 -1.196 9.334 1.00 0.00 H new ATOM 0 HD23 LEU B 3 9.068 -2.252 9.362 1.00 0.00 H new ATOM 1528 N GLU B 4 5.142 -4.819 10.627 1.00 0.00 N ATOM 1529 CA GLU B 4 4.242 -5.936 11.033 1.00 0.00 C ATOM 1530 C GLU B 4 2.953 -5.355 11.607 1.00 0.00 C ATOM 1531 O GLU B 4 1.910 -5.979 11.585 1.00 0.00 O ATOM 1532 CB GLU B 4 4.933 -6.804 12.091 1.00 0.00 C ATOM 1533 CG GLU B 4 4.076 -8.044 12.383 1.00 0.00 C ATOM 1534 CD GLU B 4 4.931 -9.111 13.070 1.00 0.00 C ATOM 1535 OE1 GLU B 4 5.895 -9.550 12.463 1.00 0.00 O ATOM 1536 OE2 GLU B 4 4.611 -9.470 14.191 1.00 0.00 O ATOM 0 H GLU B 4 5.901 -4.611 11.276 1.00 0.00 H new ATOM 0 HA GLU B 4 4.013 -6.553 10.164 1.00 0.00 H new ATOM 0 HB2 GLU B 4 5.919 -7.106 11.740 1.00 0.00 H new ATOM 0 HB3 GLU B 4 5.083 -6.230 13.005 1.00 0.00 H new ATOM 0 HG2 GLU B 4 3.233 -7.774 13.019 1.00 0.00 H new ATOM 0 HG3 GLU B 4 3.661 -8.438 11.455 1.00 0.00 H new ATOM 1543 N LYS B 5 3.017 -4.158 12.114 1.00 0.00 N ATOM 1544 CA LYS B 5 1.801 -3.520 12.683 1.00 0.00 C ATOM 1545 C LYS B 5 0.904 -3.080 11.534 1.00 0.00 C ATOM 1546 O LYS B 5 -0.276 -3.368 11.504 1.00 0.00 O ATOM 1547 CB LYS B 5 2.205 -2.295 13.507 1.00 0.00 C ATOM 1548 CG LYS B 5 3.265 -2.702 14.541 1.00 0.00 C ATOM 1549 CD LYS B 5 3.887 -1.453 15.196 1.00 0.00 C ATOM 1550 CE LYS B 5 5.298 -1.779 15.689 1.00 0.00 C ATOM 1551 NZ LYS B 5 5.918 -0.557 16.274 1.00 0.00 N ATOM 0 H LYS B 5 3.864 -3.591 12.159 1.00 0.00 H new ATOM 0 HA LYS B 5 1.274 -4.226 13.324 1.00 0.00 H new ATOM 0 HB2 LYS B 5 2.599 -1.517 12.853 1.00 0.00 H new ATOM 0 HB3 LYS B 5 1.333 -1.877 14.009 1.00 0.00 H new ATOM 0 HG2 LYS B 5 2.812 -3.334 15.305 1.00 0.00 H new ATOM 0 HG3 LYS B 5 4.044 -3.293 14.059 1.00 0.00 H new ATOM 0 HD2 LYS B 5 3.922 -0.633 14.478 1.00 0.00 H new ATOM 0 HD3 LYS B 5 3.268 -1.121 16.029 1.00 0.00 H new ATOM 0 HE2 LYS B 5 5.259 -2.572 16.436 1.00 0.00 H new ATOM 0 HE3 LYS B 5 5.906 -2.148 14.863 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 6.877 -0.780 16.609 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 5.969 0.187 15.549 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 5.342 -0.224 17.073 1.00 0.00 H new ATOM 1565 N ALA B 6 1.458 -2.374 10.588 1.00 0.00 N ATOM 1566 CA ALA B 6 0.637 -1.903 9.439 1.00 0.00 C ATOM 1567 C ALA B 6 0.044 -3.094 8.691 1.00 0.00 C ATOM 1568 O ALA B 6 -1.148 -3.174 8.474 1.00 0.00 O ATOM 1569 CB ALA B 6 1.514 -1.097 8.481 1.00 0.00 C ATOM 0 H ALA B 6 2.441 -2.104 10.561 1.00 0.00 H new ATOM 0 HA ALA B 6 -0.172 -1.278 9.818 1.00 0.00 H new ATOM 0 HB1 ALA B 6 0.913 -0.752 7.640 1.00 0.00 H new ATOM 0 HB2 ALA B 6 1.931 -0.237 9.005 1.00 0.00 H new ATOM 0 HB3 ALA B 6 2.325 -1.726 8.114 1.00 0.00 H new ATOM 1575 N MET B 7 0.868 -4.010 8.284 1.00 0.00 N ATOM 1576 CA MET B 7 0.356 -5.189 7.535 1.00 0.00 C ATOM 1577 C MET B 7 -0.740 -5.887 8.346 1.00 0.00 C ATOM 1578 O MET B 7 -1.707 -6.375 7.800 1.00 0.00 O ATOM 1579 CB MET B 7 1.506 -6.171 7.273 1.00 0.00 C ATOM 1580 CG MET B 7 2.467 -5.609 6.213 1.00 0.00 C ATOM 1581 SD MET B 7 3.368 -6.984 5.438 1.00 0.00 S ATOM 1582 CE MET B 7 5.047 -6.497 5.907 1.00 0.00 C ATOM 0 H MET B 7 1.876 -3.996 8.436 1.00 0.00 H new ATOM 0 HA MET B 7 -0.061 -4.855 6.585 1.00 0.00 H new ATOM 0 HB2 MET B 7 2.048 -6.360 8.200 1.00 0.00 H new ATOM 0 HB3 MET B 7 1.105 -7.128 6.938 1.00 0.00 H new ATOM 0 HG2 MET B 7 1.911 -5.052 5.459 1.00 0.00 H new ATOM 0 HG3 MET B 7 3.168 -4.912 6.673 1.00 0.00 H new ATOM 0 HE1 MET B 7 5.768 -7.069 5.324 1.00 0.00 H new ATOM 0 HE2 MET B 7 5.185 -5.433 5.712 1.00 0.00 H new ATOM 0 HE3 MET B 7 5.200 -6.695 6.968 1.00 0.00 H new ATOM 1592 N VAL B 8 -0.606 -5.938 9.640 1.00 0.00 N ATOM 1593 CA VAL B 8 -1.654 -6.608 10.466 1.00 0.00 C ATOM 1594 C VAL B 8 -2.899 -5.717 10.498 1.00 0.00 C ATOM 1595 O VAL B 8 -4.010 -6.166 10.303 1.00 0.00 O ATOM 1596 CB VAL B 8 -1.108 -6.826 11.896 1.00 0.00 C ATOM 1597 CG1 VAL B 8 -2.257 -6.936 12.910 1.00 0.00 C ATOM 1598 CG2 VAL B 8 -0.278 -8.116 11.938 1.00 0.00 C ATOM 0 H VAL B 8 0.178 -5.548 10.162 1.00 0.00 H new ATOM 0 HA VAL B 8 -1.917 -7.576 10.039 1.00 0.00 H new ATOM 0 HB VAL B 8 -0.486 -5.970 12.160 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -1.848 -7.089 13.909 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -2.844 -6.018 12.895 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -2.895 -7.779 12.646 1.00 0.00 H new ATOM 0 HG21 VAL B 8 0.106 -8.269 12.946 1.00 0.00 H new ATOM 0 HG22 VAL B 8 -0.906 -8.962 11.657 1.00 0.00 H new ATOM 0 HG23 VAL B 8 0.556 -8.035 11.240 1.00 0.00 H new ATOM 1608 N ALA B 9 -2.709 -4.460 10.753 1.00 0.00 N ATOM 1609 CA ALA B 9 -3.864 -3.528 10.811 1.00 0.00 C ATOM 1610 C ALA B 9 -4.669 -3.607 9.506 1.00 0.00 C ATOM 1611 O ALA B 9 -5.882 -3.504 9.506 1.00 0.00 O ATOM 1612 CB ALA B 9 -3.346 -2.101 11.019 1.00 0.00 C ATOM 0 H ALA B 9 -1.799 -4.033 10.925 1.00 0.00 H new ATOM 0 HA ALA B 9 -4.515 -3.806 11.640 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -4.189 -1.411 11.063 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -2.786 -2.050 11.953 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -2.694 -1.826 10.190 1.00 0.00 H new ATOM 1618 N LEU B 10 -4.007 -3.772 8.390 1.00 0.00 N ATOM 1619 CA LEU B 10 -4.745 -3.833 7.094 1.00 0.00 C ATOM 1620 C LEU B 10 -5.359 -5.223 6.872 1.00 0.00 C ATOM 1621 O LEU B 10 -6.508 -5.327 6.531 1.00 0.00 O ATOM 1622 CB LEU B 10 -3.777 -3.488 5.948 1.00 0.00 C ATOM 1623 CG LEU B 10 -3.756 -1.972 5.701 1.00 0.00 C ATOM 1624 CD1 LEU B 10 -3.545 -1.218 7.023 1.00 0.00 C ATOM 1625 CD2 LEU B 10 -2.607 -1.647 4.750 1.00 0.00 C ATOM 0 H LEU B 10 -2.994 -3.867 8.320 1.00 0.00 H new ATOM 0 HA LEU B 10 -5.561 -3.111 7.117 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -2.774 -3.836 6.194 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -4.081 -4.007 5.039 1.00 0.00 H new ATOM 0 HG LEU B 10 -4.708 -1.664 5.268 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -3.532 -0.145 6.832 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -4.357 -1.455 7.710 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -2.596 -1.519 7.466 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -2.580 -0.573 4.566 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -1.664 -1.962 5.197 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -2.755 -2.173 3.807 1.00 0.00 H new ATOM 1637 N ILE B 11 -4.612 -6.282 7.036 1.00 0.00 N ATOM 1638 CA ILE B 11 -5.179 -7.650 6.792 1.00 0.00 C ATOM 1639 C ILE B 11 -6.570 -7.755 7.424 1.00 0.00 C ATOM 1640 O ILE B 11 -7.421 -8.485 6.957 1.00 0.00 O ATOM 1641 CB ILE B 11 -4.244 -8.706 7.408 1.00 0.00 C ATOM 1642 CG1 ILE B 11 -3.008 -8.859 6.521 1.00 0.00 C ATOM 1643 CG2 ILE B 11 -4.961 -10.060 7.506 1.00 0.00 C ATOM 1644 CD1 ILE B 11 -1.945 -9.675 7.259 1.00 0.00 C ATOM 0 H ILE B 11 -3.635 -6.264 7.328 1.00 0.00 H new ATOM 0 HA ILE B 11 -5.264 -7.822 5.719 1.00 0.00 H new ATOM 0 HB ILE B 11 -3.954 -8.383 8.408 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -3.277 -9.353 5.587 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -2.612 -7.878 6.260 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -4.288 -10.797 7.943 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -5.846 -9.959 8.134 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -5.259 -10.387 6.510 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -1.065 -9.783 6.625 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -1.668 -9.163 8.181 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -2.344 -10.661 7.497 1.00 0.00 H new ATOM 1656 N ASP B 12 -6.813 -7.025 8.473 1.00 0.00 N ATOM 1657 CA ASP B 12 -8.157 -7.080 9.117 1.00 0.00 C ATOM 1658 C ASP B 12 -9.132 -6.223 8.310 1.00 0.00 C ATOM 1659 O ASP B 12 -10.206 -6.658 7.944 1.00 0.00 O ATOM 1660 CB ASP B 12 -8.061 -6.545 10.548 1.00 0.00 C ATOM 1661 CG ASP B 12 -9.364 -6.842 11.294 1.00 0.00 C ATOM 1662 OD1 ASP B 12 -10.321 -7.229 10.642 1.00 0.00 O ATOM 1663 OD2 ASP B 12 -9.384 -6.678 12.502 1.00 0.00 O ATOM 0 H ASP B 12 -6.144 -6.394 8.913 1.00 0.00 H new ATOM 0 HA ASP B 12 -8.512 -8.110 9.144 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -7.220 -7.008 11.065 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -7.874 -5.471 10.534 1.00 0.00 H new ATOM 1668 N VAL B 13 -8.759 -5.007 8.028 1.00 0.00 N ATOM 1669 CA VAL B 13 -9.645 -4.103 7.238 1.00 0.00 C ATOM 1670 C VAL B 13 -9.624 -4.535 5.768 1.00 0.00 C ATOM 1671 O VAL B 13 -10.565 -4.324 5.029 1.00 0.00 O ATOM 1672 CB VAL B 13 -9.128 -2.665 7.394 1.00 0.00 C ATOM 1673 CG1 VAL B 13 -10.041 -1.675 6.666 1.00 0.00 C ATOM 1674 CG2 VAL B 13 -9.092 -2.322 8.888 1.00 0.00 C ATOM 0 H VAL B 13 -7.870 -4.595 8.313 1.00 0.00 H new ATOM 0 HA VAL B 13 -10.673 -4.156 7.596 1.00 0.00 H new ATOM 0 HB VAL B 13 -8.131 -2.593 6.959 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -9.654 -0.664 6.791 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -10.073 -1.923 5.605 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -11.046 -1.733 7.083 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -8.727 -1.303 9.019 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -10.096 -2.404 9.304 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -8.427 -3.015 9.404 1.00 0.00 H new ATOM 1684 N PHE B 14 -8.553 -5.142 5.350 1.00 0.00 N ATOM 1685 CA PHE B 14 -8.453 -5.597 3.934 1.00 0.00 C ATOM 1686 C PHE B 14 -9.356 -6.824 3.719 1.00 0.00 C ATOM 1687 O PHE B 14 -10.043 -6.928 2.726 1.00 0.00 O ATOM 1688 CB PHE B 14 -6.982 -5.925 3.610 1.00 0.00 C ATOM 1689 CG PHE B 14 -6.871 -6.891 2.446 1.00 0.00 C ATOM 1690 CD1 PHE B 14 -7.717 -6.767 1.337 1.00 0.00 C ATOM 1691 CD2 PHE B 14 -5.919 -7.917 2.488 1.00 0.00 C ATOM 1692 CE1 PHE B 14 -7.609 -7.669 0.272 1.00 0.00 C ATOM 1693 CE2 PHE B 14 -5.813 -8.817 1.425 1.00 0.00 C ATOM 1694 CZ PHE B 14 -6.657 -8.695 0.318 1.00 0.00 C ATOM 0 H PHE B 14 -7.738 -5.345 5.928 1.00 0.00 H new ATOM 0 HA PHE B 14 -8.789 -4.807 3.262 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -6.447 -5.005 3.373 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -6.502 -6.356 4.489 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -8.452 -5.976 1.303 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -5.266 -8.013 3.343 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -8.260 -7.574 -0.585 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -5.078 -9.608 1.459 1.00 0.00 H new ATOM 0 HZ PHE B 14 -6.575 -9.392 -0.503 1.00 0.00 H new ATOM 1704 N HIS B 15 -9.349 -7.758 4.627 1.00 0.00 N ATOM 1705 CA HIS B 15 -10.193 -8.976 4.444 1.00 0.00 C ATOM 1706 C HIS B 15 -11.665 -8.673 4.783 1.00 0.00 C ATOM 1707 O HIS B 15 -12.569 -9.245 4.207 1.00 0.00 O ATOM 1708 CB HIS B 15 -9.658 -10.096 5.361 1.00 0.00 C ATOM 1709 CG HIS B 15 -9.897 -11.452 4.740 1.00 0.00 C ATOM 1710 ND1 HIS B 15 -9.244 -12.590 5.188 1.00 0.00 N ATOM 1711 CD2 HIS B 15 -10.696 -11.867 3.699 1.00 0.00 C ATOM 1712 CE1 HIS B 15 -9.654 -13.622 4.428 1.00 0.00 C ATOM 1713 NE2 HIS B 15 -10.538 -13.237 3.504 1.00 0.00 N ATOM 0 H HIS B 15 -8.799 -7.734 5.485 1.00 0.00 H new ATOM 0 HA HIS B 15 -10.145 -9.295 3.403 1.00 0.00 H new ATOM 0 HB2 HIS B 15 -8.592 -9.953 5.535 1.00 0.00 H new ATOM 0 HB3 HIS B 15 -10.149 -10.043 6.333 1.00 0.00 H new ATOM 0 HD1 HIS B 15 -8.574 -12.637 5.955 1.00 0.00 H new ATOM 0 HD2 HIS B 15 -11.347 -11.227 3.121 1.00 0.00 H new ATOM 0 HE1 HIS B 15 -9.310 -14.638 4.550 1.00 0.00 H new ATOM 1721 N GLN B 16 -11.911 -7.799 5.722 1.00 0.00 N ATOM 1722 CA GLN B 16 -13.324 -7.488 6.102 1.00 0.00 C ATOM 1723 C GLN B 16 -14.048 -6.763 4.960 1.00 0.00 C ATOM 1724 O GLN B 16 -15.213 -6.999 4.698 1.00 0.00 O ATOM 1725 CB GLN B 16 -13.328 -6.599 7.349 1.00 0.00 C ATOM 1726 CG GLN B 16 -12.956 -7.438 8.573 1.00 0.00 C ATOM 1727 CD GLN B 16 -14.134 -8.338 8.951 1.00 0.00 C ATOM 1728 OE1 GLN B 16 -15.206 -8.222 8.389 1.00 0.00 O ATOM 1729 NE2 GLN B 16 -13.980 -9.237 9.883 1.00 0.00 N ATOM 0 H GLN B 16 -11.198 -7.287 6.242 1.00 0.00 H new ATOM 0 HA GLN B 16 -13.844 -8.424 6.306 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -12.619 -5.780 7.227 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -14.312 -6.151 7.487 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -12.076 -8.044 8.358 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -12.699 -6.787 9.409 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -13.081 -9.334 10.354 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -14.759 -9.843 10.141 1.00 0.00 H new ATOM 1738 N TYR B 17 -13.369 -5.895 4.264 1.00 0.00 N ATOM 1739 CA TYR B 17 -14.030 -5.172 3.136 1.00 0.00 C ATOM 1740 C TYR B 17 -13.914 -6.026 1.879 1.00 0.00 C ATOM 1741 O TYR B 17 -14.901 -6.359 1.253 1.00 0.00 O ATOM 1742 CB TYR B 17 -13.356 -3.808 2.933 1.00 0.00 C ATOM 1743 CG TYR B 17 -13.925 -2.821 3.931 1.00 0.00 C ATOM 1744 CD1 TYR B 17 -13.498 -2.846 5.265 1.00 0.00 C ATOM 1745 CD2 TYR B 17 -14.895 -1.894 3.525 1.00 0.00 C ATOM 1746 CE1 TYR B 17 -14.040 -1.947 6.191 1.00 0.00 C ATOM 1747 CE2 TYR B 17 -15.434 -0.993 4.451 1.00 0.00 C ATOM 1748 CZ TYR B 17 -15.008 -1.020 5.784 1.00 0.00 C ATOM 1749 OH TYR B 17 -15.544 -0.137 6.697 1.00 0.00 O ATOM 0 H TYR B 17 -12.391 -5.654 4.424 1.00 0.00 H new ATOM 0 HA TYR B 17 -15.083 -5.001 3.358 1.00 0.00 H new ATOM 0 HB2 TYR B 17 -12.278 -3.898 3.066 1.00 0.00 H new ATOM 0 HB3 TYR B 17 -13.523 -3.453 1.916 1.00 0.00 H new ATOM 0 HD1 TYR B 17 -12.750 -3.559 5.579 1.00 0.00 H new ATOM 0 HD2 TYR B 17 -15.227 -1.875 2.497 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -13.712 -1.968 7.220 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -16.179 -0.277 4.137 1.00 0.00 H new ATOM 0 HH TYR B 17 -15.086 0.726 6.625 1.00 0.00 H new ATOM 1759 N SER B 18 -12.727 -6.409 1.517 1.00 0.00 N ATOM 1760 CA SER B 18 -12.574 -7.268 0.318 1.00 0.00 C ATOM 1761 C SER B 18 -13.450 -8.506 0.507 1.00 0.00 C ATOM 1762 O SER B 18 -13.829 -9.171 -0.436 1.00 0.00 O ATOM 1763 CB SER B 18 -11.113 -7.686 0.181 1.00 0.00 C ATOM 1764 OG SER B 18 -10.851 -8.775 1.057 1.00 0.00 O ATOM 0 H SER B 18 -11.860 -6.166 1.997 1.00 0.00 H new ATOM 0 HA SER B 18 -12.874 -6.729 -0.581 1.00 0.00 H new ATOM 0 HB2 SER B 18 -10.900 -7.973 -0.849 1.00 0.00 H new ATOM 0 HB3 SER B 18 -10.459 -6.847 0.419 1.00 0.00 H new ATOM 0 HG SER B 18 -10.166 -8.514 1.708 1.00 0.00 H new ATOM 1770 N GLY B 19 -13.771 -8.815 1.738 1.00 0.00 N ATOM 1771 CA GLY B 19 -14.623 -10.008 2.034 1.00 0.00 C ATOM 1772 C GLY B 19 -16.077 -9.576 2.257 1.00 0.00 C ATOM 1773 O GLY B 19 -16.936 -10.391 2.529 1.00 0.00 O ATOM 0 H GLY B 19 -13.476 -8.286 2.559 1.00 0.00 H new ATOM 0 HA2 GLY B 19 -14.569 -10.717 1.208 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -14.248 -10.521 2.920 1.00 0.00 H new ATOM 1777 N ARG B 20 -16.371 -8.308 2.131 1.00 0.00 N ATOM 1778 CA ARG B 20 -17.778 -7.847 2.323 1.00 0.00 C ATOM 1779 C ARG B 20 -18.650 -8.409 1.200 1.00 0.00 C ATOM 1780 O ARG B 20 -19.720 -8.937 1.433 1.00 0.00 O ATOM 1781 CB ARG B 20 -17.819 -6.315 2.283 1.00 0.00 C ATOM 1782 CG ARG B 20 -19.250 -5.808 2.503 1.00 0.00 C ATOM 1783 CD ARG B 20 -19.279 -4.294 2.302 1.00 0.00 C ATOM 1784 NE ARG B 20 -18.332 -3.649 3.256 1.00 0.00 N ATOM 1785 CZ ARG B 20 -18.679 -3.473 4.502 1.00 0.00 C ATOM 1786 NH1 ARG B 20 -19.859 -3.849 4.911 1.00 0.00 N ATOM 1787 NH2 ARG B 20 -17.844 -2.920 5.338 1.00 0.00 N ATOM 0 H ARG B 20 -15.700 -7.574 1.904 1.00 0.00 H new ATOM 0 HA ARG B 20 -18.152 -8.197 3.285 1.00 0.00 H new ATOM 0 HB2 ARG B 20 -17.161 -5.908 3.051 1.00 0.00 H new ATOM 0 HB3 ARG B 20 -17.445 -5.961 1.322 1.00 0.00 H new ATOM 0 HG2 ARG B 20 -19.933 -6.293 1.805 1.00 0.00 H new ATOM 0 HG3 ARG B 20 -19.588 -6.061 3.508 1.00 0.00 H new ATOM 0 HD2 ARG B 20 -19.004 -4.047 1.277 1.00 0.00 H new ATOM 0 HD3 ARG B 20 -20.288 -3.914 2.462 1.00 0.00 H new ATOM 0 HE ARG B 20 -17.413 -3.345 2.935 1.00 0.00 H new ATOM 0 HH11 ARG B 20 -20.512 -4.281 4.257 1.00 0.00 H new ATOM 0 HH12 ARG B 20 -20.129 -3.711 5.885 1.00 0.00 H new ATOM 0 HH21 ARG B 20 -16.921 -2.626 5.018 1.00 0.00 H new ATOM 0 HH22 ARG B 20 -18.114 -2.782 6.312 1.00 0.00 H new ATOM 1801 N GLU B 21 -18.199 -8.301 -0.018 1.00 0.00 N ATOM 1802 CA GLU B 21 -18.999 -8.830 -1.161 1.00 0.00 C ATOM 1803 C GLU B 21 -18.062 -9.181 -2.320 1.00 0.00 C ATOM 1804 O GLU B 21 -17.009 -8.593 -2.479 1.00 0.00 O ATOM 1805 CB GLU B 21 -20.010 -7.764 -1.608 1.00 0.00 C ATOM 1806 CG GLU B 21 -19.369 -6.376 -1.510 1.00 0.00 C ATOM 1807 CD GLU B 21 -20.199 -5.370 -2.311 1.00 0.00 C ATOM 1808 OE1 GLU B 21 -20.210 -5.475 -3.527 1.00 0.00 O ATOM 1809 OE2 GLU B 21 -20.811 -4.512 -1.696 1.00 0.00 O ATOM 0 H GLU B 21 -17.311 -7.869 -0.273 1.00 0.00 H new ATOM 0 HA GLU B 21 -19.535 -9.727 -0.852 1.00 0.00 H new ATOM 0 HB2 GLU B 21 -20.329 -7.957 -2.632 1.00 0.00 H new ATOM 0 HB3 GLU B 21 -20.902 -7.809 -0.983 1.00 0.00 H new ATOM 0 HG2 GLU B 21 -19.309 -6.065 -0.467 1.00 0.00 H new ATOM 0 HG3 GLU B 21 -18.349 -6.408 -1.892 1.00 0.00 H new ATOM 1816 N GLY B 22 -18.439 -10.137 -3.132 1.00 0.00 N ATOM 1817 CA GLY B 22 -17.579 -10.536 -4.290 1.00 0.00 C ATOM 1818 C GLY B 22 -16.794 -11.797 -3.941 1.00 0.00 C ATOM 1819 O GLY B 22 -17.146 -12.534 -3.042 1.00 0.00 O ATOM 0 H GLY B 22 -19.310 -10.661 -3.043 1.00 0.00 H new ATOM 0 HA2 GLY B 22 -18.197 -10.714 -5.170 1.00 0.00 H new ATOM 0 HA3 GLY B 22 -16.893 -9.727 -4.541 1.00 0.00 H new ATOM 1823 N ASP B 23 -15.724 -12.048 -4.648 1.00 0.00 N ATOM 1824 CA ASP B 23 -14.909 -13.258 -4.359 1.00 0.00 C ATOM 1825 C ASP B 23 -14.614 -13.317 -2.862 1.00 0.00 C ATOM 1826 O ASP B 23 -15.399 -13.826 -2.087 1.00 0.00 O ATOM 1827 CB ASP B 23 -13.594 -13.186 -5.141 1.00 0.00 C ATOM 1828 CG ASP B 23 -12.731 -14.405 -4.804 1.00 0.00 C ATOM 1829 OD1 ASP B 23 -12.291 -14.500 -3.669 1.00 0.00 O ATOM 1830 OD2 ASP B 23 -12.523 -15.222 -5.686 1.00 0.00 O ATOM 0 H ASP B 23 -15.381 -11.466 -5.412 1.00 0.00 H new ATOM 0 HA ASP B 23 -15.457 -14.152 -4.659 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -13.797 -13.156 -6.212 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -13.060 -12.269 -4.891 1.00 0.00 H new ATOM 1835 N LYS B 24 -13.491 -12.798 -2.445 1.00 0.00 N ATOM 1836 CA LYS B 24 -13.157 -12.830 -0.995 1.00 0.00 C ATOM 1837 C LYS B 24 -11.903 -11.988 -0.732 1.00 0.00 C ATOM 1838 O LYS B 24 -11.536 -11.753 0.401 1.00 0.00 O ATOM 1839 CB LYS B 24 -12.899 -14.285 -0.573 1.00 0.00 C ATOM 1840 CG LYS B 24 -12.971 -14.429 0.958 1.00 0.00 C ATOM 1841 CD LYS B 24 -14.430 -14.370 1.446 1.00 0.00 C ATOM 1842 CE LYS B 24 -14.545 -15.055 2.811 1.00 0.00 C ATOM 1843 NZ LYS B 24 -14.306 -16.518 2.653 1.00 0.00 N ATOM 0 H LYS B 24 -12.794 -12.355 -3.044 1.00 0.00 H new ATOM 0 HA LYS B 24 -13.987 -12.420 -0.419 1.00 0.00 H new ATOM 0 HB2 LYS B 24 -13.635 -14.940 -1.040 1.00 0.00 H new ATOM 0 HB3 LYS B 24 -11.919 -14.603 -0.927 1.00 0.00 H new ATOM 0 HG2 LYS B 24 -12.520 -15.374 1.260 1.00 0.00 H new ATOM 0 HG3 LYS B 24 -12.393 -13.635 1.430 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -14.757 -13.333 1.520 1.00 0.00 H new ATOM 0 HD3 LYS B 24 -15.085 -14.860 0.726 1.00 0.00 H new ATOM 0 HE2 LYS B 24 -13.820 -14.630 3.506 1.00 0.00 H new ATOM 0 HE3 LYS B 24 -15.534 -14.881 3.235 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 -14.818 -17.036 3.396 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 -14.645 -16.826 1.719 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 -13.288 -16.714 2.734 1.00 0.00 H new ATOM 1857 N HIS B 25 -11.226 -11.538 -1.762 1.00 0.00 N ATOM 1858 CA HIS B 25 -9.985 -10.731 -1.538 1.00 0.00 C ATOM 1859 C HIS B 25 -9.855 -9.609 -2.569 1.00 0.00 C ATOM 1860 O HIS B 25 -8.763 -9.248 -2.961 1.00 0.00 O ATOM 1861 CB HIS B 25 -8.771 -11.661 -1.624 1.00 0.00 C ATOM 1862 CG HIS B 25 -9.109 -12.977 -0.976 1.00 0.00 C ATOM 1863 ND1 HIS B 25 -9.501 -13.072 0.354 1.00 0.00 N ATOM 1864 CD2 HIS B 25 -9.131 -14.262 -1.464 1.00 0.00 C ATOM 1865 CE1 HIS B 25 -9.741 -14.370 0.615 1.00 0.00 C ATOM 1866 NE2 HIS B 25 -9.530 -15.134 -0.457 1.00 0.00 N ATOM 0 H HIS B 25 -11.476 -11.693 -2.739 1.00 0.00 H new ATOM 0 HA HIS B 25 -10.040 -10.269 -0.552 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -8.490 -11.816 -2.666 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -7.914 -11.207 -1.127 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -8.878 -14.550 -2.474 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -10.065 -14.746 1.574 1.00 0.00 H new ATOM 0 HE2 HIS B 25 -9.638 -16.146 -0.524 1.00 0.00 H new ATOM 1874 N LYS B 26 -10.949 -9.024 -2.989 1.00 0.00 N ATOM 1875 CA LYS B 26 -10.883 -7.894 -3.963 1.00 0.00 C ATOM 1876 C LYS B 26 -11.847 -6.817 -3.482 1.00 0.00 C ATOM 1877 O LYS B 26 -12.872 -7.111 -2.899 1.00 0.00 O ATOM 1878 CB LYS B 26 -11.294 -8.378 -5.356 1.00 0.00 C ATOM 1879 CG LYS B 26 -10.174 -9.242 -5.945 1.00 0.00 C ATOM 1880 CD LYS B 26 -10.710 -10.043 -7.135 1.00 0.00 C ATOM 1881 CE LYS B 26 -11.383 -9.099 -8.135 1.00 0.00 C ATOM 1882 NZ LYS B 26 -10.522 -7.903 -8.353 1.00 0.00 N ATOM 0 H LYS B 26 -11.891 -9.283 -2.696 1.00 0.00 H new ATOM 0 HA LYS B 26 -9.868 -7.501 -4.025 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -12.218 -8.953 -5.295 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -11.491 -7.525 -6.006 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -9.344 -8.611 -6.263 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -9.786 -9.919 -5.184 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -9.895 -10.580 -7.620 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -11.424 -10.791 -6.790 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -11.552 -9.615 -9.080 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -12.360 -8.793 -7.760 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -10.680 -7.532 -9.312 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -10.762 -7.171 -7.654 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -9.523 -8.170 -8.245 1.00 0.00 H new ATOM 1896 N LEU B 27 -11.525 -5.570 -3.701 1.00 0.00 N ATOM 1897 CA LEU B 27 -12.428 -4.474 -3.229 1.00 0.00 C ATOM 1898 C LEU B 27 -13.369 -4.034 -4.355 1.00 0.00 C ATOM 1899 O LEU B 27 -12.987 -3.873 -5.498 1.00 0.00 O ATOM 1900 CB LEU B 27 -11.592 -3.258 -2.762 1.00 0.00 C ATOM 1901 CG LEU B 27 -11.192 -3.384 -1.266 1.00 0.00 C ATOM 1902 CD1 LEU B 27 -9.880 -4.164 -1.128 1.00 0.00 C ATOM 1903 CD2 LEU B 27 -11.016 -1.986 -0.670 1.00 0.00 C ATOM 0 H LEU B 27 -10.681 -5.261 -4.183 1.00 0.00 H new ATOM 0 HA LEU B 27 -13.018 -4.853 -2.395 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -10.694 -3.176 -3.374 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -12.165 -2.343 -2.911 1.00 0.00 H new ATOM 0 HG LEU B 27 -11.978 -3.919 -0.734 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -9.613 -4.244 -0.074 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -10.004 -5.162 -1.547 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -9.088 -3.641 -1.664 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -10.735 -2.071 0.380 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -10.234 -1.455 -1.213 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -11.953 -1.435 -0.752 1.00 0.00 H new ATOM 1915 N LYS B 28 -14.598 -3.811 -3.991 1.00 0.00 N ATOM 1916 CA LYS B 28 -15.634 -3.339 -4.961 1.00 0.00 C ATOM 1917 C LYS B 28 -15.970 -1.883 -4.641 1.00 0.00 C ATOM 1918 O LYS B 28 -15.775 -1.433 -3.531 1.00 0.00 O ATOM 1919 CB LYS B 28 -16.902 -4.180 -4.808 1.00 0.00 C ATOM 1920 CG LYS B 28 -16.656 -5.581 -5.362 1.00 0.00 C ATOM 1921 CD LYS B 28 -17.941 -6.402 -5.247 1.00 0.00 C ATOM 1922 CE LYS B 28 -17.814 -7.692 -6.065 1.00 0.00 C ATOM 1923 NZ LYS B 28 -18.217 -7.427 -7.475 1.00 0.00 N ATOM 0 H LYS B 28 -14.941 -3.938 -3.039 1.00 0.00 H new ATOM 0 HA LYS B 28 -15.255 -3.432 -5.979 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -17.188 -4.238 -3.758 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -17.730 -3.708 -5.338 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -16.340 -5.522 -6.404 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -15.850 -6.066 -4.811 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -18.137 -6.642 -4.202 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -18.789 -5.817 -5.604 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -16.788 -8.057 -6.031 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -18.444 -8.471 -5.636 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -18.131 -8.302 -8.031 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -19.203 -7.097 -7.498 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -17.598 -6.697 -7.881 1.00 0.00 H new ATOM 1937 N LYS B 29 -16.470 -1.134 -5.593 1.00 0.00 N ATOM 1938 CA LYS B 29 -16.814 0.297 -5.313 1.00 0.00 C ATOM 1939 C LYS B 29 -17.554 0.384 -3.972 1.00 0.00 C ATOM 1940 O LYS B 29 -17.216 1.175 -3.113 1.00 0.00 O ATOM 1941 CB LYS B 29 -17.724 0.836 -6.423 1.00 0.00 C ATOM 1942 CG LYS B 29 -16.921 1.048 -7.713 1.00 0.00 C ATOM 1943 CD LYS B 29 -17.714 1.940 -8.673 1.00 0.00 C ATOM 1944 CE LYS B 29 -19.037 1.262 -9.031 1.00 0.00 C ATOM 1945 NZ LYS B 29 -19.632 1.929 -10.223 1.00 0.00 N ATOM 0 H LYS B 29 -16.654 -1.448 -6.546 1.00 0.00 H new ATOM 0 HA LYS B 29 -15.899 0.888 -5.273 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -18.540 0.137 -6.605 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -18.175 1.777 -6.108 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -15.960 1.508 -7.483 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -16.710 0.088 -8.184 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -17.904 2.909 -8.212 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -17.133 2.126 -9.576 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -18.871 0.205 -9.238 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -19.726 1.318 -8.188 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -20.532 1.467 -10.466 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -19.804 2.932 -10.010 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -18.976 1.853 -11.027 1.00 0.00 H new ATOM 1959 N SER B 30 -18.554 -0.433 -3.789 1.00 0.00 N ATOM 1960 CA SER B 30 -19.311 -0.415 -2.505 1.00 0.00 C ATOM 1961 C SER B 30 -18.319 -0.474 -1.339 1.00 0.00 C ATOM 1962 O SER B 30 -18.656 -0.182 -0.217 1.00 0.00 O ATOM 1963 CB SER B 30 -20.250 -1.628 -2.450 1.00 0.00 C ATOM 1964 OG SER B 30 -19.613 -2.740 -3.066 1.00 0.00 O ATOM 0 H SER B 30 -18.881 -1.114 -4.475 1.00 0.00 H new ATOM 0 HA SER B 30 -19.902 0.498 -2.435 1.00 0.00 H new ATOM 0 HB2 SER B 30 -20.499 -1.864 -1.415 1.00 0.00 H new ATOM 0 HB3 SER B 30 -21.186 -1.402 -2.960 1.00 0.00 H new ATOM 0 HG SER B 30 -20.210 -3.126 -3.741 1.00 0.00 H new ATOM 1970 N GLU B 31 -17.095 -0.841 -1.608 1.00 0.00 N ATOM 1971 CA GLU B 31 -16.060 -0.912 -0.524 1.00 0.00 C ATOM 1972 C GLU B 31 -15.162 0.319 -0.594 1.00 0.00 C ATOM 1973 O GLU B 31 -14.883 0.958 0.396 1.00 0.00 O ATOM 1974 CB GLU B 31 -15.209 -2.171 -0.703 1.00 0.00 C ATOM 1975 CG GLU B 31 -16.121 -3.396 -0.795 1.00 0.00 C ATOM 1976 CD GLU B 31 -15.269 -4.653 -0.977 1.00 0.00 C ATOM 1977 OE1 GLU B 31 -14.210 -4.719 -0.373 1.00 0.00 O ATOM 1978 OE2 GLU B 31 -15.689 -5.528 -1.714 1.00 0.00 O ATOM 0 H GLU B 31 -16.761 -1.097 -2.537 1.00 0.00 H new ATOM 0 HA GLU B 31 -16.558 -0.947 0.445 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -14.603 -2.088 -1.605 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -14.520 -2.279 0.135 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -16.726 -3.481 0.108 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -16.811 -3.287 -1.632 1.00 0.00 H new ATOM 1985 N LEU B 32 -14.697 0.642 -1.760 1.00 0.00 N ATOM 1986 CA LEU B 32 -13.801 1.810 -1.914 1.00 0.00 C ATOM 1987 C LEU B 32 -14.539 3.090 -1.529 1.00 0.00 C ATOM 1988 O LEU B 32 -13.972 3.975 -0.928 1.00 0.00 O ATOM 1989 CB LEU B 32 -13.313 1.821 -3.368 1.00 0.00 C ATOM 1990 CG LEU B 32 -12.503 3.074 -3.690 1.00 0.00 C ATOM 1991 CD1 LEU B 32 -11.206 3.108 -2.885 1.00 0.00 C ATOM 1992 CD2 LEU B 32 -12.154 3.062 -5.180 1.00 0.00 C ATOM 0 H LEU B 32 -14.902 0.140 -2.624 1.00 0.00 H new ATOM 0 HA LEU B 32 -12.938 1.747 -1.251 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -12.702 0.937 -3.552 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -14.170 1.761 -4.039 1.00 0.00 H new ATOM 0 HG LEU B 32 -13.098 3.951 -3.434 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -10.647 4.011 -3.133 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -11.439 3.106 -1.820 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -10.605 2.231 -3.127 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -11.575 3.952 -5.425 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -11.567 2.173 -5.409 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -13.071 3.053 -5.769 1.00 0.00 H new ATOM 2004 N LYS B 33 -15.798 3.194 -1.825 1.00 0.00 N ATOM 2005 CA LYS B 33 -16.541 4.419 -1.417 1.00 0.00 C ATOM 2006 C LYS B 33 -16.974 4.250 0.044 1.00 0.00 C ATOM 2007 O LYS B 33 -16.999 5.190 0.812 1.00 0.00 O ATOM 2008 CB LYS B 33 -17.767 4.604 -2.327 1.00 0.00 C ATOM 2009 CG LYS B 33 -18.652 5.769 -1.819 1.00 0.00 C ATOM 2010 CD LYS B 33 -19.843 5.225 -1.011 1.00 0.00 C ATOM 2011 CE LYS B 33 -20.979 4.823 -1.957 1.00 0.00 C ATOM 2012 NZ LYS B 33 -21.630 6.050 -2.496 1.00 0.00 N ATOM 0 H LYS B 33 -16.344 2.494 -2.327 1.00 0.00 H new ATOM 0 HA LYS B 33 -15.909 5.302 -1.512 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -17.442 4.805 -3.348 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -18.349 3.683 -2.354 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -18.059 6.440 -1.198 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -19.015 6.354 -2.664 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -19.529 4.364 -0.420 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -20.194 5.982 -0.310 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -20.589 4.216 -2.774 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -21.710 4.213 -1.427 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -22.597 5.823 -2.803 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -21.664 6.779 -1.755 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -21.084 6.405 -3.307 1.00 0.00 H new ATOM 2026 N GLU B 34 -17.334 3.051 0.419 1.00 0.00 N ATOM 2027 CA GLU B 34 -17.792 2.820 1.827 1.00 0.00 C ATOM 2028 C GLU B 34 -16.589 2.772 2.766 1.00 0.00 C ATOM 2029 O GLU B 34 -16.672 3.152 3.916 1.00 0.00 O ATOM 2030 CB GLU B 34 -18.563 1.505 1.931 1.00 0.00 C ATOM 2031 CG GLU B 34 -19.181 1.385 3.326 1.00 0.00 C ATOM 2032 CD GLU B 34 -20.147 0.199 3.356 1.00 0.00 C ATOM 2033 OE1 GLU B 34 -20.032 -0.658 2.495 1.00 0.00 O ATOM 2034 OE2 GLU B 34 -20.986 0.167 4.241 1.00 0.00 O ATOM 0 H GLU B 34 -17.332 2.226 -0.181 1.00 0.00 H new ATOM 0 HA GLU B 34 -18.448 3.642 2.113 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -19.344 1.468 1.171 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -17.896 0.664 1.744 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -18.398 1.249 4.072 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -19.708 2.304 3.582 1.00 0.00 H new ATOM 2041 N LEU B 35 -15.469 2.323 2.283 1.00 0.00 N ATOM 2042 CA LEU B 35 -14.258 2.268 3.144 1.00 0.00 C ATOM 2043 C LEU B 35 -13.764 3.700 3.355 1.00 0.00 C ATOM 2044 O LEU B 35 -13.193 4.030 4.375 1.00 0.00 O ATOM 2045 CB LEU B 35 -13.183 1.423 2.443 1.00 0.00 C ATOM 2046 CG LEU B 35 -11.917 1.304 3.321 1.00 0.00 C ATOM 2047 CD1 LEU B 35 -12.087 0.176 4.343 1.00 0.00 C ATOM 2048 CD2 LEU B 35 -10.708 0.989 2.433 1.00 0.00 C ATOM 0 H LEU B 35 -15.338 1.991 1.328 1.00 0.00 H new ATOM 0 HA LEU B 35 -14.482 1.813 4.109 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -13.577 0.429 2.230 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -12.925 1.876 1.486 1.00 0.00 H new ATOM 0 HG LEU B 35 -11.763 2.247 3.845 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -11.189 0.102 4.956 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -12.945 0.389 4.981 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -12.249 -0.767 3.821 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -9.814 0.905 3.051 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -10.877 0.048 1.909 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -10.572 1.790 1.706 1.00 0.00 H new ATOM 2060 N ILE B 36 -13.987 4.554 2.398 1.00 0.00 N ATOM 2061 CA ILE B 36 -13.541 5.964 2.540 1.00 0.00 C ATOM 2062 C ILE B 36 -14.491 6.706 3.487 1.00 0.00 C ATOM 2063 O ILE B 36 -14.070 7.513 4.294 1.00 0.00 O ATOM 2064 CB ILE B 36 -13.534 6.626 1.159 1.00 0.00 C ATOM 2065 CG1 ILE B 36 -12.373 6.052 0.341 1.00 0.00 C ATOM 2066 CG2 ILE B 36 -13.335 8.134 1.303 1.00 0.00 C ATOM 2067 CD1 ILE B 36 -12.516 6.458 -1.130 1.00 0.00 C ATOM 0 H ILE B 36 -14.460 4.335 1.521 1.00 0.00 H new ATOM 0 HA ILE B 36 -12.535 6.000 2.957 1.00 0.00 H new ATOM 0 HB ILE B 36 -14.485 6.432 0.662 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -11.424 6.415 0.736 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -12.359 4.965 0.427 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -13.331 8.596 0.316 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -14.147 8.553 1.897 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -12.384 8.330 1.799 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -11.686 6.045 -1.704 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -13.456 6.073 -1.524 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -12.507 7.545 -1.210 1.00 0.00 H new ATOM 2079 N ASN B 37 -15.767 6.442 3.401 1.00 0.00 N ATOM 2080 CA ASN B 37 -16.738 7.136 4.303 1.00 0.00 C ATOM 2081 C ASN B 37 -16.799 6.433 5.667 1.00 0.00 C ATOM 2082 O ASN B 37 -17.190 7.021 6.655 1.00 0.00 O ATOM 2083 CB ASN B 37 -18.129 7.125 3.663 1.00 0.00 C ATOM 2084 CG ASN B 37 -19.017 8.164 4.353 1.00 0.00 C ATOM 2085 OD1 ASN B 37 -19.592 9.015 3.705 1.00 0.00 O ATOM 2086 ND2 ASN B 37 -19.150 8.134 5.652 1.00 0.00 N ATOM 0 H ASN B 37 -16.181 5.777 2.747 1.00 0.00 H new ATOM 0 HA ASN B 37 -16.407 8.164 4.450 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -18.053 7.346 2.598 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -18.574 6.134 3.752 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -19.736 8.825 6.121 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -18.668 7.420 6.198 1.00 0.00 H new ATOM 2093 N ASN B 38 -16.460 5.171 5.725 1.00 0.00 N ATOM 2094 CA ASN B 38 -16.544 4.432 7.030 1.00 0.00 C ATOM 2095 C ASN B 38 -15.189 4.421 7.748 1.00 0.00 C ATOM 2096 O ASN B 38 -15.118 4.628 8.943 1.00 0.00 O ATOM 2097 CB ASN B 38 -16.980 2.988 6.763 1.00 0.00 C ATOM 2098 CG ASN B 38 -18.338 2.986 6.059 1.00 0.00 C ATOM 2099 OD1 ASN B 38 -18.603 3.824 5.220 1.00 0.00 O ATOM 2100 ND2 ASN B 38 -19.219 2.073 6.368 1.00 0.00 N ATOM 0 H ASN B 38 -16.130 4.619 4.933 1.00 0.00 H new ATOM 0 HA ASN B 38 -17.269 4.939 7.667 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -16.238 2.481 6.146 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -17.044 2.437 7.701 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -20.128 2.064 5.905 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -18.998 1.369 7.072 1.00 0.00 H new ATOM 2107 N GLU B 39 -14.118 4.163 7.043 1.00 0.00 N ATOM 2108 CA GLU B 39 -12.770 4.117 7.703 1.00 0.00 C ATOM 2109 C GLU B 39 -12.029 5.443 7.481 1.00 0.00 C ATOM 2110 O GLU B 39 -11.822 6.208 8.402 1.00 0.00 O ATOM 2111 CB GLU B 39 -11.963 2.943 7.102 1.00 0.00 C ATOM 2112 CG GLU B 39 -12.118 1.683 7.970 1.00 0.00 C ATOM 2113 CD GLU B 39 -13.595 1.459 8.304 1.00 0.00 C ATOM 2114 OE1 GLU B 39 -14.427 1.800 7.479 1.00 0.00 O ATOM 2115 OE2 GLU B 39 -13.870 0.952 9.380 1.00 0.00 O ATOM 0 H GLU B 39 -14.114 3.982 6.039 1.00 0.00 H new ATOM 0 HA GLU B 39 -12.888 3.968 8.776 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -12.308 2.738 6.088 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -10.910 3.216 7.032 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -11.720 0.816 7.442 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -11.541 1.790 8.888 1.00 0.00 H new ATOM 2122 N LEU B 40 -11.619 5.717 6.274 1.00 0.00 N ATOM 2123 CA LEU B 40 -10.881 6.990 6.016 1.00 0.00 C ATOM 2124 C LEU B 40 -11.868 8.166 6.052 1.00 0.00 C ATOM 2125 O LEU B 40 -11.769 9.085 5.271 1.00 0.00 O ATOM 2126 CB LEU B 40 -10.185 6.936 4.635 1.00 0.00 C ATOM 2127 CG LEU B 40 -9.820 5.493 4.252 1.00 0.00 C ATOM 2128 CD1 LEU B 40 -9.095 5.505 2.907 1.00 0.00 C ATOM 2129 CD2 LEU B 40 -8.900 4.872 5.310 1.00 0.00 C ATOM 0 H LEU B 40 -11.760 5.121 5.459 1.00 0.00 H new ATOM 0 HA LEU B 40 -10.121 7.124 6.786 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -10.843 7.361 3.877 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -9.284 7.549 4.655 1.00 0.00 H new ATOM 0 HG LEU B 40 -10.733 4.902 4.188 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -8.832 4.485 2.626 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -9.747 5.934 2.146 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -8.188 6.105 2.988 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -8.652 3.850 5.022 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -7.985 5.460 5.387 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -9.408 4.864 6.274 1.00 0.00 H new ATOM 2141 N SER B 41 -12.824 8.148 6.947 1.00 0.00 N ATOM 2142 CA SER B 41 -13.812 9.271 7.012 1.00 0.00 C ATOM 2143 C SER B 41 -13.341 10.332 8.014 1.00 0.00 C ATOM 2144 O SER B 41 -13.779 11.465 7.975 1.00 0.00 O ATOM 2145 CB SER B 41 -15.175 8.710 7.448 1.00 0.00 C ATOM 2146 OG SER B 41 -15.536 9.234 8.721 1.00 0.00 O ATOM 0 H SER B 41 -12.964 7.407 7.634 1.00 0.00 H new ATOM 0 HA SER B 41 -13.900 9.736 6.030 1.00 0.00 H new ATOM 0 HB2 SER B 41 -15.936 8.968 6.711 1.00 0.00 H new ATOM 0 HB3 SER B 41 -15.131 7.622 7.493 1.00 0.00 H new ATOM 0 HG SER B 41 -16.406 8.872 8.989 1.00 0.00 H new ATOM 2152 N HIS B 42 -12.454 9.985 8.907 1.00 0.00 N ATOM 2153 CA HIS B 42 -11.962 10.988 9.900 1.00 0.00 C ATOM 2154 C HIS B 42 -10.712 11.664 9.343 1.00 0.00 C ATOM 2155 O HIS B 42 -10.335 12.740 9.764 1.00 0.00 O ATOM 2156 CB HIS B 42 -11.615 10.282 11.214 1.00 0.00 C ATOM 2157 CG HIS B 42 -12.727 9.343 11.591 1.00 0.00 C ATOM 2158 ND1 HIS B 42 -14.057 9.742 11.618 1.00 0.00 N ATOM 2159 CD2 HIS B 42 -12.725 8.021 11.961 1.00 0.00 C ATOM 2160 CE1 HIS B 42 -14.792 8.678 11.993 1.00 0.00 C ATOM 2161 NE2 HIS B 42 -14.028 7.608 12.214 1.00 0.00 N ATOM 0 H HIS B 42 -12.048 9.053 8.993 1.00 0.00 H new ATOM 0 HA HIS B 42 -12.736 11.733 10.085 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -10.681 9.731 11.107 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -11.463 11.017 12.004 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -11.847 7.398 12.043 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -15.866 8.690 12.101 1.00 0.00 H new ATOM 0 HE2 HIS B 42 -14.335 6.681 12.507 1.00 0.00 H new ATOM 2170 N PHE B 43 -10.070 11.033 8.392 1.00 0.00 N ATOM 2171 CA PHE B 43 -8.833 11.614 7.778 1.00 0.00 C ATOM 2172 C PHE B 43 -9.162 12.073 6.355 1.00 0.00 C ATOM 2173 O PHE B 43 -8.718 13.116 5.916 1.00 0.00 O ATOM 2174 CB PHE B 43 -7.725 10.527 7.766 1.00 0.00 C ATOM 2175 CG PHE B 43 -6.459 11.045 8.424 1.00 0.00 C ATOM 2176 CD1 PHE B 43 -5.678 12.007 7.772 1.00 0.00 C ATOM 2177 CD2 PHE B 43 -6.071 10.564 9.682 1.00 0.00 C ATOM 2178 CE1 PHE B 43 -4.511 12.488 8.378 1.00 0.00 C ATOM 2179 CE2 PHE B 43 -4.904 11.046 10.287 1.00 0.00 C ATOM 2180 CZ PHE B 43 -4.123 12.007 9.634 1.00 0.00 C ATOM 0 H PHE B 43 -10.352 10.130 8.010 1.00 0.00 H new ATOM 0 HA PHE B 43 -8.478 12.471 8.351 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -8.075 9.638 8.290 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -7.512 10.229 6.739 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -5.976 12.378 6.802 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -6.672 9.821 10.185 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -3.909 13.231 7.876 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -4.606 10.677 11.257 1.00 0.00 H new ATOM 0 HZ PHE B 43 -3.221 12.377 10.099 1.00 0.00 H new ATOM 2190 N LEU B 44 -9.947 11.309 5.637 1.00 0.00 N ATOM 2191 CA LEU B 44 -10.321 11.703 4.243 1.00 0.00 C ATOM 2192 C LEU B 44 -11.743 12.272 4.264 1.00 0.00 C ATOM 2193 O LEU B 44 -12.620 11.759 4.933 1.00 0.00 O ATOM 2194 CB LEU B 44 -10.243 10.462 3.320 1.00 0.00 C ATOM 2195 CG LEU B 44 -9.737 10.851 1.915 1.00 0.00 C ATOM 2196 CD1 LEU B 44 -8.283 11.372 1.982 1.00 0.00 C ATOM 2197 CD2 LEU B 44 -9.804 9.615 1.007 1.00 0.00 C ATOM 0 H LEU B 44 -10.346 10.427 5.957 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.635 12.460 3.862 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -9.576 9.719 3.758 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -11.227 10.000 3.241 1.00 0.00 H new ATOM 0 HG LEU B 44 -10.365 11.647 1.515 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -7.946 11.641 0.981 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -8.240 12.250 2.627 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -7.636 10.593 2.386 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -9.449 9.876 0.010 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -9.177 8.825 1.420 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -10.834 9.265 0.945 1.00 0.00 H new ATOM 2209 N GLU B 45 -11.973 13.332 3.545 1.00 0.00 N ATOM 2210 CA GLU B 45 -13.333 13.946 3.529 1.00 0.00 C ATOM 2211 C GLU B 45 -14.383 12.856 3.299 1.00 0.00 C ATOM 2212 O GLU B 45 -14.246 12.018 2.428 1.00 0.00 O ATOM 2213 CB GLU B 45 -13.412 14.976 2.398 1.00 0.00 C ATOM 2214 CG GLU B 45 -12.639 16.235 2.795 1.00 0.00 C ATOM 2215 CD GLU B 45 -12.578 17.194 1.605 1.00 0.00 C ATOM 2216 OE1 GLU B 45 -13.574 17.852 1.348 1.00 0.00 O ATOM 2217 OE2 GLU B 45 -11.538 17.256 0.969 1.00 0.00 O ATOM 0 H GLU B 45 -11.278 13.803 2.965 1.00 0.00 H new ATOM 0 HA GLU B 45 -13.522 14.437 4.484 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -12.998 14.557 1.481 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -14.453 15.226 2.192 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -13.124 16.720 3.642 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -11.631 15.970 3.114 1.00 0.00 H new ATOM 2224 N GLU B 46 -15.428 12.859 4.084 1.00 0.00 N ATOM 2225 CA GLU B 46 -16.489 11.823 3.930 1.00 0.00 C ATOM 2226 C GLU B 46 -17.015 11.826 2.493 1.00 0.00 C ATOM 2227 O GLU B 46 -18.012 12.446 2.185 1.00 0.00 O ATOM 2228 CB GLU B 46 -17.637 12.117 4.910 1.00 0.00 C ATOM 2229 CG GLU B 46 -18.194 13.542 4.685 1.00 0.00 C ATOM 2230 CD GLU B 46 -18.711 14.119 6.008 1.00 0.00 C ATOM 2231 OE1 GLU B 46 -17.907 14.297 6.908 1.00 0.00 O ATOM 2232 OE2 GLU B 46 -19.901 14.374 6.096 1.00 0.00 O ATOM 0 H GLU B 46 -15.592 13.537 4.828 1.00 0.00 H new ATOM 0 HA GLU B 46 -16.070 10.841 4.150 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -18.433 11.384 4.776 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -17.281 12.018 5.936 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -17.414 14.186 4.278 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -19.000 13.515 3.951 1.00 0.00 H new ATOM 2239 N ILE B 47 -16.358 11.132 1.610 1.00 0.00 N ATOM 2240 CA ILE B 47 -16.833 11.095 0.200 1.00 0.00 C ATOM 2241 C ILE B 47 -18.286 10.601 0.186 1.00 0.00 C ATOM 2242 O ILE B 47 -18.595 9.538 0.686 1.00 0.00 O ATOM 2243 CB ILE B 47 -15.907 10.155 -0.612 1.00 0.00 C ATOM 2244 CG1 ILE B 47 -14.690 10.959 -1.121 1.00 0.00 C ATOM 2245 CG2 ILE B 47 -16.652 9.538 -1.805 1.00 0.00 C ATOM 2246 CD1 ILE B 47 -13.666 10.048 -1.825 1.00 0.00 C ATOM 0 H ILE B 47 -15.515 10.590 1.801 1.00 0.00 H new ATOM 0 HA ILE B 47 -16.800 12.085 -0.254 1.00 0.00 H new ATOM 0 HB ILE B 47 -15.578 9.345 0.038 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -15.026 11.732 -1.812 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -14.212 11.467 -0.283 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -15.977 8.883 -2.356 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -17.503 8.961 -1.443 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -17.005 10.332 -2.463 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -12.823 10.647 -2.170 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -13.311 9.291 -1.126 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -14.138 9.561 -2.678 1.00 0.00 H new ATOM 2258 N LYS B 48 -19.175 11.376 -0.388 1.00 0.00 N ATOM 2259 CA LYS B 48 -20.619 10.980 -0.454 1.00 0.00 C ATOM 2260 C LYS B 48 -21.008 10.773 -1.918 1.00 0.00 C ATOM 2261 O LYS B 48 -22.014 10.165 -2.225 1.00 0.00 O ATOM 2262 CB LYS B 48 -21.478 12.098 0.150 1.00 0.00 C ATOM 2263 CG LYS B 48 -22.885 11.567 0.435 1.00 0.00 C ATOM 2264 CD LYS B 48 -23.780 12.719 0.898 1.00 0.00 C ATOM 2265 CE LYS B 48 -25.217 12.218 1.061 1.00 0.00 C ATOM 2266 NZ LYS B 48 -25.278 11.238 2.183 1.00 0.00 N ATOM 0 H LYS B 48 -18.960 12.275 -0.818 1.00 0.00 H new ATOM 0 HA LYS B 48 -20.779 10.058 0.105 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -21.023 12.463 1.071 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -21.529 12.943 -0.537 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -23.300 11.107 -0.462 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -22.845 10.793 1.201 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -23.414 13.120 1.843 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -23.748 13.532 0.173 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -25.885 13.056 1.259 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -25.557 11.751 0.137 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -26.270 11.078 2.450 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -24.851 10.339 1.882 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -24.756 11.613 3.000 1.00 0.00 H new ATOM 2280 N GLU B 49 -20.204 11.266 -2.825 1.00 0.00 N ATOM 2281 CA GLU B 49 -20.500 11.097 -4.279 1.00 0.00 C ATOM 2282 C GLU B 49 -19.654 9.942 -4.819 1.00 0.00 C ATOM 2283 O GLU B 49 -18.587 9.657 -4.312 1.00 0.00 O ATOM 2284 CB GLU B 49 -20.143 12.386 -5.025 1.00 0.00 C ATOM 2285 CG GLU B 49 -21.071 13.514 -4.568 1.00 0.00 C ATOM 2286 CD GLU B 49 -20.647 14.827 -5.232 1.00 0.00 C ATOM 2287 OE1 GLU B 49 -20.306 14.792 -6.403 1.00 0.00 O ATOM 2288 OE2 GLU B 49 -20.670 15.843 -4.558 1.00 0.00 O ATOM 0 H GLU B 49 -19.349 11.782 -2.619 1.00 0.00 H new ATOM 0 HA GLU B 49 -21.559 10.882 -4.423 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -19.104 12.655 -4.832 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -20.239 12.235 -6.100 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -22.103 13.279 -4.830 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -21.032 13.614 -3.483 1.00 0.00 H new ATOM 2295 N GLN B 50 -20.120 9.267 -5.834 1.00 0.00 N ATOM 2296 CA GLN B 50 -19.340 8.123 -6.398 1.00 0.00 C ATOM 2297 C GLN B 50 -18.462 8.615 -7.551 1.00 0.00 C ATOM 2298 O GLN B 50 -17.418 8.058 -7.830 1.00 0.00 O ATOM 2299 CB GLN B 50 -20.311 7.062 -6.921 1.00 0.00 C ATOM 2300 CG GLN B 50 -21.161 6.535 -5.763 1.00 0.00 C ATOM 2301 CD GLN B 50 -22.269 5.633 -6.312 1.00 0.00 C ATOM 2302 OE1 GLN B 50 -22.337 5.388 -7.500 1.00 0.00 O ATOM 2303 NE2 GLN B 50 -23.148 5.127 -5.490 1.00 0.00 N ATOM 0 H GLN B 50 -21.008 9.457 -6.299 1.00 0.00 H new ATOM 0 HA GLN B 50 -18.708 7.696 -5.619 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -20.952 7.489 -7.692 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -19.758 6.244 -7.383 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -20.537 5.978 -5.064 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -21.596 7.367 -5.209 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -23.091 5.333 -4.493 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -23.892 4.526 -5.845 1.00 0.00 H new ATOM 2312 N GLU B 51 -18.881 9.646 -8.231 1.00 0.00 N ATOM 2313 CA GLU B 51 -18.085 10.163 -9.373 1.00 0.00 C ATOM 2314 C GLU B 51 -16.629 10.325 -8.961 1.00 0.00 C ATOM 2315 O GLU B 51 -15.730 10.169 -9.765 1.00 0.00 O ATOM 2316 CB GLU B 51 -18.646 11.513 -9.827 1.00 0.00 C ATOM 2317 CG GLU B 51 -20.162 11.406 -10.002 1.00 0.00 C ATOM 2318 CD GLU B 51 -20.690 12.685 -10.655 1.00 0.00 C ATOM 2319 OE1 GLU B 51 -19.978 13.249 -11.469 1.00 0.00 O ATOM 2320 OE2 GLU B 51 -21.798 13.080 -10.327 1.00 0.00 O ATOM 0 H GLU B 51 -19.745 10.153 -8.042 1.00 0.00 H new ATOM 0 HA GLU B 51 -18.145 9.453 -10.198 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -18.408 12.283 -9.093 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -18.182 11.814 -10.766 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -20.408 10.542 -10.619 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -20.641 11.254 -9.035 1.00 0.00 H new ATOM 2327 N VAL B 52 -16.371 10.615 -7.719 1.00 0.00 N ATOM 2328 CA VAL B 52 -14.958 10.752 -7.290 1.00 0.00 C ATOM 2329 C VAL B 52 -14.369 9.363 -7.180 1.00 0.00 C ATOM 2330 O VAL B 52 -13.233 9.126 -7.539 1.00 0.00 O ATOM 2331 CB VAL B 52 -14.879 11.470 -5.943 1.00 0.00 C ATOM 2332 CG1 VAL B 52 -15.579 10.628 -4.877 1.00 0.00 C ATOM 2333 CG2 VAL B 52 -13.411 11.672 -5.556 1.00 0.00 C ATOM 0 H VAL B 52 -17.070 10.761 -6.991 1.00 0.00 H new ATOM 0 HA VAL B 52 -14.399 11.343 -8.016 1.00 0.00 H new ATOM 0 HB VAL B 52 -15.369 12.441 -6.018 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -15.524 11.139 -3.916 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -16.624 10.487 -5.153 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -15.089 9.657 -4.801 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -13.355 12.184 -4.595 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -12.918 10.703 -5.480 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -12.913 12.273 -6.317 1.00 0.00 H new ATOM 2343 N VAL B 53 -15.140 8.430 -6.714 1.00 0.00 N ATOM 2344 CA VAL B 53 -14.625 7.048 -6.617 1.00 0.00 C ATOM 2345 C VAL B 53 -14.435 6.551 -8.044 1.00 0.00 C ATOM 2346 O VAL B 53 -13.636 5.676 -8.314 1.00 0.00 O ATOM 2347 CB VAL B 53 -15.598 6.167 -5.777 1.00 0.00 C ATOM 2348 CG1 VAL B 53 -16.448 5.234 -6.646 1.00 0.00 C ATOM 2349 CG2 VAL B 53 -14.789 5.317 -4.800 1.00 0.00 C ATOM 0 H VAL B 53 -16.100 8.565 -6.398 1.00 0.00 H new ATOM 0 HA VAL B 53 -13.670 6.999 -6.095 1.00 0.00 H new ATOM 0 HB VAL B 53 -16.273 6.843 -5.252 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -17.107 4.644 -6.009 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -17.047 5.826 -7.338 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -15.796 4.567 -7.210 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -15.465 4.699 -4.210 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -14.104 4.677 -5.356 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -14.220 5.968 -4.136 1.00 0.00 H new ATOM 2359 N ASP B 54 -15.143 7.144 -8.965 1.00 0.00 N ATOM 2360 CA ASP B 54 -14.979 6.750 -10.385 1.00 0.00 C ATOM 2361 C ASP B 54 -13.681 7.383 -10.879 1.00 0.00 C ATOM 2362 O ASP B 54 -12.992 6.852 -11.727 1.00 0.00 O ATOM 2363 CB ASP B 54 -16.159 7.269 -11.209 1.00 0.00 C ATOM 2364 CG ASP B 54 -16.038 6.766 -12.649 1.00 0.00 C ATOM 2365 OD1 ASP B 54 -14.958 6.338 -13.018 1.00 0.00 O ATOM 2366 OD2 ASP B 54 -17.029 6.819 -13.359 1.00 0.00 O ATOM 0 H ASP B 54 -15.825 7.882 -8.793 1.00 0.00 H new ATOM 0 HA ASP B 54 -14.946 5.665 -10.487 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -17.098 6.930 -10.772 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -16.175 8.359 -11.194 1.00 0.00 H new ATOM 2371 N LYS B 55 -13.342 8.523 -10.329 1.00 0.00 N ATOM 2372 CA LYS B 55 -12.081 9.217 -10.733 1.00 0.00 C ATOM 2373 C LYS B 55 -10.905 8.606 -9.948 1.00 0.00 C ATOM 2374 O LYS B 55 -9.918 8.201 -10.530 1.00 0.00 O ATOM 2375 CB LYS B 55 -12.259 10.749 -10.487 1.00 0.00 C ATOM 2376 CG LYS B 55 -11.080 11.411 -9.731 1.00 0.00 C ATOM 2377 CD LYS B 55 -9.837 11.478 -10.623 1.00 0.00 C ATOM 2378 CE LYS B 55 -8.730 12.233 -9.891 1.00 0.00 C ATOM 2379 NZ LYS B 55 -7.503 12.261 -10.739 1.00 0.00 N ATOM 0 H LYS B 55 -13.888 9.004 -9.614 1.00 0.00 H new ATOM 0 HA LYS B 55 -11.862 9.081 -11.792 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -12.386 11.248 -11.448 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -13.176 10.911 -9.920 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -11.362 12.415 -9.415 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -10.856 10.844 -8.828 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -9.502 10.472 -10.875 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -10.075 11.979 -11.561 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -9.054 13.249 -9.668 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -8.515 11.751 -8.937 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -6.880 13.031 -10.423 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -7.002 11.354 -10.655 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -7.771 12.418 -11.732 1.00 0.00 H new ATOM 2393 N VAL B 56 -10.990 8.534 -8.641 1.00 0.00 N ATOM 2394 CA VAL B 56 -9.865 7.948 -7.849 1.00 0.00 C ATOM 2395 C VAL B 56 -9.425 6.639 -8.508 1.00 0.00 C ATOM 2396 O VAL B 56 -8.250 6.373 -8.665 1.00 0.00 O ATOM 2397 CB VAL B 56 -10.326 7.733 -6.393 1.00 0.00 C ATOM 2398 CG1 VAL B 56 -11.012 6.377 -6.228 1.00 0.00 C ATOM 2399 CG2 VAL B 56 -9.119 7.800 -5.447 1.00 0.00 C ATOM 0 H VAL B 56 -11.787 8.855 -8.091 1.00 0.00 H new ATOM 0 HA VAL B 56 -9.010 8.623 -7.831 1.00 0.00 H new ATOM 0 HB VAL B 56 -11.038 8.521 -6.147 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -11.327 6.252 -5.192 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -11.884 6.329 -6.880 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -10.315 5.582 -6.494 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -9.452 7.647 -4.421 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -8.403 7.023 -5.715 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -8.644 8.777 -5.532 1.00 0.00 H new ATOM 2409 N MET B 57 -10.364 5.835 -8.917 1.00 0.00 N ATOM 2410 CA MET B 57 -10.000 4.560 -9.593 1.00 0.00 C ATOM 2411 C MET B 57 -9.287 4.883 -10.906 1.00 0.00 C ATOM 2412 O MET B 57 -8.424 4.158 -11.353 1.00 0.00 O ATOM 2413 CB MET B 57 -11.266 3.761 -9.891 1.00 0.00 C ATOM 2414 CG MET B 57 -11.847 3.232 -8.584 1.00 0.00 C ATOM 2415 SD MET B 57 -13.523 2.611 -8.886 1.00 0.00 S ATOM 2416 CE MET B 57 -13.279 0.936 -8.248 1.00 0.00 C ATOM 0 H MET B 57 -11.365 6.004 -8.813 1.00 0.00 H new ATOM 0 HA MET B 57 -9.346 3.974 -8.947 1.00 0.00 H new ATOM 0 HB2 MET B 57 -11.997 4.391 -10.398 1.00 0.00 H new ATOM 0 HB3 MET B 57 -11.038 2.933 -10.562 1.00 0.00 H new ATOM 0 HG2 MET B 57 -11.217 2.436 -8.188 1.00 0.00 H new ATOM 0 HG3 MET B 57 -11.869 4.024 -7.835 1.00 0.00 H new ATOM 0 HE1 MET B 57 -14.165 0.336 -8.454 1.00 0.00 H new ATOM 0 HE2 MET B 57 -12.414 0.484 -8.733 1.00 0.00 H new ATOM 0 HE3 MET B 57 -13.111 0.977 -7.172 1.00 0.00 H new ATOM 2426 N GLU B 58 -9.641 5.975 -11.525 1.00 0.00 N ATOM 2427 CA GLU B 58 -8.982 6.351 -12.807 1.00 0.00 C ATOM 2428 C GLU B 58 -7.491 6.550 -12.559 1.00 0.00 C ATOM 2429 O GLU B 58 -6.666 6.293 -13.413 1.00 0.00 O ATOM 2430 CB GLU B 58 -9.600 7.653 -13.331 1.00 0.00 C ATOM 2431 CG GLU B 58 -9.304 7.811 -14.825 1.00 0.00 C ATOM 2432 CD GLU B 58 -10.068 9.021 -15.367 1.00 0.00 C ATOM 2433 OE1 GLU B 58 -11.288 8.998 -15.314 1.00 0.00 O ATOM 2434 OE2 GLU B 58 -9.424 9.948 -15.824 1.00 0.00 O ATOM 0 H GLU B 58 -10.358 6.623 -11.199 1.00 0.00 H new ATOM 0 HA GLU B 58 -9.126 5.563 -13.546 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -10.677 7.646 -13.164 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -9.197 8.503 -12.780 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -8.234 7.942 -14.983 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -9.598 6.910 -15.363 1.00 0.00 H new ATOM 2441 N THR B 59 -7.140 7.005 -11.388 1.00 0.00 N ATOM 2442 CA THR B 59 -5.703 7.221 -11.069 1.00 0.00 C ATOM 2443 C THR B 59 -5.121 5.949 -10.461 1.00 0.00 C ATOM 2444 O THR B 59 -3.960 5.640 -10.643 1.00 0.00 O ATOM 2445 CB THR B 59 -5.572 8.365 -10.064 1.00 0.00 C ATOM 2446 OG1 THR B 59 -6.149 9.543 -10.611 1.00 0.00 O ATOM 2447 CG2 THR B 59 -4.095 8.609 -9.767 1.00 0.00 C ATOM 0 H THR B 59 -7.790 7.237 -10.637 1.00 0.00 H new ATOM 0 HA THR B 59 -5.162 7.471 -11.982 1.00 0.00 H new ATOM 0 HB THR B 59 -6.090 8.104 -9.141 1.00 0.00 H new ATOM 0 HG1 THR B 59 -7.124 9.500 -10.525 1.00 0.00 H new ATOM 0 HG21 THR B 59 -3.998 9.425 -9.050 1.00 0.00 H new ATOM 0 HG22 THR B 59 -3.654 7.704 -9.349 1.00 0.00 H new ATOM 0 HG23 THR B 59 -3.577 8.873 -10.689 1.00 0.00 H new ATOM 2455 N LEU B 60 -5.912 5.210 -9.729 1.00 0.00 N ATOM 2456 CA LEU B 60 -5.385 3.957 -9.099 1.00 0.00 C ATOM 2457 C LEU B 60 -5.560 2.769 -10.050 1.00 0.00 C ATOM 2458 O LEU B 60 -4.663 1.965 -10.208 1.00 0.00 O ATOM 2459 CB LEU B 60 -6.139 3.683 -7.785 1.00 0.00 C ATOM 2460 CG LEU B 60 -5.457 4.394 -6.606 1.00 0.00 C ATOM 2461 CD1 LEU B 60 -4.049 3.804 -6.344 1.00 0.00 C ATOM 2462 CD2 LEU B 60 -5.353 5.896 -6.904 1.00 0.00 C ATOM 0 H LEU B 60 -6.893 5.415 -9.539 1.00 0.00 H new ATOM 0 HA LEU B 60 -4.323 4.087 -8.890 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -7.170 4.025 -7.874 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -6.174 2.610 -7.597 1.00 0.00 H new ATOM 0 HG LEU B 60 -6.059 4.241 -5.710 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -3.587 4.324 -5.505 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -4.137 2.743 -6.110 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -3.431 3.929 -7.233 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -4.869 6.400 -6.067 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -4.764 6.048 -7.809 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -6.352 6.308 -7.048 1.00 0.00 H new ATOM 2474 N ASP B 61 -6.689 2.638 -10.687 1.00 0.00 N ATOM 2475 CA ASP B 61 -6.887 1.492 -11.621 1.00 0.00 C ATOM 2476 C ASP B 61 -5.790 1.489 -12.675 1.00 0.00 C ATOM 2477 O ASP B 61 -5.863 2.165 -13.682 1.00 0.00 O ATOM 2478 CB ASP B 61 -8.254 1.628 -12.281 1.00 0.00 C ATOM 2479 CG ASP B 61 -8.644 0.304 -12.940 1.00 0.00 C ATOM 2480 OD1 ASP B 61 -7.887 -0.644 -12.816 1.00 0.00 O ATOM 2481 OD2 ASP B 61 -9.695 0.262 -13.559 1.00 0.00 O ATOM 0 H ASP B 61 -7.483 3.273 -10.603 1.00 0.00 H new ATOM 0 HA ASP B 61 -6.840 0.552 -11.072 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -9.001 1.909 -11.538 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -8.231 2.423 -13.026 1.00 0.00 H new ATOM 2486 N GLU B 62 -4.771 0.716 -12.437 1.00 0.00 N ATOM 2487 CA GLU B 62 -3.641 0.631 -13.404 1.00 0.00 C ATOM 2488 C GLU B 62 -3.929 -0.488 -14.392 1.00 0.00 C ATOM 2489 O GLU B 62 -3.642 -0.385 -15.569 1.00 0.00 O ATOM 2490 CB GLU B 62 -2.336 0.342 -12.656 1.00 0.00 C ATOM 2491 CG GLU B 62 -2.471 -0.960 -11.862 1.00 0.00 C ATOM 2492 CD GLU B 62 -1.309 -1.075 -10.874 1.00 0.00 C ATOM 2493 OE1 GLU B 62 -1.251 -0.268 -9.961 1.00 0.00 O ATOM 2494 OE2 GLU B 62 -0.495 -1.966 -11.049 1.00 0.00 O ATOM 0 H GLU B 62 -4.670 0.133 -11.606 1.00 0.00 H new ATOM 0 HA GLU B 62 -3.536 1.577 -13.936 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -1.510 0.263 -13.363 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -2.102 1.167 -11.983 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -3.421 -0.976 -11.327 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -2.473 -1.814 -12.540 1.00 0.00 H new ATOM 2501 N ASP B 63 -4.517 -1.552 -13.927 1.00 0.00 N ATOM 2502 CA ASP B 63 -4.849 -2.668 -14.845 1.00 0.00 C ATOM 2503 C ASP B 63 -6.156 -2.325 -15.552 1.00 0.00 C ATOM 2504 O ASP B 63 -6.621 -3.054 -16.406 1.00 0.00 O ATOM 2505 CB ASP B 63 -5.023 -3.961 -14.042 1.00 0.00 C ATOM 2506 CG ASP B 63 -5.936 -3.700 -12.842 1.00 0.00 C ATOM 2507 OD1 ASP B 63 -6.364 -2.568 -12.685 1.00 0.00 O ATOM 2508 OD2 ASP B 63 -6.191 -4.635 -12.102 1.00 0.00 O ATOM 0 H ASP B 63 -4.781 -1.695 -12.952 1.00 0.00 H new ATOM 0 HA ASP B 63 -4.050 -2.811 -15.572 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -5.450 -4.739 -14.674 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -4.053 -4.323 -13.702 1.00 0.00 H new ATOM 2513 N GLY B 64 -6.759 -1.216 -15.203 1.00 0.00 N ATOM 2514 CA GLY B 64 -8.038 -0.844 -15.864 1.00 0.00 C ATOM 2515 C GLY B 64 -9.071 -1.916 -15.538 1.00 0.00 C ATOM 2516 O GLY B 64 -9.782 -2.390 -16.401 1.00 0.00 O ATOM 0 H GLY B 64 -6.422 -0.562 -14.497 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -8.378 0.131 -15.513 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -7.900 -0.765 -16.942 1.00 0.00 H new ATOM 2520 N ASP B 65 -9.148 -2.317 -14.293 1.00 0.00 N ATOM 2521 CA ASP B 65 -10.125 -3.379 -13.904 1.00 0.00 C ATOM 2522 C ASP B 65 -11.365 -2.734 -13.298 1.00 0.00 C ATOM 2523 O ASP B 65 -12.338 -3.399 -13.000 1.00 0.00 O ATOM 2524 CB ASP B 65 -9.478 -4.300 -12.867 1.00 0.00 C ATOM 2525 CG ASP B 65 -9.062 -3.478 -11.646 1.00 0.00 C ATOM 2526 OD1 ASP B 65 -9.295 -2.280 -11.656 1.00 0.00 O ATOM 2527 OD2 ASP B 65 -8.519 -4.061 -10.721 1.00 0.00 O ATOM 0 H ASP B 65 -8.576 -1.955 -13.530 1.00 0.00 H new ATOM 0 HA ASP B 65 -10.409 -3.954 -14.785 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -10.178 -5.082 -12.572 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -8.609 -4.797 -13.298 1.00 0.00 H new ATOM 2532 N GLY B 66 -11.343 -1.447 -13.102 1.00 0.00 N ATOM 2533 CA GLY B 66 -12.531 -0.781 -12.502 1.00 0.00 C ATOM 2534 C GLY B 66 -12.678 -1.263 -11.065 1.00 0.00 C ATOM 2535 O GLY B 66 -13.557 -0.841 -10.340 1.00 0.00 O ATOM 0 H GLY B 66 -10.562 -0.832 -13.329 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -12.412 0.302 -12.528 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -13.428 -1.017 -13.075 1.00 0.00 H new ATOM 2539 N GLU B 67 -11.800 -2.135 -10.650 1.00 0.00 N ATOM 2540 CA GLU B 67 -11.825 -2.663 -9.255 1.00 0.00 C ATOM 2541 C GLU B 67 -10.462 -2.364 -8.638 1.00 0.00 C ATOM 2542 O GLU B 67 -9.587 -1.843 -9.302 1.00 0.00 O ATOM 2543 CB GLU B 67 -12.070 -4.181 -9.277 1.00 0.00 C ATOM 2544 CG GLU B 67 -13.574 -4.464 -9.376 1.00 0.00 C ATOM 2545 CD GLU B 67 -14.107 -3.957 -10.718 1.00 0.00 C ATOM 2546 OE1 GLU B 67 -13.914 -4.644 -11.707 1.00 0.00 O ATOM 2547 OE2 GLU B 67 -14.702 -2.892 -10.732 1.00 0.00 O ATOM 0 H GLU B 67 -11.051 -2.511 -11.231 1.00 0.00 H new ATOM 0 HA GLU B 67 -12.623 -2.198 -8.676 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -11.550 -4.630 -10.123 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -11.664 -4.637 -8.374 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -13.760 -5.534 -9.281 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -14.101 -3.975 -8.556 1.00 0.00 H new ATOM 2554 N CYS B 68 -10.268 -2.673 -7.383 1.00 0.00 N ATOM 2555 CA CYS B 68 -8.948 -2.391 -6.729 1.00 0.00 C ATOM 2556 C CYS B 68 -8.410 -3.652 -6.052 1.00 0.00 C ATOM 2557 O CYS B 68 -8.650 -3.881 -4.882 1.00 0.00 O ATOM 2558 CB CYS B 68 -9.138 -1.302 -5.671 1.00 0.00 C ATOM 2559 SG CYS B 68 -9.796 0.192 -6.453 1.00 0.00 S ATOM 0 H CYS B 68 -10.965 -3.109 -6.779 1.00 0.00 H new ATOM 0 HA CYS B 68 -8.238 -2.063 -7.489 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -9.820 -1.649 -4.895 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -8.187 -1.082 -5.185 1.00 0.00 H new ATOM 0 HG CYS B 68 -9.569 1.218 -5.688 1.00 0.00 H new ATOM 2565 N ASP B 69 -7.688 -4.475 -6.772 1.00 0.00 N ATOM 2566 CA ASP B 69 -7.132 -5.714 -6.156 1.00 0.00 C ATOM 2567 C ASP B 69 -6.370 -5.331 -4.880 1.00 0.00 C ATOM 2568 O ASP B 69 -6.399 -4.195 -4.462 1.00 0.00 O ATOM 2569 CB ASP B 69 -6.193 -6.394 -7.157 1.00 0.00 C ATOM 2570 CG ASP B 69 -5.626 -7.678 -6.552 1.00 0.00 C ATOM 2571 OD1 ASP B 69 -6.411 -8.550 -6.219 1.00 0.00 O ATOM 2572 OD2 ASP B 69 -4.415 -7.765 -6.433 1.00 0.00 O ATOM 0 H ASP B 69 -7.461 -4.341 -7.757 1.00 0.00 H new ATOM 0 HA ASP B 69 -7.934 -6.407 -5.900 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -6.732 -6.622 -8.076 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -5.381 -5.718 -7.423 1.00 0.00 H new ATOM 2577 N PHE B 70 -5.694 -6.252 -4.247 1.00 0.00 N ATOM 2578 CA PHE B 70 -4.959 -5.911 -2.992 1.00 0.00 C ATOM 2579 C PHE B 70 -3.681 -5.109 -3.295 1.00 0.00 C ATOM 2580 O PHE B 70 -3.227 -4.324 -2.486 1.00 0.00 O ATOM 2581 CB PHE B 70 -4.591 -7.214 -2.258 1.00 0.00 C ATOM 2582 CG PHE B 70 -4.358 -8.328 -3.261 1.00 0.00 C ATOM 2583 CD1 PHE B 70 -3.194 -8.344 -4.041 1.00 0.00 C ATOM 2584 CD2 PHE B 70 -5.305 -9.350 -3.404 1.00 0.00 C ATOM 2585 CE1 PHE B 70 -2.980 -9.377 -4.961 1.00 0.00 C ATOM 2586 CE2 PHE B 70 -5.092 -10.382 -4.326 1.00 0.00 C ATOM 2587 CZ PHE B 70 -3.930 -10.396 -5.104 1.00 0.00 C ATOM 0 H PHE B 70 -5.618 -7.225 -4.543 1.00 0.00 H new ATOM 0 HA PHE B 70 -5.604 -5.293 -2.366 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.695 -7.062 -1.657 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -5.391 -7.493 -1.572 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -2.461 -7.558 -3.932 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -6.201 -9.342 -2.802 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.082 -9.388 -5.561 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -5.825 -11.167 -4.436 1.00 0.00 H new ATOM 0 HZ PHE B 70 -3.765 -11.192 -5.815 1.00 0.00 H new ATOM 2597 N GLN B 71 -3.085 -5.329 -4.427 1.00 0.00 N ATOM 2598 CA GLN B 71 -1.822 -4.621 -4.765 1.00 0.00 C ATOM 2599 C GLN B 71 -2.089 -3.139 -5.036 1.00 0.00 C ATOM 2600 O GLN B 71 -1.332 -2.270 -4.638 1.00 0.00 O ATOM 2601 CB GLN B 71 -1.210 -5.275 -6.006 1.00 0.00 C ATOM 2602 CG GLN B 71 0.097 -4.576 -6.349 1.00 0.00 C ATOM 2603 CD GLN B 71 0.871 -5.408 -7.374 1.00 0.00 C ATOM 2604 OE1 GLN B 71 1.153 -4.945 -8.460 1.00 0.00 O ATOM 2605 NE2 GLN B 71 1.226 -6.627 -7.073 1.00 0.00 N ATOM 0 H GLN B 71 -3.421 -5.975 -5.141 1.00 0.00 H new ATOM 0 HA GLN B 71 -1.132 -4.693 -3.924 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -1.032 -6.335 -5.823 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -1.902 -5.209 -6.845 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -0.105 -3.583 -6.750 1.00 0.00 H new ATOM 0 HG3 GLN B 71 0.696 -4.441 -5.448 1.00 0.00 H new ATOM 0 HE21 GLN B 71 0.989 -7.017 -6.161 1.00 0.00 H new ATOM 0 HE22 GLN B 71 1.740 -7.190 -7.750 1.00 0.00 H new ATOM 2614 N GLU B 72 -3.167 -2.837 -5.692 1.00 0.00 N ATOM 2615 CA GLU B 72 -3.493 -1.414 -5.987 1.00 0.00 C ATOM 2616 C GLU B 72 -4.320 -0.843 -4.839 1.00 0.00 C ATOM 2617 O GLU B 72 -4.189 0.307 -4.478 1.00 0.00 O ATOM 2618 CB GLU B 72 -4.280 -1.383 -7.302 1.00 0.00 C ATOM 2619 CG GLU B 72 -4.812 0.024 -7.616 1.00 0.00 C ATOM 2620 CD GLU B 72 -5.715 -0.061 -8.839 1.00 0.00 C ATOM 2621 OE1 GLU B 72 -5.276 -0.611 -9.836 1.00 0.00 O ATOM 2622 OE2 GLU B 72 -6.835 0.416 -8.756 1.00 0.00 O ATOM 0 H GLU B 72 -3.843 -3.516 -6.041 1.00 0.00 H new ATOM 0 HA GLU B 72 -2.591 -0.809 -6.087 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -3.639 -1.719 -8.117 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -5.114 -2.082 -7.243 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -5.365 0.418 -6.764 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -3.985 0.708 -7.803 1.00 0.00 H new ATOM 2629 N PHE B 73 -5.171 -1.633 -4.260 1.00 0.00 N ATOM 2630 CA PHE B 73 -5.997 -1.120 -3.137 1.00 0.00 C ATOM 2631 C PHE B 73 -5.080 -0.514 -2.084 1.00 0.00 C ATOM 2632 O PHE B 73 -5.317 0.564 -1.585 1.00 0.00 O ATOM 2633 CB PHE B 73 -6.796 -2.275 -2.534 1.00 0.00 C ATOM 2634 CG PHE B 73 -7.344 -1.917 -1.166 1.00 0.00 C ATOM 2635 CD1 PHE B 73 -7.945 -0.671 -0.936 1.00 0.00 C ATOM 2636 CD2 PHE B 73 -7.265 -2.854 -0.126 1.00 0.00 C ATOM 2637 CE1 PHE B 73 -8.462 -0.367 0.328 1.00 0.00 C ATOM 2638 CE2 PHE B 73 -7.786 -2.550 1.132 1.00 0.00 C ATOM 2639 CZ PHE B 73 -8.384 -1.309 1.360 1.00 0.00 C ATOM 0 H PHE B 73 -5.332 -2.608 -4.513 1.00 0.00 H new ATOM 0 HA PHE B 73 -6.687 -0.357 -3.496 1.00 0.00 H new ATOM 0 HB2 PHE B 73 -7.619 -2.536 -3.200 1.00 0.00 H new ATOM 0 HB3 PHE B 73 -6.159 -3.156 -2.453 1.00 0.00 H new ATOM 0 HD1 PHE B 73 -8.009 0.054 -1.734 1.00 0.00 H new ATOM 0 HD2 PHE B 73 -6.800 -3.813 -0.299 1.00 0.00 H new ATOM 0 HE1 PHE B 73 -8.921 0.594 0.507 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -7.727 -3.275 1.930 1.00 0.00 H new ATOM 0 HZ PHE B 73 -8.787 -1.076 2.334 1.00 0.00 H new ATOM 2649 N MET B 74 -4.021 -1.177 -1.749 1.00 0.00 N ATOM 2650 CA MET B 74 -3.112 -0.583 -0.747 1.00 0.00 C ATOM 2651 C MET B 74 -2.598 0.716 -1.359 1.00 0.00 C ATOM 2652 O MET B 74 -2.510 1.740 -0.713 1.00 0.00 O ATOM 2653 CB MET B 74 -1.953 -1.563 -0.456 1.00 0.00 C ATOM 2654 CG MET B 74 -1.508 -1.497 1.030 1.00 0.00 C ATOM 2655 SD MET B 74 0.303 -1.546 1.128 1.00 0.00 S ATOM 2656 CE MET B 74 0.435 -2.126 2.834 1.00 0.00 C ATOM 0 H MET B 74 -3.748 -2.088 -2.117 1.00 0.00 H new ATOM 0 HA MET B 74 -3.614 -0.387 0.201 1.00 0.00 H new ATOM 0 HB2 MET B 74 -2.265 -2.579 -0.698 1.00 0.00 H new ATOM 0 HB3 MET B 74 -1.106 -1.328 -1.101 1.00 0.00 H new ATOM 0 HG2 MET B 74 -1.882 -0.583 1.492 1.00 0.00 H new ATOM 0 HG3 MET B 74 -1.935 -2.332 1.585 1.00 0.00 H new ATOM 0 HE1 MET B 74 1.427 -1.895 3.221 1.00 0.00 H new ATOM 0 HE2 MET B 74 -0.318 -1.630 3.446 1.00 0.00 H new ATOM 0 HE3 MET B 74 0.275 -3.204 2.865 1.00 0.00 H new ATOM 2666 N ALA B 75 -2.248 0.659 -2.614 1.00 0.00 N ATOM 2667 CA ALA B 75 -1.724 1.884 -3.286 1.00 0.00 C ATOM 2668 C ALA B 75 -2.693 3.048 -3.060 1.00 0.00 C ATOM 2669 O ALA B 75 -2.325 4.200 -3.172 1.00 0.00 O ATOM 2670 CB ALA B 75 -1.556 1.619 -4.785 1.00 0.00 C ATOM 0 H ALA B 75 -2.301 -0.174 -3.200 1.00 0.00 H new ATOM 0 HA ALA B 75 -0.753 2.144 -2.863 1.00 0.00 H new ATOM 0 HB1 ALA B 75 -1.173 2.516 -5.272 1.00 0.00 H new ATOM 0 HB2 ALA B 75 -0.854 0.798 -4.933 1.00 0.00 H new ATOM 0 HB3 ALA B 75 -2.521 1.354 -5.218 1.00 0.00 H new ATOM 2676 N PHE B 76 -3.923 2.765 -2.725 1.00 0.00 N ATOM 2677 CA PHE B 76 -4.880 3.884 -2.478 1.00 0.00 C ATOM 2678 C PHE B 76 -4.551 4.507 -1.122 1.00 0.00 C ATOM 2679 O PHE B 76 -4.343 5.698 -1.018 1.00 0.00 O ATOM 2680 CB PHE B 76 -6.329 3.377 -2.506 1.00 0.00 C ATOM 2681 CG PHE B 76 -7.280 4.447 -1.997 1.00 0.00 C ATOM 2682 CD1 PHE B 76 -7.264 5.737 -2.549 1.00 0.00 C ATOM 2683 CD2 PHE B 76 -8.187 4.140 -0.973 1.00 0.00 C ATOM 2684 CE1 PHE B 76 -8.149 6.713 -2.073 1.00 0.00 C ATOM 2685 CE2 PHE B 76 -9.070 5.116 -0.501 1.00 0.00 C ATOM 2686 CZ PHE B 76 -9.050 6.403 -1.050 1.00 0.00 C ATOM 0 H PHE B 76 -4.303 1.825 -2.613 1.00 0.00 H new ATOM 0 HA PHE B 76 -4.782 4.634 -3.263 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -6.602 3.095 -3.523 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -6.418 2.481 -1.892 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -6.570 5.977 -3.341 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -8.204 3.147 -0.548 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -8.135 7.706 -2.497 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -9.768 4.876 0.288 1.00 0.00 H new ATOM 0 HZ PHE B 76 -9.731 7.157 -0.683 1.00 0.00 H new ATOM 2696 N VAL B 77 -4.466 3.716 -0.083 1.00 0.00 N ATOM 2697 CA VAL B 77 -4.115 4.291 1.249 1.00 0.00 C ATOM 2698 C VAL B 77 -2.803 5.077 1.115 1.00 0.00 C ATOM 2699 O VAL B 77 -2.593 6.085 1.750 1.00 0.00 O ATOM 2700 CB VAL B 77 -3.928 3.164 2.270 1.00 0.00 C ATOM 2701 CG1 VAL B 77 -3.384 3.744 3.576 1.00 0.00 C ATOM 2702 CG2 VAL B 77 -5.271 2.488 2.549 1.00 0.00 C ATOM 0 H VAL B 77 -4.623 2.708 -0.099 1.00 0.00 H new ATOM 0 HA VAL B 77 -4.916 4.949 1.587 1.00 0.00 H new ATOM 0 HB VAL B 77 -3.227 2.432 1.868 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -3.251 2.942 4.303 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -2.425 4.226 3.388 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -4.088 4.477 3.970 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -5.131 1.688 3.276 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -5.972 3.222 2.947 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -5.668 2.072 1.623 1.00 0.00 H new ATOM 2712 N SER B 78 -1.922 4.615 0.283 1.00 0.00 N ATOM 2713 CA SER B 78 -0.629 5.321 0.088 1.00 0.00 C ATOM 2714 C SER B 78 -0.915 6.669 -0.560 1.00 0.00 C ATOM 2715 O SER B 78 -0.198 7.631 -0.386 1.00 0.00 O ATOM 2716 CB SER B 78 0.260 4.494 -0.839 1.00 0.00 C ATOM 2717 OG SER B 78 1.617 4.876 -0.658 1.00 0.00 O ATOM 0 H SER B 78 -2.041 3.771 -0.277 1.00 0.00 H new ATOM 0 HA SER B 78 -0.124 5.460 1.044 1.00 0.00 H new ATOM 0 HB2 SER B 78 0.138 3.432 -0.625 1.00 0.00 H new ATOM 0 HB3 SER B 78 -0.037 4.646 -1.877 1.00 0.00 H new ATOM 0 HG SER B 78 2.100 4.778 -1.505 1.00 0.00 H new ATOM 2723 N MET B 79 -1.967 6.725 -1.316 1.00 0.00 N ATOM 2724 CA MET B 79 -2.337 7.989 -2.007 1.00 0.00 C ATOM 2725 C MET B 79 -2.956 8.968 -1.014 1.00 0.00 C ATOM 2726 O MET B 79 -2.805 10.168 -1.140 1.00 0.00 O ATOM 2727 CB MET B 79 -3.351 7.679 -3.111 1.00 0.00 C ATOM 2728 CG MET B 79 -3.546 8.905 -4.010 1.00 0.00 C ATOM 2729 SD MET B 79 -5.180 8.813 -4.787 1.00 0.00 S ATOM 2730 CE MET B 79 -4.716 9.504 -6.391 1.00 0.00 C ATOM 0 H MET B 79 -2.596 5.941 -1.489 1.00 0.00 H new ATOM 0 HA MET B 79 -1.442 8.438 -2.438 1.00 0.00 H new ATOM 0 HB2 MET B 79 -3.005 6.834 -3.706 1.00 0.00 H new ATOM 0 HB3 MET B 79 -4.304 7.388 -2.669 1.00 0.00 H new ATOM 0 HG2 MET B 79 -3.459 9.820 -3.423 1.00 0.00 H new ATOM 0 HG3 MET B 79 -2.768 8.940 -4.773 1.00 0.00 H new ATOM 0 HE1 MET B 79 -5.558 9.425 -7.079 1.00 0.00 H new ATOM 0 HE2 MET B 79 -4.443 10.552 -6.270 1.00 0.00 H new ATOM 0 HE3 MET B 79 -3.866 8.952 -6.793 1.00 0.00 H new ATOM 2740 N VAL B 80 -3.631 8.476 -0.013 1.00 0.00 N ATOM 2741 CA VAL B 80 -4.227 9.387 0.996 1.00 0.00 C ATOM 2742 C VAL B 80 -3.152 9.610 2.039 1.00 0.00 C ATOM 2743 O VAL B 80 -3.049 10.665 2.633 1.00 0.00 O ATOM 2744 CB VAL B 80 -5.509 8.779 1.619 1.00 0.00 C ATOM 2745 CG1 VAL B 80 -6.243 7.946 0.570 1.00 0.00 C ATOM 2746 CG2 VAL B 80 -5.183 7.889 2.829 1.00 0.00 C ATOM 0 H VAL B 80 -3.794 7.482 0.148 1.00 0.00 H new ATOM 0 HA VAL B 80 -4.539 10.329 0.545 1.00 0.00 H new ATOM 0 HB VAL B 80 -6.138 9.602 1.958 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -7.144 7.519 1.010 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -6.516 8.581 -0.273 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -5.593 7.143 0.223 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -6.106 7.480 3.239 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -4.533 7.072 2.515 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -4.678 8.482 3.592 1.00 0.00 H new ATOM 2756 N THR B 81 -2.322 8.621 2.245 1.00 0.00 N ATOM 2757 CA THR B 81 -1.231 8.791 3.227 1.00 0.00 C ATOM 2758 C THR B 81 -0.245 9.786 2.647 1.00 0.00 C ATOM 2759 O THR B 81 0.324 10.597 3.352 1.00 0.00 O ATOM 2760 CB THR B 81 -0.512 7.462 3.455 1.00 0.00 C ATOM 2761 OG1 THR B 81 -1.458 6.457 3.783 1.00 0.00 O ATOM 2762 CG2 THR B 81 0.497 7.611 4.595 1.00 0.00 C ATOM 0 H THR B 81 -2.358 7.715 1.777 1.00 0.00 H new ATOM 0 HA THR B 81 -1.636 9.139 4.177 1.00 0.00 H new ATOM 0 HB THR B 81 0.014 7.177 2.544 1.00 0.00 H new ATOM 0 HG1 THR B 81 -2.271 6.876 4.135 1.00 0.00 H new ATOM 0 HG21 THR B 81 1.008 6.662 4.755 1.00 0.00 H new ATOM 0 HG22 THR B 81 1.228 8.377 4.336 1.00 0.00 H new ATOM 0 HG23 THR B 81 -0.025 7.900 5.507 1.00 0.00 H new ATOM 2770 N THR B 82 -0.010 9.722 1.362 1.00 0.00 N ATOM 2771 CA THR B 82 0.966 10.652 0.738 1.00 0.00 C ATOM 2772 C THR B 82 0.481 12.095 0.848 1.00 0.00 C ATOM 2773 O THR B 82 1.260 12.991 1.108 1.00 0.00 O ATOM 2774 CB THR B 82 1.136 10.266 -0.731 1.00 0.00 C ATOM 2775 OG1 THR B 82 -0.139 9.990 -1.291 1.00 0.00 O ATOM 2776 CG2 THR B 82 2.029 9.018 -0.839 1.00 0.00 C ATOM 0 H THR B 82 -0.454 9.064 0.721 1.00 0.00 H new ATOM 0 HA THR B 82 1.922 10.578 1.257 1.00 0.00 H new ATOM 0 HB THR B 82 1.604 11.088 -1.273 1.00 0.00 H new ATOM 0 HG1 THR B 82 -0.375 9.054 -1.122 1.00 0.00 H new ATOM 0 HG21 THR B 82 2.148 8.745 -1.888 1.00 0.00 H new ATOM 0 HG22 THR B 82 3.006 9.231 -0.406 1.00 0.00 H new ATOM 0 HG23 THR B 82 1.566 8.192 -0.300 1.00 0.00 H new ATOM 2784 N ALA B 83 -0.788 12.350 0.665 1.00 0.00 N ATOM 2785 CA ALA B 83 -1.269 13.750 0.778 1.00 0.00 C ATOM 2786 C ALA B 83 -0.997 14.240 2.196 1.00 0.00 C ATOM 2787 O ALA B 83 -0.725 15.402 2.423 1.00 0.00 O ATOM 2788 CB ALA B 83 -2.773 13.798 0.495 1.00 0.00 C ATOM 0 H ALA B 83 -1.502 11.655 0.445 1.00 0.00 H new ATOM 0 HA ALA B 83 -0.753 14.385 0.058 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -3.126 14.826 0.578 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -2.966 13.428 -0.512 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -3.299 13.174 1.217 1.00 0.00 H new ATOM 2794 N CYS B 84 -1.067 13.356 3.154 1.00 0.00 N ATOM 2795 CA CYS B 84 -0.805 13.769 4.563 1.00 0.00 C ATOM 2796 C CYS B 84 0.704 13.896 4.785 1.00 0.00 C ATOM 2797 O CYS B 84 1.153 14.541 5.711 1.00 0.00 O ATOM 2798 CB CYS B 84 -1.378 12.722 5.520 1.00 0.00 C ATOM 2799 SG CYS B 84 -1.027 13.213 7.227 1.00 0.00 S ATOM 0 H CYS B 84 -1.293 12.370 3.023 1.00 0.00 H new ATOM 0 HA CYS B 84 -1.282 14.730 4.754 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -2.454 12.627 5.371 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -0.940 11.746 5.313 1.00 0.00 H new ATOM 0 HG CYS B 84 0.045 13.948 7.255 1.00 0.00 H new ATOM 2805 N HIS B 85 1.491 13.284 3.940 1.00 0.00 N ATOM 2806 CA HIS B 85 2.973 13.368 4.098 1.00 0.00 C ATOM 2807 C HIS B 85 3.492 14.625 3.397 1.00 0.00 C ATOM 2808 O HIS B 85 4.391 15.285 3.877 1.00 0.00 O ATOM 2809 CB HIS B 85 3.619 12.130 3.469 1.00 0.00 C ATOM 2810 CG HIS B 85 5.117 12.287 3.446 1.00 0.00 C ATOM 2811 ND1 HIS B 85 5.895 11.769 2.423 1.00 0.00 N ATOM 2812 CD2 HIS B 85 5.993 12.893 4.313 1.00 0.00 C ATOM 2813 CE1 HIS B 85 7.177 12.065 2.698 1.00 0.00 C ATOM 2814 NE2 HIS B 85 7.294 12.750 3.838 1.00 0.00 N ATOM 0 H HIS B 85 1.171 12.729 3.146 1.00 0.00 H new ATOM 0 HA HIS B 85 3.225 13.415 5.157 1.00 0.00 H new ATOM 0 HB2 HIS B 85 3.347 11.240 4.036 1.00 0.00 H new ATOM 0 HB3 HIS B 85 3.244 11.989 2.455 1.00 0.00 H new ATOM 0 HD1 HIS B 85 5.556 11.256 1.609 1.00 0.00 H new ATOM 0 HD2 HIS B 85 5.715 13.402 5.224 1.00 0.00 H new ATOM 0 HE1 HIS B 85 8.011 11.783 2.073 1.00 0.00 H new ATOM 2822 N GLU B 86 2.940 14.960 2.264 1.00 0.00 N ATOM 2823 CA GLU B 86 3.419 16.175 1.544 1.00 0.00 C ATOM 2824 C GLU B 86 2.847 17.426 2.218 1.00 0.00 C ATOM 2825 O GLU B 86 3.408 18.500 2.133 1.00 0.00 O ATOM 2826 CB GLU B 86 2.973 16.119 0.078 1.00 0.00 C ATOM 2827 CG GLU B 86 1.463 16.354 -0.016 1.00 0.00 C ATOM 2828 CD GLU B 86 0.961 15.920 -1.396 1.00 0.00 C ATOM 2829 OE1 GLU B 86 1.202 14.782 -1.762 1.00 0.00 O ATOM 2830 OE2 GLU B 86 0.343 16.733 -2.062 1.00 0.00 O ATOM 0 H GLU B 86 2.184 14.450 1.808 1.00 0.00 H new ATOM 0 HA GLU B 86 4.508 16.213 1.581 1.00 0.00 H new ATOM 0 HB2 GLU B 86 3.504 16.874 -0.502 1.00 0.00 H new ATOM 0 HB3 GLU B 86 3.227 15.150 -0.352 1.00 0.00 H new ATOM 0 HG2 GLU B 86 0.948 15.792 0.763 1.00 0.00 H new ATOM 0 HG3 GLU B 86 1.238 17.408 0.149 1.00 0.00 H new ATOM 2837 N PHE B 87 1.736 17.294 2.888 1.00 0.00 N ATOM 2838 CA PHE B 87 1.134 18.475 3.568 1.00 0.00 C ATOM 2839 C PHE B 87 2.008 18.875 4.759 1.00 0.00 C ATOM 2840 O PHE B 87 2.240 20.041 5.011 1.00 0.00 O ATOM 2841 CB PHE B 87 -0.269 18.115 4.064 1.00 0.00 C ATOM 2842 CG PHE B 87 -1.016 19.375 4.433 1.00 0.00 C ATOM 2843 CD1 PHE B 87 -1.605 20.156 3.429 1.00 0.00 C ATOM 2844 CD2 PHE B 87 -1.123 19.764 5.774 1.00 0.00 C ATOM 2845 CE1 PHE B 87 -2.298 21.324 3.768 1.00 0.00 C ATOM 2846 CE2 PHE B 87 -1.817 20.932 6.112 1.00 0.00 C ATOM 2847 CZ PHE B 87 -2.405 21.712 5.109 1.00 0.00 C ATOM 0 H PHE B 87 1.219 16.421 2.994 1.00 0.00 H new ATOM 0 HA PHE B 87 1.070 19.307 2.867 1.00 0.00 H new ATOM 0 HB2 PHE B 87 -0.811 17.573 3.289 1.00 0.00 H new ATOM 0 HB3 PHE B 87 -0.202 17.454 4.928 1.00 0.00 H new ATOM 0 HD1 PHE B 87 -1.524 19.857 2.394 1.00 0.00 H new ATOM 0 HD2 PHE B 87 -0.670 19.163 6.548 1.00 0.00 H new ATOM 0 HE1 PHE B 87 -2.751 21.926 2.994 1.00 0.00 H new ATOM 0 HE2 PHE B 87 -1.899 21.231 7.146 1.00 0.00 H new ATOM 0 HZ PHE B 87 -2.941 22.613 5.370 1.00 0.00 H new ATOM 2857 N PHE B 88 2.490 17.913 5.497 1.00 0.00 N ATOM 2858 CA PHE B 88 3.346 18.230 6.677 1.00 0.00 C ATOM 2859 C PHE B 88 4.574 19.039 6.243 1.00 0.00 C ATOM 2860 O PHE B 88 4.727 20.190 6.600 1.00 0.00 O ATOM 2861 CB PHE B 88 3.806 16.925 7.334 1.00 0.00 C ATOM 2862 CG PHE B 88 4.594 17.238 8.586 1.00 0.00 C ATOM 2863 CD1 PHE B 88 3.923 17.575 9.768 1.00 0.00 C ATOM 2864 CD2 PHE B 88 5.993 17.187 8.565 1.00 0.00 C ATOM 2865 CE1 PHE B 88 4.651 17.861 10.928 1.00 0.00 C ATOM 2866 CE2 PHE B 88 6.721 17.475 9.726 1.00 0.00 C ATOM 2867 CZ PHE B 88 6.050 17.812 10.908 1.00 0.00 C ATOM 0 H PHE B 88 2.328 16.919 5.334 1.00 0.00 H new ATOM 0 HA PHE B 88 2.766 18.820 7.386 1.00 0.00 H new ATOM 0 HB2 PHE B 88 2.943 16.306 7.580 1.00 0.00 H new ATOM 0 HB3 PHE B 88 4.420 16.353 6.639 1.00 0.00 H new ATOM 0 HD1 PHE B 88 2.844 17.614 9.784 1.00 0.00 H new ATOM 0 HD2 PHE B 88 6.510 16.926 7.654 1.00 0.00 H new ATOM 0 HE1 PHE B 88 4.133 18.120 11.840 1.00 0.00 H new ATOM 0 HE2 PHE B 88 7.800 17.437 9.710 1.00 0.00 H new ATOM 0 HZ PHE B 88 6.611 18.034 11.804 1.00 0.00 H new ATOM 2877 N GLU B 89 5.460 18.442 5.489 1.00 0.00 N ATOM 2878 CA GLU B 89 6.685 19.178 5.055 1.00 0.00 C ATOM 2879 C GLU B 89 6.332 20.233 4.005 1.00 0.00 C ATOM 2880 O GLU B 89 7.182 20.688 3.266 1.00 0.00 O ATOM 2881 CB GLU B 89 7.703 18.191 4.474 1.00 0.00 C ATOM 2882 CG GLU B 89 7.009 17.232 3.504 1.00 0.00 C ATOM 2883 CD GLU B 89 8.059 16.359 2.815 1.00 0.00 C ATOM 2884 OE1 GLU B 89 9.021 16.912 2.307 1.00 0.00 O ATOM 2885 OE2 GLU B 89 7.883 15.150 2.807 1.00 0.00 O ATOM 0 H GLU B 89 5.389 17.481 5.156 1.00 0.00 H new ATOM 0 HA GLU B 89 7.117 19.678 5.922 1.00 0.00 H new ATOM 0 HB2 GLU B 89 8.494 18.734 3.957 1.00 0.00 H new ATOM 0 HB3 GLU B 89 8.176 17.628 5.279 1.00 0.00 H new ATOM 0 HG2 GLU B 89 6.296 16.607 4.041 1.00 0.00 H new ATOM 0 HG3 GLU B 89 6.443 17.795 2.761 1.00 0.00 H new ATOM 2892 N HIS B 90 5.095 20.641 3.938 1.00 0.00 N ATOM 2893 CA HIS B 90 4.719 21.678 2.939 1.00 0.00 C ATOM 2894 C HIS B 90 5.390 23.001 3.317 1.00 0.00 C ATOM 2895 O HIS B 90 4.944 23.703 4.203 1.00 0.00 O ATOM 2896 CB HIS B 90 3.201 21.865 2.925 1.00 0.00 C ATOM 2897 CG HIS B 90 2.840 22.930 1.925 1.00 0.00 C ATOM 2898 ND1 HIS B 90 1.780 23.806 2.122 1.00 0.00 N ATOM 2899 CD2 HIS B 90 3.390 23.274 0.714 1.00 0.00 C ATOM 2900 CE1 HIS B 90 1.727 24.627 1.056 1.00 0.00 C ATOM 2901 NE2 HIS B 90 2.685 24.344 0.171 1.00 0.00 N ATOM 0 H HIS B 90 4.334 20.304 4.527 1.00 0.00 H new ATOM 0 HA HIS B 90 5.047 21.362 1.949 1.00 0.00 H new ATOM 0 HB2 HIS B 90 2.710 20.927 2.667 1.00 0.00 H new ATOM 0 HB3 HIS B 90 2.849 22.147 3.917 1.00 0.00 H new ATOM 0 HD2 HIS B 90 4.238 22.789 0.254 1.00 0.00 H new ATOM 0 HE1 HIS B 90 1.000 25.416 0.933 1.00 0.00 H new ATOM 0 HE2 HIS B 90 2.863 24.813 -0.717 1.00 0.00 H new ATOM 2910 N GLU B 91 6.456 23.349 2.651 1.00 0.00 N ATOM 2911 CA GLU B 91 7.151 24.629 2.969 1.00 0.00 C ATOM 2912 C GLU B 91 6.277 25.804 2.528 1.00 0.00 C ATOM 2913 O GLU B 91 5.404 26.188 3.291 1.00 0.00 O ATOM 2914 CB GLU B 91 8.489 24.683 2.227 1.00 0.00 C ATOM 2915 CG GLU B 91 9.275 25.919 2.672 1.00 0.00 C ATOM 2916 CD GLU B 91 10.584 26.002 1.885 1.00 0.00 C ATOM 2917 OE1 GLU B 91 10.715 25.279 0.913 1.00 0.00 O ATOM 2918 OE2 GLU B 91 11.435 26.789 2.270 1.00 0.00 O ATOM 2919 OXT GLU B 91 6.494 26.302 1.436 1.00 0.00 O ATOM 0 H GLU B 91 6.877 22.802 1.900 1.00 0.00 H new ATOM 0 HA GLU B 91 7.329 24.689 4.043 1.00 0.00 H new ATOM 0 HB2 GLU B 91 9.066 23.781 2.430 1.00 0.00 H new ATOM 0 HB3 GLU B 91 8.318 24.716 1.151 1.00 0.00 H new ATOM 0 HG2 GLU B 91 8.682 26.819 2.508 1.00 0.00 H new ATOM 0 HG3 GLU B 91 9.484 25.865 3.741 1.00 0.00 H new TER 2926 GLU B 91 HETATM 2927 CA CA A 92 15.077 8.262 -2.078 1.00 0.00 CA HETATM 2928 CA CA A 93 7.637 1.557 -10.671 1.00 0.00 CA HETATM 2929 ZN ZN A 94 8.889 13.337 2.709 1.00 0.00 ZN HETATM 2930 CA CA B 92 -14.654 -7.853 -2.151 1.00 0.00 CA HETATM 2931 CA CA B 93 -7.229 -1.790 -10.394 1.00 0.00 CA HETATM 2932 ZN ZN B 94 -8.903 -13.382 2.297 1.00 0.00 ZN