USER MOD reduce.3.24.130724 H: found=0, std=0, add=1410, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1410 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 7 MET CE :methyl 175:sc= -0.604 (180deg=-0.587) USER MOD Set 1.2: B 81 THR OG1 : rot 84:sc= 1.19 USER MOD Set 2.1: B 57 MET CE :methyl -130:sc= -0.175 (180deg=-2.55!) USER MOD Set 2.2: B 68 CYS SG : rot 180:sc= 0 USER MOD Set 3.1: A 81 THR OG1 : rot 87:sc= 1.21 USER MOD Set 3.2: B 7 MET CE :methyl 171:sc= -0.568 (180deg=-0.714) USER MOD Set 4.1: A 57 MET CE :methyl -134:sc= -0.188 (180deg=-2.4) USER MOD Set 4.2: A 68 CYS SG : rot 180:sc= 0 USER MOD Single : A 1 SER N :NH3+ -137:sc= 0.927 (180deg=0.134!) USER MOD Single : A 1 SER OG : rot 180:sc= 0.201 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 HIS : no HD1:sc= -0.238 K(o=-0.24,f=-1.4) USER MOD Single : A 16 GLN : amide:sc= -3.49! C(o=-3.5!,f=-2.1!) USER MOD Single : A 17 TYR OH : rot -166:sc= -3.79! USER MOD Single : A 18 SER OG : rot 111:sc= 1.25 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -0.0399 X(o=-0.04,f=-0.21) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -131:sc= -0.322 (180deg=-1.43!) USER MOD Single : A 29 LYS NZ :NH3+ -105:sc= 0.575 (180deg=-0.0639) USER MOD Single : A 30 SER OG : rot 180:sc= -0.0954 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= -0.474 K(o=-0.47,f=-2.8!) USER MOD Single : A 38 ASN : amide:sc= -0.0137 K(o=-0.014,f=-1.2) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 74 MET CE :methyl 157:sc= -0.344 (180deg=-2.31) USER MOD Single : A 78 SER OG : rot -51:sc= 0.474 USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 THR OG1 : rot 67:sc= 0.749 USER MOD Single : A 84 CYS SG : rot -51:sc= -0.288 USER MOD Single : A 85 HIS : no HD1:sc= -0.0197 X(o=-0.02,f=0) USER MOD Single : A 90 HIS : no HD1:sc= -0.298 K(o=-0.3,f=-0.85) USER MOD Single : B 1 SER N :NH3+ -156:sc= 0.84 (180deg=-0.225!) USER MOD Single : B 1 SER OG : rot 180:sc= 0.207 USER MOD Single : B 5 LYS NZ :NH3+ 140:sc= 0.01 (180deg=0) USER MOD Single : B 15 HIS : no HD1:sc= -0.235 K(o=-0.24,f=-1.4) USER MOD Single : B 16 GLN : amide:sc= -3.37! C(o=-3.4!,f=-2!) USER MOD Single : B 17 TYR OH : rot -166:sc= -3.82! USER MOD Single : B 18 SER OG : rot 95:sc= 1.06 USER MOD Single : B 24 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000793) USER MOD Single : B 25 HIS : no HD1:sc= -0.0327 X(o=-0.033,f=-0.26) USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ -120:sc= -0.332 (180deg=-1.47!) USER MOD Single : B 29 LYS NZ :NH3+ -106:sc= 0.534 (180deg=-0.0726) USER MOD Single : B 30 SER OG : rot 180:sc= -0.153 USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 37 ASN : amide:sc= -0.49 K(o=-0.49,f=-2.8!) USER MOD Single : B 38 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 GLN : amide:sc= -0.0057 K(o=-0.0057,f=-0.6) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 THR OG1 : rot 180:sc= 0 USER MOD Single : B 71 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : B 74 MET CE :methyl 156:sc= -0.24 (180deg=-2.2) USER MOD Single : B 78 SER OG : rot -52:sc= 0.507 USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 82 THR OG1 : rot 67:sc= 0.713 USER MOD Single : B 84 CYS SG : rot -51:sc= -0.211 USER MOD Single : B 85 HIS : no HD1:sc= -0.0221 X(o=-0.022,f=0) USER MOD Single : B 90 HIS : no HD1:sc= -0.297 K(o=-0.3,f=-0.83) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 69.077 12.631 -9.157 1.00 0.00 N ATOM 2 CA SER A 1 68.610 12.121 -10.477 1.00 0.00 C ATOM 3 C SER A 1 68.009 10.724 -10.298 1.00 0.00 C ATOM 4 O SER A 1 67.337 10.452 -9.327 1.00 0.00 O ATOM 5 CB SER A 1 69.792 12.055 -11.444 1.00 0.00 C ATOM 6 OG SER A 1 69.308 11.847 -12.764 1.00 0.00 O ATOM 0 H1 SER A 1 68.804 13.629 -9.054 1.00 0.00 H new ATOM 0 H2 SER A 1 68.641 12.073 -8.395 1.00 0.00 H new ATOM 0 H3 SER A 1 70.112 12.548 -9.099 1.00 0.00 H new ATOM 0 HA SER A 1 67.851 12.791 -10.881 1.00 0.00 H new ATOM 0 HB2 SER A 1 70.367 12.980 -11.397 1.00 0.00 H new ATOM 0 HB3 SER A 1 70.465 11.246 -11.159 1.00 0.00 H new ATOM 0 HG SER A 1 70.064 11.806 -13.387 1.00 0.00 H new ATOM 14 N GLU A 2 68.251 9.835 -11.225 1.00 0.00 N ATOM 15 CA GLU A 2 67.693 8.455 -11.103 1.00 0.00 C ATOM 16 C GLU A 2 68.213 7.804 -9.827 1.00 0.00 C ATOM 17 O GLU A 2 67.555 6.979 -9.225 1.00 0.00 O ATOM 18 CB GLU A 2 68.117 7.620 -12.313 1.00 0.00 C ATOM 19 CG GLU A 2 69.635 7.694 -12.483 1.00 0.00 C ATOM 20 CD GLU A 2 70.051 6.886 -13.714 1.00 0.00 C ATOM 21 OE1 GLU A 2 69.279 6.039 -14.132 1.00 0.00 O ATOM 22 OE2 GLU A 2 71.130 7.136 -14.226 1.00 0.00 O ATOM 0 H GLU A 2 68.810 10.004 -12.061 1.00 0.00 H new ATOM 0 HA GLU A 2 66.605 8.509 -11.064 1.00 0.00 H new ATOM 0 HB2 GLU A 2 67.806 6.584 -12.179 1.00 0.00 H new ATOM 0 HB3 GLU A 2 67.622 7.987 -13.212 1.00 0.00 H new ATOM 0 HG2 GLU A 2 69.949 8.732 -12.593 1.00 0.00 H new ATOM 0 HG3 GLU A 2 70.131 7.304 -11.594 1.00 0.00 H new ATOM 29 N LEU A 3 69.389 8.165 -9.403 1.00 0.00 N ATOM 30 CA LEU A 3 69.951 7.568 -8.165 1.00 0.00 C ATOM 31 C LEU A 3 69.168 8.072 -6.947 1.00 0.00 C ATOM 32 O LEU A 3 68.986 7.361 -5.980 1.00 0.00 O ATOM 33 CB LEU A 3 71.425 7.974 -8.042 1.00 0.00 C ATOM 34 CG LEU A 3 72.048 7.375 -6.771 1.00 0.00 C ATOM 35 CD1 LEU A 3 71.985 5.840 -6.826 1.00 0.00 C ATOM 36 CD2 LEU A 3 73.510 7.824 -6.675 1.00 0.00 C ATOM 0 H LEU A 3 69.987 8.851 -9.863 1.00 0.00 H new ATOM 0 HA LEU A 3 69.873 6.482 -8.210 1.00 0.00 H new ATOM 0 HB2 LEU A 3 71.976 7.633 -8.919 1.00 0.00 H new ATOM 0 HB3 LEU A 3 71.507 9.061 -8.016 1.00 0.00 H new ATOM 0 HG LEU A 3 71.494 7.720 -5.898 1.00 0.00 H new ATOM 0 HD11 LEU A 3 72.429 5.425 -5.921 1.00 0.00 H new ATOM 0 HD12 LEU A 3 70.945 5.521 -6.900 1.00 0.00 H new ATOM 0 HD13 LEU A 3 72.536 5.484 -7.697 1.00 0.00 H new ATOM 0 HD21 LEU A 3 73.961 7.404 -5.776 1.00 0.00 H new ATOM 0 HD22 LEU A 3 74.056 7.476 -7.552 1.00 0.00 H new ATOM 0 HD23 LEU A 3 73.554 8.912 -6.629 1.00 0.00 H new ATOM 48 N GLU A 4 68.703 9.295 -6.982 1.00 0.00 N ATOM 49 CA GLU A 4 67.935 9.835 -5.820 1.00 0.00 C ATOM 50 C GLU A 4 66.657 9.017 -5.611 1.00 0.00 C ATOM 51 O GLU A 4 66.313 8.659 -4.502 1.00 0.00 O ATOM 52 CB GLU A 4 67.574 11.303 -6.080 1.00 0.00 C ATOM 53 CG GLU A 4 66.818 11.867 -4.873 1.00 0.00 C ATOM 54 CD GLU A 4 66.569 13.364 -5.073 1.00 0.00 C ATOM 55 OE1 GLU A 4 67.095 13.910 -6.028 1.00 0.00 O ATOM 56 OE2 GLU A 4 65.858 13.938 -4.265 1.00 0.00 O ATOM 0 H GLU A 4 68.822 9.941 -7.762 1.00 0.00 H new ATOM 0 HA GLU A 4 68.550 9.767 -4.923 1.00 0.00 H new ATOM 0 HB2 GLU A 4 68.478 11.884 -6.260 1.00 0.00 H new ATOM 0 HB3 GLU A 4 66.960 11.384 -6.977 1.00 0.00 H new ATOM 0 HG2 GLU A 4 65.870 11.344 -4.749 1.00 0.00 H new ATOM 0 HG3 GLU A 4 67.394 11.703 -3.962 1.00 0.00 H new ATOM 63 N LYS A 5 65.946 8.727 -6.665 1.00 0.00 N ATOM 64 CA LYS A 5 64.682 7.943 -6.524 1.00 0.00 C ATOM 65 C LYS A 5 64.984 6.575 -5.907 1.00 0.00 C ATOM 66 O LYS A 5 64.242 6.085 -5.077 1.00 0.00 O ATOM 67 CB LYS A 5 64.041 7.756 -7.907 1.00 0.00 C ATOM 68 CG LYS A 5 63.290 9.033 -8.315 1.00 0.00 C ATOM 69 CD LYS A 5 64.289 10.166 -8.560 1.00 0.00 C ATOM 70 CE LYS A 5 63.602 11.297 -9.328 1.00 0.00 C ATOM 71 NZ LYS A 5 64.584 12.386 -9.602 1.00 0.00 N ATOM 0 H LYS A 5 66.184 8.998 -7.619 1.00 0.00 H new ATOM 0 HA LYS A 5 63.994 8.482 -5.873 1.00 0.00 H new ATOM 0 HB2 LYS A 5 64.809 7.525 -8.645 1.00 0.00 H new ATOM 0 HB3 LYS A 5 63.353 6.910 -7.887 1.00 0.00 H new ATOM 0 HG2 LYS A 5 62.706 8.850 -9.217 1.00 0.00 H new ATOM 0 HG3 LYS A 5 62.587 9.318 -7.532 1.00 0.00 H new ATOM 0 HD2 LYS A 5 64.673 10.538 -7.610 1.00 0.00 H new ATOM 0 HD3 LYS A 5 65.144 9.795 -9.126 1.00 0.00 H new ATOM 0 HE2 LYS A 5 63.194 10.918 -10.265 1.00 0.00 H new ATOM 0 HE3 LYS A 5 62.764 11.686 -8.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 64.115 13.153 -10.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 64.954 12.755 -8.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 65.369 12.010 -10.171 1.00 0.00 H new ATOM 85 N ALA A 6 66.060 5.958 -6.298 1.00 0.00 N ATOM 86 CA ALA A 6 66.393 4.625 -5.720 1.00 0.00 C ATOM 87 C ALA A 6 66.560 4.767 -4.208 1.00 0.00 C ATOM 88 O ALA A 6 65.989 4.025 -3.434 1.00 0.00 O ATOM 89 CB ALA A 6 67.699 4.110 -6.329 1.00 0.00 C ATOM 0 H ALA A 6 66.721 6.314 -6.988 1.00 0.00 H new ATOM 0 HA ALA A 6 65.592 3.920 -5.941 1.00 0.00 H new ATOM 0 HB1 ALA A 6 67.939 3.135 -5.904 1.00 0.00 H new ATOM 0 HB2 ALA A 6 67.585 4.017 -7.409 1.00 0.00 H new ATOM 0 HB3 ALA A 6 68.504 4.810 -6.108 1.00 0.00 H new ATOM 95 N MET A 7 67.339 5.724 -3.788 1.00 0.00 N ATOM 96 CA MET A 7 67.551 5.937 -2.331 1.00 0.00 C ATOM 97 C MET A 7 66.211 6.288 -1.674 1.00 0.00 C ATOM 98 O MET A 7 65.828 5.722 -0.669 1.00 0.00 O ATOM 99 CB MET A 7 68.533 7.097 -2.159 1.00 0.00 C ATOM 100 CG MET A 7 69.886 6.700 -2.758 1.00 0.00 C ATOM 101 SD MET A 7 70.921 8.171 -2.954 1.00 0.00 S ATOM 102 CE MET A 7 71.496 8.288 -1.245 1.00 0.00 C ATOM 0 H MET A 7 67.841 6.371 -4.396 1.00 0.00 H new ATOM 0 HA MET A 7 67.950 5.037 -1.864 1.00 0.00 H new ATOM 0 HB2 MET A 7 68.150 7.990 -2.653 1.00 0.00 H new ATOM 0 HB3 MET A 7 68.646 7.341 -1.103 1.00 0.00 H new ATOM 0 HG2 MET A 7 70.383 5.977 -2.111 1.00 0.00 H new ATOM 0 HG3 MET A 7 69.739 6.215 -3.723 1.00 0.00 H new ATOM 0 HE1 MET A 7 72.229 9.090 -1.162 1.00 0.00 H new ATOM 0 HE2 MET A 7 70.651 8.500 -0.590 1.00 0.00 H new ATOM 0 HE3 MET A 7 71.956 7.345 -0.950 1.00 0.00 H new ATOM 112 N VAL A 8 65.511 7.234 -2.236 1.00 0.00 N ATOM 113 CA VAL A 8 64.201 7.665 -1.663 1.00 0.00 C ATOM 114 C VAL A 8 63.222 6.486 -1.634 1.00 0.00 C ATOM 115 O VAL A 8 62.463 6.328 -0.698 1.00 0.00 O ATOM 116 CB VAL A 8 63.621 8.789 -2.532 1.00 0.00 C ATOM 117 CG1 VAL A 8 62.185 9.105 -2.097 1.00 0.00 C ATOM 118 CG2 VAL A 8 64.486 10.042 -2.383 1.00 0.00 C ATOM 0 H VAL A 8 65.793 7.734 -3.079 1.00 0.00 H new ATOM 0 HA VAL A 8 64.354 8.021 -0.644 1.00 0.00 H new ATOM 0 HB VAL A 8 63.613 8.467 -3.573 1.00 0.00 H new ATOM 0 HG11 VAL A 8 61.783 9.904 -2.720 1.00 0.00 H new ATOM 0 HG12 VAL A 8 61.567 8.214 -2.207 1.00 0.00 H new ATOM 0 HG13 VAL A 8 62.182 9.422 -1.054 1.00 0.00 H new ATOM 0 HG21 VAL A 8 64.076 10.842 -2.999 1.00 0.00 H new ATOM 0 HG22 VAL A 8 64.495 10.356 -1.339 1.00 0.00 H new ATOM 0 HG23 VAL A 8 65.504 9.822 -2.704 1.00 0.00 H new ATOM 128 N ALA A 9 63.211 5.674 -2.653 1.00 0.00 N ATOM 129 CA ALA A 9 62.250 4.535 -2.667 1.00 0.00 C ATOM 130 C ALA A 9 62.451 3.683 -1.414 1.00 0.00 C ATOM 131 O ALA A 9 61.501 3.224 -0.810 1.00 0.00 O ATOM 132 CB ALA A 9 62.485 3.672 -3.912 1.00 0.00 C ATOM 0 H ALA A 9 63.818 5.747 -3.469 1.00 0.00 H new ATOM 0 HA ALA A 9 61.232 4.925 -2.686 1.00 0.00 H new ATOM 0 HB1 ALA A 9 61.780 2.841 -3.917 1.00 0.00 H new ATOM 0 HB2 ALA A 9 62.339 4.277 -4.807 1.00 0.00 H new ATOM 0 HB3 ALA A 9 63.503 3.284 -3.899 1.00 0.00 H new ATOM 138 N LEU A 10 63.671 3.471 -1.011 1.00 0.00 N ATOM 139 CA LEU A 10 63.914 2.650 0.210 1.00 0.00 C ATOM 140 C LEU A 10 63.269 3.317 1.432 1.00 0.00 C ATOM 141 O LEU A 10 62.622 2.668 2.228 1.00 0.00 O ATOM 142 CB LEU A 10 65.421 2.507 0.451 1.00 0.00 C ATOM 143 CG LEU A 10 66.054 1.608 -0.623 1.00 0.00 C ATOM 144 CD1 LEU A 10 67.579 1.651 -0.468 1.00 0.00 C ATOM 145 CD2 LEU A 10 65.559 0.154 -0.473 1.00 0.00 C ATOM 0 H LEU A 10 64.509 3.828 -1.471 1.00 0.00 H new ATOM 0 HA LEU A 10 63.472 1.665 0.061 1.00 0.00 H new ATOM 0 HB2 LEU A 10 65.893 3.490 0.436 1.00 0.00 H new ATOM 0 HB3 LEU A 10 65.599 2.083 1.439 1.00 0.00 H new ATOM 0 HG LEU A 10 65.766 1.970 -1.610 1.00 0.00 H new ATOM 0 HD11 LEU A 10 68.040 1.016 -1.225 1.00 0.00 H new ATOM 0 HD12 LEU A 10 67.929 2.676 -0.592 1.00 0.00 H new ATOM 0 HD13 LEU A 10 67.854 1.291 0.523 1.00 0.00 H new ATOM 0 HD21 LEU A 10 66.018 -0.468 -1.242 1.00 0.00 H new ATOM 0 HD22 LEU A 10 65.834 -0.224 0.512 1.00 0.00 H new ATOM 0 HD23 LEU A 10 64.475 0.126 -0.583 1.00 0.00 H new ATOM 157 N ILE A 11 63.450 4.604 1.601 1.00 0.00 N ATOM 158 CA ILE A 11 62.852 5.281 2.792 1.00 0.00 C ATOM 159 C ILE A 11 61.331 5.119 2.767 1.00 0.00 C ATOM 160 O ILE A 11 60.724 4.711 3.738 1.00 0.00 O ATOM 161 CB ILE A 11 63.205 6.771 2.770 1.00 0.00 C ATOM 162 CG1 ILE A 11 64.726 6.937 2.831 1.00 0.00 C ATOM 163 CG2 ILE A 11 62.566 7.466 3.976 1.00 0.00 C ATOM 164 CD1 ILE A 11 65.095 8.404 2.587 1.00 0.00 C ATOM 0 H ILE A 11 63.980 5.209 0.973 1.00 0.00 H new ATOM 0 HA ILE A 11 63.251 4.827 3.699 1.00 0.00 H new ATOM 0 HB ILE A 11 62.828 7.220 1.851 1.00 0.00 H new ATOM 0 HG12 ILE A 11 65.098 6.615 3.804 1.00 0.00 H new ATOM 0 HG13 ILE A 11 65.201 6.303 2.082 1.00 0.00 H new ATOM 0 HG21 ILE A 11 62.817 8.526 3.960 1.00 0.00 H new ATOM 0 HG22 ILE A 11 61.483 7.349 3.932 1.00 0.00 H new ATOM 0 HG23 ILE A 11 62.942 7.018 4.896 1.00 0.00 H new ATOM 0 HD11 ILE A 11 66.178 8.519 2.631 1.00 0.00 H new ATOM 0 HD12 ILE A 11 64.737 8.711 1.604 1.00 0.00 H new ATOM 0 HD13 ILE A 11 64.633 9.028 3.352 1.00 0.00 H new ATOM 176 N ASP A 12 60.710 5.447 1.669 1.00 0.00 N ATOM 177 CA ASP A 12 59.229 5.321 1.591 1.00 0.00 C ATOM 178 C ASP A 12 58.848 3.859 1.829 1.00 0.00 C ATOM 179 O ASP A 12 57.899 3.558 2.526 1.00 0.00 O ATOM 180 CB ASP A 12 58.761 5.769 0.202 1.00 0.00 C ATOM 181 CG ASP A 12 57.238 5.651 0.093 1.00 0.00 C ATOM 182 OD1 ASP A 12 56.664 4.875 0.836 1.00 0.00 O ATOM 183 OD2 ASP A 12 56.671 6.347 -0.734 1.00 0.00 O ATOM 0 H ASP A 12 61.163 5.796 0.824 1.00 0.00 H new ATOM 0 HA ASP A 12 58.753 5.947 2.346 1.00 0.00 H new ATOM 0 HB2 ASP A 12 59.067 6.800 0.022 1.00 0.00 H new ATOM 0 HB3 ASP A 12 59.236 5.157 -0.565 1.00 0.00 H new ATOM 188 N VAL A 13 59.591 2.950 1.266 1.00 0.00 N ATOM 189 CA VAL A 13 59.289 1.507 1.471 1.00 0.00 C ATOM 190 C VAL A 13 59.606 1.105 2.919 1.00 0.00 C ATOM 191 O VAL A 13 58.851 0.393 3.551 1.00 0.00 O ATOM 192 CB VAL A 13 60.122 0.670 0.492 1.00 0.00 C ATOM 193 CG1 VAL A 13 60.016 -0.818 0.851 1.00 0.00 C ATOM 194 CG2 VAL A 13 59.588 0.889 -0.928 1.00 0.00 C ATOM 0 H VAL A 13 60.397 3.144 0.671 1.00 0.00 H new ATOM 0 HA VAL A 13 58.230 1.327 1.285 1.00 0.00 H new ATOM 0 HB VAL A 13 61.167 0.976 0.551 1.00 0.00 H new ATOM 0 HG11 VAL A 13 60.611 -1.405 0.151 1.00 0.00 H new ATOM 0 HG12 VAL A 13 60.388 -0.975 1.863 1.00 0.00 H new ATOM 0 HG13 VAL A 13 58.974 -1.133 0.794 1.00 0.00 H new ATOM 0 HG21 VAL A 13 60.174 0.298 -1.632 1.00 0.00 H new ATOM 0 HG22 VAL A 13 58.544 0.580 -0.976 1.00 0.00 H new ATOM 0 HG23 VAL A 13 59.666 1.945 -1.187 1.00 0.00 H new ATOM 204 N PHE A 14 60.721 1.544 3.447 1.00 0.00 N ATOM 205 CA PHE A 14 61.079 1.166 4.848 1.00 0.00 C ATOM 206 C PHE A 14 60.044 1.733 5.826 1.00 0.00 C ATOM 207 O PHE A 14 59.476 1.010 6.621 1.00 0.00 O ATOM 208 CB PHE A 14 62.464 1.732 5.188 1.00 0.00 C ATOM 209 CG PHE A 14 62.856 1.351 6.603 1.00 0.00 C ATOM 210 CD1 PHE A 14 62.412 2.121 7.686 1.00 0.00 C ATOM 211 CD2 PHE A 14 63.670 0.233 6.829 1.00 0.00 C ATOM 212 CE1 PHE A 14 62.781 1.773 8.994 1.00 0.00 C ATOM 213 CE2 PHE A 14 64.041 -0.114 8.138 1.00 0.00 C ATOM 214 CZ PHE A 14 63.596 0.657 9.219 1.00 0.00 C ATOM 0 H PHE A 14 61.395 2.144 2.972 1.00 0.00 H new ATOM 0 HA PHE A 14 61.092 0.079 4.933 1.00 0.00 H new ATOM 0 HB2 PHE A 14 63.203 1.351 4.484 1.00 0.00 H new ATOM 0 HB3 PHE A 14 62.456 2.817 5.085 1.00 0.00 H new ATOM 0 HD1 PHE A 14 61.785 2.983 7.514 1.00 0.00 H new ATOM 0 HD2 PHE A 14 64.012 -0.362 5.995 1.00 0.00 H new ATOM 0 HE1 PHE A 14 62.436 2.366 9.828 1.00 0.00 H new ATOM 0 HE2 PHE A 14 64.669 -0.975 8.311 1.00 0.00 H new ATOM 0 HZ PHE A 14 63.881 0.391 10.226 1.00 0.00 H new ATOM 224 N HIS A 15 59.827 3.024 5.816 1.00 0.00 N ATOM 225 CA HIS A 15 58.871 3.625 6.791 1.00 0.00 C ATOM 226 C HIS A 15 57.468 3.043 6.627 1.00 0.00 C ATOM 227 O HIS A 15 56.816 2.727 7.602 1.00 0.00 O ATOM 228 CB HIS A 15 58.800 5.139 6.570 1.00 0.00 C ATOM 229 CG HIS A 15 60.074 5.793 7.031 1.00 0.00 C ATOM 230 ND1 HIS A 15 60.906 5.220 7.981 1.00 0.00 N ATOM 231 CD2 HIS A 15 60.661 6.988 6.690 1.00 0.00 C ATOM 232 CE1 HIS A 15 61.939 6.063 8.178 1.00 0.00 C ATOM 233 NE2 HIS A 15 61.833 7.153 7.416 1.00 0.00 N ATOM 0 H HIS A 15 60.269 3.685 5.177 1.00 0.00 H new ATOM 0 HA HIS A 15 59.230 3.398 7.795 1.00 0.00 H new ATOM 0 HB2 HIS A 15 58.635 5.352 5.514 1.00 0.00 H new ATOM 0 HB3 HIS A 15 57.952 5.554 7.115 1.00 0.00 H new ATOM 0 HD2 HIS A 15 60.271 7.691 5.968 1.00 0.00 H new ATOM 0 HE1 HIS A 15 62.751 5.879 8.866 1.00 0.00 H new ATOM 0 HE2 HIS A 15 62.478 7.942 7.375 1.00 0.00 H new ATOM 242 N GLN A 16 56.977 2.883 5.428 1.00 0.00 N ATOM 243 CA GLN A 16 55.610 2.307 5.281 1.00 0.00 C ATOM 244 C GLN A 16 55.637 0.832 5.669 1.00 0.00 C ATOM 245 O GLN A 16 54.738 0.328 6.311 1.00 0.00 O ATOM 246 CB GLN A 16 55.157 2.439 3.824 1.00 0.00 C ATOM 247 CG GLN A 16 54.893 3.911 3.498 1.00 0.00 C ATOM 248 CD GLN A 16 54.449 4.041 2.040 1.00 0.00 C ATOM 249 OE1 GLN A 16 53.980 5.082 1.626 1.00 0.00 O ATOM 250 NE2 GLN A 16 54.581 3.020 1.236 1.00 0.00 N ATOM 0 H GLN A 16 57.453 3.121 4.558 1.00 0.00 H new ATOM 0 HA GLN A 16 54.917 2.843 5.930 1.00 0.00 H new ATOM 0 HB2 GLN A 16 55.922 2.040 3.158 1.00 0.00 H new ATOM 0 HB3 GLN A 16 54.253 1.852 3.659 1.00 0.00 H new ATOM 0 HG2 GLN A 16 54.124 4.308 4.160 1.00 0.00 H new ATOM 0 HG3 GLN A 16 55.795 4.499 3.668 1.00 0.00 H new ATOM 0 HE21 GLN A 16 54.975 2.145 1.583 1.00 0.00 H new ATOM 0 HE22 GLN A 16 54.290 3.097 0.261 1.00 0.00 H new ATOM 259 N TYR A 17 56.668 0.142 5.280 1.00 0.00 N ATOM 260 CA TYR A 17 56.770 -1.300 5.621 1.00 0.00 C ATOM 261 C TYR A 17 57.075 -1.456 7.112 1.00 0.00 C ATOM 262 O TYR A 17 56.554 -2.326 7.780 1.00 0.00 O ATOM 263 CB TYR A 17 57.883 -1.943 4.799 1.00 0.00 C ATOM 264 CG TYR A 17 57.972 -3.401 5.156 1.00 0.00 C ATOM 265 CD1 TYR A 17 57.214 -4.339 4.447 1.00 0.00 C ATOM 266 CD2 TYR A 17 58.804 -3.815 6.201 1.00 0.00 C ATOM 267 CE1 TYR A 17 57.288 -5.694 4.784 1.00 0.00 C ATOM 268 CE2 TYR A 17 58.879 -5.170 6.537 1.00 0.00 C ATOM 269 CZ TYR A 17 58.121 -6.109 5.828 1.00 0.00 C ATOM 270 OH TYR A 17 58.193 -7.441 6.162 1.00 0.00 O ATOM 0 H TYR A 17 57.447 0.516 4.739 1.00 0.00 H new ATOM 0 HA TYR A 17 55.824 -1.792 5.394 1.00 0.00 H new ATOM 0 HB2 TYR A 17 57.680 -1.827 3.734 1.00 0.00 H new ATOM 0 HB3 TYR A 17 58.833 -1.447 4.998 1.00 0.00 H new ATOM 0 HD1 TYR A 17 56.572 -4.017 3.640 1.00 0.00 H new ATOM 0 HD2 TYR A 17 59.388 -3.089 6.748 1.00 0.00 H new ATOM 0 HE1 TYR A 17 56.703 -6.419 4.239 1.00 0.00 H new ATOM 0 HE2 TYR A 17 59.521 -5.492 7.343 1.00 0.00 H new ATOM 0 HH TYR A 17 58.629 -7.536 7.034 1.00 0.00 H new ATOM 280 N SER A 18 57.929 -0.619 7.630 1.00 0.00 N ATOM 281 CA SER A 18 58.294 -0.707 9.073 1.00 0.00 C ATOM 282 C SER A 18 57.181 -0.114 9.940 1.00 0.00 C ATOM 283 O SER A 18 57.097 -0.386 11.122 1.00 0.00 O ATOM 284 CB SER A 18 59.594 0.062 9.315 1.00 0.00 C ATOM 285 OG SER A 18 60.567 -0.350 8.364 1.00 0.00 O ATOM 0 H SER A 18 58.394 0.128 7.113 1.00 0.00 H new ATOM 0 HA SER A 18 58.429 -1.755 9.341 1.00 0.00 H new ATOM 0 HB2 SER A 18 59.417 1.134 9.230 1.00 0.00 H new ATOM 0 HB3 SER A 18 59.956 -0.122 10.326 1.00 0.00 H new ATOM 0 HG SER A 18 60.742 0.382 7.737 1.00 0.00 H new ATOM 291 N GLY A 19 56.329 0.702 9.375 1.00 0.00 N ATOM 292 CA GLY A 19 55.229 1.317 10.178 1.00 0.00 C ATOM 293 C GLY A 19 53.992 0.415 10.169 1.00 0.00 C ATOM 294 O GLY A 19 52.895 0.859 10.446 1.00 0.00 O ATOM 0 H GLY A 19 56.347 0.970 8.391 1.00 0.00 H new ATOM 0 HA2 GLY A 19 55.564 1.476 11.203 1.00 0.00 H new ATOM 0 HA3 GLY A 19 54.976 2.296 9.770 1.00 0.00 H new ATOM 298 N ARG A 20 54.145 -0.847 9.861 1.00 0.00 N ATOM 299 CA ARG A 20 52.959 -1.754 9.851 1.00 0.00 C ATOM 300 C ARG A 20 52.663 -2.238 11.273 1.00 0.00 C ATOM 301 O ARG A 20 51.529 -2.249 11.709 1.00 0.00 O ATOM 302 CB ARG A 20 53.247 -2.963 8.959 1.00 0.00 C ATOM 303 CG ARG A 20 53.322 -2.517 7.497 1.00 0.00 C ATOM 304 CD ARG A 20 53.609 -3.729 6.607 1.00 0.00 C ATOM 305 NE ARG A 20 52.430 -4.642 6.616 1.00 0.00 N ATOM 306 CZ ARG A 20 52.487 -5.787 5.990 1.00 0.00 C ATOM 307 NH1 ARG A 20 53.571 -6.125 5.347 1.00 0.00 N ATOM 308 NH2 ARG A 20 51.460 -6.592 6.008 1.00 0.00 N ATOM 0 H ARG A 20 55.033 -1.286 9.618 1.00 0.00 H new ATOM 0 HA ARG A 20 52.097 -1.209 9.466 1.00 0.00 H new ATOM 0 HB2 ARG A 20 54.186 -3.431 9.255 1.00 0.00 H new ATOM 0 HB3 ARG A 20 52.465 -3.712 9.081 1.00 0.00 H new ATOM 0 HG2 ARG A 20 52.384 -2.049 7.200 1.00 0.00 H new ATOM 0 HG3 ARG A 20 54.105 -1.769 7.374 1.00 0.00 H new ATOM 0 HD2 ARG A 20 53.823 -3.404 5.589 1.00 0.00 H new ATOM 0 HD3 ARG A 20 54.493 -4.256 6.966 1.00 0.00 H new ATOM 0 HE ARG A 20 51.580 -4.373 7.111 1.00 0.00 H new ATOM 0 HH11 ARG A 20 54.373 -5.495 5.333 1.00 0.00 H new ATOM 0 HH12 ARG A 20 53.616 -7.019 4.858 1.00 0.00 H new ATOM 0 HH21 ARG A 20 50.613 -6.327 6.511 1.00 0.00 H new ATOM 0 HH22 ARG A 20 51.504 -7.486 5.519 1.00 0.00 H new ATOM 322 N GLU A 21 53.681 -2.644 11.996 1.00 0.00 N ATOM 323 CA GLU A 21 53.485 -3.141 13.395 1.00 0.00 C ATOM 324 C GLU A 21 54.422 -2.393 14.343 1.00 0.00 C ATOM 325 O GLU A 21 55.552 -2.096 14.011 1.00 0.00 O ATOM 326 CB GLU A 21 53.798 -4.638 13.452 1.00 0.00 C ATOM 327 CG GLU A 21 52.709 -5.413 12.708 1.00 0.00 C ATOM 328 CD GLU A 21 53.017 -6.909 12.763 1.00 0.00 C ATOM 329 OE1 GLU A 21 54.108 -7.255 13.186 1.00 0.00 O ATOM 330 OE2 GLU A 21 52.159 -7.685 12.376 1.00 0.00 O ATOM 0 H GLU A 21 54.648 -2.652 11.672 1.00 0.00 H new ATOM 0 HA GLU A 21 52.452 -2.970 13.697 1.00 0.00 H new ATOM 0 HB2 GLU A 21 54.771 -4.835 13.003 1.00 0.00 H new ATOM 0 HB3 GLU A 21 53.853 -4.970 14.489 1.00 0.00 H new ATOM 0 HG2 GLU A 21 51.736 -5.215 13.157 1.00 0.00 H new ATOM 0 HG3 GLU A 21 52.655 -5.080 11.671 1.00 0.00 H new ATOM 337 N GLY A 22 53.960 -2.089 15.525 1.00 0.00 N ATOM 338 CA GLY A 22 54.824 -1.363 16.497 1.00 0.00 C ATOM 339 C GLY A 22 55.153 0.026 15.950 1.00 0.00 C ATOM 340 O GLY A 22 54.273 0.805 15.642 1.00 0.00 O ATOM 0 H GLY A 22 53.022 -2.312 15.859 1.00 0.00 H new ATOM 0 HA2 GLY A 22 54.316 -1.276 17.457 1.00 0.00 H new ATOM 0 HA3 GLY A 22 55.742 -1.923 16.672 1.00 0.00 H new ATOM 344 N ASP A 23 56.418 0.343 15.832 1.00 0.00 N ATOM 345 CA ASP A 23 56.825 1.685 15.311 1.00 0.00 C ATOM 346 C ASP A 23 57.948 1.518 14.286 1.00 0.00 C ATOM 347 O ASP A 23 58.657 0.531 14.280 1.00 0.00 O ATOM 348 CB ASP A 23 57.325 2.544 16.474 1.00 0.00 C ATOM 349 CG ASP A 23 56.146 2.916 17.374 1.00 0.00 C ATOM 350 OD1 ASP A 23 55.021 2.844 16.905 1.00 0.00 O ATOM 351 OD2 ASP A 23 56.386 3.264 18.519 1.00 0.00 O ATOM 0 H ASP A 23 57.192 -0.275 16.076 1.00 0.00 H new ATOM 0 HA ASP A 23 55.970 2.167 14.836 1.00 0.00 H new ATOM 0 HB2 ASP A 23 58.076 1.999 17.046 1.00 0.00 H new ATOM 0 HB3 ASP A 23 57.806 3.446 16.094 1.00 0.00 H new ATOM 356 N LYS A 24 58.120 2.483 13.427 1.00 0.00 N ATOM 357 CA LYS A 24 59.201 2.396 12.406 1.00 0.00 C ATOM 358 C LYS A 24 60.558 2.488 13.106 1.00 0.00 C ATOM 359 O LYS A 24 60.630 2.800 14.276 1.00 0.00 O ATOM 360 CB LYS A 24 59.050 3.547 11.401 1.00 0.00 C ATOM 361 CG LYS A 24 59.380 4.884 12.077 1.00 0.00 C ATOM 362 CD LYS A 24 58.994 6.035 11.143 1.00 0.00 C ATOM 363 CE LYS A 24 59.530 7.358 11.700 1.00 0.00 C ATOM 364 NZ LYS A 24 58.672 7.797 12.837 1.00 0.00 N ATOM 0 H LYS A 24 57.556 3.332 13.388 1.00 0.00 H new ATOM 0 HA LYS A 24 59.132 1.448 11.873 1.00 0.00 H new ATOM 0 HB2 LYS A 24 59.713 3.387 10.551 1.00 0.00 H new ATOM 0 HB3 LYS A 24 58.032 3.569 11.012 1.00 0.00 H new ATOM 0 HG2 LYS A 24 58.841 4.970 13.020 1.00 0.00 H new ATOM 0 HG3 LYS A 24 60.443 4.933 12.312 1.00 0.00 H new ATOM 0 HD2 LYS A 24 59.399 5.859 10.147 1.00 0.00 H new ATOM 0 HD3 LYS A 24 57.910 6.085 11.042 1.00 0.00 H new ATOM 0 HE2 LYS A 24 60.560 7.235 12.033 1.00 0.00 H new ATOM 0 HE3 LYS A 24 59.536 8.119 10.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 59.033 8.695 13.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 57.696 7.930 12.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 58.688 7.073 13.584 1.00 0.00 H new ATOM 378 N HIS A 25 61.626 2.203 12.407 1.00 0.00 N ATOM 379 CA HIS A 25 62.982 2.256 13.024 1.00 0.00 C ATOM 380 C HIS A 25 63.130 1.116 14.030 1.00 0.00 C ATOM 381 O HIS A 25 63.809 1.235 15.029 1.00 0.00 O ATOM 382 CB HIS A 25 63.175 3.608 13.724 1.00 0.00 C ATOM 383 CG HIS A 25 64.644 3.906 13.872 1.00 0.00 C ATOM 384 ND1 HIS A 25 65.439 4.269 12.794 1.00 0.00 N ATOM 385 CD2 HIS A 25 65.474 3.904 14.966 1.00 0.00 C ATOM 386 CE1 HIS A 25 66.686 4.469 13.259 1.00 0.00 C ATOM 387 NE2 HIS A 25 66.758 4.259 14.574 1.00 0.00 N ATOM 0 H HIS A 25 61.614 1.933 11.424 1.00 0.00 H new ATOM 0 HA HIS A 25 63.741 2.146 12.250 1.00 0.00 H new ATOM 0 HB2 HIS A 25 62.692 4.397 13.148 1.00 0.00 H new ATOM 0 HB3 HIS A 25 62.698 3.591 14.704 1.00 0.00 H new ATOM 0 HD2 HIS A 25 65.174 3.663 15.975 1.00 0.00 H new ATOM 0 HE1 HIS A 25 67.524 4.763 12.644 1.00 0.00 H new ATOM 0 HE2 HIS A 25 67.583 4.342 15.168 1.00 0.00 H new ATOM 396 N LYS A 26 62.501 0.004 13.764 1.00 0.00 N ATOM 397 CA LYS A 26 62.610 -1.152 14.693 1.00 0.00 C ATOM 398 C LYS A 26 62.054 -2.399 14.005 1.00 0.00 C ATOM 399 O LYS A 26 60.862 -2.635 14.002 1.00 0.00 O ATOM 400 CB LYS A 26 61.803 -0.854 15.957 1.00 0.00 C ATOM 401 CG LYS A 26 62.076 -1.930 17.006 1.00 0.00 C ATOM 402 CD LYS A 26 61.267 -1.625 18.266 1.00 0.00 C ATOM 403 CE LYS A 26 61.537 -2.700 19.317 1.00 0.00 C ATOM 404 NZ LYS A 26 60.715 -2.426 20.529 1.00 0.00 N ATOM 0 H LYS A 26 61.917 -0.152 12.943 1.00 0.00 H new ATOM 0 HA LYS A 26 63.653 -1.321 14.961 1.00 0.00 H new ATOM 0 HB2 LYS A 26 62.072 0.127 16.349 1.00 0.00 H new ATOM 0 HB3 LYS A 26 60.739 -0.823 15.722 1.00 0.00 H new ATOM 0 HG2 LYS A 26 61.806 -2.911 16.616 1.00 0.00 H new ATOM 0 HG3 LYS A 26 63.140 -1.962 17.242 1.00 0.00 H new ATOM 0 HD2 LYS A 26 61.537 -0.644 18.656 1.00 0.00 H new ATOM 0 HD3 LYS A 26 60.204 -1.592 18.029 1.00 0.00 H new ATOM 0 HE2 LYS A 26 61.296 -3.685 18.916 1.00 0.00 H new ATOM 0 HE3 LYS A 26 62.595 -2.712 19.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 60.898 -3.157 21.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 60.965 -1.493 20.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 59.707 -2.436 20.274 1.00 0.00 H new ATOM 418 N LEU A 27 62.904 -3.197 13.407 1.00 0.00 N ATOM 419 CA LEU A 27 62.415 -4.423 12.704 1.00 0.00 C ATOM 420 C LEU A 27 62.534 -5.636 13.634 1.00 0.00 C ATOM 421 O LEU A 27 63.609 -6.001 14.067 1.00 0.00 O ATOM 422 CB LEU A 27 63.267 -4.656 11.447 1.00 0.00 C ATOM 423 CG LEU A 27 62.802 -3.739 10.299 1.00 0.00 C ATOM 424 CD1 LEU A 27 61.436 -4.196 9.744 1.00 0.00 C ATOM 425 CD2 LEU A 27 62.695 -2.294 10.805 1.00 0.00 C ATOM 0 H LEU A 27 63.913 -3.053 13.375 1.00 0.00 H new ATOM 0 HA LEU A 27 61.371 -4.289 12.423 1.00 0.00 H new ATOM 0 HB2 LEU A 27 64.316 -4.463 11.671 1.00 0.00 H new ATOM 0 HB3 LEU A 27 63.193 -5.699 11.139 1.00 0.00 H new ATOM 0 HG LEU A 27 63.536 -3.796 9.495 1.00 0.00 H new ATOM 0 HD11 LEU A 27 61.131 -3.532 8.935 1.00 0.00 H new ATOM 0 HD12 LEU A 27 61.520 -5.215 9.365 1.00 0.00 H new ATOM 0 HD13 LEU A 27 60.691 -4.165 10.539 1.00 0.00 H new ATOM 0 HD21 LEU A 27 62.366 -1.647 9.992 1.00 0.00 H new ATOM 0 HD22 LEU A 27 61.974 -2.247 11.621 1.00 0.00 H new ATOM 0 HD23 LEU A 27 63.669 -1.961 11.162 1.00 0.00 H new ATOM 437 N LYS A 28 61.426 -6.261 13.937 1.00 0.00 N ATOM 438 CA LYS A 28 61.442 -7.455 14.834 1.00 0.00 C ATOM 439 C LYS A 28 61.559 -8.724 13.985 1.00 0.00 C ATOM 440 O LYS A 28 61.395 -8.690 12.782 1.00 0.00 O ATOM 441 CB LYS A 28 60.141 -7.508 15.637 1.00 0.00 C ATOM 442 CG LYS A 28 60.113 -6.354 16.644 1.00 0.00 C ATOM 443 CD LYS A 28 58.867 -6.462 17.535 1.00 0.00 C ATOM 444 CE LYS A 28 57.625 -5.956 16.786 1.00 0.00 C ATOM 445 NZ LYS A 28 57.863 -4.571 16.290 1.00 0.00 N ATOM 0 H LYS A 28 60.502 -5.993 13.598 1.00 0.00 H new ATOM 0 HA LYS A 28 62.290 -7.386 15.515 1.00 0.00 H new ATOM 0 HB2 LYS A 28 59.285 -7.440 14.966 1.00 0.00 H new ATOM 0 HB3 LYS A 28 60.062 -8.462 16.159 1.00 0.00 H new ATOM 0 HG2 LYS A 28 61.013 -6.376 17.259 1.00 0.00 H new ATOM 0 HG3 LYS A 28 60.111 -5.400 16.116 1.00 0.00 H new ATOM 0 HD2 LYS A 28 58.719 -7.498 17.839 1.00 0.00 H new ATOM 0 HD3 LYS A 28 59.012 -5.880 18.445 1.00 0.00 H new ATOM 0 HE2 LYS A 28 57.399 -6.618 15.950 1.00 0.00 H new ATOM 0 HE3 LYS A 28 56.759 -5.971 17.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 57.058 -3.966 16.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 58.733 -4.194 16.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 57.964 -4.585 15.255 1.00 0.00 H new ATOM 459 N LYS A 29 61.865 -9.837 14.595 1.00 0.00 N ATOM 460 CA LYS A 29 62.019 -11.096 13.809 1.00 0.00 C ATOM 461 C LYS A 29 60.716 -11.403 13.064 1.00 0.00 C ATOM 462 O LYS A 29 60.730 -11.814 11.921 1.00 0.00 O ATOM 463 CB LYS A 29 62.322 -12.245 14.772 1.00 0.00 C ATOM 464 CG LYS A 29 63.650 -11.981 15.480 1.00 0.00 C ATOM 465 CD LYS A 29 63.954 -13.130 16.445 1.00 0.00 C ATOM 466 CE LYS A 29 65.283 -12.868 17.155 1.00 0.00 C ATOM 467 NZ LYS A 29 65.094 -11.812 18.191 1.00 0.00 N ATOM 0 H LYS A 29 62.015 -9.930 15.600 1.00 0.00 H new ATOM 0 HA LYS A 29 62.830 -10.980 13.090 1.00 0.00 H new ATOM 0 HB2 LYS A 29 61.520 -12.341 15.504 1.00 0.00 H new ATOM 0 HB3 LYS A 29 62.370 -13.188 14.227 1.00 0.00 H new ATOM 0 HG2 LYS A 29 64.452 -11.886 14.748 1.00 0.00 H new ATOM 0 HG3 LYS A 29 63.602 -11.038 16.025 1.00 0.00 H new ATOM 0 HD2 LYS A 29 63.152 -13.225 17.177 1.00 0.00 H new ATOM 0 HD3 LYS A 29 64.001 -14.073 15.900 1.00 0.00 H new ATOM 0 HE2 LYS A 29 65.647 -13.785 17.618 1.00 0.00 H new ATOM 0 HE3 LYS A 29 66.037 -12.554 16.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 65.506 -10.918 17.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 64.078 -11.679 18.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 65.566 -12.101 19.071 1.00 0.00 H new ATOM 481 N SER A 30 59.592 -11.187 13.687 1.00 0.00 N ATOM 482 CA SER A 30 58.299 -11.452 12.993 1.00 0.00 C ATOM 483 C SER A 30 58.182 -10.498 11.804 1.00 0.00 C ATOM 484 O SER A 30 57.734 -10.859 10.734 1.00 0.00 O ATOM 485 CB SER A 30 57.140 -11.215 13.962 1.00 0.00 C ATOM 486 OG SER A 30 57.046 -9.827 14.259 1.00 0.00 O ATOM 0 H SER A 30 59.511 -10.840 14.643 1.00 0.00 H new ATOM 0 HA SER A 30 58.264 -12.485 12.646 1.00 0.00 H new ATOM 0 HB2 SER A 30 56.207 -11.568 13.523 1.00 0.00 H new ATOM 0 HB3 SER A 30 57.296 -11.784 14.878 1.00 0.00 H new ATOM 0 HG SER A 30 56.302 -9.675 14.879 1.00 0.00 H new ATOM 492 N GLU A 31 58.605 -9.284 11.995 1.00 0.00 N ATOM 493 CA GLU A 31 58.553 -8.280 10.898 1.00 0.00 C ATOM 494 C GLU A 31 59.583 -8.639 9.817 1.00 0.00 C ATOM 495 O GLU A 31 59.361 -8.429 8.641 1.00 0.00 O ATOM 496 CB GLU A 31 58.854 -6.895 11.473 1.00 0.00 C ATOM 497 CG GLU A 31 57.678 -6.453 12.348 1.00 0.00 C ATOM 498 CD GLU A 31 57.988 -5.102 12.994 1.00 0.00 C ATOM 499 OE1 GLU A 31 59.106 -4.641 12.848 1.00 0.00 O ATOM 500 OE2 GLU A 31 57.101 -4.554 13.627 1.00 0.00 O ATOM 0 H GLU A 31 58.989 -8.939 12.874 1.00 0.00 H new ATOM 0 HA GLU A 31 57.560 -8.277 10.448 1.00 0.00 H new ATOM 0 HB2 GLU A 31 59.771 -6.923 12.061 1.00 0.00 H new ATOM 0 HB3 GLU A 31 59.014 -6.179 10.667 1.00 0.00 H new ATOM 0 HG2 GLU A 31 56.773 -6.378 11.745 1.00 0.00 H new ATOM 0 HG3 GLU A 31 57.487 -7.199 13.119 1.00 0.00 H new ATOM 507 N LEU A 32 60.705 -9.186 10.210 1.00 0.00 N ATOM 508 CA LEU A 32 61.741 -9.561 9.198 1.00 0.00 C ATOM 509 C LEU A 32 61.242 -10.755 8.375 1.00 0.00 C ATOM 510 O LEU A 32 61.422 -10.813 7.176 1.00 0.00 O ATOM 511 CB LEU A 32 63.054 -9.933 9.901 1.00 0.00 C ATOM 512 CG LEU A 32 64.135 -10.281 8.861 1.00 0.00 C ATOM 513 CD1 LEU A 32 64.436 -9.053 7.981 1.00 0.00 C ATOM 514 CD2 LEU A 32 65.412 -10.710 9.591 1.00 0.00 C ATOM 0 H LEU A 32 60.948 -9.388 11.180 1.00 0.00 H new ATOM 0 HA LEU A 32 61.920 -8.712 8.539 1.00 0.00 H new ATOM 0 HB2 LEU A 32 63.390 -9.103 10.522 1.00 0.00 H new ATOM 0 HB3 LEU A 32 62.891 -10.782 10.565 1.00 0.00 H new ATOM 0 HG LEU A 32 63.778 -11.093 8.227 1.00 0.00 H new ATOM 0 HD11 LEU A 32 65.202 -9.309 7.249 1.00 0.00 H new ATOM 0 HD12 LEU A 32 63.528 -8.745 7.464 1.00 0.00 H new ATOM 0 HD13 LEU A 32 64.792 -8.235 8.607 1.00 0.00 H new ATOM 0 HD21 LEU A 32 66.182 -10.958 8.861 1.00 0.00 H new ATOM 0 HD22 LEU A 32 65.761 -9.894 10.224 1.00 0.00 H new ATOM 0 HD23 LEU A 32 65.202 -11.584 10.208 1.00 0.00 H new ATOM 526 N LYS A 33 60.613 -11.701 9.016 1.00 0.00 N ATOM 527 CA LYS A 33 60.094 -12.891 8.284 1.00 0.00 C ATOM 528 C LYS A 33 59.091 -12.426 7.231 1.00 0.00 C ATOM 529 O LYS A 33 59.046 -12.925 6.124 1.00 0.00 O ATOM 530 CB LYS A 33 59.408 -13.837 9.277 1.00 0.00 C ATOM 531 CG LYS A 33 58.912 -15.094 8.547 1.00 0.00 C ATOM 532 CD LYS A 33 58.223 -16.046 9.541 1.00 0.00 C ATOM 533 CE LYS A 33 59.270 -16.865 10.308 1.00 0.00 C ATOM 534 NZ LYS A 33 58.585 -17.919 11.111 1.00 0.00 N ATOM 0 H LYS A 33 60.435 -11.701 10.020 1.00 0.00 H new ATOM 0 HA LYS A 33 60.914 -13.418 7.797 1.00 0.00 H new ATOM 0 HB2 LYS A 33 60.105 -14.116 10.067 1.00 0.00 H new ATOM 0 HB3 LYS A 33 58.570 -13.330 9.756 1.00 0.00 H new ATOM 0 HG2 LYS A 33 58.215 -14.814 7.757 1.00 0.00 H new ATOM 0 HG3 LYS A 33 59.750 -15.600 8.068 1.00 0.00 H new ATOM 0 HD2 LYS A 33 57.615 -15.473 10.241 1.00 0.00 H new ATOM 0 HD3 LYS A 33 57.549 -16.715 9.006 1.00 0.00 H new ATOM 0 HE2 LYS A 33 59.972 -17.322 9.611 1.00 0.00 H new ATOM 0 HE3 LYS A 33 59.849 -16.213 10.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 59.294 -18.475 11.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 57.932 -17.472 11.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 58.051 -18.546 10.477 1.00 0.00 H new ATOM 548 N GLU A 34 58.283 -11.469 7.584 1.00 0.00 N ATOM 549 CA GLU A 34 57.265 -10.953 6.632 1.00 0.00 C ATOM 550 C GLU A 34 57.959 -10.390 5.386 1.00 0.00 C ATOM 551 O GLU A 34 57.559 -10.656 4.270 1.00 0.00 O ATOM 552 CB GLU A 34 56.458 -9.850 7.324 1.00 0.00 C ATOM 553 CG GLU A 34 55.294 -9.414 6.433 1.00 0.00 C ATOM 554 CD GLU A 34 54.283 -10.557 6.325 1.00 0.00 C ATOM 555 OE1 GLU A 34 54.384 -11.488 7.107 1.00 0.00 O ATOM 556 OE2 GLU A 34 53.421 -10.479 5.465 1.00 0.00 O ATOM 0 H GLU A 34 58.284 -11.018 8.499 1.00 0.00 H new ATOM 0 HA GLU A 34 56.599 -11.760 6.327 1.00 0.00 H new ATOM 0 HB2 GLU A 34 56.079 -10.211 8.280 1.00 0.00 H new ATOM 0 HB3 GLU A 34 57.102 -8.997 7.538 1.00 0.00 H new ATOM 0 HG2 GLU A 34 54.815 -8.528 6.849 1.00 0.00 H new ATOM 0 HG3 GLU A 34 55.661 -9.143 5.443 1.00 0.00 H new ATOM 563 N LEU A 35 58.989 -9.608 5.562 1.00 0.00 N ATOM 564 CA LEU A 35 59.694 -9.028 4.381 1.00 0.00 C ATOM 565 C LEU A 35 60.230 -10.160 3.507 1.00 0.00 C ATOM 566 O LEU A 35 60.069 -10.157 2.303 1.00 0.00 O ATOM 567 CB LEU A 35 60.857 -8.135 4.853 1.00 0.00 C ATOM 568 CG LEU A 35 61.603 -7.513 3.634 1.00 0.00 C ATOM 569 CD1 LEU A 35 62.038 -6.077 3.962 1.00 0.00 C ATOM 570 CD2 LEU A 35 62.860 -8.329 3.284 1.00 0.00 C ATOM 0 H LEU A 35 59.373 -9.345 6.470 1.00 0.00 H new ATOM 0 HA LEU A 35 58.996 -8.422 3.803 1.00 0.00 H new ATOM 0 HB2 LEU A 35 60.475 -7.342 5.496 1.00 0.00 H new ATOM 0 HB3 LEU A 35 61.554 -8.722 5.451 1.00 0.00 H new ATOM 0 HG LEU A 35 60.918 -7.519 2.787 1.00 0.00 H new ATOM 0 HD11 LEU A 35 62.559 -5.650 3.105 1.00 0.00 H new ATOM 0 HD12 LEU A 35 61.159 -5.474 4.190 1.00 0.00 H new ATOM 0 HD13 LEU A 35 62.705 -6.087 4.824 1.00 0.00 H new ATOM 0 HD21 LEU A 35 63.363 -7.875 2.430 1.00 0.00 H new ATOM 0 HD22 LEU A 35 63.536 -8.341 4.139 1.00 0.00 H new ATOM 0 HD23 LEU A 35 62.573 -9.350 3.034 1.00 0.00 H new ATOM 582 N ILE A 36 60.879 -11.124 4.102 1.00 0.00 N ATOM 583 CA ILE A 36 61.433 -12.249 3.299 1.00 0.00 C ATOM 584 C ILE A 36 60.303 -12.974 2.558 1.00 0.00 C ATOM 585 O ILE A 36 60.398 -13.257 1.381 1.00 0.00 O ATOM 586 CB ILE A 36 62.152 -13.240 4.222 1.00 0.00 C ATOM 587 CG1 ILE A 36 63.383 -12.563 4.836 1.00 0.00 C ATOM 588 CG2 ILE A 36 62.591 -14.471 3.411 1.00 0.00 C ATOM 589 CD1 ILE A 36 63.962 -13.451 5.940 1.00 0.00 C ATOM 0 H ILE A 36 61.049 -11.180 5.106 1.00 0.00 H new ATOM 0 HA ILE A 36 62.140 -11.848 2.573 1.00 0.00 H new ATOM 0 HB ILE A 36 61.476 -13.554 5.017 1.00 0.00 H new ATOM 0 HG12 ILE A 36 64.134 -12.386 4.067 1.00 0.00 H new ATOM 0 HG13 ILE A 36 63.109 -11.590 5.244 1.00 0.00 H new ATOM 0 HG21 ILE A 36 63.102 -15.176 4.067 1.00 0.00 H new ATOM 0 HG22 ILE A 36 61.715 -14.951 2.975 1.00 0.00 H new ATOM 0 HG23 ILE A 36 63.268 -14.160 2.615 1.00 0.00 H new ATOM 0 HD11 ILE A 36 64.837 -12.967 6.375 1.00 0.00 H new ATOM 0 HD12 ILE A 36 63.211 -13.605 6.714 1.00 0.00 H new ATOM 0 HD13 ILE A 36 64.252 -14.414 5.518 1.00 0.00 H new ATOM 601 N ASN A 37 59.246 -13.295 3.252 1.00 0.00 N ATOM 602 CA ASN A 37 58.109 -14.023 2.616 1.00 0.00 C ATOM 603 C ASN A 37 57.337 -13.110 1.661 1.00 0.00 C ATOM 604 O ASN A 37 56.600 -13.572 0.813 1.00 0.00 O ATOM 605 CB ASN A 37 57.157 -14.509 3.707 1.00 0.00 C ATOM 606 CG ASN A 37 56.133 -15.473 3.102 1.00 0.00 C ATOM 607 OD1 ASN A 37 56.251 -15.865 1.958 1.00 0.00 O ATOM 608 ND2 ASN A 37 55.128 -15.882 3.830 1.00 0.00 N ATOM 0 H ASN A 37 59.119 -13.083 4.242 1.00 0.00 H new ATOM 0 HA ASN A 37 58.510 -14.863 2.050 1.00 0.00 H new ATOM 0 HB2 ASN A 37 57.718 -15.007 4.498 1.00 0.00 H new ATOM 0 HB3 ASN A 37 56.647 -13.661 4.164 1.00 0.00 H new ATOM 0 HD21 ASN A 37 54.444 -16.529 3.438 1.00 0.00 H new ATOM 0 HD22 ASN A 37 55.027 -15.554 4.791 1.00 0.00 H new ATOM 615 N ASN A 38 57.463 -11.822 1.808 1.00 0.00 N ATOM 616 CA ASN A 38 56.697 -10.892 0.926 1.00 0.00 C ATOM 617 C ASN A 38 57.004 -11.140 -0.557 1.00 0.00 C ATOM 618 O ASN A 38 56.111 -11.430 -1.330 1.00 0.00 O ATOM 619 CB ASN A 38 57.069 -9.452 1.279 1.00 0.00 C ATOM 620 CG ASN A 38 56.141 -8.489 0.537 1.00 0.00 C ATOM 621 OD1 ASN A 38 54.985 -8.792 0.314 1.00 0.00 O ATOM 622 ND2 ASN A 38 56.600 -7.334 0.142 1.00 0.00 N ATOM 0 H ASN A 38 58.062 -11.371 2.499 1.00 0.00 H new ATOM 0 HA ASN A 38 55.633 -11.067 1.087 1.00 0.00 H new ATOM 0 HB2 ASN A 38 56.986 -9.297 2.355 1.00 0.00 H new ATOM 0 HB3 ASN A 38 58.106 -9.256 1.007 1.00 0.00 H new ATOM 0 HD21 ASN A 38 55.989 -6.685 -0.354 1.00 0.00 H new ATOM 0 HD22 ASN A 38 57.570 -7.080 0.329 1.00 0.00 H new ATOM 629 N GLU A 39 58.241 -11.010 -0.979 1.00 0.00 N ATOM 630 CA GLU A 39 58.561 -11.224 -2.432 1.00 0.00 C ATOM 631 C GLU A 39 59.915 -11.929 -2.602 1.00 0.00 C ATOM 632 O GLU A 39 60.258 -12.357 -3.685 1.00 0.00 O ATOM 633 CB GLU A 39 58.588 -9.869 -3.148 1.00 0.00 C ATOM 634 CG GLU A 39 59.322 -8.842 -2.286 1.00 0.00 C ATOM 635 CD GLU A 39 59.414 -7.515 -3.042 1.00 0.00 C ATOM 636 OE1 GLU A 39 60.146 -7.462 -4.016 1.00 0.00 O ATOM 637 OE2 GLU A 39 58.751 -6.576 -2.634 1.00 0.00 O ATOM 0 H GLU A 39 59.037 -10.768 -0.389 1.00 0.00 H new ATOM 0 HA GLU A 39 57.791 -11.861 -2.868 1.00 0.00 H new ATOM 0 HB2 GLU A 39 59.084 -9.968 -4.114 1.00 0.00 H new ATOM 0 HB3 GLU A 39 57.571 -9.531 -3.345 1.00 0.00 H new ATOM 0 HG2 GLU A 39 58.795 -8.700 -1.343 1.00 0.00 H new ATOM 0 HG3 GLU A 39 60.321 -9.204 -2.042 1.00 0.00 H new ATOM 644 N LEU A 40 60.687 -12.064 -1.557 1.00 0.00 N ATOM 645 CA LEU A 40 62.007 -12.751 -1.706 1.00 0.00 C ATOM 646 C LEU A 40 61.775 -14.265 -1.735 1.00 0.00 C ATOM 647 O LEU A 40 61.087 -14.817 -0.899 1.00 0.00 O ATOM 648 CB LEU A 40 62.926 -12.385 -0.523 1.00 0.00 C ATOM 649 CG LEU A 40 63.753 -11.135 -0.853 1.00 0.00 C ATOM 650 CD1 LEU A 40 62.818 -9.982 -1.211 1.00 0.00 C ATOM 651 CD2 LEU A 40 64.598 -10.749 0.365 1.00 0.00 C ATOM 0 H LEU A 40 60.467 -11.734 -0.617 1.00 0.00 H new ATOM 0 HA LEU A 40 62.486 -12.433 -2.632 1.00 0.00 H new ATOM 0 HB2 LEU A 40 62.326 -12.207 0.370 1.00 0.00 H new ATOM 0 HB3 LEU A 40 63.591 -13.219 -0.299 1.00 0.00 H new ATOM 0 HG LEU A 40 64.407 -11.345 -1.699 1.00 0.00 H new ATOM 0 HD11 LEU A 40 63.407 -9.095 -1.445 1.00 0.00 H new ATOM 0 HD12 LEU A 40 62.216 -10.257 -2.077 1.00 0.00 H new ATOM 0 HD13 LEU A 40 62.162 -9.770 -0.367 1.00 0.00 H new ATOM 0 HD21 LEU A 40 65.186 -9.861 0.133 1.00 0.00 H new ATOM 0 HD22 LEU A 40 63.943 -10.539 1.211 1.00 0.00 H new ATOM 0 HD23 LEU A 40 65.267 -11.571 0.619 1.00 0.00 H new ATOM 663 N SER A 41 62.343 -14.936 -2.698 1.00 0.00 N ATOM 664 CA SER A 41 62.162 -16.410 -2.792 1.00 0.00 C ATOM 665 C SER A 41 63.230 -16.988 -3.725 1.00 0.00 C ATOM 666 O SER A 41 63.724 -18.080 -3.524 1.00 0.00 O ATOM 667 CB SER A 41 60.767 -16.713 -3.343 1.00 0.00 C ATOM 668 OG SER A 41 60.700 -18.075 -3.735 1.00 0.00 O ATOM 0 H SER A 41 62.927 -14.525 -3.426 1.00 0.00 H new ATOM 0 HA SER A 41 62.263 -16.862 -1.805 1.00 0.00 H new ATOM 0 HB2 SER A 41 60.012 -16.504 -2.586 1.00 0.00 H new ATOM 0 HB3 SER A 41 60.552 -16.067 -4.194 1.00 0.00 H new ATOM 0 HG SER A 41 59.806 -18.271 -4.087 1.00 0.00 H new ATOM 674 N HIS A 42 63.592 -16.254 -4.743 1.00 0.00 N ATOM 675 CA HIS A 42 64.632 -16.743 -5.692 1.00 0.00 C ATOM 676 C HIS A 42 66.008 -16.732 -5.016 1.00 0.00 C ATOM 677 O HIS A 42 66.934 -17.373 -5.473 1.00 0.00 O ATOM 678 CB HIS A 42 64.659 -15.842 -6.930 1.00 0.00 C ATOM 679 CG HIS A 42 63.422 -16.085 -7.750 1.00 0.00 C ATOM 680 ND1 HIS A 42 62.247 -15.369 -7.552 1.00 0.00 N ATOM 681 CD2 HIS A 42 63.159 -16.965 -8.770 1.00 0.00 C ATOM 682 CE1 HIS A 42 61.341 -15.829 -8.435 1.00 0.00 C ATOM 683 NE2 HIS A 42 61.846 -16.801 -9.198 1.00 0.00 N ATOM 0 H HIS A 42 63.210 -15.333 -4.958 1.00 0.00 H new ATOM 0 HA HIS A 42 64.392 -17.764 -5.990 1.00 0.00 H new ATOM 0 HB2 HIS A 42 64.711 -14.795 -6.631 1.00 0.00 H new ATOM 0 HB3 HIS A 42 65.549 -16.048 -7.524 1.00 0.00 H new ATOM 0 HD2 HIS A 42 63.863 -17.675 -9.177 1.00 0.00 H new ATOM 0 HE1 HIS A 42 60.330 -15.457 -8.516 1.00 0.00 H new ATOM 0 HE2 HIS A 42 61.369 -17.315 -9.939 1.00 0.00 H new ATOM 692 N PHE A 43 66.155 -16.004 -3.935 1.00 0.00 N ATOM 693 CA PHE A 43 67.476 -15.945 -3.228 1.00 0.00 C ATOM 694 C PHE A 43 67.428 -16.815 -1.971 1.00 0.00 C ATOM 695 O PHE A 43 68.446 -17.161 -1.404 1.00 0.00 O ATOM 696 CB PHE A 43 67.751 -14.501 -2.807 1.00 0.00 C ATOM 697 CG PHE A 43 67.893 -13.630 -4.029 1.00 0.00 C ATOM 698 CD1 PHE A 43 66.762 -13.028 -4.592 1.00 0.00 C ATOM 699 CD2 PHE A 43 69.154 -13.425 -4.600 1.00 0.00 C ATOM 700 CE1 PHE A 43 66.893 -12.219 -5.726 1.00 0.00 C ATOM 701 CE2 PHE A 43 69.286 -12.616 -5.733 1.00 0.00 C ATOM 702 CZ PHE A 43 68.154 -12.013 -6.297 1.00 0.00 C ATOM 0 H PHE A 43 65.415 -15.446 -3.510 1.00 0.00 H new ATOM 0 HA PHE A 43 68.259 -16.304 -3.896 1.00 0.00 H new ATOM 0 HB2 PHE A 43 66.938 -14.134 -2.181 1.00 0.00 H new ATOM 0 HB3 PHE A 43 68.661 -14.454 -2.208 1.00 0.00 H new ATOM 0 HD1 PHE A 43 65.789 -13.188 -4.152 1.00 0.00 H new ATOM 0 HD2 PHE A 43 70.026 -13.892 -4.166 1.00 0.00 H new ATOM 0 HE1 PHE A 43 66.021 -11.753 -6.161 1.00 0.00 H new ATOM 0 HE2 PHE A 43 70.259 -12.456 -6.173 1.00 0.00 H new ATOM 0 HZ PHE A 43 68.255 -11.389 -7.173 1.00 0.00 H new ATOM 712 N LEU A 44 66.248 -17.162 -1.528 1.00 0.00 N ATOM 713 CA LEU A 44 66.103 -18.001 -0.297 1.00 0.00 C ATOM 714 C LEU A 44 65.751 -19.436 -0.701 1.00 0.00 C ATOM 715 O LEU A 44 65.128 -19.670 -1.718 1.00 0.00 O ATOM 716 CB LEU A 44 64.974 -17.423 0.576 1.00 0.00 C ATOM 717 CG LEU A 44 65.482 -16.239 1.424 1.00 0.00 C ATOM 718 CD1 LEU A 44 66.383 -16.734 2.574 1.00 0.00 C ATOM 719 CD2 LEU A 44 66.268 -15.261 0.543 1.00 0.00 C ATOM 0 H LEU A 44 65.368 -16.898 -1.970 1.00 0.00 H new ATOM 0 HA LEU A 44 67.038 -18.000 0.263 1.00 0.00 H new ATOM 0 HB2 LEU A 44 64.151 -17.094 -0.058 1.00 0.00 H new ATOM 0 HB3 LEU A 44 64.581 -18.201 1.230 1.00 0.00 H new ATOM 0 HG LEU A 44 64.617 -15.731 1.851 1.00 0.00 H new ATOM 0 HD11 LEU A 44 66.729 -15.881 3.158 1.00 0.00 H new ATOM 0 HD12 LEU A 44 65.816 -17.408 3.216 1.00 0.00 H new ATOM 0 HD13 LEU A 44 67.242 -17.264 2.161 1.00 0.00 H new ATOM 0 HD21 LEU A 44 66.623 -14.428 1.151 1.00 0.00 H new ATOM 0 HD22 LEU A 44 67.120 -15.775 0.099 1.00 0.00 H new ATOM 0 HD23 LEU A 44 65.620 -14.883 -0.248 1.00 0.00 H new ATOM 731 N GLU A 45 66.139 -20.396 0.094 1.00 0.00 N ATOM 732 CA GLU A 45 65.823 -21.815 -0.237 1.00 0.00 C ATOM 733 C GLU A 45 64.419 -22.140 0.279 1.00 0.00 C ATOM 734 O GLU A 45 63.469 -22.199 -0.477 1.00 0.00 O ATOM 735 CB GLU A 45 66.837 -22.740 0.445 1.00 0.00 C ATOM 736 CG GLU A 45 68.211 -22.577 -0.210 1.00 0.00 C ATOM 737 CD GLU A 45 69.215 -23.505 0.478 1.00 0.00 C ATOM 738 OE1 GLU A 45 68.868 -24.060 1.509 1.00 0.00 O ATOM 739 OE2 GLU A 45 70.313 -23.643 -0.034 1.00 0.00 O ATOM 0 H GLU A 45 66.662 -20.259 0.959 1.00 0.00 H new ATOM 0 HA GLU A 45 65.870 -21.961 -1.316 1.00 0.00 H new ATOM 0 HB2 GLU A 45 66.900 -22.505 1.507 1.00 0.00 H new ATOM 0 HB3 GLU A 45 66.508 -23.776 0.367 1.00 0.00 H new ATOM 0 HG2 GLU A 45 68.150 -22.813 -1.272 1.00 0.00 H new ATOM 0 HG3 GLU A 45 68.543 -21.542 -0.132 1.00 0.00 H new ATOM 746 N GLU A 46 64.279 -22.343 1.561 1.00 0.00 N ATOM 747 CA GLU A 46 62.935 -22.654 2.126 1.00 0.00 C ATOM 748 C GLU A 46 62.964 -22.467 3.646 1.00 0.00 C ATOM 749 O GLU A 46 63.517 -23.277 4.364 1.00 0.00 O ATOM 750 CB GLU A 46 62.574 -24.107 1.795 1.00 0.00 C ATOM 751 CG GLU A 46 61.132 -24.400 2.224 1.00 0.00 C ATOM 752 CD GLU A 46 60.163 -23.602 1.349 1.00 0.00 C ATOM 753 OE1 GLU A 46 60.567 -23.190 0.273 1.00 0.00 O ATOM 754 OE2 GLU A 46 59.031 -23.419 1.767 1.00 0.00 O ATOM 0 H GLU A 46 65.038 -22.307 2.242 1.00 0.00 H new ATOM 0 HA GLU A 46 62.191 -21.984 1.694 1.00 0.00 H new ATOM 0 HB2 GLU A 46 62.687 -24.284 0.725 1.00 0.00 H new ATOM 0 HB3 GLU A 46 63.259 -24.785 2.304 1.00 0.00 H new ATOM 0 HG2 GLU A 46 60.925 -25.466 2.134 1.00 0.00 H new ATOM 0 HG3 GLU A 46 60.993 -24.136 3.272 1.00 0.00 H new ATOM 761 N ILE A 47 62.365 -21.414 4.149 1.00 0.00 N ATOM 762 CA ILE A 47 62.350 -21.189 5.630 1.00 0.00 C ATOM 763 C ILE A 47 61.005 -21.656 6.194 1.00 0.00 C ATOM 764 O ILE A 47 59.997 -20.992 6.045 1.00 0.00 O ATOM 765 CB ILE A 47 62.538 -19.699 5.927 1.00 0.00 C ATOM 766 CG1 ILE A 47 63.905 -19.242 5.407 1.00 0.00 C ATOM 767 CG2 ILE A 47 62.463 -19.466 7.437 1.00 0.00 C ATOM 768 CD1 ILE A 47 64.001 -17.716 5.486 1.00 0.00 C ATOM 0 H ILE A 47 61.886 -20.701 3.599 1.00 0.00 H new ATOM 0 HA ILE A 47 63.160 -21.752 6.093 1.00 0.00 H new ATOM 0 HB ILE A 47 61.752 -19.129 5.432 1.00 0.00 H new ATOM 0 HG12 ILE A 47 64.700 -19.697 5.997 1.00 0.00 H new ATOM 0 HG13 ILE A 47 64.043 -19.572 4.377 1.00 0.00 H new ATOM 0 HG21 ILE A 47 62.597 -18.405 7.649 1.00 0.00 H new ATOM 0 HG22 ILE A 47 61.490 -19.790 7.807 1.00 0.00 H new ATOM 0 HG23 ILE A 47 63.248 -20.037 7.933 1.00 0.00 H new ATOM 0 HD11 ILE A 47 64.974 -17.393 5.116 1.00 0.00 H new ATOM 0 HD12 ILE A 47 63.215 -17.270 4.877 1.00 0.00 H new ATOM 0 HD13 ILE A 47 63.883 -17.397 6.522 1.00 0.00 H new ATOM 780 N LYS A 48 60.987 -22.798 6.840 1.00 0.00 N ATOM 781 CA LYS A 48 59.714 -23.339 7.423 1.00 0.00 C ATOM 782 C LYS A 48 59.797 -23.332 8.955 1.00 0.00 C ATOM 783 O LYS A 48 58.790 -23.335 9.635 1.00 0.00 O ATOM 784 CB LYS A 48 59.507 -24.777 6.920 1.00 0.00 C ATOM 785 CG LYS A 48 58.166 -25.354 7.444 1.00 0.00 C ATOM 786 CD LYS A 48 58.413 -26.285 8.642 1.00 0.00 C ATOM 787 CE LYS A 48 57.079 -26.833 9.161 1.00 0.00 C ATOM 788 NZ LYS A 48 57.325 -28.082 9.938 1.00 0.00 N ATOM 0 H LYS A 48 61.807 -23.385 6.990 1.00 0.00 H new ATOM 0 HA LYS A 48 58.875 -22.716 7.114 1.00 0.00 H new ATOM 0 HB2 LYS A 48 59.513 -24.791 5.830 1.00 0.00 H new ATOM 0 HB3 LYS A 48 60.333 -25.406 7.251 1.00 0.00 H new ATOM 0 HG2 LYS A 48 57.503 -24.540 7.739 1.00 0.00 H new ATOM 0 HG3 LYS A 48 57.663 -25.902 6.647 1.00 0.00 H new ATOM 0 HD2 LYS A 48 59.064 -27.108 8.346 1.00 0.00 H new ATOM 0 HD3 LYS A 48 58.927 -25.742 9.436 1.00 0.00 H new ATOM 0 HE2 LYS A 48 56.589 -26.091 9.791 1.00 0.00 H new ATOM 0 HE3 LYS A 48 56.408 -27.037 8.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 56.421 -28.455 10.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 57.776 -28.790 9.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 57.951 -27.873 10.742 1.00 0.00 H new ATOM 802 N GLU A 49 60.992 -23.331 9.500 1.00 0.00 N ATOM 803 CA GLU A 49 61.158 -23.333 10.993 1.00 0.00 C ATOM 804 C GLU A 49 61.750 -21.998 11.456 1.00 0.00 C ATOM 805 O GLU A 49 62.662 -21.468 10.853 1.00 0.00 O ATOM 806 CB GLU A 49 62.108 -24.465 11.391 1.00 0.00 C ATOM 807 CG GLU A 49 61.421 -25.814 11.170 1.00 0.00 C ATOM 808 CD GLU A 49 62.375 -26.942 11.567 1.00 0.00 C ATOM 809 OE1 GLU A 49 63.536 -26.653 11.802 1.00 0.00 O ATOM 810 OE2 GLU A 49 61.927 -28.074 11.634 1.00 0.00 O ATOM 0 H GLU A 49 61.865 -23.329 8.973 1.00 0.00 H new ATOM 0 HA GLU A 49 60.185 -23.477 11.462 1.00 0.00 H new ATOM 0 HB2 GLU A 49 63.022 -24.410 10.800 1.00 0.00 H new ATOM 0 HB3 GLU A 49 62.397 -24.360 12.437 1.00 0.00 H new ATOM 0 HG2 GLU A 49 60.507 -25.870 11.762 1.00 0.00 H new ATOM 0 HG3 GLU A 49 61.131 -25.920 10.125 1.00 0.00 H new ATOM 817 N GLN A 50 61.239 -21.455 12.530 1.00 0.00 N ATOM 818 CA GLN A 50 61.770 -20.158 13.042 1.00 0.00 C ATOM 819 C GLN A 50 63.244 -20.322 13.426 1.00 0.00 C ATOM 820 O GLN A 50 64.021 -19.390 13.363 1.00 0.00 O ATOM 821 CB GLN A 50 60.966 -19.724 14.271 1.00 0.00 C ATOM 822 CG GLN A 50 61.129 -20.754 15.392 1.00 0.00 C ATOM 823 CD GLN A 50 60.205 -20.390 16.554 1.00 0.00 C ATOM 824 OE1 GLN A 50 59.061 -20.036 16.346 1.00 0.00 O ATOM 825 NE2 GLN A 50 60.655 -20.454 17.775 1.00 0.00 N ATOM 0 H GLN A 50 60.475 -21.855 13.075 1.00 0.00 H new ATOM 0 HA GLN A 50 61.681 -19.399 12.265 1.00 0.00 H new ATOM 0 HB2 GLN A 50 61.306 -18.746 14.612 1.00 0.00 H new ATOM 0 HB3 GLN A 50 59.913 -19.622 14.010 1.00 0.00 H new ATOM 0 HG2 GLN A 50 60.891 -21.751 15.022 1.00 0.00 H new ATOM 0 HG3 GLN A 50 62.165 -20.779 15.730 1.00 0.00 H new ATOM 0 HE21 GLN A 50 61.615 -20.751 17.950 1.00 0.00 H new ATOM 0 HE22 GLN A 50 60.047 -20.207 18.556 1.00 0.00 H new ATOM 834 N GLU A 51 63.628 -21.498 13.840 1.00 0.00 N ATOM 835 CA GLU A 51 65.045 -21.726 14.250 1.00 0.00 C ATOM 836 C GLU A 51 65.980 -21.325 13.108 1.00 0.00 C ATOM 837 O GLU A 51 67.078 -20.852 13.328 1.00 0.00 O ATOM 838 CB GLU A 51 65.242 -23.209 14.574 1.00 0.00 C ATOM 839 CG GLU A 51 64.498 -23.553 15.866 1.00 0.00 C ATOM 840 CD GLU A 51 64.675 -25.039 16.181 1.00 0.00 C ATOM 841 OE1 GLU A 51 65.277 -25.728 15.374 1.00 0.00 O ATOM 842 OE2 GLU A 51 64.210 -25.463 17.226 1.00 0.00 O ATOM 0 H GLU A 51 63.021 -22.314 13.913 1.00 0.00 H new ATOM 0 HA GLU A 51 65.272 -21.124 15.130 1.00 0.00 H new ATOM 0 HB2 GLU A 51 64.871 -23.824 13.754 1.00 0.00 H new ATOM 0 HB3 GLU A 51 66.304 -23.430 14.683 1.00 0.00 H new ATOM 0 HG2 GLU A 51 64.880 -22.949 16.689 1.00 0.00 H new ATOM 0 HG3 GLU A 51 63.439 -23.317 15.761 1.00 0.00 H new ATOM 849 N VAL A 52 65.546 -21.483 11.893 1.00 0.00 N ATOM 850 CA VAL A 52 66.392 -21.083 10.733 1.00 0.00 C ATOM 851 C VAL A 52 66.486 -19.554 10.694 1.00 0.00 C ATOM 852 O VAL A 52 67.498 -18.986 10.337 1.00 0.00 O ATOM 853 CB VAL A 52 65.753 -21.602 9.443 1.00 0.00 C ATOM 854 CG1 VAL A 52 66.460 -21.001 8.225 1.00 0.00 C ATOM 855 CG2 VAL A 52 65.873 -23.127 9.401 1.00 0.00 C ATOM 0 H VAL A 52 64.636 -21.874 11.649 1.00 0.00 H new ATOM 0 HA VAL A 52 67.392 -21.505 10.831 1.00 0.00 H new ATOM 0 HB VAL A 52 64.703 -21.311 9.421 1.00 0.00 H new ATOM 0 HG11 VAL A 52 65.997 -21.377 7.313 1.00 0.00 H new ATOM 0 HG12 VAL A 52 66.374 -19.915 8.254 1.00 0.00 H new ATOM 0 HG13 VAL A 52 67.513 -21.282 8.240 1.00 0.00 H new ATOM 0 HG21 VAL A 52 65.419 -23.503 8.484 1.00 0.00 H new ATOM 0 HG22 VAL A 52 66.925 -23.410 9.428 1.00 0.00 H new ATOM 0 HG23 VAL A 52 65.360 -23.556 10.262 1.00 0.00 H new ATOM 865 N VAL A 53 65.425 -18.892 11.068 1.00 0.00 N ATOM 866 CA VAL A 53 65.427 -17.400 11.065 1.00 0.00 C ATOM 867 C VAL A 53 66.359 -16.889 12.167 1.00 0.00 C ATOM 868 O VAL A 53 67.101 -15.947 11.980 1.00 0.00 O ATOM 869 CB VAL A 53 64.003 -16.892 11.319 1.00 0.00 C ATOM 870 CG1 VAL A 53 64.020 -15.378 11.557 1.00 0.00 C ATOM 871 CG2 VAL A 53 63.128 -17.207 10.107 1.00 0.00 C ATOM 0 H VAL A 53 64.553 -19.322 11.377 1.00 0.00 H new ATOM 0 HA VAL A 53 65.777 -17.036 10.099 1.00 0.00 H new ATOM 0 HB VAL A 53 63.599 -17.387 12.202 1.00 0.00 H new ATOM 0 HG11 VAL A 53 63.004 -15.026 11.736 1.00 0.00 H new ATOM 0 HG12 VAL A 53 64.640 -15.153 12.425 1.00 0.00 H new ATOM 0 HG13 VAL A 53 64.428 -14.876 10.679 1.00 0.00 H new ATOM 0 HG21 VAL A 53 62.115 -16.846 10.286 1.00 0.00 H new ATOM 0 HG22 VAL A 53 63.538 -16.715 9.225 1.00 0.00 H new ATOM 0 HG23 VAL A 53 63.106 -18.285 9.944 1.00 0.00 H new ATOM 881 N ASP A 54 66.312 -17.495 13.318 1.00 0.00 N ATOM 882 CA ASP A 54 67.182 -17.038 14.438 1.00 0.00 C ATOM 883 C ASP A 54 68.652 -17.144 14.030 1.00 0.00 C ATOM 884 O ASP A 54 69.452 -16.281 14.331 1.00 0.00 O ATOM 885 CB ASP A 54 66.924 -17.906 15.672 1.00 0.00 C ATOM 886 CG ASP A 54 67.815 -17.439 16.826 1.00 0.00 C ATOM 887 OD1 ASP A 54 69.014 -17.648 16.745 1.00 0.00 O ATOM 888 OD2 ASP A 54 67.282 -16.878 17.769 1.00 0.00 O ATOM 0 H ASP A 54 65.708 -18.288 13.533 1.00 0.00 H new ATOM 0 HA ASP A 54 66.952 -15.999 14.672 1.00 0.00 H new ATOM 0 HB2 ASP A 54 65.875 -17.842 15.961 1.00 0.00 H new ATOM 0 HB3 ASP A 54 67.128 -18.952 15.442 1.00 0.00 H new ATOM 893 N LYS A 55 69.014 -18.191 13.346 1.00 0.00 N ATOM 894 CA LYS A 55 70.434 -18.342 12.918 1.00 0.00 C ATOM 895 C LYS A 55 70.811 -17.167 12.013 1.00 0.00 C ATOM 896 O LYS A 55 71.873 -16.589 12.131 1.00 0.00 O ATOM 897 CB LYS A 55 70.597 -19.657 12.151 1.00 0.00 C ATOM 898 CG LYS A 55 72.086 -19.940 11.925 1.00 0.00 C ATOM 899 CD LYS A 55 72.261 -21.261 11.159 1.00 0.00 C ATOM 900 CE LYS A 55 71.928 -22.456 12.065 1.00 0.00 C ATOM 901 NZ LYS A 55 72.517 -23.696 11.486 1.00 0.00 N ATOM 0 H LYS A 55 68.391 -18.948 13.064 1.00 0.00 H new ATOM 0 HA LYS A 55 71.085 -18.353 13.792 1.00 0.00 H new ATOM 0 HB2 LYS A 55 70.142 -20.475 12.710 1.00 0.00 H new ATOM 0 HB3 LYS A 55 70.078 -19.598 11.194 1.00 0.00 H new ATOM 0 HG2 LYS A 55 72.539 -19.122 11.364 1.00 0.00 H new ATOM 0 HG3 LYS A 55 72.604 -19.994 12.883 1.00 0.00 H new ATOM 0 HD2 LYS A 55 71.612 -21.269 10.283 1.00 0.00 H new ATOM 0 HD3 LYS A 55 73.286 -21.346 10.797 1.00 0.00 H new ATOM 0 HE2 LYS A 55 72.322 -22.287 13.067 1.00 0.00 H new ATOM 0 HE3 LYS A 55 70.848 -22.564 12.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 72.292 -24.506 12.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 72.121 -23.858 10.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 73.549 -23.590 11.417 1.00 0.00 H new ATOM 915 N VAL A 56 69.943 -16.820 11.107 1.00 0.00 N ATOM 916 CA VAL A 56 70.237 -15.689 10.181 1.00 0.00 C ATOM 917 C VAL A 56 70.336 -14.385 10.981 1.00 0.00 C ATOM 918 O VAL A 56 71.174 -13.545 10.715 1.00 0.00 O ATOM 919 CB VAL A 56 69.121 -15.587 9.131 1.00 0.00 C ATOM 920 CG1 VAL A 56 69.321 -14.343 8.256 1.00 0.00 C ATOM 921 CG2 VAL A 56 69.156 -16.831 8.241 1.00 0.00 C ATOM 0 H VAL A 56 69.039 -17.271 10.966 1.00 0.00 H new ATOM 0 HA VAL A 56 71.186 -15.864 9.674 1.00 0.00 H new ATOM 0 HB VAL A 56 68.161 -15.512 9.642 1.00 0.00 H new ATOM 0 HG11 VAL A 56 68.522 -14.286 7.517 1.00 0.00 H new ATOM 0 HG12 VAL A 56 69.301 -13.451 8.882 1.00 0.00 H new ATOM 0 HG13 VAL A 56 70.282 -14.407 7.746 1.00 0.00 H new ATOM 0 HG21 VAL A 56 68.366 -16.765 7.493 1.00 0.00 H new ATOM 0 HG22 VAL A 56 70.123 -16.895 7.743 1.00 0.00 H new ATOM 0 HG23 VAL A 56 69.004 -17.720 8.853 1.00 0.00 H new ATOM 931 N MET A 57 69.480 -14.206 11.948 1.00 0.00 N ATOM 932 CA MET A 57 69.513 -12.951 12.757 1.00 0.00 C ATOM 933 C MET A 57 70.859 -12.801 13.469 1.00 0.00 C ATOM 934 O MET A 57 71.415 -11.722 13.539 1.00 0.00 O ATOM 935 CB MET A 57 68.400 -12.993 13.807 1.00 0.00 C ATOM 936 CG MET A 57 67.037 -12.877 13.125 1.00 0.00 C ATOM 937 SD MET A 57 66.852 -11.225 12.403 1.00 0.00 S ATOM 938 CE MET A 57 66.752 -10.270 13.940 1.00 0.00 C ATOM 0 H MET A 57 68.757 -14.874 12.215 1.00 0.00 H new ATOM 0 HA MET A 57 69.369 -12.104 12.086 1.00 0.00 H new ATOM 0 HB2 MET A 57 68.456 -13.924 14.372 1.00 0.00 H new ATOM 0 HB3 MET A 57 68.530 -12.179 14.520 1.00 0.00 H new ATOM 0 HG2 MET A 57 66.943 -13.636 12.349 1.00 0.00 H new ATOM 0 HG3 MET A 57 66.242 -13.060 13.848 1.00 0.00 H new ATOM 0 HE1 MET A 57 65.929 -9.558 13.873 1.00 0.00 H new ATOM 0 HE2 MET A 57 66.580 -10.946 14.778 1.00 0.00 H new ATOM 0 HE3 MET A 57 67.687 -9.731 14.095 1.00 0.00 H new ATOM 948 N GLU A 58 71.384 -13.863 14.009 1.00 0.00 N ATOM 949 CA GLU A 58 72.687 -13.752 14.723 1.00 0.00 C ATOM 950 C GLU A 58 73.758 -13.255 13.750 1.00 0.00 C ATOM 951 O GLU A 58 74.581 -12.427 14.086 1.00 0.00 O ATOM 952 CB GLU A 58 73.087 -15.118 15.288 1.00 0.00 C ATOM 953 CG GLU A 58 74.384 -14.981 16.093 1.00 0.00 C ATOM 954 CD GLU A 58 74.769 -16.341 16.679 1.00 0.00 C ATOM 955 OE1 GLU A 58 74.010 -17.279 16.495 1.00 0.00 O ATOM 956 OE2 GLU A 58 75.815 -16.421 17.301 1.00 0.00 O ATOM 0 H GLU A 58 70.973 -14.796 13.988 1.00 0.00 H new ATOM 0 HA GLU A 58 72.591 -13.044 15.546 1.00 0.00 H new ATOM 0 HB2 GLU A 58 72.292 -15.507 15.924 1.00 0.00 H new ATOM 0 HB3 GLU A 58 73.224 -15.833 14.476 1.00 0.00 H new ATOM 0 HG2 GLU A 58 75.184 -14.610 15.453 1.00 0.00 H new ATOM 0 HG3 GLU A 58 74.252 -14.253 16.893 1.00 0.00 H new ATOM 963 N THR A 59 73.748 -13.749 12.545 1.00 0.00 N ATOM 964 CA THR A 59 74.760 -13.303 11.546 1.00 0.00 C ATOM 965 C THR A 59 74.493 -11.853 11.142 1.00 0.00 C ATOM 966 O THR A 59 75.403 -11.064 10.982 1.00 0.00 O ATOM 967 CB THR A 59 74.672 -14.200 10.306 1.00 0.00 C ATOM 968 OG1 THR A 59 74.989 -15.537 10.665 1.00 0.00 O ATOM 969 CG2 THR A 59 75.644 -13.708 9.230 1.00 0.00 C ATOM 0 H THR A 59 73.082 -14.444 12.207 1.00 0.00 H new ATOM 0 HA THR A 59 75.755 -13.373 11.986 1.00 0.00 H new ATOM 0 HB THR A 59 73.658 -14.161 9.908 1.00 0.00 H new ATOM 0 HG1 THR A 59 74.931 -16.111 9.873 1.00 0.00 H new ATOM 0 HG21 THR A 59 75.573 -14.352 8.354 1.00 0.00 H new ATOM 0 HG22 THR A 59 75.390 -12.686 8.950 1.00 0.00 H new ATOM 0 HG23 THR A 59 76.662 -13.735 9.619 1.00 0.00 H new ATOM 977 N LEU A 60 73.253 -11.497 10.970 1.00 0.00 N ATOM 978 CA LEU A 60 72.921 -10.100 10.566 1.00 0.00 C ATOM 979 C LEU A 60 73.131 -9.141 11.741 1.00 0.00 C ATOM 980 O LEU A 60 73.622 -8.042 11.576 1.00 0.00 O ATOM 981 CB LEU A 60 71.444 -10.058 10.115 1.00 0.00 C ATOM 982 CG LEU A 60 71.334 -10.181 8.589 1.00 0.00 C ATOM 983 CD1 LEU A 60 71.907 -11.523 8.122 1.00 0.00 C ATOM 984 CD2 LEU A 60 69.857 -10.085 8.187 1.00 0.00 C ATOM 0 H LEU A 60 72.450 -12.114 11.092 1.00 0.00 H new ATOM 0 HA LEU A 60 73.573 -9.790 9.750 1.00 0.00 H new ATOM 0 HB2 LEU A 60 70.891 -10.869 10.590 1.00 0.00 H new ATOM 0 HB3 LEU A 60 70.986 -9.125 10.443 1.00 0.00 H new ATOM 0 HG LEU A 60 71.901 -9.377 8.120 1.00 0.00 H new ATOM 0 HD11 LEU A 60 71.823 -11.597 7.038 1.00 0.00 H new ATOM 0 HD12 LEU A 60 72.956 -11.591 8.410 1.00 0.00 H new ATOM 0 HD13 LEU A 60 71.350 -12.337 8.586 1.00 0.00 H new ATOM 0 HD21 LEU A 60 69.768 -10.171 7.104 1.00 0.00 H new ATOM 0 HD22 LEU A 60 69.297 -10.891 8.662 1.00 0.00 H new ATOM 0 HD23 LEU A 60 69.454 -9.125 8.509 1.00 0.00 H new ATOM 996 N ASP A 61 72.728 -9.529 12.915 1.00 0.00 N ATOM 997 CA ASP A 61 72.865 -8.618 14.084 1.00 0.00 C ATOM 998 C ASP A 61 74.340 -8.387 14.415 1.00 0.00 C ATOM 999 O ASP A 61 74.975 -9.179 15.081 1.00 0.00 O ATOM 1000 CB ASP A 61 72.153 -9.238 15.287 1.00 0.00 C ATOM 1001 CG ASP A 61 71.877 -8.160 16.333 1.00 0.00 C ATOM 1002 OD1 ASP A 61 72.399 -7.067 16.183 1.00 0.00 O ATOM 1003 OD2 ASP A 61 71.145 -8.444 17.265 1.00 0.00 O ATOM 0 H ASP A 61 72.310 -10.437 13.117 1.00 0.00 H new ATOM 0 HA ASP A 61 72.413 -7.656 13.842 1.00 0.00 H new ATOM 0 HB2 ASP A 61 71.217 -9.699 14.970 1.00 0.00 H new ATOM 0 HB3 ASP A 61 72.768 -10.028 15.718 1.00 0.00 H new ATOM 1008 N GLU A 62 74.883 -7.298 13.948 1.00 0.00 N ATOM 1009 CA GLU A 62 76.311 -6.998 14.228 1.00 0.00 C ATOM 1010 C GLU A 62 76.533 -6.877 15.739 1.00 0.00 C ATOM 1011 O GLU A 62 77.466 -7.431 16.283 1.00 0.00 O ATOM 1012 CB GLU A 62 76.694 -5.683 13.540 1.00 0.00 C ATOM 1013 CG GLU A 62 78.180 -5.389 13.769 1.00 0.00 C ATOM 1014 CD GLU A 62 78.559 -4.095 13.049 1.00 0.00 C ATOM 1015 OE1 GLU A 62 77.688 -3.511 12.425 1.00 0.00 O ATOM 1016 OE2 GLU A 62 79.712 -3.707 13.136 1.00 0.00 O ATOM 0 H GLU A 62 74.397 -6.602 13.383 1.00 0.00 H new ATOM 0 HA GLU A 62 76.934 -7.806 13.844 1.00 0.00 H new ATOM 0 HB2 GLU A 62 76.487 -5.748 12.472 1.00 0.00 H new ATOM 0 HB3 GLU A 62 76.088 -4.867 13.933 1.00 0.00 H new ATOM 0 HG2 GLU A 62 78.384 -5.297 14.836 1.00 0.00 H new ATOM 0 HG3 GLU A 62 78.787 -6.215 13.399 1.00 0.00 H new ATOM 1023 N ASP A 63 75.695 -6.136 16.418 1.00 0.00 N ATOM 1024 CA ASP A 63 75.872 -5.952 17.894 1.00 0.00 C ATOM 1025 C ASP A 63 75.071 -6.993 18.688 1.00 0.00 C ATOM 1026 O ASP A 63 75.152 -7.046 19.899 1.00 0.00 O ATOM 1027 CB ASP A 63 75.406 -4.547 18.284 1.00 0.00 C ATOM 1028 CG ASP A 63 73.897 -4.424 18.068 1.00 0.00 C ATOM 1029 OD1 ASP A 63 73.308 -5.371 17.572 1.00 0.00 O ATOM 1030 OD2 ASP A 63 73.358 -3.379 18.392 1.00 0.00 O ATOM 0 H ASP A 63 74.894 -5.649 16.015 1.00 0.00 H new ATOM 0 HA ASP A 63 76.928 -6.082 18.132 1.00 0.00 H new ATOM 0 HB2 ASP A 63 75.651 -4.349 19.328 1.00 0.00 H new ATOM 0 HB3 ASP A 63 75.930 -3.801 17.687 1.00 0.00 H new ATOM 1035 N GLY A 64 74.307 -7.828 18.036 1.00 0.00 N ATOM 1036 CA GLY A 64 73.527 -8.857 18.792 1.00 0.00 C ATOM 1037 C GLY A 64 72.391 -8.194 19.583 1.00 0.00 C ATOM 1038 O GLY A 64 71.991 -8.677 20.624 1.00 0.00 O ATOM 0 H GLY A 64 74.188 -7.845 17.023 1.00 0.00 H new ATOM 0 HA2 GLY A 64 73.116 -9.592 18.100 1.00 0.00 H new ATOM 0 HA3 GLY A 64 74.187 -9.395 19.473 1.00 0.00 H new ATOM 1042 N ASP A 65 71.871 -7.090 19.114 1.00 0.00 N ATOM 1043 CA ASP A 65 70.772 -6.407 19.862 1.00 0.00 C ATOM 1044 C ASP A 65 69.473 -7.221 19.768 1.00 0.00 C ATOM 1045 O ASP A 65 68.500 -6.917 20.428 1.00 0.00 O ATOM 1046 CB ASP A 65 70.545 -5.013 19.275 1.00 0.00 C ATOM 1047 CG ASP A 65 70.020 -5.137 17.845 1.00 0.00 C ATOM 1048 OD1 ASP A 65 70.203 -6.190 17.257 1.00 0.00 O ATOM 1049 OD2 ASP A 65 69.443 -4.177 17.360 1.00 0.00 O ATOM 0 H ASP A 65 72.158 -6.632 18.249 1.00 0.00 H new ATOM 0 HA ASP A 65 71.059 -6.323 20.910 1.00 0.00 H new ATOM 0 HB2 ASP A 65 69.832 -4.461 19.888 1.00 0.00 H new ATOM 0 HB3 ASP A 65 71.477 -4.448 19.283 1.00 0.00 H new ATOM 1054 N GLY A 66 69.449 -8.262 18.979 1.00 0.00 N ATOM 1055 CA GLY A 66 68.210 -9.098 18.880 1.00 0.00 C ATOM 1056 C GLY A 66 67.224 -8.496 17.873 1.00 0.00 C ATOM 1057 O GLY A 66 66.201 -9.080 17.574 1.00 0.00 O ATOM 0 H GLY A 66 70.229 -8.571 18.399 1.00 0.00 H new ATOM 0 HA2 GLY A 66 68.473 -10.111 18.576 1.00 0.00 H new ATOM 0 HA3 GLY A 66 67.737 -9.172 19.859 1.00 0.00 H new ATOM 1061 N GLU A 67 67.520 -7.338 17.348 1.00 0.00 N ATOM 1062 CA GLU A 67 66.609 -6.687 16.356 1.00 0.00 C ATOM 1063 C GLU A 67 67.465 -6.116 15.229 1.00 0.00 C ATOM 1064 O GLU A 67 68.651 -5.915 15.398 1.00 0.00 O ATOM 1065 CB GLU A 67 65.844 -5.544 17.028 1.00 0.00 C ATOM 1066 CG GLU A 67 64.841 -6.108 18.036 1.00 0.00 C ATOM 1067 CD GLU A 67 64.181 -4.952 18.791 1.00 0.00 C ATOM 1068 OE1 GLU A 67 64.496 -3.814 18.483 1.00 0.00 O ATOM 1069 OE2 GLU A 67 63.369 -5.224 19.659 1.00 0.00 O ATOM 0 H GLU A 67 68.364 -6.807 17.565 1.00 0.00 H new ATOM 0 HA GLU A 67 65.897 -7.416 15.969 1.00 0.00 H new ATOM 0 HB2 GLU A 67 66.542 -4.875 17.532 1.00 0.00 H new ATOM 0 HB3 GLU A 67 65.322 -4.952 16.276 1.00 0.00 H new ATOM 0 HG2 GLU A 67 64.085 -6.701 17.521 1.00 0.00 H new ATOM 0 HG3 GLU A 67 65.346 -6.774 18.736 1.00 0.00 H new ATOM 1076 N CYS A 68 66.890 -5.833 14.082 1.00 0.00 N ATOM 1077 CA CYS A 68 67.695 -5.254 12.959 1.00 0.00 C ATOM 1078 C CYS A 68 67.394 -3.758 12.853 1.00 0.00 C ATOM 1079 O CYS A 68 66.326 -3.351 12.431 1.00 0.00 O ATOM 1080 CB CYS A 68 67.316 -5.951 11.651 1.00 0.00 C ATOM 1081 SG CYS A 68 67.980 -7.636 11.656 1.00 0.00 S ATOM 0 H CYS A 68 65.901 -5.978 13.876 1.00 0.00 H new ATOM 0 HA CYS A 68 68.758 -5.401 13.148 1.00 0.00 H new ATOM 0 HB2 CYS A 68 66.232 -5.975 11.539 1.00 0.00 H new ATOM 0 HB3 CYS A 68 67.711 -5.395 10.801 1.00 0.00 H new ATOM 0 HG CYS A 68 67.658 -8.233 10.547 1.00 0.00 H new ATOM 1087 N ASP A 69 68.323 -2.941 13.266 1.00 0.00 N ATOM 1088 CA ASP A 69 68.117 -1.465 13.234 1.00 0.00 C ATOM 1089 C ASP A 69 68.066 -0.953 11.793 1.00 0.00 C ATOM 1090 O ASP A 69 68.283 -1.680 10.847 1.00 0.00 O ATOM 1091 CB ASP A 69 69.270 -0.781 13.971 1.00 0.00 C ATOM 1092 CG ASP A 69 69.162 -1.063 15.470 1.00 0.00 C ATOM 1093 OD1 ASP A 69 68.068 -1.367 15.920 1.00 0.00 O ATOM 1094 OD2 ASP A 69 70.175 -0.976 16.143 1.00 0.00 O ATOM 0 H ASP A 69 69.229 -3.237 13.629 1.00 0.00 H new ATOM 0 HA ASP A 69 67.168 -1.235 13.719 1.00 0.00 H new ATOM 0 HB2 ASP A 69 70.224 -1.145 13.590 1.00 0.00 H new ATOM 0 HB3 ASP A 69 69.243 0.294 13.790 1.00 0.00 H new ATOM 1099 N PHE A 70 67.783 0.312 11.641 1.00 0.00 N ATOM 1100 CA PHE A 70 67.715 0.913 10.278 1.00 0.00 C ATOM 1101 C PHE A 70 69.070 0.757 9.581 1.00 0.00 C ATOM 1102 O PHE A 70 69.154 0.306 8.456 1.00 0.00 O ATOM 1103 CB PHE A 70 67.372 2.399 10.408 1.00 0.00 C ATOM 1104 CG PHE A 70 67.318 3.038 9.040 1.00 0.00 C ATOM 1105 CD1 PHE A 70 68.474 3.598 8.486 1.00 0.00 C ATOM 1106 CD2 PHE A 70 66.112 3.078 8.332 1.00 0.00 C ATOM 1107 CE1 PHE A 70 68.424 4.199 7.223 1.00 0.00 C ATOM 1108 CE2 PHE A 70 66.061 3.677 7.069 1.00 0.00 C ATOM 1109 CZ PHE A 70 67.217 4.237 6.514 1.00 0.00 C ATOM 0 H PHE A 70 67.595 0.959 12.407 1.00 0.00 H new ATOM 0 HA PHE A 70 66.950 0.408 9.689 1.00 0.00 H new ATOM 0 HB2 PHE A 70 66.412 2.517 10.912 1.00 0.00 H new ATOM 0 HB3 PHE A 70 68.119 2.901 11.024 1.00 0.00 H new ATOM 0 HD1 PHE A 70 69.405 3.567 9.033 1.00 0.00 H new ATOM 0 HD2 PHE A 70 65.220 2.646 8.761 1.00 0.00 H new ATOM 0 HE1 PHE A 70 69.316 4.633 6.795 1.00 0.00 H new ATOM 0 HE2 PHE A 70 65.130 3.707 6.523 1.00 0.00 H new ATOM 0 HZ PHE A 70 67.178 4.699 5.538 1.00 0.00 H new ATOM 1119 N GLN A 71 70.125 1.147 10.236 1.00 0.00 N ATOM 1120 CA GLN A 71 71.471 1.045 9.602 1.00 0.00 C ATOM 1121 C GLN A 71 71.759 -0.423 9.263 1.00 0.00 C ATOM 1122 O GLN A 71 72.069 -0.753 8.135 1.00 0.00 O ATOM 1123 CB GLN A 71 72.525 1.588 10.573 1.00 0.00 C ATOM 1124 CG GLN A 71 73.917 1.503 9.940 1.00 0.00 C ATOM 1125 CD GLN A 71 74.952 2.051 10.925 1.00 0.00 C ATOM 1126 OE1 GLN A 71 74.626 2.832 11.796 1.00 0.00 O ATOM 1127 NE2 GLN A 71 76.195 1.669 10.826 1.00 0.00 N ATOM 0 H GLN A 71 70.116 1.531 11.181 1.00 0.00 H new ATOM 0 HA GLN A 71 71.501 1.631 8.683 1.00 0.00 H new ATOM 0 HB2 GLN A 71 72.296 2.622 10.829 1.00 0.00 H new ATOM 0 HB3 GLN A 71 72.504 1.017 11.501 1.00 0.00 H new ATOM 0 HG2 GLN A 71 74.151 0.469 9.685 1.00 0.00 H new ATOM 0 HG3 GLN A 71 73.943 2.074 9.012 1.00 0.00 H new ATOM 0 HE21 GLN A 71 76.470 1.013 10.095 1.00 0.00 H new ATOM 0 HE22 GLN A 71 76.892 2.026 11.480 1.00 0.00 H new ATOM 1136 N GLU A 72 71.650 -1.309 10.216 1.00 0.00 N ATOM 1137 CA GLU A 72 71.907 -2.748 9.918 1.00 0.00 C ATOM 1138 C GLU A 72 70.917 -3.201 8.844 1.00 0.00 C ATOM 1139 O GLU A 72 71.270 -3.839 7.876 1.00 0.00 O ATOM 1140 CB GLU A 72 71.690 -3.573 11.188 1.00 0.00 C ATOM 1141 CG GLU A 72 72.806 -3.273 12.191 1.00 0.00 C ATOM 1142 CD GLU A 72 72.560 -4.067 13.476 1.00 0.00 C ATOM 1143 OE1 GLU A 72 71.500 -4.662 13.588 1.00 0.00 O ATOM 1144 OE2 GLU A 72 73.432 -4.061 14.328 1.00 0.00 O ATOM 0 H GLU A 72 71.396 -1.101 11.182 1.00 0.00 H new ATOM 0 HA GLU A 72 72.931 -2.885 9.569 1.00 0.00 H new ATOM 0 HB2 GLU A 72 70.720 -3.337 11.626 1.00 0.00 H new ATOM 0 HB3 GLU A 72 71.680 -4.636 10.946 1.00 0.00 H new ATOM 0 HG2 GLU A 72 73.774 -3.539 11.766 1.00 0.00 H new ATOM 0 HG3 GLU A 72 72.836 -2.206 12.410 1.00 0.00 H new ATOM 1151 N PHE A 73 69.670 -2.883 9.044 1.00 0.00 N ATOM 1152 CA PHE A 73 68.618 -3.296 8.070 1.00 0.00 C ATOM 1153 C PHE A 73 69.119 -3.024 6.650 1.00 0.00 C ATOM 1154 O PHE A 73 68.910 -3.808 5.745 1.00 0.00 O ATOM 1155 CB PHE A 73 67.334 -2.502 8.317 1.00 0.00 C ATOM 1156 CG PHE A 73 66.319 -2.850 7.256 1.00 0.00 C ATOM 1157 CD1 PHE A 73 65.429 -3.910 7.459 1.00 0.00 C ATOM 1158 CD2 PHE A 73 66.270 -2.113 6.067 1.00 0.00 C ATOM 1159 CE1 PHE A 73 64.488 -4.232 6.474 1.00 0.00 C ATOM 1160 CE2 PHE A 73 65.330 -2.434 5.082 1.00 0.00 C ATOM 1161 CZ PHE A 73 64.439 -3.493 5.285 1.00 0.00 C ATOM 0 H PHE A 73 69.330 -2.351 9.845 1.00 0.00 H new ATOM 0 HA PHE A 73 68.407 -4.358 8.194 1.00 0.00 H new ATOM 0 HB2 PHE A 73 66.936 -2.731 9.306 1.00 0.00 H new ATOM 0 HB3 PHE A 73 67.545 -1.433 8.298 1.00 0.00 H new ATOM 0 HD1 PHE A 73 65.468 -4.480 8.376 1.00 0.00 H new ATOM 0 HD2 PHE A 73 66.958 -1.296 5.910 1.00 0.00 H new ATOM 0 HE1 PHE A 73 63.800 -5.050 6.631 1.00 0.00 H new ATOM 0 HE2 PHE A 73 65.292 -1.864 4.165 1.00 0.00 H new ATOM 0 HZ PHE A 73 63.713 -3.741 4.525 1.00 0.00 H new ATOM 1171 N MET A 74 69.784 -1.924 6.453 1.00 0.00 N ATOM 1172 CA MET A 74 70.308 -1.608 5.097 1.00 0.00 C ATOM 1173 C MET A 74 71.478 -2.548 4.755 1.00 0.00 C ATOM 1174 O MET A 74 71.791 -2.763 3.601 1.00 0.00 O ATOM 1175 CB MET A 74 70.758 -0.144 5.045 1.00 0.00 C ATOM 1176 CG MET A 74 69.522 0.762 5.106 1.00 0.00 C ATOM 1177 SD MET A 74 70.004 2.484 4.806 1.00 0.00 S ATOM 1178 CE MET A 74 70.413 2.334 3.048 1.00 0.00 C ATOM 0 H MET A 74 69.988 -1.229 7.171 1.00 0.00 H new ATOM 0 HA MET A 74 69.519 -1.757 4.360 1.00 0.00 H new ATOM 0 HB2 MET A 74 71.426 0.074 5.878 1.00 0.00 H new ATOM 0 HB3 MET A 74 71.318 0.045 4.129 1.00 0.00 H new ATOM 0 HG2 MET A 74 68.791 0.445 4.362 1.00 0.00 H new ATOM 0 HG3 MET A 74 69.043 0.674 6.081 1.00 0.00 H new ATOM 0 HE1 MET A 74 70.339 3.312 2.573 1.00 0.00 H new ATOM 0 HE2 MET A 74 71.429 1.955 2.942 1.00 0.00 H new ATOM 0 HE3 MET A 74 69.717 1.645 2.570 1.00 0.00 H new ATOM 1188 N ALA A 75 72.124 -3.122 5.741 1.00 0.00 N ATOM 1189 CA ALA A 75 73.256 -4.056 5.441 1.00 0.00 C ATOM 1190 C ALA A 75 72.712 -5.247 4.652 1.00 0.00 C ATOM 1191 O ALA A 75 73.128 -5.525 3.544 1.00 0.00 O ATOM 1192 CB ALA A 75 73.871 -4.568 6.747 1.00 0.00 C ATOM 0 H ALA A 75 71.920 -2.987 6.731 1.00 0.00 H new ATOM 0 HA ALA A 75 74.018 -3.530 4.865 1.00 0.00 H new ATOM 0 HB1 ALA A 75 74.693 -5.247 6.520 1.00 0.00 H new ATOM 0 HB2 ALA A 75 74.246 -3.725 7.328 1.00 0.00 H new ATOM 0 HB3 ALA A 75 73.112 -5.097 7.324 1.00 0.00 H new ATOM 1198 N PHE A 76 71.782 -5.949 5.232 1.00 0.00 N ATOM 1199 CA PHE A 76 71.191 -7.131 4.543 1.00 0.00 C ATOM 1200 C PHE A 76 70.746 -6.700 3.148 1.00 0.00 C ATOM 1201 O PHE A 76 70.932 -7.406 2.176 1.00 0.00 O ATOM 1202 CB PHE A 76 69.987 -7.630 5.341 1.00 0.00 C ATOM 1203 CG PHE A 76 69.307 -8.764 4.605 1.00 0.00 C ATOM 1204 CD1 PHE A 76 69.870 -10.047 4.613 1.00 0.00 C ATOM 1205 CD2 PHE A 76 68.104 -8.533 3.922 1.00 0.00 C ATOM 1206 CE1 PHE A 76 69.233 -11.096 3.938 1.00 0.00 C ATOM 1207 CE2 PHE A 76 67.467 -9.583 3.250 1.00 0.00 C ATOM 1208 CZ PHE A 76 68.031 -10.865 3.259 1.00 0.00 C ATOM 0 H PHE A 76 71.403 -5.755 6.159 1.00 0.00 H new ATOM 0 HA PHE A 76 71.924 -7.935 4.467 1.00 0.00 H new ATOM 0 HB2 PHE A 76 70.309 -7.967 6.326 1.00 0.00 H new ATOM 0 HB3 PHE A 76 69.282 -6.814 5.498 1.00 0.00 H new ATOM 0 HD1 PHE A 76 70.795 -10.227 5.140 1.00 0.00 H new ATOM 0 HD2 PHE A 76 67.669 -7.545 3.914 1.00 0.00 H new ATOM 0 HE1 PHE A 76 69.670 -12.084 3.941 1.00 0.00 H new ATOM 0 HE2 PHE A 76 66.540 -9.404 2.725 1.00 0.00 H new ATOM 0 HZ PHE A 76 67.538 -11.675 2.742 1.00 0.00 H new ATOM 1218 N VAL A 77 70.191 -5.530 3.042 1.00 0.00 N ATOM 1219 CA VAL A 77 69.769 -5.038 1.707 1.00 0.00 C ATOM 1220 C VAL A 77 71.015 -4.972 0.814 1.00 0.00 C ATOM 1221 O VAL A 77 71.003 -5.408 -0.320 1.00 0.00 O ATOM 1222 CB VAL A 77 69.139 -3.648 1.850 1.00 0.00 C ATOM 1223 CG1 VAL A 77 68.927 -3.024 0.471 1.00 0.00 C ATOM 1224 CG2 VAL A 77 67.790 -3.774 2.563 1.00 0.00 C ATOM 0 H VAL A 77 70.012 -4.895 3.819 1.00 0.00 H new ATOM 0 HA VAL A 77 69.030 -5.705 1.264 1.00 0.00 H new ATOM 0 HB VAL A 77 69.806 -3.011 2.431 1.00 0.00 H new ATOM 0 HG11 VAL A 77 68.479 -2.037 0.583 1.00 0.00 H new ATOM 0 HG12 VAL A 77 69.886 -2.931 -0.038 1.00 0.00 H new ATOM 0 HG13 VAL A 77 68.264 -3.658 -0.117 1.00 0.00 H new ATOM 0 HG21 VAL A 77 67.339 -2.787 2.666 1.00 0.00 H new ATOM 0 HG22 VAL A 77 67.129 -4.415 1.980 1.00 0.00 H new ATOM 0 HG23 VAL A 77 67.940 -4.209 3.551 1.00 0.00 H new ATOM 1234 N SER A 78 72.095 -4.432 1.325 1.00 0.00 N ATOM 1235 CA SER A 78 73.347 -4.338 0.516 1.00 0.00 C ATOM 1236 C SER A 78 73.903 -5.739 0.236 1.00 0.00 C ATOM 1237 O SER A 78 74.323 -6.044 -0.864 1.00 0.00 O ATOM 1238 CB SER A 78 74.393 -3.540 1.295 1.00 0.00 C ATOM 1239 OG SER A 78 74.875 -4.332 2.372 1.00 0.00 O ATOM 0 H SER A 78 72.162 -4.052 2.269 1.00 0.00 H new ATOM 0 HA SER A 78 73.120 -3.843 -0.428 1.00 0.00 H new ATOM 0 HB2 SER A 78 75.216 -3.257 0.638 1.00 0.00 H new ATOM 0 HB3 SER A 78 73.956 -2.616 1.674 1.00 0.00 H new ATOM 0 HG SER A 78 74.117 -4.685 2.883 1.00 0.00 H new ATOM 1245 N MET A 79 73.938 -6.583 1.231 1.00 0.00 N ATOM 1246 CA MET A 79 74.505 -7.951 1.034 1.00 0.00 C ATOM 1247 C MET A 79 73.709 -8.685 -0.038 1.00 0.00 C ATOM 1248 O MET A 79 74.265 -9.325 -0.909 1.00 0.00 O ATOM 1249 CB MET A 79 74.422 -8.720 2.356 1.00 0.00 C ATOM 1250 CG MET A 79 75.055 -10.104 2.196 1.00 0.00 C ATOM 1251 SD MET A 79 74.974 -10.982 3.777 1.00 0.00 S ATOM 1252 CE MET A 79 75.676 -12.549 3.209 1.00 0.00 C ATOM 0 H MET A 79 73.599 -6.386 2.173 1.00 0.00 H new ATOM 0 HA MET A 79 75.545 -7.877 0.717 1.00 0.00 H new ATOM 0 HB2 MET A 79 74.934 -8.165 3.142 1.00 0.00 H new ATOM 0 HB3 MET A 79 73.381 -8.820 2.663 1.00 0.00 H new ATOM 0 HG2 MET A 79 74.532 -10.670 1.425 1.00 0.00 H new ATOM 0 HG3 MET A 79 76.091 -10.008 1.872 1.00 0.00 H new ATOM 0 HE1 MET A 79 75.719 -13.251 4.041 1.00 0.00 H new ATOM 0 HE2 MET A 79 75.051 -12.962 2.418 1.00 0.00 H new ATOM 0 HE3 MET A 79 76.682 -12.379 2.825 1.00 0.00 H new ATOM 1262 N VAL A 80 72.418 -8.573 -0.012 1.00 0.00 N ATOM 1263 CA VAL A 80 71.602 -9.237 -1.060 1.00 0.00 C ATOM 1264 C VAL A 80 71.897 -8.534 -2.387 1.00 0.00 C ATOM 1265 O VAL A 80 71.914 -9.139 -3.439 1.00 0.00 O ATOM 1266 CB VAL A 80 70.113 -9.124 -0.714 1.00 0.00 C ATOM 1267 CG1 VAL A 80 69.264 -9.606 -1.895 1.00 0.00 C ATOM 1268 CG2 VAL A 80 69.813 -10.000 0.506 1.00 0.00 C ATOM 0 H VAL A 80 71.890 -8.051 0.688 1.00 0.00 H new ATOM 0 HA VAL A 80 71.850 -10.296 -1.130 1.00 0.00 H new ATOM 0 HB VAL A 80 69.873 -8.083 -0.497 1.00 0.00 H new ATOM 0 HG11 VAL A 80 68.207 -9.523 -1.641 1.00 0.00 H new ATOM 0 HG12 VAL A 80 69.477 -8.992 -2.770 1.00 0.00 H new ATOM 0 HG13 VAL A 80 69.503 -10.646 -2.115 1.00 0.00 H new ATOM 0 HG21 VAL A 80 68.755 -9.924 0.757 1.00 0.00 H new ATOM 0 HG22 VAL A 80 70.058 -11.037 0.278 1.00 0.00 H new ATOM 0 HG23 VAL A 80 70.412 -9.663 1.352 1.00 0.00 H new ATOM 1278 N THR A 81 72.152 -7.252 -2.328 1.00 0.00 N ATOM 1279 CA THR A 81 72.471 -6.497 -3.573 1.00 0.00 C ATOM 1280 C THR A 81 73.851 -6.931 -4.076 1.00 0.00 C ATOM 1281 O THR A 81 74.060 -7.118 -5.259 1.00 0.00 O ATOM 1282 CB THR A 81 72.486 -4.996 -3.277 1.00 0.00 C ATOM 1283 OG1 THR A 81 71.210 -4.598 -2.799 1.00 0.00 O ATOM 1284 CG2 THR A 81 72.809 -4.224 -4.559 1.00 0.00 C ATOM 0 H THR A 81 72.153 -6.698 -1.472 1.00 0.00 H new ATOM 0 HA THR A 81 71.716 -6.704 -4.332 1.00 0.00 H new ATOM 0 HB THR A 81 73.244 -4.783 -2.523 1.00 0.00 H new ATOM 0 HG1 THR A 81 71.168 -4.731 -1.829 1.00 0.00 H new ATOM 0 HG21 THR A 81 72.819 -3.155 -4.347 1.00 0.00 H new ATOM 0 HG22 THR A 81 73.787 -4.530 -4.931 1.00 0.00 H new ATOM 0 HG23 THR A 81 72.051 -4.437 -5.313 1.00 0.00 H new ATOM 1292 N THR A 82 74.795 -7.104 -3.186 1.00 0.00 N ATOM 1293 CA THR A 82 76.155 -7.536 -3.620 1.00 0.00 C ATOM 1294 C THR A 82 76.041 -8.939 -4.218 1.00 0.00 C ATOM 1295 O THR A 82 76.442 -9.185 -5.338 1.00 0.00 O ATOM 1296 CB THR A 82 77.094 -7.560 -2.403 1.00 0.00 C ATOM 1297 OG1 THR A 82 76.915 -6.368 -1.651 1.00 0.00 O ATOM 1298 CG2 THR A 82 78.554 -7.647 -2.861 1.00 0.00 C ATOM 0 H THR A 82 74.682 -6.965 -2.182 1.00 0.00 H new ATOM 0 HA THR A 82 76.558 -6.846 -4.362 1.00 0.00 H new ATOM 0 HB THR A 82 76.859 -8.431 -1.791 1.00 0.00 H new ATOM 0 HG1 THR A 82 76.019 -6.363 -1.254 1.00 0.00 H new ATOM 0 HG21 THR A 82 79.208 -7.663 -1.989 1.00 0.00 H new ATOM 0 HG22 THR A 82 78.700 -8.558 -3.441 1.00 0.00 H new ATOM 0 HG23 THR A 82 78.794 -6.781 -3.479 1.00 0.00 H new ATOM 1306 N ALA A 83 75.511 -9.865 -3.458 1.00 0.00 N ATOM 1307 CA ALA A 83 75.379 -11.270 -3.949 1.00 0.00 C ATOM 1308 C ALA A 83 74.878 -11.265 -5.394 1.00 0.00 C ATOM 1309 O ALA A 83 75.307 -12.055 -6.211 1.00 0.00 O ATOM 1310 CB ALA A 83 74.385 -12.029 -3.067 1.00 0.00 C ATOM 0 H ALA A 83 75.162 -9.706 -2.513 1.00 0.00 H new ATOM 0 HA ALA A 83 76.352 -11.760 -3.905 1.00 0.00 H new ATOM 0 HB1 ALA A 83 74.289 -13.054 -3.426 1.00 0.00 H new ATOM 0 HB2 ALA A 83 74.744 -12.037 -2.038 1.00 0.00 H new ATOM 0 HB3 ALA A 83 73.413 -11.538 -3.108 1.00 0.00 H new ATOM 1316 N CYS A 84 73.990 -10.369 -5.722 1.00 0.00 N ATOM 1317 CA CYS A 84 73.487 -10.307 -7.123 1.00 0.00 C ATOM 1318 C CYS A 84 74.540 -9.595 -7.975 1.00 0.00 C ATOM 1319 O CYS A 84 74.234 -8.788 -8.829 1.00 0.00 O ATOM 1320 CB CYS A 84 72.171 -9.526 -7.163 1.00 0.00 C ATOM 1321 SG CYS A 84 71.466 -9.610 -8.828 1.00 0.00 S ATOM 0 H CYS A 84 73.592 -9.680 -5.084 1.00 0.00 H new ATOM 0 HA CYS A 84 73.308 -11.311 -7.507 1.00 0.00 H new ATOM 0 HB2 CYS A 84 71.469 -9.939 -6.439 1.00 0.00 H new ATOM 0 HB3 CYS A 84 72.344 -8.487 -6.882 1.00 0.00 H new ATOM 0 HG CYS A 84 72.370 -9.274 -9.700 1.00 0.00 H new ATOM 1327 N HIS A 85 75.786 -9.893 -7.726 1.00 0.00 N ATOM 1328 CA HIS A 85 76.897 -9.249 -8.483 1.00 0.00 C ATOM 1329 C HIS A 85 76.764 -9.556 -9.978 1.00 0.00 C ATOM 1330 O HIS A 85 77.012 -8.713 -10.818 1.00 0.00 O ATOM 1331 CB HIS A 85 78.233 -9.787 -7.966 1.00 0.00 C ATOM 1332 CG HIS A 85 79.366 -9.110 -8.689 1.00 0.00 C ATOM 1333 ND1 HIS A 85 79.913 -7.915 -8.242 1.00 0.00 N ATOM 1334 CD2 HIS A 85 80.070 -9.448 -9.818 1.00 0.00 C ATOM 1335 CE1 HIS A 85 80.902 -7.580 -9.090 1.00 0.00 C ATOM 1336 NE2 HIS A 85 81.037 -8.479 -10.067 1.00 0.00 N ATOM 0 H HIS A 85 76.085 -10.565 -7.020 1.00 0.00 H new ATOM 0 HA HIS A 85 76.852 -8.169 -8.340 1.00 0.00 H new ATOM 0 HB2 HIS A 85 78.316 -9.611 -6.894 1.00 0.00 H new ATOM 0 HB3 HIS A 85 78.285 -10.865 -8.117 1.00 0.00 H new ATOM 0 HD2 HIS A 85 79.900 -10.329 -10.419 1.00 0.00 H new ATOM 0 HE1 HIS A 85 81.511 -6.694 -8.992 1.00 0.00 H new ATOM 0 HE2 HIS A 85 81.708 -8.460 -10.835 1.00 0.00 H new ATOM 1345 N GLU A 86 76.394 -10.761 -10.319 1.00 0.00 N ATOM 1346 CA GLU A 86 76.268 -11.122 -11.760 1.00 0.00 C ATOM 1347 C GLU A 86 75.431 -10.064 -12.479 1.00 0.00 C ATOM 1348 O GLU A 86 74.382 -9.665 -12.014 1.00 0.00 O ATOM 1349 CB GLU A 86 75.575 -12.480 -11.882 1.00 0.00 C ATOM 1350 CG GLU A 86 76.483 -13.570 -11.312 1.00 0.00 C ATOM 1351 CD GLU A 86 75.763 -14.918 -11.381 1.00 0.00 C ATOM 1352 OE1 GLU A 86 75.061 -15.241 -10.437 1.00 0.00 O ATOM 1353 OE2 GLU A 86 75.925 -15.603 -12.377 1.00 0.00 O ATOM 0 H GLU A 86 76.174 -11.510 -9.663 1.00 0.00 H new ATOM 0 HA GLU A 86 77.259 -11.172 -12.211 1.00 0.00 H new ATOM 0 HB2 GLU A 86 74.626 -12.465 -11.346 1.00 0.00 H new ATOM 0 HB3 GLU A 86 75.347 -12.691 -12.927 1.00 0.00 H new ATOM 0 HG2 GLU A 86 77.415 -13.614 -11.875 1.00 0.00 H new ATOM 0 HG3 GLU A 86 76.745 -13.338 -10.280 1.00 0.00 H new ATOM 1360 N PHE A 87 75.892 -9.605 -13.612 1.00 0.00 N ATOM 1361 CA PHE A 87 75.129 -8.570 -14.359 1.00 0.00 C ATOM 1362 C PHE A 87 73.905 -9.208 -15.014 1.00 0.00 C ATOM 1363 O PHE A 87 73.998 -10.236 -15.655 1.00 0.00 O ATOM 1364 CB PHE A 87 76.020 -7.951 -15.436 1.00 0.00 C ATOM 1365 CG PHE A 87 75.292 -6.790 -16.064 1.00 0.00 C ATOM 1366 CD1 PHE A 87 75.392 -5.515 -15.496 1.00 0.00 C ATOM 1367 CD2 PHE A 87 74.513 -6.987 -17.210 1.00 0.00 C ATOM 1368 CE1 PHE A 87 74.712 -4.436 -16.071 1.00 0.00 C ATOM 1369 CE2 PHE A 87 73.833 -5.907 -17.787 1.00 0.00 C ATOM 1370 CZ PHE A 87 73.931 -4.632 -17.217 1.00 0.00 C ATOM 0 H PHE A 87 76.763 -9.903 -14.050 1.00 0.00 H new ATOM 0 HA PHE A 87 74.806 -7.793 -13.667 1.00 0.00 H new ATOM 0 HB2 PHE A 87 76.961 -7.615 -15.000 1.00 0.00 H new ATOM 0 HB3 PHE A 87 76.268 -8.695 -16.193 1.00 0.00 H new ATOM 0 HD1 PHE A 87 75.995 -5.364 -14.613 1.00 0.00 H new ATOM 0 HD2 PHE A 87 74.436 -7.971 -17.649 1.00 0.00 H new ATOM 0 HE1 PHE A 87 74.789 -3.453 -15.631 1.00 0.00 H new ATOM 0 HE2 PHE A 87 73.233 -6.058 -18.672 1.00 0.00 H new ATOM 0 HZ PHE A 87 73.405 -3.800 -17.661 1.00 0.00 H new ATOM 1380 N PHE A 88 72.755 -8.617 -14.842 1.00 0.00 N ATOM 1381 CA PHE A 88 71.522 -9.202 -15.438 1.00 0.00 C ATOM 1382 C PHE A 88 71.679 -9.278 -16.960 1.00 0.00 C ATOM 1383 O PHE A 88 72.123 -8.344 -17.597 1.00 0.00 O ATOM 1384 CB PHE A 88 70.324 -8.313 -15.082 1.00 0.00 C ATOM 1385 CG PHE A 88 69.041 -9.084 -15.278 1.00 0.00 C ATOM 1386 CD1 PHE A 88 68.621 -9.985 -14.294 1.00 0.00 C ATOM 1387 CD2 PHE A 88 68.278 -8.904 -16.436 1.00 0.00 C ATOM 1388 CE1 PHE A 88 67.435 -10.708 -14.469 1.00 0.00 C ATOM 1389 CE2 PHE A 88 67.093 -9.627 -16.613 1.00 0.00 C ATOM 1390 CZ PHE A 88 66.671 -10.528 -15.629 1.00 0.00 C ATOM 0 H PHE A 88 72.616 -7.755 -14.315 1.00 0.00 H new ATOM 0 HA PHE A 88 71.360 -10.206 -15.045 1.00 0.00 H new ATOM 0 HB2 PHE A 88 70.403 -7.977 -14.048 1.00 0.00 H new ATOM 0 HB3 PHE A 88 70.322 -7.421 -15.708 1.00 0.00 H new ATOM 0 HD1 PHE A 88 69.211 -10.123 -13.400 1.00 0.00 H new ATOM 0 HD2 PHE A 88 68.603 -8.207 -17.194 1.00 0.00 H new ATOM 0 HE1 PHE A 88 67.109 -11.404 -13.710 1.00 0.00 H new ATOM 0 HE2 PHE A 88 66.505 -9.490 -17.508 1.00 0.00 H new ATOM 0 HZ PHE A 88 65.756 -11.085 -15.764 1.00 0.00 H new ATOM 1400 N GLU A 89 71.323 -10.391 -17.545 1.00 0.00 N ATOM 1401 CA GLU A 89 71.461 -10.535 -19.023 1.00 0.00 C ATOM 1402 C GLU A 89 70.615 -9.471 -19.721 1.00 0.00 C ATOM 1403 O GLU A 89 71.019 -8.887 -20.707 1.00 0.00 O ATOM 1404 CB GLU A 89 70.974 -11.925 -19.446 1.00 0.00 C ATOM 1405 CG GLU A 89 71.953 -12.986 -18.941 1.00 0.00 C ATOM 1406 CD GLU A 89 71.466 -14.373 -19.363 1.00 0.00 C ATOM 1407 OE1 GLU A 89 70.697 -14.962 -18.620 1.00 0.00 O ATOM 1408 OE2 GLU A 89 71.868 -14.824 -20.423 1.00 0.00 O ATOM 0 H GLU A 89 70.943 -11.206 -17.063 1.00 0.00 H new ATOM 0 HA GLU A 89 72.507 -10.411 -19.303 1.00 0.00 H new ATOM 0 HB2 GLU A 89 69.979 -12.112 -19.042 1.00 0.00 H new ATOM 0 HB3 GLU A 89 70.892 -11.978 -20.532 1.00 0.00 H new ATOM 0 HG2 GLU A 89 72.948 -12.800 -19.346 1.00 0.00 H new ATOM 0 HG3 GLU A 89 72.035 -12.933 -17.855 1.00 0.00 H new ATOM 1415 N HIS A 90 69.445 -9.211 -19.212 1.00 0.00 N ATOM 1416 CA HIS A 90 68.566 -8.185 -19.839 1.00 0.00 C ATOM 1417 C HIS A 90 68.411 -8.493 -21.329 1.00 0.00 C ATOM 1418 O HIS A 90 68.048 -7.644 -22.117 1.00 0.00 O ATOM 1419 CB HIS A 90 69.206 -6.805 -19.670 1.00 0.00 C ATOM 1420 CG HIS A 90 68.174 -5.732 -19.895 1.00 0.00 C ATOM 1421 ND1 HIS A 90 68.094 -5.019 -21.082 1.00 0.00 N ATOM 1422 CD2 HIS A 90 67.174 -5.238 -19.092 1.00 0.00 C ATOM 1423 CE1 HIS A 90 67.078 -4.142 -20.962 1.00 0.00 C ATOM 1424 NE2 HIS A 90 66.487 -4.237 -19.770 1.00 0.00 N ATOM 0 H HIS A 90 69.057 -9.666 -18.386 1.00 0.00 H new ATOM 0 HA HIS A 90 67.587 -8.197 -19.361 1.00 0.00 H new ATOM 0 HB2 HIS A 90 69.630 -6.711 -18.670 1.00 0.00 H new ATOM 0 HB3 HIS A 90 70.027 -6.686 -20.377 1.00 0.00 H new ATOM 0 HD2 HIS A 90 66.956 -5.575 -18.089 1.00 0.00 H new ATOM 0 HE1 HIS A 90 66.780 -3.449 -21.734 1.00 0.00 H new ATOM 0 HE2 HIS A 90 65.697 -3.690 -19.428 1.00 0.00 H new ATOM 1433 N GLU A 91 68.686 -9.705 -21.717 1.00 0.00 N ATOM 1434 CA GLU A 91 68.558 -10.083 -23.156 1.00 0.00 C ATOM 1435 C GLU A 91 67.105 -10.452 -23.463 1.00 0.00 C ATOM 1436 O GLU A 91 66.499 -9.765 -24.269 1.00 0.00 O ATOM 1437 CB GLU A 91 69.466 -11.279 -23.457 1.00 0.00 C ATOM 1438 CG GLU A 91 70.927 -10.826 -23.443 1.00 0.00 C ATOM 1439 CD GLU A 91 71.836 -12.018 -23.744 1.00 0.00 C ATOM 1440 OE1 GLU A 91 71.320 -13.117 -23.865 1.00 0.00 O ATOM 1441 OE2 GLU A 91 73.035 -11.814 -23.840 1.00 0.00 O ATOM 1442 OXT GLU A 91 66.623 -11.413 -22.889 1.00 0.00 O ATOM 0 H GLU A 91 68.995 -10.455 -21.099 1.00 0.00 H new ATOM 0 HA GLU A 91 68.855 -9.239 -23.778 1.00 0.00 H new ATOM 0 HB2 GLU A 91 69.310 -12.063 -22.716 1.00 0.00 H new ATOM 0 HB3 GLU A 91 69.215 -11.704 -24.429 1.00 0.00 H new ATOM 0 HG2 GLU A 91 71.082 -10.041 -24.183 1.00 0.00 H new ATOM 0 HG3 GLU A 91 71.177 -10.401 -22.471 1.00 0.00 H new TER 1449 GLU A 91 ATOM 1450 N SER B 1 60.252 -7.288 -6.460 1.00 0.00 N ATOM 1451 CA SER B 1 59.188 -6.318 -6.846 1.00 0.00 C ATOM 1452 C SER B 1 59.802 -4.926 -7.024 1.00 0.00 C ATOM 1453 O SER B 1 60.894 -4.782 -7.530 1.00 0.00 O ATOM 1454 CB SER B 1 58.124 -6.271 -5.750 1.00 0.00 C ATOM 1455 OG SER B 1 56.968 -5.610 -6.249 1.00 0.00 O ATOM 0 H1 SER B 1 59.959 -8.249 -6.727 1.00 0.00 H new ATOM 0 H2 SER B 1 61.136 -7.047 -6.951 1.00 0.00 H new ATOM 0 H3 SER B 1 60.404 -7.246 -5.432 1.00 0.00 H new ATOM 0 HA SER B 1 58.731 -6.633 -7.784 1.00 0.00 H new ATOM 0 HB2 SER B 1 57.870 -7.281 -5.430 1.00 0.00 H new ATOM 0 HB3 SER B 1 58.509 -5.746 -4.875 1.00 0.00 H new ATOM 0 HG SER B 1 56.282 -5.579 -5.550 1.00 0.00 H new ATOM 1463 N GLU B 2 59.106 -3.903 -6.607 1.00 0.00 N ATOM 1464 CA GLU B 2 59.648 -2.520 -6.751 1.00 0.00 C ATOM 1465 C GLU B 2 60.963 -2.404 -5.985 1.00 0.00 C ATOM 1466 O GLU B 2 61.838 -1.642 -6.347 1.00 0.00 O ATOM 1467 CB GLU B 2 58.639 -1.514 -6.191 1.00 0.00 C ATOM 1468 CG GLU B 2 58.266 -1.900 -4.759 1.00 0.00 C ATOM 1469 CD GLU B 2 57.225 -0.916 -4.219 1.00 0.00 C ATOM 1470 OE1 GLU B 2 57.142 0.180 -4.749 1.00 0.00 O ATOM 1471 OE2 GLU B 2 56.520 -1.279 -3.292 1.00 0.00 O ATOM 0 H GLU B 2 58.185 -3.965 -6.173 1.00 0.00 H new ATOM 0 HA GLU B 2 59.824 -2.308 -7.806 1.00 0.00 H new ATOM 0 HB2 GLU B 2 59.064 -0.510 -6.208 1.00 0.00 H new ATOM 0 HB3 GLU B 2 57.746 -1.493 -6.816 1.00 0.00 H new ATOM 0 HG2 GLU B 2 57.869 -2.915 -4.736 1.00 0.00 H new ATOM 0 HG3 GLU B 2 59.153 -1.891 -4.126 1.00 0.00 H new ATOM 1478 N LEU B 3 61.115 -3.154 -4.933 1.00 0.00 N ATOM 1479 CA LEU B 3 62.376 -3.088 -4.149 1.00 0.00 C ATOM 1480 C LEU B 3 63.522 -3.701 -4.962 1.00 0.00 C ATOM 1481 O LEU B 3 64.653 -3.267 -4.876 1.00 0.00 O ATOM 1482 CB LEU B 3 62.193 -3.863 -2.839 1.00 0.00 C ATOM 1483 CG LEU B 3 63.478 -3.817 -1.998 1.00 0.00 C ATOM 1484 CD1 LEU B 3 63.826 -2.365 -1.637 1.00 0.00 C ATOM 1485 CD2 LEU B 3 63.255 -4.621 -0.713 1.00 0.00 C ATOM 0 H LEU B 3 60.419 -3.811 -4.581 1.00 0.00 H new ATOM 0 HA LEU B 3 62.617 -2.049 -3.927 1.00 0.00 H new ATOM 0 HB2 LEU B 3 61.365 -3.438 -2.271 1.00 0.00 H new ATOM 0 HB3 LEU B 3 61.931 -4.899 -3.057 1.00 0.00 H new ATOM 0 HG LEU B 3 64.301 -4.243 -2.572 1.00 0.00 H new ATOM 0 HD11 LEU B 3 64.739 -2.347 -1.041 1.00 0.00 H new ATOM 0 HD12 LEU B 3 63.977 -1.789 -2.550 1.00 0.00 H new ATOM 0 HD13 LEU B 3 63.009 -1.927 -1.063 1.00 0.00 H new ATOM 0 HD21 LEU B 3 64.160 -4.596 -0.107 1.00 0.00 H new ATOM 0 HD22 LEU B 3 62.429 -4.186 -0.150 1.00 0.00 H new ATOM 0 HD23 LEU B 3 63.016 -5.654 -0.967 1.00 0.00 H new ATOM 1497 N GLU B 4 63.244 -4.708 -5.750 1.00 0.00 N ATOM 1498 CA GLU B 4 64.327 -5.341 -6.561 1.00 0.00 C ATOM 1499 C GLU B 4 64.909 -4.322 -7.544 1.00 0.00 C ATOM 1500 O GLU B 4 66.109 -4.217 -7.703 1.00 0.00 O ATOM 1501 CB GLU B 4 63.756 -6.535 -7.335 1.00 0.00 C ATOM 1502 CG GLU B 4 64.874 -7.214 -8.131 1.00 0.00 C ATOM 1503 CD GLU B 4 64.333 -8.479 -8.802 1.00 0.00 C ATOM 1504 OE1 GLU B 4 63.206 -8.845 -8.511 1.00 0.00 O ATOM 1505 OE2 GLU B 4 65.057 -9.062 -9.593 1.00 0.00 O ATOM 0 H GLU B 4 62.317 -5.118 -5.867 1.00 0.00 H new ATOM 0 HA GLU B 4 65.118 -5.684 -5.894 1.00 0.00 H new ATOM 0 HB2 GLU B 4 63.304 -7.247 -6.644 1.00 0.00 H new ATOM 0 HB3 GLU B 4 62.967 -6.201 -8.009 1.00 0.00 H new ATOM 0 HG2 GLU B 4 65.265 -6.530 -8.884 1.00 0.00 H new ATOM 0 HG3 GLU B 4 65.703 -7.467 -7.470 1.00 0.00 H new ATOM 1512 N LYS B 5 64.072 -3.580 -8.214 1.00 0.00 N ATOM 1513 CA LYS B 5 64.578 -2.578 -9.197 1.00 0.00 C ATOM 1514 C LYS B 5 65.477 -1.560 -8.492 1.00 0.00 C ATOM 1515 O LYS B 5 66.497 -1.153 -9.012 1.00 0.00 O ATOM 1516 CB LYS B 5 63.390 -1.855 -9.850 1.00 0.00 C ATOM 1517 CG LYS B 5 62.776 -2.737 -10.949 1.00 0.00 C ATOM 1518 CD LYS B 5 62.119 -3.966 -10.318 1.00 0.00 C ATOM 1519 CE LYS B 5 61.208 -4.645 -11.342 1.00 0.00 C ATOM 1520 NZ LYS B 5 60.512 -5.798 -10.701 1.00 0.00 N ATOM 0 H LYS B 5 63.057 -3.623 -8.124 1.00 0.00 H new ATOM 0 HA LYS B 5 65.158 -3.091 -9.964 1.00 0.00 H new ATOM 0 HB2 LYS B 5 62.637 -1.622 -9.097 1.00 0.00 H new ATOM 0 HB3 LYS B 5 63.720 -0.907 -10.275 1.00 0.00 H new ATOM 0 HG2 LYS B 5 62.038 -2.168 -11.515 1.00 0.00 H new ATOM 0 HG3 LYS B 5 63.548 -3.047 -11.653 1.00 0.00 H new ATOM 0 HD2 LYS B 5 62.883 -4.664 -9.977 1.00 0.00 H new ATOM 0 HD3 LYS B 5 61.542 -3.672 -9.441 1.00 0.00 H new ATOM 0 HE2 LYS B 5 60.477 -3.932 -11.724 1.00 0.00 H new ATOM 0 HE3 LYS B 5 61.794 -4.988 -12.195 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 59.526 -5.835 -11.030 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 60.996 -6.682 -10.958 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 60.528 -5.682 -9.668 1.00 0.00 H new ATOM 1534 N ALA B 6 65.110 -1.145 -7.313 1.00 0.00 N ATOM 1535 CA ALA B 6 65.952 -0.158 -6.582 1.00 0.00 C ATOM 1536 C ALA B 6 67.341 -0.759 -6.363 1.00 0.00 C ATOM 1537 O ALA B 6 68.350 -0.147 -6.652 1.00 0.00 O ATOM 1538 CB ALA B 6 65.311 0.157 -5.229 1.00 0.00 C ATOM 0 H ALA B 6 64.266 -1.445 -6.825 1.00 0.00 H new ATOM 0 HA ALA B 6 66.034 0.761 -7.162 1.00 0.00 H new ATOM 0 HB1 ALA B 6 65.927 0.879 -4.694 1.00 0.00 H new ATOM 0 HB2 ALA B 6 64.316 0.574 -5.386 1.00 0.00 H new ATOM 0 HB3 ALA B 6 65.232 -0.758 -4.642 1.00 0.00 H new ATOM 1544 N MET B 7 67.392 -1.959 -5.858 1.00 0.00 N ATOM 1545 CA MET B 7 68.706 -2.617 -5.621 1.00 0.00 C ATOM 1546 C MET B 7 69.431 -2.793 -6.960 1.00 0.00 C ATOM 1547 O MET B 7 70.589 -2.454 -7.106 1.00 0.00 O ATOM 1548 CB MET B 7 68.445 -3.985 -4.989 1.00 0.00 C ATOM 1549 CG MET B 7 67.818 -3.792 -3.605 1.00 0.00 C ATOM 1550 SD MET B 7 67.086 -5.350 -3.045 1.00 0.00 S ATOM 1551 CE MET B 7 68.595 -6.099 -2.389 1.00 0.00 C ATOM 0 H MET B 7 66.577 -2.515 -5.598 1.00 0.00 H new ATOM 0 HA MET B 7 69.326 -2.011 -4.960 1.00 0.00 H new ATOM 0 HB2 MET B 7 67.780 -4.571 -5.624 1.00 0.00 H new ATOM 0 HB3 MET B 7 69.378 -4.543 -4.904 1.00 0.00 H new ATOM 0 HG2 MET B 7 68.575 -3.459 -2.895 1.00 0.00 H new ATOM 0 HG3 MET B 7 67.055 -3.014 -3.646 1.00 0.00 H new ATOM 0 HE1 MET B 7 68.343 -7.009 -1.845 1.00 0.00 H new ATOM 0 HE2 MET B 7 69.268 -6.342 -3.211 1.00 0.00 H new ATOM 0 HE3 MET B 7 69.086 -5.398 -1.714 1.00 0.00 H new ATOM 1561 N VAL B 8 68.750 -3.338 -7.931 1.00 0.00 N ATOM 1562 CA VAL B 8 69.373 -3.573 -9.268 1.00 0.00 C ATOM 1563 C VAL B 8 69.835 -2.245 -9.876 1.00 0.00 C ATOM 1564 O VAL B 8 70.876 -2.169 -10.497 1.00 0.00 O ATOM 1565 CB VAL B 8 68.339 -4.229 -10.193 1.00 0.00 C ATOM 1566 CG1 VAL B 8 68.876 -4.305 -11.627 1.00 0.00 C ATOM 1567 CG2 VAL B 8 68.044 -5.643 -9.691 1.00 0.00 C ATOM 0 H VAL B 8 67.777 -3.634 -7.855 1.00 0.00 H new ATOM 0 HA VAL B 8 70.238 -4.227 -9.154 1.00 0.00 H new ATOM 0 HB VAL B 8 67.428 -3.630 -10.188 1.00 0.00 H new ATOM 0 HG11 VAL B 8 68.131 -4.773 -12.270 1.00 0.00 H new ATOM 0 HG12 VAL B 8 69.089 -3.299 -11.990 1.00 0.00 H new ATOM 0 HG13 VAL B 8 69.791 -4.897 -11.642 1.00 0.00 H new ATOM 0 HG21 VAL B 8 67.310 -6.115 -10.344 1.00 0.00 H new ATOM 0 HG22 VAL B 8 68.963 -6.229 -9.694 1.00 0.00 H new ATOM 0 HG23 VAL B 8 67.649 -5.594 -8.676 1.00 0.00 H new ATOM 1577 N ALA B 9 69.065 -1.205 -9.730 1.00 0.00 N ATOM 1578 CA ALA B 9 69.471 0.096 -10.334 1.00 0.00 C ATOM 1579 C ALA B 9 70.859 0.484 -9.824 1.00 0.00 C ATOM 1580 O ALA B 9 71.684 0.979 -10.566 1.00 0.00 O ATOM 1581 CB ALA B 9 68.459 1.182 -9.953 1.00 0.00 C ATOM 0 H ALA B 9 68.180 -1.197 -9.224 1.00 0.00 H new ATOM 0 HA ALA B 9 69.498 -0.003 -11.419 1.00 0.00 H new ATOM 0 HB1 ALA B 9 68.760 2.131 -10.397 1.00 0.00 H new ATOM 0 HB2 ALA B 9 67.472 0.905 -10.323 1.00 0.00 H new ATOM 0 HB3 ALA B 9 68.425 1.283 -8.868 1.00 0.00 H new ATOM 1587 N LEU B 10 71.130 0.263 -8.570 1.00 0.00 N ATOM 1588 CA LEU B 10 72.473 0.621 -8.031 1.00 0.00 C ATOM 1589 C LEU B 10 73.564 -0.179 -8.754 1.00 0.00 C ATOM 1590 O LEU B 10 74.581 0.362 -9.143 1.00 0.00 O ATOM 1591 CB LEU B 10 72.531 0.307 -6.534 1.00 0.00 C ATOM 1592 CG LEU B 10 71.642 1.284 -5.754 1.00 0.00 C ATOM 1593 CD1 LEU B 10 71.537 0.807 -4.301 1.00 0.00 C ATOM 1594 CD2 LEU B 10 72.233 2.712 -5.799 1.00 0.00 C ATOM 0 H LEU B 10 70.484 -0.148 -7.896 1.00 0.00 H new ATOM 0 HA LEU B 10 72.640 1.686 -8.191 1.00 0.00 H new ATOM 0 HB2 LEU B 10 72.202 -0.717 -6.357 1.00 0.00 H new ATOM 0 HB3 LEU B 10 73.559 0.377 -6.180 1.00 0.00 H new ATOM 0 HG LEU B 10 70.652 1.311 -6.209 1.00 0.00 H new ATOM 0 HD11 LEU B 10 70.907 1.495 -3.737 1.00 0.00 H new ATOM 0 HD12 LEU B 10 71.098 -0.190 -4.276 1.00 0.00 H new ATOM 0 HD13 LEU B 10 72.531 0.777 -3.855 1.00 0.00 H new ATOM 0 HD21 LEU B 10 71.588 3.390 -5.240 1.00 0.00 H new ATOM 0 HD22 LEU B 10 73.228 2.708 -5.354 1.00 0.00 H new ATOM 0 HD23 LEU B 10 72.300 3.046 -6.835 1.00 0.00 H new ATOM 1606 N ILE B 11 73.378 -1.463 -8.926 1.00 0.00 N ATOM 1607 CA ILE B 11 74.429 -2.277 -9.610 1.00 0.00 C ATOM 1608 C ILE B 11 74.656 -1.743 -11.025 1.00 0.00 C ATOM 1609 O ILE B 11 75.772 -1.487 -11.432 1.00 0.00 O ATOM 1610 CB ILE B 11 73.977 -3.738 -9.688 1.00 0.00 C ATOM 1611 CG1 ILE B 11 73.797 -4.290 -8.270 1.00 0.00 C ATOM 1612 CG2 ILE B 11 75.036 -4.563 -10.430 1.00 0.00 C ATOM 1613 CD1 ILE B 11 73.112 -5.658 -8.332 1.00 0.00 C ATOM 0 H ILE B 11 72.552 -1.980 -8.626 1.00 0.00 H new ATOM 0 HA ILE B 11 75.358 -2.211 -9.043 1.00 0.00 H new ATOM 0 HB ILE B 11 73.030 -3.799 -10.225 1.00 0.00 H new ATOM 0 HG12 ILE B 11 74.766 -4.380 -7.779 1.00 0.00 H new ATOM 0 HG13 ILE B 11 73.200 -3.600 -7.674 1.00 0.00 H new ATOM 0 HG21 ILE B 11 74.714 -5.603 -10.485 1.00 0.00 H new ATOM 0 HG22 ILE B 11 75.164 -4.169 -11.438 1.00 0.00 H new ATOM 0 HG23 ILE B 11 75.984 -4.505 -9.895 1.00 0.00 H new ATOM 0 HD11 ILE B 11 72.986 -6.048 -7.322 1.00 0.00 H new ATOM 0 HD12 ILE B 11 72.136 -5.555 -8.806 1.00 0.00 H new ATOM 0 HD13 ILE B 11 73.726 -6.347 -8.912 1.00 0.00 H new ATOM 1625 N ASP B 12 73.606 -1.581 -11.780 1.00 0.00 N ATOM 1626 CA ASP B 12 73.767 -1.075 -13.170 1.00 0.00 C ATOM 1627 C ASP B 12 74.420 0.308 -13.115 1.00 0.00 C ATOM 1628 O ASP B 12 75.295 0.626 -13.895 1.00 0.00 O ATOM 1629 CB ASP B 12 72.388 -0.979 -13.833 1.00 0.00 C ATOM 1630 CG ASP B 12 72.525 -0.461 -15.268 1.00 0.00 C ATOM 1631 OD1 ASP B 12 73.512 0.195 -15.552 1.00 0.00 O ATOM 1632 OD2 ASP B 12 71.638 -0.736 -16.059 1.00 0.00 O ATOM 0 H ASP B 12 72.646 -1.777 -11.495 1.00 0.00 H new ATOM 0 HA ASP B 12 74.394 -1.751 -13.751 1.00 0.00 H new ATOM 0 HB2 ASP B 12 71.909 -1.958 -13.836 1.00 0.00 H new ATOM 0 HB3 ASP B 12 71.746 -0.312 -13.258 1.00 0.00 H new ATOM 1637 N VAL B 13 74.008 1.125 -12.187 1.00 0.00 N ATOM 1638 CA VAL B 13 74.614 2.480 -12.067 1.00 0.00 C ATOM 1639 C VAL B 13 76.057 2.364 -11.556 1.00 0.00 C ATOM 1640 O VAL B 13 76.948 3.035 -12.038 1.00 0.00 O ATOM 1641 CB VAL B 13 73.777 3.332 -11.105 1.00 0.00 C ATOM 1642 CG1 VAL B 13 74.516 4.634 -10.778 1.00 0.00 C ATOM 1643 CG2 VAL B 13 72.441 3.668 -11.771 1.00 0.00 C ATOM 0 H VAL B 13 73.278 0.913 -11.507 1.00 0.00 H new ATOM 0 HA VAL B 13 74.628 2.959 -13.046 1.00 0.00 H new ATOM 0 HB VAL B 13 73.609 2.775 -10.184 1.00 0.00 H new ATOM 0 HG11 VAL B 13 73.914 5.232 -10.094 1.00 0.00 H new ATOM 0 HG12 VAL B 13 75.473 4.402 -10.310 1.00 0.00 H new ATOM 0 HG13 VAL B 13 74.688 5.195 -11.696 1.00 0.00 H new ATOM 0 HG21 VAL B 13 71.839 4.274 -11.094 1.00 0.00 H new ATOM 0 HG22 VAL B 13 72.623 4.224 -12.691 1.00 0.00 H new ATOM 0 HG23 VAL B 13 71.908 2.746 -12.003 1.00 0.00 H new ATOM 1653 N PHE B 14 76.296 1.531 -10.574 1.00 0.00 N ATOM 1654 CA PHE B 14 77.683 1.398 -10.035 1.00 0.00 C ATOM 1655 C PHE B 14 78.619 0.856 -11.119 1.00 0.00 C ATOM 1656 O PHE B 14 79.641 1.443 -11.411 1.00 0.00 O ATOM 1657 CB PHE B 14 77.674 0.437 -8.839 1.00 0.00 C ATOM 1658 CG PHE B 14 79.072 0.289 -8.270 1.00 0.00 C ATOM 1659 CD1 PHE B 14 79.970 -0.621 -8.840 1.00 0.00 C ATOM 1660 CD2 PHE B 14 79.463 1.055 -7.164 1.00 0.00 C ATOM 1661 CE1 PHE B 14 81.260 -0.764 -8.305 1.00 0.00 C ATOM 1662 CE2 PHE B 14 80.751 0.910 -6.627 1.00 0.00 C ATOM 1663 CZ PHE B 14 81.650 0.000 -7.198 1.00 0.00 C ATOM 0 H PHE B 14 75.595 0.941 -10.125 1.00 0.00 H new ATOM 0 HA PHE B 14 78.038 2.378 -9.717 1.00 0.00 H new ATOM 0 HB2 PHE B 14 76.999 0.810 -8.069 1.00 0.00 H new ATOM 0 HB3 PHE B 14 77.296 -0.537 -9.150 1.00 0.00 H new ATOM 0 HD1 PHE B 14 79.670 -1.213 -9.692 1.00 0.00 H new ATOM 0 HD2 PHE B 14 78.772 1.758 -6.724 1.00 0.00 H new ATOM 0 HE1 PHE B 14 81.953 -1.464 -8.748 1.00 0.00 H new ATOM 0 HE2 PHE B 14 81.049 1.500 -5.773 1.00 0.00 H new ATOM 0 HZ PHE B 14 82.642 -0.112 -6.785 1.00 0.00 H new ATOM 1673 N HIS B 15 78.314 -0.287 -11.684 1.00 0.00 N ATOM 1674 CA HIS B 15 79.229 -0.880 -12.704 1.00 0.00 C ATOM 1675 C HIS B 15 79.412 0.054 -13.899 1.00 0.00 C ATOM 1676 O HIS B 15 80.515 0.233 -14.375 1.00 0.00 O ATOM 1677 CB HIS B 15 78.641 -2.203 -13.207 1.00 0.00 C ATOM 1678 CG HIS B 15 78.738 -3.259 -12.138 1.00 0.00 C ATOM 1679 ND1 HIS B 15 79.666 -3.195 -11.106 1.00 0.00 N ATOM 1680 CD2 HIS B 15 78.039 -4.424 -11.942 1.00 0.00 C ATOM 1681 CE1 HIS B 15 79.500 -4.294 -10.346 1.00 0.00 C ATOM 1682 NE2 HIS B 15 78.522 -5.072 -10.813 1.00 0.00 N ATOM 0 H HIS B 15 77.475 -0.831 -11.483 1.00 0.00 H new ATOM 0 HA HIS B 15 80.198 -1.041 -12.232 1.00 0.00 H new ATOM 0 HB2 HIS B 15 77.599 -2.060 -13.493 1.00 0.00 H new ATOM 0 HB3 HIS B 15 79.174 -2.530 -14.100 1.00 0.00 H new ATOM 0 HD2 HIS B 15 77.236 -4.782 -12.570 1.00 0.00 H new ATOM 0 HE1 HIS B 15 80.086 -4.518 -9.467 1.00 0.00 H new ATOM 0 HE2 HIS B 15 78.197 -5.957 -10.423 1.00 0.00 H new ATOM 1691 N GLN B 16 78.373 0.664 -14.398 1.00 0.00 N ATOM 1692 CA GLN B 16 78.559 1.580 -15.556 1.00 0.00 C ATOM 1693 C GLN B 16 79.303 2.831 -15.102 1.00 0.00 C ATOM 1694 O GLN B 16 80.170 3.341 -15.784 1.00 0.00 O ATOM 1695 CB GLN B 16 77.188 1.976 -16.108 1.00 0.00 C ATOM 1696 CG GLN B 16 76.557 0.778 -16.822 1.00 0.00 C ATOM 1697 CD GLN B 16 75.187 1.181 -17.369 1.00 0.00 C ATOM 1698 OE1 GLN B 16 74.588 0.453 -18.136 1.00 0.00 O ATOM 1699 NE2 GLN B 16 74.661 2.317 -17.001 1.00 0.00 N ATOM 0 H GLN B 16 77.416 0.570 -14.059 1.00 0.00 H new ATOM 0 HA GLN B 16 79.137 1.077 -16.331 1.00 0.00 H new ATOM 0 HB2 GLN B 16 76.541 2.311 -15.297 1.00 0.00 H new ATOM 0 HB3 GLN B 16 77.291 2.812 -16.800 1.00 0.00 H new ATOM 0 HG2 GLN B 16 77.202 0.443 -17.635 1.00 0.00 H new ATOM 0 HG3 GLN B 16 76.454 -0.059 -16.131 1.00 0.00 H new ATOM 0 HE21 GLN B 16 75.164 2.927 -16.357 1.00 0.00 H new ATOM 0 HE22 GLN B 16 73.746 2.595 -17.357 1.00 0.00 H new ATOM 1708 N TYR B 17 78.967 3.322 -13.945 1.00 0.00 N ATOM 1709 CA TYR B 17 79.646 4.537 -13.428 1.00 0.00 C ATOM 1710 C TYR B 17 81.069 4.187 -12.993 1.00 0.00 C ATOM 1711 O TYR B 17 82.001 4.937 -13.205 1.00 0.00 O ATOM 1712 CB TYR B 17 78.867 5.088 -12.235 1.00 0.00 C ATOM 1713 CG TYR B 17 79.568 6.319 -11.722 1.00 0.00 C ATOM 1714 CD1 TYR B 17 79.233 7.576 -12.235 1.00 0.00 C ATOM 1715 CD2 TYR B 17 80.557 6.201 -10.740 1.00 0.00 C ATOM 1716 CE1 TYR B 17 79.888 8.718 -11.764 1.00 0.00 C ATOM 1717 CE2 TYR B 17 81.211 7.342 -10.268 1.00 0.00 C ATOM 1718 CZ TYR B 17 80.877 8.600 -10.781 1.00 0.00 C ATOM 1719 OH TYR B 17 81.522 9.723 -10.319 1.00 0.00 O ATOM 0 H TYR B 17 78.249 2.933 -13.334 1.00 0.00 H new ATOM 0 HA TYR B 17 79.686 5.290 -14.215 1.00 0.00 H new ATOM 0 HB2 TYR B 17 77.846 5.331 -12.531 1.00 0.00 H new ATOM 0 HB3 TYR B 17 78.801 4.336 -11.448 1.00 0.00 H new ATOM 0 HD1 TYR B 17 78.470 7.665 -12.994 1.00 0.00 H new ATOM 0 HD2 TYR B 17 80.815 5.229 -10.347 1.00 0.00 H new ATOM 0 HE1 TYR B 17 79.631 9.690 -12.158 1.00 0.00 H new ATOM 0 HE2 TYR B 17 81.973 7.253 -9.508 1.00 0.00 H new ATOM 0 HH TYR B 17 82.319 9.458 -9.815 1.00 0.00 H new ATOM 1729 N SER B 18 81.237 3.051 -12.375 1.00 0.00 N ATOM 1730 CA SER B 18 82.589 2.639 -11.907 1.00 0.00 C ATOM 1731 C SER B 18 83.425 2.122 -13.083 1.00 0.00 C ATOM 1732 O SER B 18 84.636 2.060 -13.010 1.00 0.00 O ATOM 1733 CB SER B 18 82.446 1.535 -10.860 1.00 0.00 C ATOM 1734 OG SER B 18 81.508 1.943 -9.872 1.00 0.00 O ATOM 0 H SER B 18 80.490 2.386 -12.173 1.00 0.00 H new ATOM 0 HA SER B 18 83.092 3.502 -11.470 1.00 0.00 H new ATOM 0 HB2 SER B 18 82.115 0.610 -11.333 1.00 0.00 H new ATOM 0 HB3 SER B 18 83.412 1.329 -10.398 1.00 0.00 H new ATOM 0 HG SER B 18 80.622 1.591 -10.098 1.00 0.00 H new ATOM 1740 N GLY B 19 82.793 1.741 -14.161 1.00 0.00 N ATOM 1741 CA GLY B 19 83.555 1.216 -15.336 1.00 0.00 C ATOM 1742 C GLY B 19 83.947 2.363 -16.273 1.00 0.00 C ATOM 1743 O GLY B 19 84.251 2.146 -17.430 1.00 0.00 O ATOM 0 H GLY B 19 81.780 1.770 -14.281 1.00 0.00 H new ATOM 0 HA2 GLY B 19 84.449 0.695 -14.994 1.00 0.00 H new ATOM 0 HA3 GLY B 19 82.949 0.488 -15.875 1.00 0.00 H new ATOM 1747 N ARG B 20 83.951 3.580 -15.798 1.00 0.00 N ATOM 1748 CA ARG B 20 84.334 4.721 -16.681 1.00 0.00 C ATOM 1749 C ARG B 20 85.861 4.843 -16.738 1.00 0.00 C ATOM 1750 O ARG B 20 86.439 5.017 -17.792 1.00 0.00 O ATOM 1751 CB ARG B 20 83.747 6.018 -16.122 1.00 0.00 C ATOM 1752 CG ARG B 20 82.225 6.002 -16.272 1.00 0.00 C ATOM 1753 CD ARG B 20 81.648 7.303 -15.710 1.00 0.00 C ATOM 1754 NE ARG B 20 82.037 8.439 -16.593 1.00 0.00 N ATOM 1755 CZ ARG B 20 81.718 9.661 -16.263 1.00 0.00 C ATOM 1756 NH1 ARG B 20 81.040 9.887 -15.171 1.00 0.00 N ATOM 1757 NH2 ARG B 20 82.074 10.658 -17.027 1.00 0.00 N ATOM 0 H ARG B 20 83.707 3.833 -14.841 1.00 0.00 H new ATOM 0 HA ARG B 20 83.946 4.543 -17.684 1.00 0.00 H new ATOM 0 HB2 ARG B 20 84.017 6.128 -15.072 1.00 0.00 H new ATOM 0 HB3 ARG B 20 84.165 6.875 -16.650 1.00 0.00 H new ATOM 0 HG2 ARG B 20 81.953 5.893 -17.322 1.00 0.00 H new ATOM 0 HG3 ARG B 20 81.805 5.146 -15.744 1.00 0.00 H new ATOM 0 HD2 ARG B 20 80.562 7.234 -15.645 1.00 0.00 H new ATOM 0 HD3 ARG B 20 82.018 7.471 -14.699 1.00 0.00 H new ATOM 0 HE ARG B 20 82.552 8.262 -17.455 1.00 0.00 H new ATOM 0 HH11 ARG B 20 80.759 9.109 -14.575 1.00 0.00 H new ATOM 0 HH12 ARG B 20 80.791 10.842 -14.914 1.00 0.00 H new ATOM 0 HH21 ARG B 20 82.602 10.482 -17.882 1.00 0.00 H new ATOM 0 HH22 ARG B 20 81.825 11.613 -16.769 1.00 0.00 H new ATOM 1771 N GLU B 21 86.514 4.760 -15.603 1.00 0.00 N ATOM 1772 CA GLU B 21 88.006 4.877 -15.556 1.00 0.00 C ATOM 1773 C GLU B 21 88.594 3.683 -14.805 1.00 0.00 C ATOM 1774 O GLU B 21 88.044 3.219 -13.827 1.00 0.00 O ATOM 1775 CB GLU B 21 88.385 6.170 -14.833 1.00 0.00 C ATOM 1776 CG GLU B 21 88.052 7.368 -15.724 1.00 0.00 C ATOM 1777 CD GLU B 21 88.431 8.663 -15.005 1.00 0.00 C ATOM 1778 OE1 GLU B 21 88.768 8.590 -13.835 1.00 0.00 O ATOM 1779 OE2 GLU B 21 88.371 9.706 -15.635 1.00 0.00 O ATOM 0 H GLU B 21 86.070 4.614 -14.696 1.00 0.00 H new ATOM 0 HA GLU B 21 88.402 4.892 -16.571 1.00 0.00 H new ATOM 0 HB2 GLU B 21 87.845 6.244 -13.889 1.00 0.00 H new ATOM 0 HB3 GLU B 21 89.448 6.167 -14.592 1.00 0.00 H new ATOM 0 HG2 GLU B 21 88.592 7.293 -16.668 1.00 0.00 H new ATOM 0 HG3 GLU B 21 86.989 7.371 -15.964 1.00 0.00 H new ATOM 1786 N GLY B 22 89.713 3.183 -15.254 1.00 0.00 N ATOM 1787 CA GLY B 22 90.337 2.022 -14.563 1.00 0.00 C ATOM 1788 C GLY B 22 89.418 0.807 -14.674 1.00 0.00 C ATOM 1789 O GLY B 22 89.053 0.390 -15.756 1.00 0.00 O ATOM 0 H GLY B 22 90.221 3.529 -16.068 1.00 0.00 H new ATOM 0 HA2 GLY B 22 91.307 1.799 -15.008 1.00 0.00 H new ATOM 0 HA3 GLY B 22 90.515 2.262 -13.515 1.00 0.00 H new ATOM 1793 N ASP B 23 89.046 0.231 -13.558 1.00 0.00 N ATOM 1794 CA ASP B 23 88.152 -0.968 -13.579 1.00 0.00 C ATOM 1795 C ASP B 23 87.060 -0.808 -12.522 1.00 0.00 C ATOM 1796 O ASP B 23 87.207 -0.071 -11.566 1.00 0.00 O ATOM 1797 CB ASP B 23 88.978 -2.217 -13.266 1.00 0.00 C ATOM 1798 CG ASP B 23 89.910 -2.520 -14.440 1.00 0.00 C ATOM 1799 OD1 ASP B 23 89.636 -2.039 -15.527 1.00 0.00 O ATOM 1800 OD2 ASP B 23 90.885 -3.224 -14.231 1.00 0.00 O ATOM 0 H ASP B 23 89.325 0.542 -12.627 1.00 0.00 H new ATOM 0 HA ASP B 23 87.694 -1.065 -14.564 1.00 0.00 H new ATOM 0 HB2 ASP B 23 89.559 -2.063 -12.357 1.00 0.00 H new ATOM 0 HB3 ASP B 23 88.319 -3.065 -13.083 1.00 0.00 H new ATOM 1805 N LYS B 24 85.966 -1.502 -12.680 1.00 0.00 N ATOM 1806 CA LYS B 24 84.865 -1.403 -11.684 1.00 0.00 C ATOM 1807 C LYS B 24 85.326 -2.025 -10.366 1.00 0.00 C ATOM 1808 O LYS B 24 86.358 -2.660 -10.308 1.00 0.00 O ATOM 1809 CB LYS B 24 83.629 -2.149 -12.202 1.00 0.00 C ATOM 1810 CG LYS B 24 83.896 -3.659 -12.235 1.00 0.00 C ATOM 1811 CD LYS B 24 82.755 -4.359 -12.978 1.00 0.00 C ATOM 1812 CE LYS B 24 82.872 -5.877 -12.808 1.00 0.00 C ATOM 1813 NZ LYS B 24 83.999 -6.391 -13.638 1.00 0.00 N ATOM 0 H LYS B 24 85.788 -2.135 -13.460 1.00 0.00 H new ATOM 0 HA LYS B 24 84.608 -0.356 -11.526 1.00 0.00 H new ATOM 0 HB2 LYS B 24 82.773 -1.938 -11.561 1.00 0.00 H new ATOM 0 HB3 LYS B 24 83.374 -1.796 -13.201 1.00 0.00 H new ATOM 0 HG2 LYS B 24 84.846 -3.861 -12.730 1.00 0.00 H new ATOM 0 HG3 LYS B 24 83.977 -4.048 -11.220 1.00 0.00 H new ATOM 0 HD2 LYS B 24 81.795 -4.015 -12.594 1.00 0.00 H new ATOM 0 HD3 LYS B 24 82.786 -4.100 -14.036 1.00 0.00 H new ATOM 0 HE2 LYS B 24 83.038 -6.123 -11.759 1.00 0.00 H new ATOM 0 HE3 LYS B 24 81.940 -6.359 -13.105 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 84.064 -7.424 -13.533 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 83.831 -6.154 -14.637 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 84.889 -5.954 -13.324 1.00 0.00 H new ATOM 1827 N HIS B 25 84.581 -1.830 -9.307 1.00 0.00 N ATOM 1828 CA HIS B 25 84.971 -2.393 -7.982 1.00 0.00 C ATOM 1829 C HIS B 25 86.203 -1.653 -7.461 1.00 0.00 C ATOM 1830 O HIS B 25 87.037 -2.215 -6.776 1.00 0.00 O ATOM 1831 CB HIS B 25 85.276 -3.889 -8.127 1.00 0.00 C ATOM 1832 CG HIS B 25 85.138 -4.576 -6.794 1.00 0.00 C ATOM 1833 ND1 HIS B 25 83.903 -4.799 -6.201 1.00 0.00 N ATOM 1834 CD2 HIS B 25 86.069 -5.100 -5.931 1.00 0.00 C ATOM 1835 CE1 HIS B 25 84.122 -5.433 -5.034 1.00 0.00 C ATOM 1836 NE2 HIS B 25 85.423 -5.639 -4.824 1.00 0.00 N ATOM 0 H HIS B 25 83.710 -1.299 -9.306 1.00 0.00 H new ATOM 0 HA HIS B 25 84.152 -2.267 -7.274 1.00 0.00 H new ATOM 0 HB2 HIS B 25 84.595 -4.339 -8.849 1.00 0.00 H new ATOM 0 HB3 HIS B 25 86.286 -4.027 -8.513 1.00 0.00 H new ATOM 0 HD2 HIS B 25 87.138 -5.094 -6.088 1.00 0.00 H new ATOM 0 HE1 HIS B 25 83.341 -5.737 -4.352 1.00 0.00 H new ATOM 0 HE2 HIS B 25 85.854 -6.096 -4.020 1.00 0.00 H new ATOM 1845 N LYS B 26 86.316 -0.393 -7.771 1.00 0.00 N ATOM 1846 CA LYS B 26 87.483 0.389 -7.287 1.00 0.00 C ATOM 1847 C LYS B 26 87.220 1.878 -7.516 1.00 0.00 C ATOM 1848 O LYS B 26 87.438 2.396 -8.594 1.00 0.00 O ATOM 1849 CB LYS B 26 88.730 -0.042 -8.059 1.00 0.00 C ATOM 1850 CG LYS B 26 89.971 0.586 -7.425 1.00 0.00 C ATOM 1851 CD LYS B 26 91.212 0.148 -8.203 1.00 0.00 C ATOM 1852 CE LYS B 26 92.456 0.774 -7.574 1.00 0.00 C ATOM 1853 NZ LYS B 26 93.653 0.405 -8.379 1.00 0.00 N ATOM 0 H LYS B 26 85.649 0.129 -8.340 1.00 0.00 H new ATOM 0 HA LYS B 26 87.637 0.210 -6.223 1.00 0.00 H new ATOM 0 HB2 LYS B 26 88.816 -1.129 -8.052 1.00 0.00 H new ATOM 0 HB3 LYS B 26 88.648 0.264 -9.102 1.00 0.00 H new ATOM 0 HG2 LYS B 26 89.887 1.673 -7.433 1.00 0.00 H new ATOM 0 HG3 LYS B 26 90.055 0.281 -6.382 1.00 0.00 H new ATOM 0 HD2 LYS B 26 91.295 -0.939 -8.194 1.00 0.00 H new ATOM 0 HD3 LYS B 26 91.127 0.453 -9.246 1.00 0.00 H new ATOM 0 HE2 LYS B 26 92.351 1.858 -7.534 1.00 0.00 H new ATOM 0 HE3 LYS B 26 92.573 0.427 -6.547 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 94.502 0.830 -7.954 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 93.755 -0.630 -8.396 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 93.540 0.757 -9.351 1.00 0.00 H new ATOM 1867 N LEU B 27 86.737 2.573 -6.515 1.00 0.00 N ATOM 1868 CA LEU B 27 86.442 4.030 -6.687 1.00 0.00 C ATOM 1869 C LEU B 27 87.623 4.861 -6.174 1.00 0.00 C ATOM 1870 O LEU B 27 87.981 4.806 -5.014 1.00 0.00 O ATOM 1871 CB LEU B 27 85.178 4.386 -5.890 1.00 0.00 C ATOM 1872 CG LEU B 27 83.914 3.971 -6.669 1.00 0.00 C ATOM 1873 CD1 LEU B 27 83.695 4.887 -7.891 1.00 0.00 C ATOM 1874 CD2 LEU B 27 84.052 2.517 -7.136 1.00 0.00 C ATOM 0 H LEU B 27 86.535 2.196 -5.589 1.00 0.00 H new ATOM 0 HA LEU B 27 86.284 4.248 -7.743 1.00 0.00 H new ATOM 0 HB2 LEU B 27 85.197 3.884 -4.923 1.00 0.00 H new ATOM 0 HB3 LEU B 27 85.155 5.458 -5.693 1.00 0.00 H new ATOM 0 HG LEU B 27 83.054 4.067 -6.007 1.00 0.00 H new ATOM 0 HD11 LEU B 27 82.797 4.574 -8.424 1.00 0.00 H new ATOM 0 HD12 LEU B 27 83.578 5.918 -7.557 1.00 0.00 H new ATOM 0 HD13 LEU B 27 84.555 4.817 -8.557 1.00 0.00 H new ATOM 0 HD21 LEU B 27 83.158 2.225 -7.686 1.00 0.00 H new ATOM 0 HD22 LEU B 27 84.923 2.424 -7.784 1.00 0.00 H new ATOM 0 HD23 LEU B 27 84.173 1.867 -6.270 1.00 0.00 H new ATOM 1886 N LYS B 28 88.225 5.632 -7.041 1.00 0.00 N ATOM 1887 CA LYS B 28 89.383 6.483 -6.636 1.00 0.00 C ATOM 1888 C LYS B 28 88.874 7.866 -6.227 1.00 0.00 C ATOM 1889 O LYS B 28 87.737 8.215 -6.477 1.00 0.00 O ATOM 1890 CB LYS B 28 90.342 6.632 -7.816 1.00 0.00 C ATOM 1891 CG LYS B 28 91.010 5.284 -8.106 1.00 0.00 C ATOM 1892 CD LYS B 28 92.057 5.442 -9.220 1.00 0.00 C ATOM 1893 CE LYS B 28 91.376 5.501 -10.593 1.00 0.00 C ATOM 1894 NZ LYS B 28 90.524 4.293 -10.785 1.00 0.00 N ATOM 0 H LYS B 28 87.961 5.709 -8.023 1.00 0.00 H new ATOM 0 HA LYS B 28 89.902 6.017 -5.798 1.00 0.00 H new ATOM 0 HB2 LYS B 28 89.801 6.978 -8.696 1.00 0.00 H new ATOM 0 HB3 LYS B 28 91.099 7.384 -7.591 1.00 0.00 H new ATOM 0 HG2 LYS B 28 91.484 4.903 -7.202 1.00 0.00 H new ATOM 0 HG3 LYS B 28 90.258 4.553 -8.404 1.00 0.00 H new ATOM 0 HD2 LYS B 28 92.637 6.350 -9.056 1.00 0.00 H new ATOM 0 HD3 LYS B 28 92.757 4.607 -9.190 1.00 0.00 H new ATOM 0 HE2 LYS B 28 90.768 6.402 -10.669 1.00 0.00 H new ATOM 0 HE3 LYS B 28 92.128 5.556 -11.380 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 90.854 3.764 -11.618 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 90.587 3.686 -9.943 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 89.536 4.584 -10.929 1.00 0.00 H new ATOM 1908 N LYS B 29 89.695 8.650 -5.584 1.00 0.00 N ATOM 1909 CA LYS B 29 89.243 10.000 -5.142 1.00 0.00 C ATOM 1910 C LYS B 29 88.788 10.817 -6.355 1.00 0.00 C ATOM 1911 O LYS B 29 87.797 11.517 -6.302 1.00 0.00 O ATOM 1912 CB LYS B 29 90.414 10.718 -4.471 1.00 0.00 C ATOM 1913 CG LYS B 29 90.848 9.939 -3.229 1.00 0.00 C ATOM 1914 CD LYS B 29 92.020 10.658 -2.558 1.00 0.00 C ATOM 1915 CE LYS B 29 92.456 9.880 -1.315 1.00 0.00 C ATOM 1916 NZ LYS B 29 93.213 8.665 -1.732 1.00 0.00 N ATOM 0 H LYS B 29 90.658 8.415 -5.346 1.00 0.00 H new ATOM 0 HA LYS B 29 88.413 9.895 -4.444 1.00 0.00 H new ATOM 0 HB2 LYS B 29 91.248 10.806 -5.168 1.00 0.00 H new ATOM 0 HB3 LYS B 29 90.122 11.731 -4.194 1.00 0.00 H new ATOM 0 HG2 LYS B 29 90.014 9.851 -2.532 1.00 0.00 H new ATOM 0 HG3 LYS B 29 91.140 8.926 -3.506 1.00 0.00 H new ATOM 0 HD2 LYS B 29 92.853 10.746 -3.255 1.00 0.00 H new ATOM 0 HD3 LYS B 29 91.728 11.671 -2.281 1.00 0.00 H new ATOM 0 HE2 LYS B 29 93.078 10.509 -0.678 1.00 0.00 H new ATOM 0 HE3 LYS B 29 91.584 9.595 -0.727 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 92.619 7.822 -1.596 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 93.474 8.746 -2.735 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 94.075 8.578 -1.156 1.00 0.00 H new ATOM 1930 N SER B 30 89.486 10.723 -7.452 1.00 0.00 N ATOM 1931 CA SER B 30 89.068 11.484 -8.663 1.00 0.00 C ATOM 1932 C SER B 30 87.702 10.967 -9.116 1.00 0.00 C ATOM 1933 O SER B 30 86.832 11.715 -9.513 1.00 0.00 O ATOM 1934 CB SER B 30 90.091 11.278 -9.782 1.00 0.00 C ATOM 1935 OG SER B 30 90.058 9.921 -10.204 1.00 0.00 O ATOM 0 H SER B 30 90.325 10.154 -7.563 1.00 0.00 H new ATOM 0 HA SER B 30 89.008 12.547 -8.431 1.00 0.00 H new ATOM 0 HB2 SER B 30 89.867 11.937 -10.621 1.00 0.00 H new ATOM 0 HB3 SER B 30 91.089 11.537 -9.430 1.00 0.00 H new ATOM 0 HG SER B 30 90.711 9.786 -10.922 1.00 0.00 H new ATOM 1941 N GLU B 31 87.519 9.683 -9.037 1.00 0.00 N ATOM 1942 CA GLU B 31 86.220 9.074 -9.435 1.00 0.00 C ATOM 1943 C GLU B 31 85.135 9.455 -8.417 1.00 0.00 C ATOM 1944 O GLU B 31 83.986 9.646 -8.763 1.00 0.00 O ATOM 1945 CB GLU B 31 86.374 7.552 -9.499 1.00 0.00 C ATOM 1946 CG GLU B 31 87.257 7.191 -10.695 1.00 0.00 C ATOM 1947 CD GLU B 31 87.499 5.681 -10.727 1.00 0.00 C ATOM 1948 OE1 GLU B 31 87.088 5.016 -9.792 1.00 0.00 O ATOM 1949 OE2 GLU B 31 88.092 5.215 -11.686 1.00 0.00 O ATOM 0 H GLU B 31 88.221 9.019 -8.710 1.00 0.00 H new ATOM 0 HA GLU B 31 85.926 9.446 -10.416 1.00 0.00 H new ATOM 0 HB2 GLU B 31 86.819 7.179 -8.576 1.00 0.00 H new ATOM 0 HB3 GLU B 31 85.397 7.078 -9.596 1.00 0.00 H new ATOM 0 HG2 GLU B 31 86.779 7.511 -11.621 1.00 0.00 H new ATOM 0 HG3 GLU B 31 88.208 7.719 -10.628 1.00 0.00 H new ATOM 1956 N LEU B 32 85.496 9.572 -7.164 1.00 0.00 N ATOM 1957 CA LEU B 32 84.482 9.946 -6.132 1.00 0.00 C ATOM 1958 C LEU B 32 84.063 11.407 -6.331 1.00 0.00 C ATOM 1959 O LEU B 32 82.905 11.754 -6.221 1.00 0.00 O ATOM 1960 CB LEU B 32 85.072 9.770 -4.727 1.00 0.00 C ATOM 1961 CG LEU B 32 84.013 10.104 -3.659 1.00 0.00 C ATOM 1962 CD1 LEU B 32 82.830 9.122 -3.763 1.00 0.00 C ATOM 1963 CD2 LEU B 32 84.651 9.998 -2.269 1.00 0.00 C ATOM 0 H LEU B 32 86.442 9.426 -6.813 1.00 0.00 H new ATOM 0 HA LEU B 32 83.612 9.298 -6.237 1.00 0.00 H new ATOM 0 HB2 LEU B 32 85.420 8.745 -4.597 1.00 0.00 H new ATOM 0 HB3 LEU B 32 85.939 10.419 -4.605 1.00 0.00 H new ATOM 0 HG LEU B 32 83.644 11.117 -3.819 1.00 0.00 H new ATOM 0 HD11 LEU B 32 82.087 9.366 -3.004 1.00 0.00 H new ATOM 0 HD12 LEU B 32 82.378 9.200 -4.752 1.00 0.00 H new ATOM 0 HD13 LEU B 32 83.187 8.104 -3.607 1.00 0.00 H new ATOM 0 HD21 LEU B 32 83.907 10.233 -1.508 1.00 0.00 H new ATOM 0 HD22 LEU B 32 85.020 8.984 -2.114 1.00 0.00 H new ATOM 0 HD23 LEU B 32 85.480 10.701 -2.195 1.00 0.00 H new ATOM 1975 N LYS B 33 85.004 12.261 -6.628 1.00 0.00 N ATOM 1976 CA LYS B 33 84.674 13.700 -6.842 1.00 0.00 C ATOM 1977 C LYS B 33 83.688 13.815 -8.003 1.00 0.00 C ATOM 1978 O LYS B 33 82.761 14.601 -7.979 1.00 0.00 O ATOM 1979 CB LYS B 33 85.960 14.470 -7.168 1.00 0.00 C ATOM 1980 CG LYS B 33 85.649 15.961 -7.359 1.00 0.00 C ATOM 1981 CD LYS B 33 86.940 16.735 -7.683 1.00 0.00 C ATOM 1982 CE LYS B 33 87.719 17.038 -6.397 1.00 0.00 C ATOM 1983 NZ LYS B 33 88.878 17.918 -6.717 1.00 0.00 N ATOM 0 H LYS B 33 85.991 12.024 -6.732 1.00 0.00 H new ATOM 0 HA LYS B 33 84.225 14.120 -5.942 1.00 0.00 H new ATOM 0 HB2 LYS B 33 86.684 14.342 -6.363 1.00 0.00 H new ATOM 0 HB3 LYS B 33 86.415 14.067 -8.073 1.00 0.00 H new ATOM 0 HG2 LYS B 33 84.927 16.089 -8.166 1.00 0.00 H new ATOM 0 HG3 LYS B 33 85.192 16.364 -6.455 1.00 0.00 H new ATOM 0 HD2 LYS B 33 87.561 16.151 -8.363 1.00 0.00 H new ATOM 0 HD3 LYS B 33 86.695 17.666 -8.195 1.00 0.00 H new ATOM 0 HE2 LYS B 33 87.068 17.525 -5.671 1.00 0.00 H new ATOM 0 HE3 LYS B 33 88.067 16.111 -5.942 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 89.408 18.125 -5.846 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 89.502 17.437 -7.396 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 88.534 18.807 -7.133 1.00 0.00 H new ATOM 1997 N GLU B 34 83.897 13.031 -9.020 1.00 0.00 N ATOM 1998 CA GLU B 34 82.996 13.073 -10.203 1.00 0.00 C ATOM 1999 C GLU B 34 81.564 12.731 -9.776 1.00 0.00 C ATOM 2000 O GLU B 34 80.618 13.391 -10.161 1.00 0.00 O ATOM 2001 CB GLU B 34 83.494 12.055 -11.234 1.00 0.00 C ATOM 2002 CG GLU B 34 82.700 12.189 -12.535 1.00 0.00 C ATOM 2003 CD GLU B 34 83.014 13.536 -13.187 1.00 0.00 C ATOM 2004 OE1 GLU B 34 83.982 14.157 -12.781 1.00 0.00 O ATOM 2005 OE2 GLU B 34 82.285 13.921 -14.086 1.00 0.00 O ATOM 0 H GLU B 34 84.660 12.357 -9.084 1.00 0.00 H new ATOM 0 HA GLU B 34 83.000 14.072 -10.640 1.00 0.00 H new ATOM 0 HB2 GLU B 34 84.555 12.213 -11.429 1.00 0.00 H new ATOM 0 HB3 GLU B 34 83.390 11.045 -10.838 1.00 0.00 H new ATOM 0 HG2 GLU B 34 82.955 11.376 -13.215 1.00 0.00 H new ATOM 0 HG3 GLU B 34 81.632 12.112 -12.331 1.00 0.00 H new ATOM 2012 N LEU B 35 81.393 11.701 -8.993 1.00 0.00 N ATOM 2013 CA LEU B 35 80.017 11.319 -8.553 1.00 0.00 C ATOM 2014 C LEU B 35 79.390 12.479 -7.783 1.00 0.00 C ATOM 2015 O LEU B 35 78.258 12.854 -8.017 1.00 0.00 O ATOM 2016 CB LEU B 35 80.089 10.074 -7.650 1.00 0.00 C ATOM 2017 CG LEU B 35 78.662 9.653 -7.185 1.00 0.00 C ATOM 2018 CD1 LEU B 35 78.575 8.125 -7.087 1.00 0.00 C ATOM 2019 CD2 LEU B 35 78.322 10.256 -5.805 1.00 0.00 C ATOM 0 H LEU B 35 82.143 11.108 -8.639 1.00 0.00 H new ATOM 0 HA LEU B 35 79.406 11.092 -9.427 1.00 0.00 H new ATOM 0 HB2 LEU B 35 80.559 9.252 -8.190 1.00 0.00 H new ATOM 0 HB3 LEU B 35 80.714 10.283 -6.782 1.00 0.00 H new ATOM 0 HG LEU B 35 77.950 10.027 -7.920 1.00 0.00 H new ATOM 0 HD11 LEU B 35 77.575 7.838 -6.762 1.00 0.00 H new ATOM 0 HD12 LEU B 35 78.779 7.686 -8.063 1.00 0.00 H new ATOM 0 HD13 LEU B 35 79.309 7.764 -6.366 1.00 0.00 H new ATOM 0 HD21 LEU B 35 77.321 9.944 -5.508 1.00 0.00 H new ATOM 0 HD22 LEU B 35 79.044 9.907 -5.067 1.00 0.00 H new ATOM 0 HD23 LEU B 35 78.361 11.344 -5.864 1.00 0.00 H new ATOM 2031 N ILE B 36 80.113 13.044 -6.856 1.00 0.00 N ATOM 2032 CA ILE B 36 79.557 14.173 -6.061 1.00 0.00 C ATOM 2033 C ILE B 36 79.188 15.338 -6.990 1.00 0.00 C ATOM 2034 O ILE B 36 78.119 15.908 -6.895 1.00 0.00 O ATOM 2035 CB ILE B 36 80.599 14.642 -5.040 1.00 0.00 C ATOM 2036 CG1 ILE B 36 80.824 13.535 -4.004 1.00 0.00 C ATOM 2037 CG2 ILE B 36 80.091 15.902 -4.334 1.00 0.00 C ATOM 2038 CD1 ILE B 36 82.032 13.882 -3.131 1.00 0.00 C ATOM 0 H ILE B 36 81.066 12.772 -6.615 1.00 0.00 H new ATOM 0 HA ILE B 36 78.661 13.835 -5.540 1.00 0.00 H new ATOM 0 HB ILE B 36 81.536 14.864 -5.550 1.00 0.00 H new ATOM 0 HG12 ILE B 36 79.936 13.419 -3.383 1.00 0.00 H new ATOM 0 HG13 ILE B 36 80.988 12.582 -4.506 1.00 0.00 H new ATOM 0 HG21 ILE B 36 80.832 16.236 -3.608 1.00 0.00 H new ATOM 0 HG22 ILE B 36 79.924 16.689 -5.070 1.00 0.00 H new ATOM 0 HG23 ILE B 36 79.155 15.680 -3.821 1.00 0.00 H new ATOM 0 HD11 ILE B 36 82.188 13.093 -2.396 1.00 0.00 H new ATOM 0 HD12 ILE B 36 82.919 13.975 -3.758 1.00 0.00 H new ATOM 0 HD13 ILE B 36 81.850 14.826 -2.617 1.00 0.00 H new ATOM 2050 N ASN B 37 80.078 15.702 -7.871 1.00 0.00 N ATOM 2051 CA ASN B 37 79.812 16.841 -8.799 1.00 0.00 C ATOM 2052 C ASN B 37 78.773 16.457 -9.855 1.00 0.00 C ATOM 2053 O ASN B 37 78.181 17.308 -10.489 1.00 0.00 O ATOM 2054 CB ASN B 37 81.112 17.219 -9.508 1.00 0.00 C ATOM 2055 CG ASN B 37 80.920 18.539 -10.257 1.00 0.00 C ATOM 2056 OD1 ASN B 37 79.909 19.196 -10.104 1.00 0.00 O ATOM 2057 ND2 ASN B 37 81.855 18.961 -11.065 1.00 0.00 N ATOM 0 H ASN B 37 80.987 15.256 -7.990 1.00 0.00 H new ATOM 0 HA ASN B 37 79.429 17.679 -8.217 1.00 0.00 H new ATOM 0 HB2 ASN B 37 81.920 17.315 -8.782 1.00 0.00 H new ATOM 0 HB3 ASN B 37 81.401 16.432 -10.205 1.00 0.00 H new ATOM 0 HD21 ASN B 37 81.736 19.841 -11.567 1.00 0.00 H new ATOM 0 HD22 ASN B 37 82.704 18.411 -11.194 1.00 0.00 H new ATOM 2064 N ASN B 38 78.569 15.191 -10.082 1.00 0.00 N ATOM 2065 CA ASN B 38 77.596 14.769 -11.134 1.00 0.00 C ATOM 2066 C ASN B 38 76.195 15.338 -10.865 1.00 0.00 C ATOM 2067 O ASN B 38 75.651 16.046 -11.689 1.00 0.00 O ATOM 2068 CB ASN B 38 77.525 13.243 -11.161 1.00 0.00 C ATOM 2069 CG ASN B 38 76.688 12.791 -12.359 1.00 0.00 C ATOM 2070 OD1 ASN B 38 76.708 13.417 -13.400 1.00 0.00 O ATOM 2071 ND2 ASN B 38 75.946 11.723 -12.254 1.00 0.00 N ATOM 0 H ASN B 38 79.032 14.429 -9.587 1.00 0.00 H new ATOM 0 HA ASN B 38 77.938 15.154 -12.094 1.00 0.00 H new ATOM 0 HB2 ASN B 38 78.529 12.823 -11.226 1.00 0.00 H new ATOM 0 HB3 ASN B 38 77.084 12.873 -10.236 1.00 0.00 H new ATOM 0 HD21 ASN B 38 75.383 11.414 -13.046 1.00 0.00 H new ATOM 0 HD22 ASN B 38 75.929 11.198 -11.380 1.00 0.00 H new ATOM 2078 N GLU B 39 75.589 15.028 -9.741 1.00 0.00 N ATOM 2079 CA GLU B 39 74.209 15.555 -9.468 1.00 0.00 C ATOM 2080 C GLU B 39 74.039 15.917 -7.984 1.00 0.00 C ATOM 2081 O GLU B 39 73.062 16.531 -7.605 1.00 0.00 O ATOM 2082 CB GLU B 39 73.174 14.496 -9.867 1.00 0.00 C ATOM 2083 CG GLU B 39 73.645 13.114 -9.409 1.00 0.00 C ATOM 2084 CD GLU B 39 72.566 12.076 -9.727 1.00 0.00 C ATOM 2085 OE1 GLU B 39 71.520 12.125 -9.100 1.00 0.00 O ATOM 2086 OE2 GLU B 39 72.803 11.252 -10.595 1.00 0.00 O ATOM 0 H GLU B 39 75.984 14.439 -9.008 1.00 0.00 H new ATOM 0 HA GLU B 39 74.059 16.460 -10.056 1.00 0.00 H new ATOM 0 HB2 GLU B 39 72.209 14.729 -9.417 1.00 0.00 H new ATOM 0 HB3 GLU B 39 73.031 14.502 -10.948 1.00 0.00 H new ATOM 0 HG2 GLU B 39 74.577 12.851 -9.910 1.00 0.00 H new ATOM 0 HG3 GLU B 39 73.851 13.124 -8.339 1.00 0.00 H new ATOM 2093 N LEU B 40 74.967 15.555 -7.140 1.00 0.00 N ATOM 2094 CA LEU B 40 74.819 15.905 -5.693 1.00 0.00 C ATOM 2095 C LEU B 40 75.207 17.374 -5.497 1.00 0.00 C ATOM 2096 O LEU B 40 76.241 17.822 -5.950 1.00 0.00 O ATOM 2097 CB LEU B 40 75.730 15.001 -4.841 1.00 0.00 C ATOM 2098 CG LEU B 40 74.982 13.726 -4.433 1.00 0.00 C ATOM 2099 CD1 LEU B 40 74.483 13.004 -5.682 1.00 0.00 C ATOM 2100 CD2 LEU B 40 75.926 12.805 -3.653 1.00 0.00 C ATOM 0 H LEU B 40 75.812 15.038 -7.383 1.00 0.00 H new ATOM 0 HA LEU B 40 73.786 15.754 -5.380 1.00 0.00 H new ATOM 0 HB2 LEU B 40 76.626 14.741 -5.405 1.00 0.00 H new ATOM 0 HB3 LEU B 40 76.058 15.539 -3.952 1.00 0.00 H new ATOM 0 HG LEU B 40 74.132 13.991 -3.804 1.00 0.00 H new ATOM 0 HD11 LEU B 40 73.952 12.098 -5.391 1.00 0.00 H new ATOM 0 HD12 LEU B 40 73.809 13.658 -6.235 1.00 0.00 H new ATOM 0 HD13 LEU B 40 75.332 12.740 -6.313 1.00 0.00 H new ATOM 0 HD21 LEU B 40 75.393 11.899 -3.363 1.00 0.00 H new ATOM 0 HD22 LEU B 40 76.777 12.541 -4.280 1.00 0.00 H new ATOM 0 HD23 LEU B 40 76.280 13.319 -2.759 1.00 0.00 H new ATOM 2112 N SER B 41 74.374 18.123 -4.831 1.00 0.00 N ATOM 2113 CA SER B 41 74.675 19.562 -4.605 1.00 0.00 C ATOM 2114 C SER B 41 73.788 20.090 -3.475 1.00 0.00 C ATOM 2115 O SER B 41 74.192 20.921 -2.687 1.00 0.00 O ATOM 2116 CB SER B 41 74.385 20.340 -5.888 1.00 0.00 C ATOM 2117 OG SER B 41 74.424 21.732 -5.614 1.00 0.00 O ATOM 0 H SER B 41 73.493 17.798 -4.432 1.00 0.00 H new ATOM 0 HA SER B 41 75.723 19.684 -4.332 1.00 0.00 H new ATOM 0 HB2 SER B 41 75.119 20.088 -6.653 1.00 0.00 H new ATOM 0 HB3 SER B 41 73.407 20.063 -6.281 1.00 0.00 H new ATOM 0 HG SER B 41 74.240 22.233 -6.436 1.00 0.00 H new ATOM 2123 N HIS B 42 72.578 19.609 -3.398 1.00 0.00 N ATOM 2124 CA HIS B 42 71.649 20.067 -2.325 1.00 0.00 C ATOM 2125 C HIS B 42 72.103 19.524 -0.967 1.00 0.00 C ATOM 2126 O HIS B 42 71.700 20.015 0.070 1.00 0.00 O ATOM 2127 CB HIS B 42 70.231 19.578 -2.631 1.00 0.00 C ATOM 2128 CG HIS B 42 69.679 20.343 -3.803 1.00 0.00 C ATOM 2129 ND1 HIS B 42 69.839 19.913 -5.113 1.00 0.00 N ATOM 2130 CD2 HIS B 42 68.969 21.518 -3.878 1.00 0.00 C ATOM 2131 CE1 HIS B 42 69.239 20.815 -5.912 1.00 0.00 C ATOM 2132 NE2 HIS B 42 68.695 21.809 -5.208 1.00 0.00 N ATOM 0 H HIS B 42 72.190 18.914 -4.036 1.00 0.00 H new ATOM 0 HA HIS B 42 71.657 21.156 -2.289 1.00 0.00 H new ATOM 0 HB2 HIS B 42 70.243 18.511 -2.853 1.00 0.00 H new ATOM 0 HB3 HIS B 42 69.591 19.716 -1.759 1.00 0.00 H new ATOM 0 HD2 HIS B 42 68.671 22.121 -3.033 1.00 0.00 H new ATOM 0 HE1 HIS B 42 69.203 20.743 -6.989 1.00 0.00 H new ATOM 0 HE2 HIS B 42 68.185 22.614 -5.571 1.00 0.00 H new ATOM 2141 N PHE B 43 72.934 18.509 -0.958 1.00 0.00 N ATOM 2142 CA PHE B 43 73.412 17.925 0.337 1.00 0.00 C ATOM 2143 C PHE B 43 74.842 18.391 0.616 1.00 0.00 C ATOM 2144 O PHE B 43 75.333 18.295 1.723 1.00 0.00 O ATOM 2145 CB PHE B 43 73.412 16.400 0.223 1.00 0.00 C ATOM 2146 CG PHE B 43 72.000 15.901 0.038 1.00 0.00 C ATOM 2147 CD1 PHE B 43 71.461 15.788 -1.248 1.00 0.00 C ATOM 2148 CD2 PHE B 43 71.229 15.552 1.153 1.00 0.00 C ATOM 2149 CE1 PHE B 43 70.152 15.325 -1.422 1.00 0.00 C ATOM 2150 CE2 PHE B 43 69.920 15.087 0.981 1.00 0.00 C ATOM 2151 CZ PHE B 43 69.381 14.975 -0.307 1.00 0.00 C ATOM 0 H PHE B 43 73.303 18.058 -1.795 1.00 0.00 H new ATOM 0 HA PHE B 43 72.755 18.248 1.144 1.00 0.00 H new ATOM 0 HB2 PHE B 43 74.030 16.089 -0.619 1.00 0.00 H new ATOM 0 HB3 PHE B 43 73.849 15.959 1.119 1.00 0.00 H new ATOM 0 HD1 PHE B 43 72.056 16.058 -2.108 1.00 0.00 H new ATOM 0 HD2 PHE B 43 71.644 15.642 2.146 1.00 0.00 H new ATOM 0 HE1 PHE B 43 69.737 15.238 -2.415 1.00 0.00 H new ATOM 0 HE2 PHE B 43 69.326 14.815 1.841 1.00 0.00 H new ATOM 0 HZ PHE B 43 68.370 14.619 -0.440 1.00 0.00 H new ATOM 2161 N LEU B 44 75.517 18.883 -0.391 1.00 0.00 N ATOM 2162 CA LEU B 44 76.927 19.349 -0.216 1.00 0.00 C ATOM 2163 C LEU B 44 76.956 20.880 -0.183 1.00 0.00 C ATOM 2164 O LEU B 44 76.133 21.541 -0.786 1.00 0.00 O ATOM 2165 CB LEU B 44 77.773 18.847 -1.402 1.00 0.00 C ATOM 2166 CG LEU B 44 78.214 17.384 -1.189 1.00 0.00 C ATOM 2167 CD1 LEU B 44 79.324 17.296 -0.126 1.00 0.00 C ATOM 2168 CD2 LEU B 44 77.016 16.531 -0.752 1.00 0.00 C ATOM 0 H LEU B 44 75.148 18.983 -1.337 1.00 0.00 H new ATOM 0 HA LEU B 44 77.332 18.958 0.718 1.00 0.00 H new ATOM 0 HB2 LEU B 44 77.196 18.926 -2.323 1.00 0.00 H new ATOM 0 HB3 LEU B 44 78.651 19.481 -1.521 1.00 0.00 H new ATOM 0 HG LEU B 44 78.604 17.006 -2.134 1.00 0.00 H new ATOM 0 HD11 LEU B 44 79.619 16.255 0.007 1.00 0.00 H new ATOM 0 HD12 LEU B 44 80.186 17.878 -0.451 1.00 0.00 H new ATOM 0 HD13 LEU B 44 78.954 17.692 0.820 1.00 0.00 H new ATOM 0 HD21 LEU B 44 77.338 15.500 -0.604 1.00 0.00 H new ATOM 0 HD22 LEU B 44 76.612 16.922 0.182 1.00 0.00 H new ATOM 0 HD23 LEU B 44 76.246 16.564 -1.523 1.00 0.00 H new ATOM 2180 N GLU B 45 77.905 21.447 0.512 1.00 0.00 N ATOM 2181 CA GLU B 45 77.998 22.933 0.581 1.00 0.00 C ATOM 2182 C GLU B 45 78.766 23.438 -0.642 1.00 0.00 C ATOM 2183 O GLU B 45 78.188 23.944 -1.583 1.00 0.00 O ATOM 2184 CB GLU B 45 78.746 23.338 1.855 1.00 0.00 C ATOM 2185 CG GLU B 45 77.877 23.048 3.082 1.00 0.00 C ATOM 2186 CD GLU B 45 78.639 23.450 4.347 1.00 0.00 C ATOM 2187 OE1 GLU B 45 79.815 23.755 4.234 1.00 0.00 O ATOM 2188 OE2 GLU B 45 78.034 23.447 5.406 1.00 0.00 O ATOM 0 H GLU B 45 78.621 20.944 1.036 1.00 0.00 H new ATOM 0 HA GLU B 45 76.998 23.367 0.596 1.00 0.00 H new ATOM 0 HB2 GLU B 45 79.685 22.790 1.926 1.00 0.00 H new ATOM 0 HB3 GLU B 45 78.997 24.398 1.819 1.00 0.00 H new ATOM 0 HG2 GLU B 45 76.940 23.601 3.017 1.00 0.00 H new ATOM 0 HG3 GLU B 45 77.621 21.989 3.119 1.00 0.00 H new ATOM 2195 N GLU B 46 80.064 23.298 -0.638 1.00 0.00 N ATOM 2196 CA GLU B 46 80.866 23.763 -1.805 1.00 0.00 C ATOM 2197 C GLU B 46 82.271 23.154 -1.730 1.00 0.00 C ATOM 2198 O GLU B 46 83.086 23.567 -0.929 1.00 0.00 O ATOM 2199 CB GLU B 46 80.968 25.291 -1.770 1.00 0.00 C ATOM 2200 CG GLU B 46 81.656 25.799 -3.041 1.00 0.00 C ATOM 2201 CD GLU B 46 80.749 25.554 -4.247 1.00 0.00 C ATOM 2202 OE1 GLU B 46 79.558 25.380 -4.042 1.00 0.00 O ATOM 2203 OE2 GLU B 46 81.258 25.547 -5.355 1.00 0.00 O ATOM 0 H GLU B 46 80.603 22.882 0.122 1.00 0.00 H new ATOM 0 HA GLU B 46 80.384 23.451 -2.731 1.00 0.00 H new ATOM 0 HB2 GLU B 46 79.973 25.728 -1.685 1.00 0.00 H new ATOM 0 HB3 GLU B 46 81.531 25.606 -0.891 1.00 0.00 H new ATOM 0 HG2 GLU B 46 81.875 26.863 -2.948 1.00 0.00 H new ATOM 0 HG3 GLU B 46 82.609 25.288 -3.180 1.00 0.00 H new ATOM 2210 N ILE B 47 82.570 22.188 -2.565 1.00 0.00 N ATOM 2211 CA ILE B 47 83.935 21.570 -2.546 1.00 0.00 C ATOM 2212 C ILE B 47 84.777 22.179 -3.669 1.00 0.00 C ATOM 2213 O ILE B 47 84.602 21.863 -4.829 1.00 0.00 O ATOM 2214 CB ILE B 47 83.817 20.056 -2.756 1.00 0.00 C ATOM 2215 CG1 ILE B 47 83.016 19.446 -1.601 1.00 0.00 C ATOM 2216 CG2 ILE B 47 85.215 19.432 -2.797 1.00 0.00 C ATOM 2217 CD1 ILE B 47 82.681 17.986 -1.918 1.00 0.00 C ATOM 0 H ILE B 47 81.930 21.801 -3.258 1.00 0.00 H new ATOM 0 HA ILE B 47 84.411 21.763 -1.585 1.00 0.00 H new ATOM 0 HB ILE B 47 83.307 19.857 -3.699 1.00 0.00 H new ATOM 0 HG12 ILE B 47 83.591 19.505 -0.677 1.00 0.00 H new ATOM 0 HG13 ILE B 47 82.099 20.013 -1.443 1.00 0.00 H new ATOM 0 HG21 ILE B 47 85.129 18.356 -2.946 1.00 0.00 H new ATOM 0 HG22 ILE B 47 85.784 19.868 -3.618 1.00 0.00 H new ATOM 0 HG23 ILE B 47 85.729 19.628 -1.856 1.00 0.00 H new ATOM 0 HD11 ILE B 47 82.111 17.556 -1.094 1.00 0.00 H new ATOM 0 HD12 ILE B 47 82.089 17.939 -2.832 1.00 0.00 H new ATOM 0 HD13 ILE B 47 83.604 17.422 -2.054 1.00 0.00 H new ATOM 2229 N LYS B 48 85.691 23.057 -3.327 1.00 0.00 N ATOM 2230 CA LYS B 48 86.560 23.712 -4.359 1.00 0.00 C ATOM 2231 C LYS B 48 88.014 23.257 -4.182 1.00 0.00 C ATOM 2232 O LYS B 48 88.806 23.320 -5.102 1.00 0.00 O ATOM 2233 CB LYS B 48 86.470 25.237 -4.192 1.00 0.00 C ATOM 2234 CG LYS B 48 87.307 25.960 -5.282 1.00 0.00 C ATOM 2235 CD LYS B 48 88.638 26.454 -4.698 1.00 0.00 C ATOM 2236 CE LYS B 48 89.439 27.171 -5.787 1.00 0.00 C ATOM 2237 NZ LYS B 48 90.532 27.963 -5.156 1.00 0.00 N ATOM 0 H LYS B 48 85.874 23.351 -2.368 1.00 0.00 H new ATOM 0 HA LYS B 48 86.221 23.429 -5.356 1.00 0.00 H new ATOM 0 HB2 LYS B 48 85.429 25.554 -4.256 1.00 0.00 H new ATOM 0 HB3 LYS B 48 86.829 25.521 -3.203 1.00 0.00 H new ATOM 0 HG2 LYS B 48 87.497 25.281 -6.113 1.00 0.00 H new ATOM 0 HG3 LYS B 48 86.743 26.803 -5.682 1.00 0.00 H new ATOM 0 HD2 LYS B 48 88.452 27.130 -3.864 1.00 0.00 H new ATOM 0 HD3 LYS B 48 89.210 25.613 -4.306 1.00 0.00 H new ATOM 0 HE2 LYS B 48 89.857 26.445 -6.484 1.00 0.00 H new ATOM 0 HE3 LYS B 48 88.786 27.826 -6.363 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 91.078 28.451 -5.894 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 90.122 28.665 -4.507 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 91.160 27.326 -4.625 1.00 0.00 H new ATOM 2251 N GLU B 49 88.369 22.804 -3.003 1.00 0.00 N ATOM 2252 CA GLU B 49 89.775 22.342 -2.744 1.00 0.00 C ATOM 2253 C GLU B 49 89.796 20.828 -2.519 1.00 0.00 C ATOM 2254 O GLU B 49 88.957 20.279 -1.833 1.00 0.00 O ATOM 2255 CB GLU B 49 90.308 23.043 -1.492 1.00 0.00 C ATOM 2256 CG GLU B 49 90.545 24.524 -1.793 1.00 0.00 C ATOM 2257 CD GLU B 49 91.075 25.219 -0.537 1.00 0.00 C ATOM 2258 OE1 GLU B 49 91.053 24.598 0.512 1.00 0.00 O ATOM 2259 OE2 GLU B 49 91.494 26.360 -0.648 1.00 0.00 O ATOM 0 H GLU B 49 87.742 22.733 -2.202 1.00 0.00 H new ATOM 0 HA GLU B 49 90.398 22.585 -3.605 1.00 0.00 H new ATOM 0 HB2 GLU B 49 89.596 22.938 -0.673 1.00 0.00 H new ATOM 0 HB3 GLU B 49 91.237 22.574 -1.169 1.00 0.00 H new ATOM 0 HG2 GLU B 49 91.259 24.631 -2.610 1.00 0.00 H new ATOM 0 HG3 GLU B 49 89.616 24.994 -2.118 1.00 0.00 H new ATOM 2266 N GLN B 50 90.758 20.150 -3.088 1.00 0.00 N ATOM 2267 CA GLN B 50 90.843 18.672 -2.907 1.00 0.00 C ATOM 2268 C GLN B 50 91.050 18.347 -1.425 1.00 0.00 C ATOM 2269 O GLN B 50 90.650 17.306 -0.944 1.00 0.00 O ATOM 2270 CB GLN B 50 92.019 18.125 -3.722 1.00 0.00 C ATOM 2271 CG GLN B 50 93.333 18.717 -3.202 1.00 0.00 C ATOM 2272 CD GLN B 50 94.481 18.285 -4.116 1.00 0.00 C ATOM 2273 OE1 GLN B 50 94.353 18.305 -5.324 1.00 0.00 O ATOM 2274 NE2 GLN B 50 95.605 17.886 -3.585 1.00 0.00 N ATOM 0 H GLN B 50 91.489 20.557 -3.671 1.00 0.00 H new ATOM 0 HA GLN B 50 89.917 18.211 -3.251 1.00 0.00 H new ATOM 0 HB2 GLN B 50 92.047 17.038 -3.652 1.00 0.00 H new ATOM 0 HB3 GLN B 50 91.890 18.373 -4.775 1.00 0.00 H new ATOM 0 HG2 GLN B 50 93.268 19.805 -3.171 1.00 0.00 H new ATOM 0 HG3 GLN B 50 93.518 18.380 -2.182 1.00 0.00 H new ATOM 0 HE21 GLN B 50 95.712 17.869 -2.571 1.00 0.00 H new ATOM 0 HE22 GLN B 50 96.376 17.591 -4.184 1.00 0.00 H new ATOM 2283 N GLU B 51 91.692 19.224 -0.706 1.00 0.00 N ATOM 2284 CA GLU B 51 91.951 18.967 0.740 1.00 0.00 C ATOM 2285 C GLU B 51 90.629 18.681 1.453 1.00 0.00 C ATOM 2286 O GLU B 51 90.570 17.908 2.388 1.00 0.00 O ATOM 2287 CB GLU B 51 92.608 20.202 1.361 1.00 0.00 C ATOM 2288 CG GLU B 51 94.032 20.346 0.821 1.00 0.00 C ATOM 2289 CD GLU B 51 94.690 21.582 1.437 1.00 0.00 C ATOM 2290 OE1 GLU B 51 94.010 22.296 2.154 1.00 0.00 O ATOM 2291 OE2 GLU B 51 95.865 21.793 1.180 1.00 0.00 O ATOM 0 H GLU B 51 92.050 20.112 -1.058 1.00 0.00 H new ATOM 0 HA GLU B 51 92.612 18.107 0.846 1.00 0.00 H new ATOM 0 HB2 GLU B 51 92.026 21.094 1.126 1.00 0.00 H new ATOM 0 HB3 GLU B 51 92.627 20.110 2.447 1.00 0.00 H new ATOM 0 HG2 GLU B 51 94.614 19.455 1.058 1.00 0.00 H new ATOM 0 HG3 GLU B 51 94.013 20.435 -0.265 1.00 0.00 H new ATOM 2298 N VAL B 52 89.564 19.278 1.003 1.00 0.00 N ATOM 2299 CA VAL B 52 88.237 19.025 1.629 1.00 0.00 C ATOM 2300 C VAL B 52 87.797 17.596 1.292 1.00 0.00 C ATOM 2301 O VAL B 52 87.171 16.917 2.081 1.00 0.00 O ATOM 2302 CB VAL B 52 87.222 20.029 1.074 1.00 0.00 C ATOM 2303 CG1 VAL B 52 85.807 19.638 1.510 1.00 0.00 C ATOM 2304 CG2 VAL B 52 87.556 21.425 1.604 1.00 0.00 C ATOM 0 H VAL B 52 89.554 19.935 0.223 1.00 0.00 H new ATOM 0 HA VAL B 52 88.300 19.140 2.711 1.00 0.00 H new ATOM 0 HB VAL B 52 87.269 20.027 -0.015 1.00 0.00 H new ATOM 0 HG11 VAL B 52 85.092 20.357 1.111 1.00 0.00 H new ATOM 0 HG12 VAL B 52 85.571 18.643 1.131 1.00 0.00 H new ATOM 0 HG13 VAL B 52 85.750 19.635 2.598 1.00 0.00 H new ATOM 0 HG21 VAL B 52 86.837 22.145 1.212 1.00 0.00 H new ATOM 0 HG22 VAL B 52 87.510 21.421 2.693 1.00 0.00 H new ATOM 0 HG23 VAL B 52 88.560 21.705 1.285 1.00 0.00 H new ATOM 2314 N VAL B 53 88.131 17.143 0.115 1.00 0.00 N ATOM 2315 CA VAL B 53 87.748 15.763 -0.298 1.00 0.00 C ATOM 2316 C VAL B 53 88.547 14.744 0.520 1.00 0.00 C ATOM 2317 O VAL B 53 88.027 13.736 0.956 1.00 0.00 O ATOM 2318 CB VAL B 53 88.057 15.583 -1.789 1.00 0.00 C ATOM 2319 CG1 VAL B 53 87.897 14.112 -2.187 1.00 0.00 C ATOM 2320 CG2 VAL B 53 87.097 16.448 -2.610 1.00 0.00 C ATOM 0 H VAL B 53 88.655 17.672 -0.582 1.00 0.00 H new ATOM 0 HA VAL B 53 86.683 15.608 -0.123 1.00 0.00 H new ATOM 0 HB VAL B 53 89.085 15.889 -1.983 1.00 0.00 H new ATOM 0 HG11 VAL B 53 88.119 13.996 -3.248 1.00 0.00 H new ATOM 0 HG12 VAL B 53 88.585 13.500 -1.603 1.00 0.00 H new ATOM 0 HG13 VAL B 53 86.873 13.792 -1.993 1.00 0.00 H new ATOM 0 HG21 VAL B 53 87.312 16.324 -3.671 1.00 0.00 H new ATOM 0 HG22 VAL B 53 86.070 16.142 -2.410 1.00 0.00 H new ATOM 0 HG23 VAL B 53 87.224 17.495 -2.334 1.00 0.00 H new ATOM 2330 N ASP B 54 89.810 14.994 0.722 1.00 0.00 N ATOM 2331 CA ASP B 54 90.646 14.036 1.499 1.00 0.00 C ATOM 2332 C ASP B 54 90.078 13.879 2.911 1.00 0.00 C ATOM 2333 O ASP B 54 90.034 12.794 3.455 1.00 0.00 O ATOM 2334 CB ASP B 54 92.084 14.558 1.576 1.00 0.00 C ATOM 2335 CG ASP B 54 92.944 13.577 2.374 1.00 0.00 C ATOM 2336 OD1 ASP B 54 92.754 13.491 3.575 1.00 0.00 O ATOM 2337 OD2 ASP B 54 93.781 12.926 1.767 1.00 0.00 O ATOM 0 H ASP B 54 90.301 15.821 0.382 1.00 0.00 H new ATOM 0 HA ASP B 54 90.639 13.066 1.002 1.00 0.00 H new ATOM 0 HB2 ASP B 54 92.491 14.681 0.572 1.00 0.00 H new ATOM 0 HB3 ASP B 54 92.100 15.540 2.049 1.00 0.00 H new ATOM 2342 N LYS B 55 89.636 14.951 3.506 1.00 0.00 N ATOM 2343 CA LYS B 55 89.063 14.856 4.878 1.00 0.00 C ATOM 2344 C LYS B 55 87.848 13.929 4.854 1.00 0.00 C ATOM 2345 O LYS B 55 87.666 13.096 5.719 1.00 0.00 O ATOM 2346 CB LYS B 55 88.642 16.249 5.349 1.00 0.00 C ATOM 2347 CG LYS B 55 88.283 16.200 6.838 1.00 0.00 C ATOM 2348 CD LYS B 55 87.862 17.596 7.323 1.00 0.00 C ATOM 2349 CE LYS B 55 89.081 18.527 7.399 1.00 0.00 C ATOM 2350 NZ LYS B 55 88.761 19.692 8.269 1.00 0.00 N ATOM 0 H LYS B 55 89.646 15.888 3.103 1.00 0.00 H new ATOM 0 HA LYS B 55 89.810 14.455 5.563 1.00 0.00 H new ATOM 0 HB2 LYS B 55 89.451 16.960 5.183 1.00 0.00 H new ATOM 0 HB3 LYS B 55 87.787 16.597 4.769 1.00 0.00 H new ATOM 0 HG2 LYS B 55 87.473 15.489 7.002 1.00 0.00 H new ATOM 0 HG3 LYS B 55 89.138 15.848 7.415 1.00 0.00 H new ATOM 0 HD2 LYS B 55 87.119 18.015 6.645 1.00 0.00 H new ATOM 0 HD3 LYS B 55 87.392 17.521 8.304 1.00 0.00 H new ATOM 0 HE2 LYS B 55 89.940 17.987 7.797 1.00 0.00 H new ATOM 0 HE3 LYS B 55 89.354 18.869 6.401 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 89.586 20.323 8.321 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 87.953 20.211 7.871 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 88.521 19.357 9.224 1.00 0.00 H new ATOM 2364 N VAL B 56 87.013 14.081 3.868 1.00 0.00 N ATOM 2365 CA VAL B 56 85.801 13.221 3.777 1.00 0.00 C ATOM 2366 C VAL B 56 86.221 11.764 3.560 1.00 0.00 C ATOM 2367 O VAL B 56 85.640 10.851 4.111 1.00 0.00 O ATOM 2368 CB VAL B 56 84.927 13.695 2.609 1.00 0.00 C ATOM 2369 CG1 VAL B 56 83.764 12.722 2.399 1.00 0.00 C ATOM 2370 CG2 VAL B 56 84.373 15.087 2.925 1.00 0.00 C ATOM 0 H VAL B 56 87.117 14.765 3.119 1.00 0.00 H new ATOM 0 HA VAL B 56 85.231 13.292 4.703 1.00 0.00 H new ATOM 0 HB VAL B 56 85.530 13.734 1.702 1.00 0.00 H new ATOM 0 HG11 VAL B 56 83.148 13.065 1.568 1.00 0.00 H new ATOM 0 HG12 VAL B 56 84.156 11.730 2.175 1.00 0.00 H new ATOM 0 HG13 VAL B 56 83.159 12.677 3.305 1.00 0.00 H new ATOM 0 HG21 VAL B 56 83.751 15.428 2.097 1.00 0.00 H new ATOM 0 HG22 VAL B 56 83.774 15.042 3.834 1.00 0.00 H new ATOM 0 HG23 VAL B 56 85.199 15.783 3.069 1.00 0.00 H new ATOM 2380 N MET B 57 87.220 11.538 2.751 1.00 0.00 N ATOM 2381 CA MET B 57 87.672 10.140 2.488 1.00 0.00 C ATOM 2382 C MET B 57 88.131 9.467 3.782 1.00 0.00 C ATOM 2383 O MET B 57 87.849 8.309 4.020 1.00 0.00 O ATOM 2384 CB MET B 57 88.839 10.161 1.499 1.00 0.00 C ATOM 2385 CG MET B 57 88.340 10.585 0.117 1.00 0.00 C ATOM 2386 SD MET B 57 87.262 9.295 -0.569 1.00 0.00 S ATOM 2387 CE MET B 57 88.522 8.024 -0.865 1.00 0.00 C ATOM 0 H MET B 57 87.744 12.262 2.259 1.00 0.00 H new ATOM 0 HA MET B 57 86.835 9.578 2.074 1.00 0.00 H new ATOM 0 HB2 MET B 57 89.609 10.851 1.845 1.00 0.00 H new ATOM 0 HB3 MET B 57 89.298 9.174 1.443 1.00 0.00 H new ATOM 0 HG2 MET B 57 87.795 11.526 0.190 1.00 0.00 H new ATOM 0 HG3 MET B 57 89.186 10.757 -0.548 1.00 0.00 H new ATOM 0 HE1 MET B 57 88.429 7.649 -1.884 1.00 0.00 H new ATOM 0 HE2 MET B 57 89.513 8.455 -0.726 1.00 0.00 H new ATOM 0 HE3 MET B 57 88.382 7.202 -0.162 1.00 0.00 H new ATOM 2397 N GLU B 58 88.844 10.169 4.615 1.00 0.00 N ATOM 2398 CA GLU B 58 89.320 9.541 5.879 1.00 0.00 C ATOM 2399 C GLU B 58 88.116 9.085 6.702 1.00 0.00 C ATOM 2400 O GLU B 58 88.114 8.018 7.283 1.00 0.00 O ATOM 2401 CB GLU B 58 90.142 10.551 6.685 1.00 0.00 C ATOM 2402 CG GLU B 58 90.697 9.872 7.941 1.00 0.00 C ATOM 2403 CD GLU B 58 91.560 10.864 8.721 1.00 0.00 C ATOM 2404 OE1 GLU B 58 91.731 11.974 8.243 1.00 0.00 O ATOM 2405 OE2 GLU B 58 92.037 10.498 9.784 1.00 0.00 O ATOM 0 H GLU B 58 89.117 11.142 4.479 1.00 0.00 H new ATOM 0 HA GLU B 58 89.947 8.681 5.641 1.00 0.00 H new ATOM 0 HB2 GLU B 58 90.959 10.938 6.077 1.00 0.00 H new ATOM 0 HB3 GLU B 58 89.521 11.402 6.963 1.00 0.00 H new ATOM 0 HG2 GLU B 58 89.878 9.517 8.566 1.00 0.00 H new ATOM 0 HG3 GLU B 58 91.288 8.999 7.664 1.00 0.00 H new ATOM 2412 N THR B 59 87.089 9.884 6.752 1.00 0.00 N ATOM 2413 CA THR B 59 85.880 9.498 7.534 1.00 0.00 C ATOM 2414 C THR B 59 85.162 8.336 6.849 1.00 0.00 C ATOM 2415 O THR B 59 84.685 7.422 7.492 1.00 0.00 O ATOM 2416 CB THR B 59 84.929 10.694 7.619 1.00 0.00 C ATOM 2417 OG1 THR B 59 85.560 11.752 8.326 1.00 0.00 O ATOM 2418 CG2 THR B 59 83.643 10.279 8.337 1.00 0.00 C ATOM 0 H THR B 59 87.033 10.789 6.285 1.00 0.00 H new ATOM 0 HA THR B 59 86.186 9.193 8.535 1.00 0.00 H new ATOM 0 HB THR B 59 84.680 11.034 6.614 1.00 0.00 H new ATOM 0 HG1 THR B 59 84.952 12.519 8.379 1.00 0.00 H new ATOM 0 HG21 THR B 59 82.968 11.133 8.396 1.00 0.00 H new ATOM 0 HG22 THR B 59 83.161 9.473 7.784 1.00 0.00 H new ATOM 0 HG23 THR B 59 83.883 9.936 9.343 1.00 0.00 H new ATOM 2426 N LEU B 60 85.078 8.365 5.549 1.00 0.00 N ATOM 2427 CA LEU B 60 84.384 7.265 4.819 1.00 0.00 C ATOM 2428 C LEU B 60 85.239 5.996 4.837 1.00 0.00 C ATOM 2429 O LEU B 60 84.734 4.903 5.005 1.00 0.00 O ATOM 2430 CB LEU B 60 84.135 7.705 3.359 1.00 0.00 C ATOM 2431 CG LEU B 60 82.732 8.306 3.201 1.00 0.00 C ATOM 2432 CD1 LEU B 60 82.574 9.525 4.113 1.00 0.00 C ATOM 2433 CD2 LEU B 60 82.532 8.729 1.742 1.00 0.00 C ATOM 0 H LEU B 60 85.460 9.103 4.958 1.00 0.00 H new ATOM 0 HA LEU B 60 83.433 7.052 5.308 1.00 0.00 H new ATOM 0 HB2 LEU B 60 84.885 8.439 3.063 1.00 0.00 H new ATOM 0 HB3 LEU B 60 84.246 6.849 2.693 1.00 0.00 H new ATOM 0 HG LEU B 60 81.987 7.560 3.478 1.00 0.00 H new ATOM 0 HD11 LEU B 60 81.575 9.943 3.992 1.00 0.00 H new ATOM 0 HD12 LEU B 60 82.718 9.224 5.151 1.00 0.00 H new ATOM 0 HD13 LEU B 60 83.316 10.277 3.847 1.00 0.00 H new ATOM 0 HD21 LEU B 60 81.537 9.157 1.620 1.00 0.00 H new ATOM 0 HD22 LEU B 60 83.282 9.472 1.472 1.00 0.00 H new ATOM 0 HD23 LEU B 60 82.634 7.859 1.094 1.00 0.00 H new ATOM 2445 N ASP B 61 86.518 6.116 4.622 1.00 0.00 N ATOM 2446 CA ASP B 61 87.380 4.905 4.581 1.00 0.00 C ATOM 2447 C ASP B 61 87.430 4.231 5.951 1.00 0.00 C ATOM 2448 O ASP B 61 88.182 4.619 6.823 1.00 0.00 O ATOM 2449 CB ASP B 61 88.791 5.320 4.158 1.00 0.00 C ATOM 2450 CG ASP B 61 89.556 4.098 3.651 1.00 0.00 C ATOM 2451 OD1 ASP B 61 89.064 2.998 3.834 1.00 0.00 O ATOM 2452 OD2 ASP B 61 90.622 4.286 3.091 1.00 0.00 O ATOM 0 H ASP B 61 87.003 7.001 4.473 1.00 0.00 H new ATOM 0 HA ASP B 61 86.966 4.194 3.866 1.00 0.00 H new ATOM 0 HB2 ASP B 61 88.739 6.078 3.377 1.00 0.00 H new ATOM 0 HB3 ASP B 61 89.318 5.767 5.001 1.00 0.00 H new ATOM 2457 N GLU B 62 86.635 3.219 6.138 1.00 0.00 N ATOM 2458 CA GLU B 62 86.630 2.504 7.440 1.00 0.00 C ATOM 2459 C GLU B 62 88.017 1.917 7.718 1.00 0.00 C ATOM 2460 O GLU B 62 88.551 2.050 8.803 1.00 0.00 O ATOM 2461 CB GLU B 62 85.593 1.379 7.394 1.00 0.00 C ATOM 2462 CG GLU B 62 85.498 0.708 8.765 1.00 0.00 C ATOM 2463 CD GLU B 62 84.451 -0.406 8.714 1.00 0.00 C ATOM 2464 OE1 GLU B 62 83.833 -0.564 7.673 1.00 0.00 O ATOM 2465 OE2 GLU B 62 84.285 -1.081 9.715 1.00 0.00 O ATOM 0 H GLU B 62 85.985 2.854 5.441 1.00 0.00 H new ATOM 0 HA GLU B 62 86.376 3.203 8.236 1.00 0.00 H new ATOM 0 HB2 GLU B 62 84.621 1.779 7.106 1.00 0.00 H new ATOM 0 HB3 GLU B 62 85.872 0.645 6.638 1.00 0.00 H new ATOM 0 HG2 GLU B 62 86.467 0.298 9.050 1.00 0.00 H new ATOM 0 HG3 GLU B 62 85.227 1.442 9.524 1.00 0.00 H new ATOM 2472 N ASP B 63 88.594 1.243 6.756 1.00 0.00 N ATOM 2473 CA ASP B 63 89.935 0.614 6.969 1.00 0.00 C ATOM 2474 C ASP B 63 91.071 1.558 6.544 1.00 0.00 C ATOM 2475 O ASP B 63 92.232 1.247 6.718 1.00 0.00 O ATOM 2476 CB ASP B 63 90.014 -0.678 6.152 1.00 0.00 C ATOM 2477 CG ASP B 63 89.987 -0.350 4.660 1.00 0.00 C ATOM 2478 OD1 ASP B 63 89.836 0.815 4.331 1.00 0.00 O ATOM 2479 OD2 ASP B 63 90.111 -1.272 3.871 1.00 0.00 O ATOM 0 H ASP B 63 88.194 1.100 5.829 1.00 0.00 H new ATOM 0 HA ASP B 63 90.053 0.402 8.032 1.00 0.00 H new ATOM 0 HB2 ASP B 63 90.928 -1.219 6.398 1.00 0.00 H new ATOM 0 HB3 ASP B 63 89.179 -1.331 6.405 1.00 0.00 H new ATOM 2484 N GLY B 64 90.763 2.704 5.999 1.00 0.00 N ATOM 2485 CA GLY B 64 91.855 3.642 5.587 1.00 0.00 C ATOM 2486 C GLY B 64 92.603 3.091 4.363 1.00 0.00 C ATOM 2487 O GLY B 64 93.776 3.348 4.183 1.00 0.00 O ATOM 0 H GLY B 64 89.814 3.032 5.821 1.00 0.00 H new ATOM 0 HA2 GLY B 64 91.434 4.620 5.354 1.00 0.00 H new ATOM 0 HA3 GLY B 64 92.552 3.784 6.413 1.00 0.00 H new ATOM 2491 N ASP B 65 91.946 2.329 3.528 1.00 0.00 N ATOM 2492 CA ASP B 65 92.642 1.762 2.332 1.00 0.00 C ATOM 2493 C ASP B 65 92.938 2.867 1.308 1.00 0.00 C ATOM 2494 O ASP B 65 93.629 2.644 0.334 1.00 0.00 O ATOM 2495 CB ASP B 65 91.759 0.692 1.686 1.00 0.00 C ATOM 2496 CG ASP B 65 90.491 1.340 1.129 1.00 0.00 C ATOM 2497 OD1 ASP B 65 90.170 2.435 1.560 1.00 0.00 O ATOM 2498 OD2 ASP B 65 89.863 0.731 0.278 1.00 0.00 O ATOM 0 H ASP B 65 90.962 2.075 3.620 1.00 0.00 H new ATOM 0 HA ASP B 65 93.585 1.319 2.653 1.00 0.00 H new ATOM 0 HB2 ASP B 65 92.304 0.190 0.887 1.00 0.00 H new ATOM 0 HB3 ASP B 65 91.498 -0.070 2.420 1.00 0.00 H new ATOM 2503 N GLY B 66 92.448 4.059 1.524 1.00 0.00 N ATOM 2504 CA GLY B 66 92.735 5.173 0.566 1.00 0.00 C ATOM 2505 C GLY B 66 91.755 5.143 -0.614 1.00 0.00 C ATOM 2506 O GLY B 66 91.760 6.023 -1.452 1.00 0.00 O ATOM 0 H GLY B 66 91.862 4.312 2.320 1.00 0.00 H new ATOM 0 HA2 GLY B 66 92.661 6.130 1.082 1.00 0.00 H new ATOM 0 HA3 GLY B 66 93.757 5.088 0.198 1.00 0.00 H new ATOM 2510 N GLU B 67 90.917 4.145 -0.685 1.00 0.00 N ATOM 2511 CA GLU B 67 89.929 4.048 -1.804 1.00 0.00 C ATOM 2512 C GLU B 67 88.586 3.622 -1.214 1.00 0.00 C ATOM 2513 O GLU B 67 88.536 3.088 -0.124 1.00 0.00 O ATOM 2514 CB GLU B 67 90.388 2.994 -2.816 1.00 0.00 C ATOM 2515 CG GLU B 67 91.650 3.473 -3.533 1.00 0.00 C ATOM 2516 CD GLU B 67 92.159 2.362 -4.455 1.00 0.00 C ATOM 2517 OE1 GLU B 67 91.525 1.320 -4.497 1.00 0.00 O ATOM 2518 OE2 GLU B 67 93.170 2.571 -5.103 1.00 0.00 O ATOM 0 H GLU B 67 90.872 3.383 -0.009 1.00 0.00 H new ATOM 0 HA GLU B 67 89.843 5.010 -2.309 1.00 0.00 H new ATOM 0 HB2 GLU B 67 90.585 2.051 -2.307 1.00 0.00 H new ATOM 0 HB3 GLU B 67 89.597 2.806 -3.542 1.00 0.00 H new ATOM 0 HG2 GLU B 67 91.435 4.372 -4.111 1.00 0.00 H new ATOM 0 HG3 GLU B 67 92.417 3.738 -2.806 1.00 0.00 H new ATOM 2525 N CYS B 68 87.494 3.831 -1.915 1.00 0.00 N ATOM 2526 CA CYS B 68 86.162 3.409 -1.376 1.00 0.00 C ATOM 2527 C CYS B 68 85.723 2.129 -2.090 1.00 0.00 C ATOM 2528 O CYS B 68 85.368 2.139 -3.254 1.00 0.00 O ATOM 2529 CB CYS B 68 85.138 4.518 -1.627 1.00 0.00 C ATOM 2530 SG CYS B 68 85.477 5.910 -0.518 1.00 0.00 S ATOM 0 H CYS B 68 87.469 4.274 -2.833 1.00 0.00 H new ATOM 0 HA CYS B 68 86.234 3.225 -0.304 1.00 0.00 H new ATOM 0 HB2 CYS B 68 85.187 4.845 -2.665 1.00 0.00 H new ATOM 0 HB3 CYS B 68 84.129 4.142 -1.459 1.00 0.00 H new ATOM 0 HG CYS B 68 84.610 6.855 -0.730 1.00 0.00 H new ATOM 2536 N ASP B 69 85.781 1.022 -1.401 1.00 0.00 N ATOM 2537 CA ASP B 69 85.407 -0.283 -2.016 1.00 0.00 C ATOM 2538 C ASP B 69 83.904 -0.340 -2.300 1.00 0.00 C ATOM 2539 O ASP B 69 83.152 0.545 -1.950 1.00 0.00 O ATOM 2540 CB ASP B 69 85.780 -1.418 -1.061 1.00 0.00 C ATOM 2541 CG ASP B 69 87.303 -1.548 -0.983 1.00 0.00 C ATOM 2542 OD1 ASP B 69 87.964 -1.122 -1.917 1.00 0.00 O ATOM 2543 OD2 ASP B 69 87.783 -2.067 0.011 1.00 0.00 O ATOM 0 H ASP B 69 86.075 0.966 -0.426 1.00 0.00 H new ATOM 0 HA ASP B 69 85.946 -0.390 -2.958 1.00 0.00 H new ATOM 0 HB2 ASP B 69 85.371 -1.221 -0.070 1.00 0.00 H new ATOM 0 HB3 ASP B 69 85.343 -2.355 -1.406 1.00 0.00 H new ATOM 2548 N PHE B 70 83.477 -1.398 -2.931 1.00 0.00 N ATOM 2549 CA PHE B 70 82.030 -1.556 -3.251 1.00 0.00 C ATOM 2550 C PHE B 70 81.215 -1.556 -1.953 1.00 0.00 C ATOM 2551 O PHE B 70 80.238 -0.846 -1.820 1.00 0.00 O ATOM 2552 CB PHE B 70 81.825 -2.883 -3.987 1.00 0.00 C ATOM 2553 CG PHE B 70 80.361 -3.079 -4.304 1.00 0.00 C ATOM 2554 CD1 PHE B 70 79.528 -3.735 -3.388 1.00 0.00 C ATOM 2555 CD2 PHE B 70 79.837 -2.610 -5.512 1.00 0.00 C ATOM 2556 CE1 PHE B 70 78.173 -3.921 -3.683 1.00 0.00 C ATOM 2557 CE2 PHE B 70 78.481 -2.794 -5.808 1.00 0.00 C ATOM 2558 CZ PHE B 70 77.649 -3.449 -4.893 1.00 0.00 C ATOM 0 H PHE B 70 84.073 -2.166 -3.241 1.00 0.00 H new ATOM 0 HA PHE B 70 81.699 -0.731 -3.881 1.00 0.00 H new ATOM 0 HB2 PHE B 70 82.409 -2.891 -4.907 1.00 0.00 H new ATOM 0 HB3 PHE B 70 82.186 -3.708 -3.373 1.00 0.00 H new ATOM 0 HD1 PHE B 70 79.932 -4.097 -2.454 1.00 0.00 H new ATOM 0 HD2 PHE B 70 80.479 -2.105 -6.218 1.00 0.00 H new ATOM 0 HE1 PHE B 70 77.531 -4.428 -2.978 1.00 0.00 H new ATOM 0 HE2 PHE B 70 78.077 -2.431 -6.742 1.00 0.00 H new ATOM 0 HZ PHE B 70 76.603 -3.591 -5.120 1.00 0.00 H new ATOM 2568 N GLN B 71 81.602 -2.363 -1.008 1.00 0.00 N ATOM 2569 CA GLN B 71 80.836 -2.426 0.271 1.00 0.00 C ATOM 2570 C GLN B 71 80.840 -1.043 0.933 1.00 0.00 C ATOM 2571 O GLN B 71 79.801 -0.498 1.247 1.00 0.00 O ATOM 2572 CB GLN B 71 81.487 -3.460 1.196 1.00 0.00 C ATOM 2573 CG GLN B 71 80.697 -3.565 2.502 1.00 0.00 C ATOM 2574 CD GLN B 71 81.359 -4.600 3.413 1.00 0.00 C ATOM 2575 OE1 GLN B 71 82.043 -5.489 2.945 1.00 0.00 O ATOM 2576 NE2 GLN B 71 81.188 -4.521 4.704 1.00 0.00 N ATOM 0 H GLN B 71 82.412 -2.981 -1.062 1.00 0.00 H new ATOM 0 HA GLN B 71 79.805 -2.721 0.076 1.00 0.00 H new ATOM 0 HB2 GLN B 71 81.520 -4.431 0.703 1.00 0.00 H new ATOM 0 HB3 GLN B 71 82.517 -3.174 1.407 1.00 0.00 H new ATOM 0 HG2 GLN B 71 80.663 -2.595 2.999 1.00 0.00 H new ATOM 0 HG3 GLN B 71 79.666 -3.853 2.295 1.00 0.00 H new ATOM 0 HE21 GLN B 71 80.614 -3.775 5.098 1.00 0.00 H new ATOM 0 HE22 GLN B 71 81.628 -5.205 5.320 1.00 0.00 H new ATOM 2585 N GLU B 72 81.992 -0.462 1.137 1.00 0.00 N ATOM 2586 CA GLU B 72 82.033 0.893 1.765 1.00 0.00 C ATOM 2587 C GLU B 72 81.258 1.861 0.873 1.00 0.00 C ATOM 2588 O GLU B 72 80.442 2.636 1.327 1.00 0.00 O ATOM 2589 CB GLU B 72 83.488 1.354 1.870 1.00 0.00 C ATOM 2590 CG GLU B 72 84.218 0.518 2.923 1.00 0.00 C ATOM 2591 CD GLU B 72 85.685 0.946 2.983 1.00 0.00 C ATOM 2592 OE1 GLU B 72 86.089 1.732 2.141 1.00 0.00 O ATOM 2593 OE2 GLU B 72 86.383 0.480 3.869 1.00 0.00 O ATOM 0 H GLU B 72 82.900 -0.862 0.899 1.00 0.00 H new ATOM 0 HA GLU B 72 81.590 0.863 2.761 1.00 0.00 H new ATOM 0 HB2 GLU B 72 83.983 1.252 0.904 1.00 0.00 H new ATOM 0 HB3 GLU B 72 83.527 2.410 2.139 1.00 0.00 H new ATOM 0 HG2 GLU B 72 83.749 0.650 3.898 1.00 0.00 H new ATOM 0 HG3 GLU B 72 84.146 -0.541 2.676 1.00 0.00 H new ATOM 2600 N PHE B 73 81.543 1.825 -0.398 1.00 0.00 N ATOM 2601 CA PHE B 73 80.861 2.745 -1.352 1.00 0.00 C ATOM 2602 C PHE B 73 79.362 2.765 -1.046 1.00 0.00 C ATOM 2603 O PHE B 73 78.719 3.795 -1.091 1.00 0.00 O ATOM 2604 CB PHE B 73 81.081 2.264 -2.789 1.00 0.00 C ATOM 2605 CG PHE B 73 80.290 3.133 -3.736 1.00 0.00 C ATOM 2606 CD1 PHE B 73 78.976 2.786 -4.068 1.00 0.00 C ATOM 2607 CD2 PHE B 73 80.871 4.283 -4.278 1.00 0.00 C ATOM 2608 CE1 PHE B 73 78.240 3.593 -4.944 1.00 0.00 C ATOM 2609 CE2 PHE B 73 80.136 5.090 -5.156 1.00 0.00 C ATOM 2610 CZ PHE B 73 78.820 4.744 -5.489 1.00 0.00 C ATOM 0 H PHE B 73 82.224 1.194 -0.821 1.00 0.00 H new ATOM 0 HA PHE B 73 81.274 3.748 -1.245 1.00 0.00 H new ATOM 0 HB2 PHE B 73 82.141 2.305 -3.040 1.00 0.00 H new ATOM 0 HB3 PHE B 73 80.771 1.224 -2.887 1.00 0.00 H new ATOM 0 HD1 PHE B 73 78.530 1.896 -3.649 1.00 0.00 H new ATOM 0 HD2 PHE B 73 81.885 4.549 -4.020 1.00 0.00 H new ATOM 0 HE1 PHE B 73 77.225 3.327 -5.199 1.00 0.00 H new ATOM 0 HE2 PHE B 73 80.584 5.979 -5.576 1.00 0.00 H new ATOM 0 HZ PHE B 73 78.253 5.366 -6.166 1.00 0.00 H new ATOM 2620 N MET B 74 78.804 1.634 -0.721 1.00 0.00 N ATOM 2621 CA MET B 74 77.351 1.590 -0.401 1.00 0.00 C ATOM 2622 C MET B 74 77.099 2.266 0.960 1.00 0.00 C ATOM 2623 O MET B 74 76.008 2.716 1.244 1.00 0.00 O ATOM 2624 CB MET B 74 76.872 0.135 -0.373 1.00 0.00 C ATOM 2625 CG MET B 74 76.882 -0.424 -1.801 1.00 0.00 C ATOM 2626 SD MET B 74 76.059 -2.039 -1.839 1.00 0.00 S ATOM 2627 CE MET B 74 74.364 -1.466 -1.547 1.00 0.00 C ATOM 0 H MET B 74 79.290 0.739 -0.663 1.00 0.00 H new ATOM 0 HA MET B 74 76.793 2.127 -1.168 1.00 0.00 H new ATOM 0 HB2 MET B 74 77.520 -0.462 0.269 1.00 0.00 H new ATOM 0 HB3 MET B 74 75.867 0.078 0.046 1.00 0.00 H new ATOM 0 HG2 MET B 74 76.376 0.267 -2.475 1.00 0.00 H new ATOM 0 HG3 MET B 74 77.908 -0.521 -2.155 1.00 0.00 H new ATOM 0 HE1 MET B 74 73.659 -2.198 -1.942 1.00 0.00 H new ATOM 0 HE2 MET B 74 74.200 -1.345 -0.476 1.00 0.00 H new ATOM 0 HE3 MET B 74 74.212 -0.510 -2.047 1.00 0.00 H new ATOM 2637 N ALA B 75 78.102 2.358 1.801 1.00 0.00 N ATOM 2638 CA ALA B 75 77.902 3.026 3.129 1.00 0.00 C ATOM 2639 C ALA B 75 77.519 4.487 2.889 1.00 0.00 C ATOM 2640 O ALA B 75 76.469 4.947 3.289 1.00 0.00 O ATOM 2641 CB ALA B 75 79.205 2.980 3.932 1.00 0.00 C ATOM 0 H ALA B 75 79.043 2.003 1.629 1.00 0.00 H new ATOM 0 HA ALA B 75 77.117 2.512 3.683 1.00 0.00 H new ATOM 0 HB1 ALA B 75 79.056 3.466 4.896 1.00 0.00 H new ATOM 0 HB2 ALA B 75 79.498 1.942 4.091 1.00 0.00 H new ATOM 0 HB3 ALA B 75 79.990 3.499 3.382 1.00 0.00 H new ATOM 2647 N PHE B 76 78.381 5.210 2.234 1.00 0.00 N ATOM 2648 CA PHE B 76 78.102 6.646 1.949 1.00 0.00 C ATOM 2649 C PHE B 76 76.719 6.749 1.313 1.00 0.00 C ATOM 2650 O PHE B 76 75.941 7.628 1.624 1.00 0.00 O ATOM 2651 CB PHE B 76 79.160 7.185 0.986 1.00 0.00 C ATOM 2652 CG PHE B 76 78.836 8.612 0.599 1.00 0.00 C ATOM 2653 CD1 PHE B 76 79.088 9.655 1.497 1.00 0.00 C ATOM 2654 CD2 PHE B 76 78.292 8.891 -0.662 1.00 0.00 C ATOM 2655 CE1 PHE B 76 78.798 10.977 1.135 1.00 0.00 C ATOM 2656 CE2 PHE B 76 78.004 10.212 -1.024 1.00 0.00 C ATOM 2657 CZ PHE B 76 78.258 11.255 -0.125 1.00 0.00 C ATOM 0 H PHE B 76 79.274 4.867 1.881 1.00 0.00 H new ATOM 0 HA PHE B 76 78.131 7.230 2.869 1.00 0.00 H new ATOM 0 HB2 PHE B 76 80.144 7.142 1.454 1.00 0.00 H new ATOM 0 HB3 PHE B 76 79.203 6.560 0.094 1.00 0.00 H new ATOM 0 HD1 PHE B 76 79.506 9.441 2.469 1.00 0.00 H new ATOM 0 HD2 PHE B 76 78.095 8.086 -1.355 1.00 0.00 H new ATOM 0 HE1 PHE B 76 78.991 11.782 1.829 1.00 0.00 H new ATOM 0 HE2 PHE B 76 77.586 10.427 -1.996 1.00 0.00 H new ATOM 0 HZ PHE B 76 78.037 12.274 -0.405 1.00 0.00 H new ATOM 2667 N VAL B 77 76.399 5.832 0.450 1.00 0.00 N ATOM 2668 CA VAL B 77 75.054 5.856 -0.175 1.00 0.00 C ATOM 2669 C VAL B 77 74.011 5.735 0.944 1.00 0.00 C ATOM 2670 O VAL B 77 73.037 6.460 0.978 1.00 0.00 O ATOM 2671 CB VAL B 77 74.923 4.693 -1.160 1.00 0.00 C ATOM 2672 CG1 VAL B 77 73.470 4.561 -1.618 1.00 0.00 C ATOM 2673 CG2 VAL B 77 75.814 4.961 -2.375 1.00 0.00 C ATOM 0 H VAL B 77 77.008 5.070 0.151 1.00 0.00 H new ATOM 0 HA VAL B 77 74.900 6.784 -0.725 1.00 0.00 H new ATOM 0 HB VAL B 77 75.230 3.769 -0.671 1.00 0.00 H new ATOM 0 HG11 VAL B 77 73.384 3.731 -2.319 1.00 0.00 H new ATOM 0 HG12 VAL B 77 72.832 4.374 -0.754 1.00 0.00 H new ATOM 0 HG13 VAL B 77 73.158 5.483 -2.107 1.00 0.00 H new ATOM 0 HG21 VAL B 77 75.725 4.135 -3.081 1.00 0.00 H new ATOM 0 HG22 VAL B 77 75.502 5.887 -2.858 1.00 0.00 H new ATOM 0 HG23 VAL B 77 76.851 5.052 -2.053 1.00 0.00 H new ATOM 2683 N SER B 78 74.214 4.822 1.863 1.00 0.00 N ATOM 2684 CA SER B 78 73.240 4.654 2.984 1.00 0.00 C ATOM 2685 C SER B 78 73.251 5.893 3.883 1.00 0.00 C ATOM 2686 O SER B 78 72.219 6.378 4.302 1.00 0.00 O ATOM 2687 CB SER B 78 73.629 3.437 3.824 1.00 0.00 C ATOM 2688 OG SER B 78 74.823 3.727 4.542 1.00 0.00 O ATOM 0 H SER B 78 75.012 4.187 1.884 1.00 0.00 H new ATOM 0 HA SER B 78 72.244 4.517 2.563 1.00 0.00 H new ATOM 0 HB2 SER B 78 72.826 3.186 4.517 1.00 0.00 H new ATOM 0 HB3 SER B 78 73.778 2.569 3.182 1.00 0.00 H new ATOM 0 HG SER B 78 75.504 4.063 3.922 1.00 0.00 H new ATOM 2694 N MET B 79 74.414 6.384 4.214 1.00 0.00 N ATOM 2695 CA MET B 79 74.495 7.565 5.125 1.00 0.00 C ATOM 2696 C MET B 79 73.764 8.745 4.496 1.00 0.00 C ATOM 2697 O MET B 79 73.018 9.445 5.151 1.00 0.00 O ATOM 2698 CB MET B 79 75.966 7.929 5.344 1.00 0.00 C ATOM 2699 CG MET B 79 76.072 9.108 6.314 1.00 0.00 C ATOM 2700 SD MET B 79 77.819 9.476 6.615 1.00 0.00 S ATOM 2701 CE MET B 79 77.570 10.947 7.637 1.00 0.00 C ATOM 0 H MET B 79 75.312 6.020 3.894 1.00 0.00 H new ATOM 0 HA MET B 79 74.031 7.324 6.081 1.00 0.00 H new ATOM 0 HB2 MET B 79 76.507 7.070 5.741 1.00 0.00 H new ATOM 0 HB3 MET B 79 76.431 8.187 4.393 1.00 0.00 H new ATOM 0 HG2 MET B 79 75.570 9.982 5.899 1.00 0.00 H new ATOM 0 HG3 MET B 79 75.572 8.869 7.252 1.00 0.00 H new ATOM 0 HE1 MET B 79 78.537 11.347 7.941 1.00 0.00 H new ATOM 0 HE2 MET B 79 77.029 11.701 7.064 1.00 0.00 H new ATOM 0 HE3 MET B 79 76.993 10.681 8.523 1.00 0.00 H new ATOM 2711 N VAL B 80 73.939 8.955 3.228 1.00 0.00 N ATOM 2712 CA VAL B 80 73.215 10.071 2.566 1.00 0.00 C ATOM 2713 C VAL B 80 71.726 9.719 2.566 1.00 0.00 C ATOM 2714 O VAL B 80 70.871 10.573 2.683 1.00 0.00 O ATOM 2715 CB VAL B 80 73.722 10.247 1.131 1.00 0.00 C ATOM 2716 CG1 VAL B 80 72.841 11.264 0.393 1.00 0.00 C ATOM 2717 CG2 VAL B 80 75.162 10.763 1.164 1.00 0.00 C ATOM 0 H VAL B 80 74.549 8.407 2.621 1.00 0.00 H new ATOM 0 HA VAL B 80 73.383 11.008 3.097 1.00 0.00 H new ATOM 0 HB VAL B 80 73.683 9.288 0.614 1.00 0.00 H new ATOM 0 HG11 VAL B 80 73.204 11.387 -0.627 1.00 0.00 H new ATOM 0 HG12 VAL B 80 71.812 10.906 0.371 1.00 0.00 H new ATOM 0 HG13 VAL B 80 72.881 12.223 0.910 1.00 0.00 H new ATOM 0 HG21 VAL B 80 75.527 10.890 0.145 1.00 0.00 H new ATOM 0 HG22 VAL B 80 75.193 11.721 1.682 1.00 0.00 H new ATOM 0 HG23 VAL B 80 75.793 10.046 1.689 1.00 0.00 H new ATOM 2727 N THR B 81 71.422 8.452 2.458 1.00 0.00 N ATOM 2728 CA THR B 81 69.996 8.022 2.476 1.00 0.00 C ATOM 2729 C THR B 81 69.432 8.221 3.885 1.00 0.00 C ATOM 2730 O THR B 81 68.318 8.674 4.059 1.00 0.00 O ATOM 2731 CB THR B 81 69.894 6.544 2.095 1.00 0.00 C ATOM 2732 OG1 THR B 81 70.424 6.353 0.790 1.00 0.00 O ATOM 2733 CG2 THR B 81 68.427 6.108 2.121 1.00 0.00 C ATOM 0 H THR B 81 72.101 7.698 2.358 1.00 0.00 H new ATOM 0 HA THR B 81 69.429 8.617 1.760 1.00 0.00 H new ATOM 0 HB THR B 81 70.461 5.946 2.808 1.00 0.00 H new ATOM 0 HG1 THR B 81 71.398 6.262 0.843 1.00 0.00 H new ATOM 0 HG21 THR B 81 68.356 5.055 1.849 1.00 0.00 H new ATOM 0 HG22 THR B 81 68.022 6.253 3.123 1.00 0.00 H new ATOM 0 HG23 THR B 81 67.857 6.706 1.410 1.00 0.00 H new ATOM 2741 N THR B 82 70.197 7.895 4.897 1.00 0.00 N ATOM 2742 CA THR B 82 69.699 8.077 6.290 1.00 0.00 C ATOM 2743 C THR B 82 69.500 9.575 6.532 1.00 0.00 C ATOM 2744 O THR B 82 68.435 10.018 6.913 1.00 0.00 O ATOM 2745 CB THR B 82 70.739 7.519 7.279 1.00 0.00 C ATOM 2746 OG1 THR B 82 71.179 6.245 6.831 1.00 0.00 O ATOM 2747 CG2 THR B 82 70.128 7.372 8.680 1.00 0.00 C ATOM 0 H THR B 82 71.139 7.513 4.817 1.00 0.00 H new ATOM 0 HA THR B 82 68.757 7.548 6.434 1.00 0.00 H new ATOM 0 HB THR B 82 71.579 8.212 7.329 1.00 0.00 H new ATOM 0 HG1 THR B 82 71.685 6.348 5.998 1.00 0.00 H new ATOM 0 HG21 THR B 82 70.878 6.976 9.364 1.00 0.00 H new ATOM 0 HG22 THR B 82 69.791 8.346 9.034 1.00 0.00 H new ATOM 0 HG23 THR B 82 69.280 6.689 8.637 1.00 0.00 H new ATOM 2755 N ALA B 83 70.536 10.349 6.331 1.00 0.00 N ATOM 2756 CA ALA B 83 70.442 11.822 6.563 1.00 0.00 C ATOM 2757 C ALA B 83 69.127 12.350 5.988 1.00 0.00 C ATOM 2758 O ALA B 83 68.484 13.203 6.568 1.00 0.00 O ATOM 2759 CB ALA B 83 71.617 12.522 5.878 1.00 0.00 C ATOM 0 H ALA B 83 71.449 10.022 6.014 1.00 0.00 H new ATOM 0 HA ALA B 83 70.474 12.022 7.634 1.00 0.00 H new ATOM 0 HB1 ALA B 83 71.549 13.597 6.047 1.00 0.00 H new ATOM 0 HB2 ALA B 83 72.554 12.148 6.291 1.00 0.00 H new ATOM 0 HB3 ALA B 83 71.587 12.320 4.807 1.00 0.00 H new ATOM 2765 N CYS B 84 68.710 11.835 4.867 1.00 0.00 N ATOM 2766 CA CYS B 84 67.422 12.295 4.277 1.00 0.00 C ATOM 2767 C CYS B 84 66.281 11.615 5.038 1.00 0.00 C ATOM 2768 O CYS B 84 65.300 11.182 4.465 1.00 0.00 O ATOM 2769 CB CYS B 84 67.365 11.903 2.800 1.00 0.00 C ATOM 2770 SG CYS B 84 65.898 12.641 2.037 1.00 0.00 S ATOM 0 H CYS B 84 69.203 11.118 4.335 1.00 0.00 H new ATOM 0 HA CYS B 84 67.334 13.379 4.355 1.00 0.00 H new ATOM 0 HB2 CYS B 84 68.265 12.243 2.287 1.00 0.00 H new ATOM 0 HB3 CYS B 84 67.333 10.818 2.701 1.00 0.00 H new ATOM 0 HG CYS B 84 64.849 12.358 2.750 1.00 0.00 H new ATOM 2776 N HIS B 85 66.424 11.509 6.330 1.00 0.00 N ATOM 2777 CA HIS B 85 65.383 10.849 7.167 1.00 0.00 C ATOM 2778 C HIS B 85 64.047 11.588 7.028 1.00 0.00 C ATOM 2779 O HIS B 85 62.995 10.982 6.978 1.00 0.00 O ATOM 2780 CB HIS B 85 65.827 10.873 8.632 1.00 0.00 C ATOM 2781 CG HIS B 85 64.810 10.162 9.480 1.00 0.00 C ATOM 2782 ND1 HIS B 85 64.843 8.788 9.675 1.00 0.00 N ATOM 2783 CD2 HIS B 85 63.725 10.614 10.190 1.00 0.00 C ATOM 2784 CE1 HIS B 85 63.808 8.465 10.472 1.00 0.00 C ATOM 2785 NE2 HIS B 85 63.097 9.540 10.813 1.00 0.00 N ATOM 0 H HIS B 85 67.230 11.857 6.849 1.00 0.00 H new ATOM 0 HA HIS B 85 65.255 9.819 6.834 1.00 0.00 H new ATOM 0 HB2 HIS B 85 66.800 10.393 8.735 1.00 0.00 H new ATOM 0 HB3 HIS B 85 65.942 11.903 8.971 1.00 0.00 H new ATOM 0 HD2 HIS B 85 63.408 11.644 10.255 1.00 0.00 H new ATOM 0 HE1 HIS B 85 63.581 7.460 10.795 1.00 0.00 H new ATOM 0 HE2 HIS B 85 62.267 9.569 11.406 1.00 0.00 H new ATOM 2794 N GLU B 86 64.077 12.893 6.984 1.00 0.00 N ATOM 2795 CA GLU B 86 62.805 13.663 6.871 1.00 0.00 C ATOM 2796 C GLU B 86 61.963 13.095 5.729 1.00 0.00 C ATOM 2797 O GLU B 86 62.452 12.855 4.643 1.00 0.00 O ATOM 2798 CB GLU B 86 63.127 15.130 6.578 1.00 0.00 C ATOM 2799 CG GLU B 86 63.828 15.751 7.786 1.00 0.00 C ATOM 2800 CD GLU B 86 64.201 17.200 7.468 1.00 0.00 C ATOM 2801 OE1 GLU B 86 65.284 17.409 6.944 1.00 0.00 O ATOM 2802 OE2 GLU B 86 63.399 18.074 7.750 1.00 0.00 O ATOM 0 H GLU B 86 64.925 13.458 7.021 1.00 0.00 H new ATOM 0 HA GLU B 86 62.250 13.586 7.806 1.00 0.00 H new ATOM 0 HB2 GLU B 86 63.764 15.204 5.697 1.00 0.00 H new ATOM 0 HB3 GLU B 86 62.211 15.677 6.356 1.00 0.00 H new ATOM 0 HG2 GLU B 86 63.174 15.715 8.658 1.00 0.00 H new ATOM 0 HG3 GLU B 86 64.722 15.180 8.035 1.00 0.00 H new ATOM 2809 N PHE B 87 60.699 12.875 5.969 1.00 0.00 N ATOM 2810 CA PHE B 87 59.826 12.317 4.901 1.00 0.00 C ATOM 2811 C PHE B 87 59.531 13.399 3.863 1.00 0.00 C ATOM 2812 O PHE B 87 59.166 14.509 4.195 1.00 0.00 O ATOM 2813 CB PHE B 87 58.513 11.827 5.512 1.00 0.00 C ATOM 2814 CG PHE B 87 57.720 11.106 4.453 1.00 0.00 C ATOM 2815 CD1 PHE B 87 57.929 9.739 4.238 1.00 0.00 C ATOM 2816 CD2 PHE B 87 56.780 11.800 3.684 1.00 0.00 C ATOM 2817 CE1 PHE B 87 57.200 9.067 3.253 1.00 0.00 C ATOM 2818 CE2 PHE B 87 56.049 11.128 2.698 1.00 0.00 C ATOM 2819 CZ PHE B 87 56.260 9.761 2.481 1.00 0.00 C ATOM 0 H PHE B 87 60.235 13.058 6.859 1.00 0.00 H new ATOM 0 HA PHE B 87 60.336 11.482 4.421 1.00 0.00 H new ATOM 0 HB2 PHE B 87 58.713 11.161 6.351 1.00 0.00 H new ATOM 0 HB3 PHE B 87 57.942 12.669 5.903 1.00 0.00 H new ATOM 0 HD1 PHE B 87 58.654 9.203 4.833 1.00 0.00 H new ATOM 0 HD2 PHE B 87 56.618 12.855 3.851 1.00 0.00 H new ATOM 0 HE1 PHE B 87 57.362 8.012 3.087 1.00 0.00 H new ATOM 0 HE2 PHE B 87 55.323 11.663 2.105 1.00 0.00 H new ATOM 0 HZ PHE B 87 55.698 9.242 1.719 1.00 0.00 H new ATOM 2829 N PHE B 88 59.706 13.091 2.609 1.00 0.00 N ATOM 2830 CA PHE B 88 59.455 14.108 1.550 1.00 0.00 C ATOM 2831 C PHE B 88 57.994 14.567 1.622 1.00 0.00 C ATOM 2832 O PHE B 88 57.088 13.770 1.746 1.00 0.00 O ATOM 2833 CB PHE B 88 59.741 13.481 0.180 1.00 0.00 C ATOM 2834 CG PHE B 88 59.924 14.571 -0.848 1.00 0.00 C ATOM 2835 CD1 PHE B 88 61.152 15.235 -0.941 1.00 0.00 C ATOM 2836 CD2 PHE B 88 58.872 14.920 -1.701 1.00 0.00 C ATOM 2837 CE1 PHE B 88 61.327 16.251 -1.889 1.00 0.00 C ATOM 2838 CE2 PHE B 88 59.047 15.936 -2.649 1.00 0.00 C ATOM 2839 CZ PHE B 88 60.274 16.602 -2.742 1.00 0.00 C ATOM 0 H PHE B 88 60.012 12.179 2.271 1.00 0.00 H new ATOM 0 HA PHE B 88 60.106 14.970 1.697 1.00 0.00 H new ATOM 0 HB2 PHE B 88 60.637 12.862 0.232 1.00 0.00 H new ATOM 0 HB3 PHE B 88 58.919 12.827 -0.111 1.00 0.00 H new ATOM 0 HD1 PHE B 88 61.964 14.964 -0.282 1.00 0.00 H new ATOM 0 HD2 PHE B 88 57.925 14.406 -1.629 1.00 0.00 H new ATOM 0 HE1 PHE B 88 62.275 16.764 -1.962 1.00 0.00 H new ATOM 0 HE2 PHE B 88 58.235 16.205 -3.308 1.00 0.00 H new ATOM 0 HZ PHE B 88 60.409 17.387 -3.472 1.00 0.00 H new ATOM 2849 N GLU B 89 57.766 15.852 1.553 1.00 0.00 N ATOM 2850 CA GLU B 89 56.367 16.366 1.629 1.00 0.00 C ATOM 2851 C GLU B 89 55.546 15.787 0.476 1.00 0.00 C ATOM 2852 O GLU B 89 54.398 15.423 0.637 1.00 0.00 O ATOM 2853 CB GLU B 89 56.383 17.894 1.521 1.00 0.00 C ATOM 2854 CG GLU B 89 57.001 18.490 2.788 1.00 0.00 C ATOM 2855 CD GLU B 89 57.016 20.016 2.678 1.00 0.00 C ATOM 2856 OE1 GLU B 89 57.982 20.543 2.151 1.00 0.00 O ATOM 2857 OE2 GLU B 89 56.061 20.632 3.122 1.00 0.00 O ATOM 0 H GLU B 89 58.486 16.566 1.448 1.00 0.00 H new ATOM 0 HA GLU B 89 55.921 16.068 2.578 1.00 0.00 H new ATOM 0 HB2 GLU B 89 56.955 18.201 0.646 1.00 0.00 H new ATOM 0 HB3 GLU B 89 55.369 18.270 1.387 1.00 0.00 H new ATOM 0 HG2 GLU B 89 56.429 18.183 3.664 1.00 0.00 H new ATOM 0 HG3 GLU B 89 58.015 18.114 2.922 1.00 0.00 H new ATOM 2864 N HIS B 90 56.128 15.696 -0.684 1.00 0.00 N ATOM 2865 CA HIS B 90 55.389 15.141 -1.853 1.00 0.00 C ATOM 2866 C HIS B 90 54.063 15.885 -2.009 1.00 0.00 C ATOM 2867 O HIS B 90 53.138 15.408 -2.636 1.00 0.00 O ATOM 2868 CB HIS B 90 55.114 13.655 -1.613 1.00 0.00 C ATOM 2869 CG HIS B 90 54.766 12.984 -2.915 1.00 0.00 C ATOM 2870 ND1 HIS B 90 53.459 12.677 -3.266 1.00 0.00 N ATOM 2871 CD2 HIS B 90 55.547 12.557 -3.962 1.00 0.00 C ATOM 2872 CE1 HIS B 90 53.491 12.092 -4.477 1.00 0.00 C ATOM 2873 NE2 HIS B 90 54.738 11.996 -4.944 1.00 0.00 N ATOM 0 H HIS B 90 57.088 15.983 -0.876 1.00 0.00 H new ATOM 0 HA HIS B 90 55.984 15.262 -2.758 1.00 0.00 H new ATOM 0 HB2 HIS B 90 55.990 13.180 -1.172 1.00 0.00 H new ATOM 0 HB3 HIS B 90 54.296 13.537 -0.903 1.00 0.00 H new ATOM 0 HD2 HIS B 90 56.622 12.644 -4.014 1.00 0.00 H new ATOM 0 HE1 HIS B 90 52.616 11.743 -5.006 1.00 0.00 H new ATOM 0 HE2 HIS B 90 55.035 11.595 -5.834 1.00 0.00 H new ATOM 2882 N GLU B 91 53.966 17.051 -1.440 1.00 0.00 N ATOM 2883 CA GLU B 91 52.703 17.839 -1.547 1.00 0.00 C ATOM 2884 C GLU B 91 52.699 18.630 -2.857 1.00 0.00 C ATOM 2885 O GLU B 91 51.836 18.369 -3.678 1.00 0.00 O ATOM 2886 CB GLU B 91 52.596 18.806 -0.363 1.00 0.00 C ATOM 2887 CG GLU B 91 52.283 18.017 0.911 1.00 0.00 C ATOM 2888 CD GLU B 91 52.174 18.978 2.097 1.00 0.00 C ATOM 2889 OE1 GLU B 91 52.412 20.158 1.902 1.00 0.00 O ATOM 2890 OE2 GLU B 91 51.859 18.515 3.181 1.00 0.00 O ATOM 2891 OXT GLU B 91 53.557 19.483 -3.015 1.00 0.00 O ATOM 0 H GLU B 91 54.709 17.497 -0.902 1.00 0.00 H new ATOM 0 HA GLU B 91 51.852 17.158 -1.534 1.00 0.00 H new ATOM 0 HB2 GLU B 91 53.529 19.356 -0.243 1.00 0.00 H new ATOM 0 HB3 GLU B 91 51.814 19.542 -0.550 1.00 0.00 H new ATOM 0 HG2 GLU B 91 51.350 17.466 0.790 1.00 0.00 H new ATOM 0 HG3 GLU B 91 53.066 17.282 1.097 1.00 0.00 H new TER 2898 GLU B 91 HETATM 2899 CA CA A 101 58.595 -1.853 12.680 1.00 0.00 CA HETATM 2900 CA CA B 102 86.593 2.522 -11.134 1.00 0.00 CA HETATM 2901 CA CA A 103 71.351 -5.293 15.748 1.00 0.00 CA HETATM 2902 CA CA B 104 88.283 1.633 2.251 1.00 0.00 CA