USER MOD reduce.3.24.130724 H: found=0, std=0, add=1050, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1048 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 103 THR OG1 : rot -106:sc= 0.447 USER MOD Set 1.2: A 127 CYS SG : rot 144:sc= -3.13! USER MOD Set 2.1: A 105 THR OG1 : rot 140:sc= 0.972 USER MOD Set 2.2: A 108 THR OG1 : rot -35:sc= -1.72! USER MOD Set 3.1: A 25 LYS NZ :NH3+ -139:sc= -0.26 (180deg=-2.64!) USER MOD Set 3.2: A 107 LYS NZ :NH3+ -161:sc= 0 (180deg=0) USER MOD Set 4.1: A 24 TYR OH : rot 30:sc= 0.832 USER MOD Set 4.2: A 104 LYS NZ :NH3+ -131:sc= 0.802 (180deg=-0.565) USER MOD Set 5.1: A 6 TYR OH : rot -10:sc= -1.97! USER MOD Set 5.2: A 133 HIS :FLIP no HD1:sc= -3.71! C(o=-7.2!,f=-5.7!) USER MOD Single : A 1 ALA N :NH3+ 168:sc= -0.0424 (180deg=-0.235) USER MOD Single : A 4 ASN : amide:sc= -1.84 K(o=-1.8,f=-6.1!) USER MOD Single : A 9 ASN : amide:sc= -10.2! C(o=-10!,f=-10!) USER MOD Single : A 11 MET CE :methyl -115:sc= -0.479 (180deg=-2.35!) USER MOD Single : A 15 THR OG1 : rot 83:sc= 0.0309 USER MOD Single : A 16 CYS SG : rot -99:sc= -5.01! USER MOD Single : A 17 GLN : amide:sc= -2.08 K(o=-2.1,f=-3.3!) USER MOD Single : A 27 SER OG : rot 35:sc= 0.195 USER MOD Single : A 29 SER OG : rot 81:sc= 0.00899 USER MOD Single : A 37 LYS NZ :NH3+ -165:sc= -0.0158 (180deg=-0.283) USER MOD Single : A 38 THR OG1 : rot 32:sc= 0.627 USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=-0.0086) USER MOD Single : A 43 THR OG1 : rot 180:sc= -1.81 USER MOD Single : A 53 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.00487) USER MOD Single : A 56 SER OG : rot -36:sc= 0.206 USER MOD Single : A 57 SER OG : rot 176:sc= -1.29 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -4.08! C(o=-4.1!,f=-6.4!) USER MOD Single : A 64 THR OG1 : rot 37:sc= -2.94! USER MOD Single : A 68 GLN :FLIP amide:sc= -2.57 F(o=-5.3!,f=-2.6) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 CYS SG : rot -60:sc= -8.57! USER MOD Single : A 71 SER OG : rot 49:sc= -3.22! USER MOD Single : A 76 SER OG : rot 140:sc= -2.28! USER MOD Single : A 79 GLN : amide:sc= -0.716 X(o=-0.72,f=-0.47) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 85 MET CE :methyl -135:sc= -3.9! (180deg=-8.22!) USER MOD Single : A 89 THR OG1 : rot 62:sc= -1.57! USER MOD Single : A 90 LYS NZ :NH3+ -139:sc= 0 (180deg=-0.179) USER MOD Single : A 91 SER OG : rot 147:sc= -1.82 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= -4.42! C(o=-4.4!,f=-9.9!) USER MOD Single : A 101 THR OG1 : rot -100:sc=-0.00803 USER MOD Single : A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 HIS : no HD1:sc= -0.177 X(o=-0.18,f=-0.041) USER MOD Single : A 124 ASN : amide:sc= -2.12 K(o=-2.1,f=-3.1!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 LYS NZ :NH3+ -165:sc= -2.29 (180deg=-2.93) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 MET CE :methyl -139:sc= -4.91 (180deg=-8.99!) USER MOD Single : A 132 SER OG : rot 38:sc= 1 USER MOD Single : A 137 SER OG : rot 92:sc= 0.167 USER MOD Single : A 138 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -20.709 15.050 4.303 1.00 0.00 N ATOM 2 CA ALA A 1 -21.053 16.280 3.535 1.00 0.00 C ATOM 3 C ALA A 1 -19.805 16.801 2.795 1.00 0.00 C ATOM 4 O ALA A 1 -19.697 17.987 2.494 1.00 0.00 O ATOM 5 CB ALA A 1 -21.563 17.351 4.506 1.00 0.00 C ATOM 0 H1 ALA A 1 -21.486 14.819 4.955 1.00 0.00 H new ATOM 0 H2 ALA A 1 -20.563 14.259 3.644 1.00 0.00 H new ATOM 0 H3 ALA A 1 -19.838 15.213 4.847 1.00 0.00 H new ATOM 0 HA ALA A 1 -21.827 16.049 2.803 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -21.817 18.254 3.951 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -22.449 16.982 5.023 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -20.786 17.580 5.236 1.00 0.00 H new ATOM 13 N GLY A 2 -18.864 15.915 2.498 1.00 0.00 N ATOM 14 CA GLY A 2 -17.610 16.335 1.773 1.00 0.00 C ATOM 15 C GLY A 2 -17.211 15.277 0.731 1.00 0.00 C ATOM 16 O GLY A 2 -16.710 15.609 -0.327 1.00 0.00 O ATOM 0 H GLY A 2 -18.914 14.922 2.728 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -17.771 17.295 1.282 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -16.799 16.474 2.488 1.00 0.00 H new ATOM 20 N TRP A 3 -17.412 14.008 1.043 1.00 0.00 N ATOM 21 CA TRP A 3 -17.039 12.895 0.106 1.00 0.00 C ATOM 22 C TRP A 3 -17.541 13.159 -1.343 1.00 0.00 C ATOM 23 O TRP A 3 -16.796 12.993 -2.302 1.00 0.00 O ATOM 24 CB TRP A 3 -17.651 11.647 0.601 1.00 0.00 C ATOM 25 CG TRP A 3 -16.775 10.967 1.631 1.00 0.00 C ATOM 26 CD1 TRP A 3 -17.143 9.843 2.238 1.00 0.00 C ATOM 27 CD2 TRP A 3 -15.427 11.309 2.189 1.00 0.00 C ATOM 28 NE1 TRP A 3 -16.169 9.449 3.129 1.00 0.00 N ATOM 29 CE2 TRP A 3 -15.099 10.307 3.141 1.00 0.00 C ATOM 30 CE3 TRP A 3 -14.460 12.356 1.989 1.00 0.00 C ATOM 31 CZ2 TRP A 3 -13.911 10.324 3.853 1.00 0.00 C ATOM 32 CZ3 TRP A 3 -13.265 12.351 2.718 1.00 0.00 C ATOM 33 CH2 TRP A 3 -12.997 11.339 3.645 1.00 0.00 C ATOM 0 H TRP A 3 -17.825 13.697 1.922 1.00 0.00 H new ATOM 0 HA TRP A 3 -15.952 12.823 0.075 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -18.624 11.867 1.039 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -17.824 10.969 -0.235 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -18.069 9.316 2.059 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -16.236 8.615 3.713 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -14.656 13.144 1.277 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -13.699 9.545 4.570 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -12.542 13.138 2.563 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -12.071 11.351 4.201 1.00 0.00 H new ATOM 44 N ASN A 4 -18.810 13.536 -1.501 1.00 0.00 N ATOM 45 CA ASN A 4 -19.389 13.780 -2.885 1.00 0.00 C ATOM 46 C ASN A 4 -18.614 14.866 -3.625 1.00 0.00 C ATOM 47 O ASN A 4 -18.612 14.898 -4.836 1.00 0.00 O ATOM 48 CB ASN A 4 -20.853 14.193 -2.762 1.00 0.00 C ATOM 49 CG ASN A 4 -20.962 15.411 -1.836 1.00 0.00 C ATOM 50 OD1 ASN A 4 -20.319 16.419 -2.060 1.00 0.00 O ATOM 51 ND2 ASN A 4 -21.760 15.360 -0.804 1.00 0.00 N ATOM 0 H ASN A 4 -19.465 13.684 -0.733 1.00 0.00 H new ATOM 0 HA ASN A 4 -19.310 12.854 -3.455 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -21.259 14.432 -3.745 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -21.443 13.367 -2.366 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -21.845 16.166 -0.185 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -22.299 14.514 -0.617 1.00 0.00 H new ATOM 58 N ALA A 5 -17.957 15.737 -2.901 1.00 0.00 N ATOM 59 CA ALA A 5 -17.131 16.836 -3.537 1.00 0.00 C ATOM 60 C ALA A 5 -15.862 16.188 -4.078 1.00 0.00 C ATOM 61 O ALA A 5 -15.398 16.512 -5.168 1.00 0.00 O ATOM 62 CB ALA A 5 -16.776 17.903 -2.492 1.00 0.00 C ATOM 0 H ALA A 5 -17.951 15.742 -1.881 1.00 0.00 H new ATOM 0 HA ALA A 5 -17.687 17.325 -4.337 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -16.182 18.688 -2.961 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -17.691 18.334 -2.086 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -16.202 17.446 -1.686 1.00 0.00 H new ATOM 68 N TYR A 6 -15.317 15.221 -3.344 1.00 0.00 N ATOM 69 CA TYR A 6 -14.096 14.483 -3.852 1.00 0.00 C ATOM 70 C TYR A 6 -14.555 13.552 -4.984 1.00 0.00 C ATOM 71 O TYR A 6 -13.768 13.062 -5.739 1.00 0.00 O ATOM 72 CB TYR A 6 -13.394 13.750 -2.715 1.00 0.00 C ATOM 73 CG TYR A 6 -13.258 14.747 -1.617 1.00 0.00 C ATOM 74 CD1 TYR A 6 -12.311 15.769 -1.687 1.00 0.00 C ATOM 75 CD2 TYR A 6 -14.152 14.704 -0.598 1.00 0.00 C ATOM 76 CE1 TYR A 6 -12.288 16.751 -0.695 1.00 0.00 C ATOM 77 CE2 TYR A 6 -14.126 15.656 0.406 1.00 0.00 C ATOM 78 CZ TYR A 6 -13.206 16.684 0.360 1.00 0.00 C ATOM 79 OH TYR A 6 -13.231 17.658 1.324 1.00 0.00 O ATOM 0 H TYR A 6 -15.660 14.918 -2.432 1.00 0.00 H new ATOM 0 HA TYR A 6 -13.353 15.175 -4.249 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -13.973 12.886 -2.390 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -12.419 13.380 -3.031 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -11.602 15.800 -2.501 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -14.892 13.918 -0.570 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -11.569 17.555 -0.741 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -14.826 15.595 1.226 1.00 0.00 H new ATOM 0 HH TYR A 6 -12.448 18.239 1.223 1.00 0.00 H new ATOM 89 N ILE A 7 -15.869 13.403 -5.142 1.00 0.00 N ATOM 90 CA ILE A 7 -16.428 12.641 -6.298 1.00 0.00 C ATOM 91 C ILE A 7 -16.641 13.726 -7.433 1.00 0.00 C ATOM 92 O ILE A 7 -16.506 13.470 -8.652 1.00 0.00 O ATOM 93 CB ILE A 7 -17.729 11.946 -5.875 1.00 0.00 C ATOM 94 CG1 ILE A 7 -17.327 10.655 -5.130 1.00 0.00 C ATOM 95 CG2 ILE A 7 -18.598 11.620 -7.092 1.00 0.00 C ATOM 96 CD1 ILE A 7 -16.877 9.569 -6.108 1.00 0.00 C ATOM 0 H ILE A 7 -16.569 13.785 -4.507 1.00 0.00 H new ATOM 0 HA ILE A 7 -15.776 11.845 -6.656 1.00 0.00 H new ATOM 0 HB ILE A 7 -18.320 12.598 -5.232 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -16.522 10.873 -4.429 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -18.171 10.293 -4.543 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -19.514 11.128 -6.764 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -18.849 12.542 -7.617 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -18.051 10.958 -7.763 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -16.600 8.672 -5.554 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -17.692 9.335 -6.793 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -16.017 9.924 -6.676 1.00 0.00 H new ATOM 108 N ASP A 8 -16.893 14.969 -7.000 1.00 0.00 N ATOM 109 CA ASP A 8 -17.032 16.099 -7.935 1.00 0.00 C ATOM 110 C ASP A 8 -15.665 16.335 -8.604 1.00 0.00 C ATOM 111 O ASP A 8 -15.576 16.937 -9.636 1.00 0.00 O ATOM 112 CB ASP A 8 -17.516 17.318 -7.158 1.00 0.00 C ATOM 113 CG ASP A 8 -19.047 17.344 -7.165 1.00 0.00 C ATOM 114 OD1 ASP A 8 -19.610 17.602 -8.217 1.00 0.00 O ATOM 115 OD2 ASP A 8 -19.630 17.098 -6.122 1.00 0.00 O ATOM 0 H ASP A 8 -17.004 15.219 -6.017 1.00 0.00 H new ATOM 0 HA ASP A 8 -17.764 15.894 -8.717 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -17.146 17.282 -6.133 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -17.123 18.230 -7.607 1.00 0.00 H new ATOM 120 N ASN A 9 -14.613 15.789 -8.002 1.00 0.00 N ATOM 121 CA ASN A 9 -13.231 15.847 -8.540 1.00 0.00 C ATOM 122 C ASN A 9 -13.196 15.281 -9.922 1.00 0.00 C ATOM 123 O ASN A 9 -12.493 15.737 -10.773 1.00 0.00 O ATOM 124 CB ASN A 9 -12.381 14.946 -7.552 1.00 0.00 C ATOM 125 CG ASN A 9 -11.585 13.702 -8.244 1.00 0.00 C ATOM 126 OD1 ASN A 9 -10.757 13.918 -9.105 1.00 0.00 O ATOM 127 ND2 ASN A 9 -11.848 12.381 -7.862 1.00 0.00 N ATOM 0 H ASN A 9 -14.682 15.286 -7.117 1.00 0.00 H new ATOM 0 HA ASN A 9 -12.848 16.865 -8.603 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -11.655 15.581 -7.043 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -13.048 14.547 -6.787 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -11.346 11.612 -8.306 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -12.542 12.187 -7.140 1.00 0.00 H new ATOM 134 N LEU A 10 -13.944 14.290 -10.077 1.00 0.00 N ATOM 135 CA LEU A 10 -14.071 13.531 -11.341 1.00 0.00 C ATOM 136 C LEU A 10 -14.860 14.246 -12.296 1.00 0.00 C ATOM 137 O LEU A 10 -14.635 14.203 -13.502 1.00 0.00 O ATOM 138 CB LEU A 10 -14.857 12.297 -11.037 1.00 0.00 C ATOM 139 CG LEU A 10 -14.108 11.360 -10.147 1.00 0.00 C ATOM 140 CD1 LEU A 10 -12.568 11.396 -10.377 1.00 0.00 C ATOM 141 CD2 LEU A 10 -14.460 11.664 -8.638 1.00 0.00 C ATOM 0 H LEU A 10 -14.533 13.924 -9.329 1.00 0.00 H new ATOM 0 HA LEU A 10 -13.072 13.343 -11.734 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -15.798 12.575 -10.561 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -15.109 11.789 -11.968 1.00 0.00 H new ATOM 0 HG LEU A 10 -14.425 10.349 -10.401 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -12.082 10.693 -9.700 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -12.347 11.118 -11.408 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -12.195 12.402 -10.185 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -13.912 10.979 -7.991 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -14.181 12.690 -8.399 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -15.531 11.533 -8.481 1.00 0.00 H new ATOM 153 N MET A 11 -15.825 14.854 -11.809 1.00 0.00 N ATOM 154 CA MET A 11 -16.727 15.549 -12.669 1.00 0.00 C ATOM 155 C MET A 11 -15.995 16.846 -13.176 1.00 0.00 C ATOM 156 O MET A 11 -16.224 17.318 -14.276 1.00 0.00 O ATOM 157 CB MET A 11 -18.008 15.734 -11.845 1.00 0.00 C ATOM 158 CG MET A 11 -18.463 14.270 -11.294 1.00 0.00 C ATOM 159 SD MET A 11 -19.480 13.458 -12.555 1.00 0.00 S ATOM 160 CE MET A 11 -18.139 12.573 -13.397 1.00 0.00 C ATOM 0 H MET A 11 -16.042 14.906 -10.814 1.00 0.00 H new ATOM 0 HA MET A 11 -17.021 15.036 -13.585 1.00 0.00 H new ATOM 0 HB2 MET A 11 -17.832 16.417 -11.014 1.00 0.00 H new ATOM 0 HB3 MET A 11 -18.796 16.173 -12.457 1.00 0.00 H new ATOM 0 HG2 MET A 11 -17.586 13.663 -11.069 1.00 0.00 H new ATOM 0 HG3 MET A 11 -19.025 14.375 -10.366 1.00 0.00 H new ATOM 0 HE1 MET A 11 -18.033 12.954 -14.413 1.00 0.00 H new ATOM 0 HE2 MET A 11 -17.206 12.724 -12.854 1.00 0.00 H new ATOM 0 HE3 MET A 11 -18.371 11.508 -13.431 1.00 0.00 H new ATOM 170 N ALA A 12 -15.076 17.358 -12.365 1.00 0.00 N ATOM 171 CA ALA A 12 -14.231 18.554 -12.715 1.00 0.00 C ATOM 172 C ALA A 12 -12.944 18.224 -13.576 1.00 0.00 C ATOM 173 O ALA A 12 -12.444 19.075 -14.295 1.00 0.00 O ATOM 174 CB ALA A 12 -13.797 19.218 -11.406 1.00 0.00 C ATOM 0 H ALA A 12 -14.876 16.975 -11.441 1.00 0.00 H new ATOM 0 HA ALA A 12 -14.844 19.206 -13.338 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -13.182 20.090 -11.627 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -14.679 19.529 -10.846 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -13.221 18.509 -10.812 1.00 0.00 H new ATOM 180 N ASP A 13 -12.358 17.046 -13.386 1.00 0.00 N ATOM 181 CA ASP A 13 -10.989 16.692 -14.080 1.00 0.00 C ATOM 182 C ASP A 13 -11.057 16.418 -15.581 1.00 0.00 C ATOM 183 O ASP A 13 -10.013 16.215 -16.169 1.00 0.00 O ATOM 184 CB ASP A 13 -10.314 15.433 -13.400 1.00 0.00 C ATOM 185 CG ASP A 13 -11.314 14.497 -12.838 1.00 0.00 C ATOM 186 OD1 ASP A 13 -12.284 14.272 -13.495 1.00 0.00 O ATOM 187 OD2 ASP A 13 -11.074 13.986 -11.756 1.00 0.00 O ATOM 0 H ASP A 13 -12.738 16.306 -12.796 1.00 0.00 H new ATOM 0 HA ASP A 13 -10.400 17.599 -13.944 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -9.702 14.910 -14.135 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -9.645 15.766 -12.607 1.00 0.00 H new ATOM 192 N GLY A 14 -12.229 16.444 -16.223 1.00 0.00 N ATOM 193 CA GLY A 14 -12.322 16.186 -17.759 1.00 0.00 C ATOM 194 C GLY A 14 -11.193 15.205 -18.256 1.00 0.00 C ATOM 195 O GLY A 14 -10.651 15.354 -19.338 1.00 0.00 O ATOM 0 H GLY A 14 -13.124 16.629 -15.770 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -13.299 15.767 -17.999 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -12.242 17.133 -18.292 1.00 0.00 H new ATOM 199 N THR A 15 -10.849 14.247 -17.423 1.00 0.00 N ATOM 200 CA THR A 15 -9.769 13.248 -17.717 1.00 0.00 C ATOM 201 C THR A 15 -10.184 11.923 -17.094 1.00 0.00 C ATOM 202 O THR A 15 -9.955 10.855 -17.659 1.00 0.00 O ATOM 203 CB THR A 15 -8.452 13.737 -17.094 1.00 0.00 C ATOM 204 OG1 THR A 15 -7.914 14.789 -17.893 1.00 0.00 O ATOM 205 CG2 THR A 15 -7.480 12.581 -17.044 1.00 0.00 C ATOM 0 H THR A 15 -11.293 14.113 -16.514 1.00 0.00 H new ATOM 0 HA THR A 15 -9.625 13.128 -18.791 1.00 0.00 H new ATOM 0 HB THR A 15 -8.629 14.111 -16.085 1.00 0.00 H new ATOM 0 HG1 THR A 15 -8.348 15.635 -17.655 1.00 0.00 H new ATOM 0 HG21 THR A 15 -6.540 12.915 -16.604 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.900 11.778 -16.438 1.00 0.00 H new ATOM 0 HG23 THR A 15 -7.298 12.215 -18.054 1.00 0.00 H new ATOM 213 N CYS A 16 -10.762 11.999 -15.933 1.00 0.00 N ATOM 214 CA CYS A 16 -11.185 10.807 -15.213 1.00 0.00 C ATOM 215 C CYS A 16 -12.376 10.175 -15.990 1.00 0.00 C ATOM 216 O CYS A 16 -12.742 10.615 -17.076 1.00 0.00 O ATOM 217 CB CYS A 16 -11.634 11.278 -13.781 1.00 0.00 C ATOM 218 SG CYS A 16 -13.402 11.654 -13.779 1.00 0.00 S ATOM 0 H CYS A 16 -10.958 12.876 -15.450 1.00 0.00 H new ATOM 0 HA CYS A 16 -10.392 10.064 -15.126 1.00 0.00 H new ATOM 0 HB2 CYS A 16 -11.419 10.499 -13.049 1.00 0.00 H new ATOM 0 HB3 CYS A 16 -11.066 12.160 -13.485 1.00 0.00 H new ATOM 0 HG CYS A 16 -13.573 12.938 -13.888 1.00 0.00 H new ATOM 224 N GLN A 17 -12.983 9.203 -15.388 1.00 0.00 N ATOM 225 CA GLN A 17 -14.171 8.534 -15.950 1.00 0.00 C ATOM 226 C GLN A 17 -14.993 8.042 -14.756 1.00 0.00 C ATOM 227 O GLN A 17 -16.199 8.230 -14.682 1.00 0.00 O ATOM 228 CB GLN A 17 -13.757 7.388 -16.829 1.00 0.00 C ATOM 229 CG GLN A 17 -14.899 7.051 -17.799 1.00 0.00 C ATOM 230 CD GLN A 17 -15.739 5.878 -17.253 1.00 0.00 C ATOM 231 OE1 GLN A 17 -15.282 5.094 -16.437 1.00 0.00 O ATOM 232 NE2 GLN A 17 -16.959 5.726 -17.683 1.00 0.00 N ATOM 0 H GLN A 17 -12.687 8.830 -14.486 1.00 0.00 H new ATOM 0 HA GLN A 17 -14.757 9.213 -16.570 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -12.857 7.649 -17.386 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -13.514 6.517 -16.220 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -15.534 7.926 -17.942 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -14.491 6.791 -18.775 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -17.344 6.379 -18.365 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -17.529 4.954 -17.338 1.00 0.00 H new ATOM 241 N ASP A 18 -14.298 7.448 -13.786 1.00 0.00 N ATOM 242 CA ASP A 18 -14.953 6.962 -12.527 1.00 0.00 C ATOM 243 C ASP A 18 -14.116 7.428 -11.329 1.00 0.00 C ATOM 244 O ASP A 18 -13.188 8.211 -11.487 1.00 0.00 O ATOM 245 CB ASP A 18 -15.108 5.437 -12.547 1.00 0.00 C ATOM 246 CG ASP A 18 -16.341 5.036 -11.735 1.00 0.00 C ATOM 247 OD1 ASP A 18 -17.387 5.613 -11.954 1.00 0.00 O ATOM 248 OD2 ASP A 18 -16.210 4.155 -10.901 1.00 0.00 O ATOM 0 H ASP A 18 -13.292 7.283 -13.827 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.956 7.380 -12.446 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -15.206 5.085 -13.574 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -14.217 4.965 -12.132 1.00 0.00 H new ATOM 253 N ALA A 19 -14.482 7.013 -10.136 1.00 0.00 N ATOM 254 CA ALA A 19 -13.770 7.476 -8.906 1.00 0.00 C ATOM 255 C ALA A 19 -14.247 6.681 -7.735 1.00 0.00 C ATOM 256 O ALA A 19 -15.451 6.519 -7.592 1.00 0.00 O ATOM 257 CB ALA A 19 -14.171 8.856 -8.697 1.00 0.00 C ATOM 0 H ALA A 19 -15.252 6.367 -9.964 1.00 0.00 H new ATOM 0 HA ALA A 19 -12.691 7.367 -9.012 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -13.678 9.247 -7.807 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -13.884 9.453 -9.563 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -15.252 8.905 -8.564 1.00 0.00 H new ATOM 263 N ALA A 20 -13.375 6.194 -6.862 1.00 0.00 N ATOM 264 CA ALA A 20 -13.940 5.437 -5.682 1.00 0.00 C ATOM 265 C ALA A 20 -13.203 5.642 -4.385 1.00 0.00 C ATOM 266 O ALA A 20 -12.144 5.092 -4.159 1.00 0.00 O ATOM 267 CB ALA A 20 -13.995 3.965 -5.961 1.00 0.00 C ATOM 0 H ALA A 20 -12.360 6.280 -6.908 1.00 0.00 H new ATOM 0 HA ALA A 20 -14.939 5.854 -5.555 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -14.405 3.446 -5.095 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -14.630 3.782 -6.828 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -12.990 3.595 -6.163 1.00 0.00 H new ATOM 273 N ILE A 21 -13.849 6.328 -3.474 1.00 0.00 N ATOM 274 CA ILE A 21 -13.305 6.461 -2.106 1.00 0.00 C ATOM 275 C ILE A 21 -13.853 5.223 -1.421 1.00 0.00 C ATOM 276 O ILE A 21 -15.028 4.893 -1.614 1.00 0.00 O ATOM 277 CB ILE A 21 -13.805 7.727 -1.438 1.00 0.00 C ATOM 278 CG1 ILE A 21 -13.391 8.915 -2.327 1.00 0.00 C ATOM 279 CG2 ILE A 21 -13.162 7.832 -0.025 1.00 0.00 C ATOM 280 CD1 ILE A 21 -13.584 10.235 -1.594 1.00 0.00 C ATOM 0 H ILE A 21 -14.738 6.803 -3.631 1.00 0.00 H new ATOM 0 HA ILE A 21 -12.218 6.534 -2.072 1.00 0.00 H new ATOM 0 HB ILE A 21 -14.889 7.723 -1.321 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -12.347 8.807 -2.622 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -13.983 8.913 -3.242 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -13.513 8.739 0.468 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -13.445 6.963 0.569 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -12.077 7.868 -0.121 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -13.285 11.058 -2.242 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -14.633 10.350 -1.322 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -12.972 10.243 -0.692 1.00 0.00 H new ATOM 292 N VAL A 22 -13.047 4.466 -0.716 1.00 0.00 N ATOM 293 CA VAL A 22 -13.581 3.181 -0.154 1.00 0.00 C ATOM 294 C VAL A 22 -13.161 2.948 1.304 1.00 0.00 C ATOM 295 O VAL A 22 -12.014 2.663 1.558 1.00 0.00 O ATOM 296 CB VAL A 22 -13.017 2.038 -1.027 1.00 0.00 C ATOM 297 CG1 VAL A 22 -13.606 0.687 -0.593 1.00 0.00 C ATOM 298 CG2 VAL A 22 -13.366 2.305 -2.506 1.00 0.00 C ATOM 0 H VAL A 22 -12.070 4.672 -0.508 1.00 0.00 H new ATOM 0 HA VAL A 22 -14.670 3.220 -0.165 1.00 0.00 H new ATOM 0 HB VAL A 22 -11.935 2.001 -0.904 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -13.197 -0.106 -1.219 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -13.349 0.496 0.449 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.690 0.712 -0.700 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -12.969 1.500 -3.125 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -14.449 2.351 -2.622 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -12.927 3.253 -2.818 1.00 0.00 H new ATOM 308 N GLY A 23 -14.111 3.009 2.263 1.00 0.00 N ATOM 309 CA GLY A 23 -13.770 2.713 3.711 1.00 0.00 C ATOM 310 C GLY A 23 -13.376 1.227 3.780 1.00 0.00 C ATOM 311 O GLY A 23 -14.198 0.359 4.016 1.00 0.00 O ATOM 0 H GLY A 23 -15.088 3.249 2.093 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -12.951 3.346 4.053 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.623 2.917 4.359 1.00 0.00 H new ATOM 315 N TYR A 24 -12.124 0.958 3.515 1.00 0.00 N ATOM 316 CA TYR A 24 -11.580 -0.434 3.473 1.00 0.00 C ATOM 317 C TYR A 24 -11.140 -0.922 4.889 1.00 0.00 C ATOM 318 O TYR A 24 -10.154 -1.646 5.016 1.00 0.00 O ATOM 319 CB TYR A 24 -10.368 -0.428 2.484 1.00 0.00 C ATOM 320 CG TYR A 24 -9.091 0.082 3.166 1.00 0.00 C ATOM 321 CD1 TYR A 24 -9.135 1.130 4.122 1.00 0.00 C ATOM 322 CD2 TYR A 24 -7.881 -0.523 2.864 1.00 0.00 C ATOM 323 CE1 TYR A 24 -7.970 1.547 4.748 1.00 0.00 C ATOM 324 CE2 TYR A 24 -6.718 -0.110 3.498 1.00 0.00 C ATOM 325 CZ TYR A 24 -6.758 0.930 4.443 1.00 0.00 C ATOM 326 OH TYR A 24 -5.606 1.335 5.077 1.00 0.00 O ATOM 0 H TYR A 24 -11.428 1.677 3.318 1.00 0.00 H new ATOM 0 HA TYR A 24 -12.351 -1.127 3.136 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -10.202 -1.436 2.104 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -10.600 0.202 1.625 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -10.076 1.603 4.362 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -7.843 -1.318 2.134 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -8.002 2.349 5.471 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -5.779 -0.589 3.265 1.00 0.00 H new ATOM 0 HH TYR A 24 -5.825 1.664 5.974 1.00 0.00 H new ATOM 336 N LYS A 25 -11.863 -0.548 5.937 1.00 0.00 N ATOM 337 CA LYS A 25 -11.498 -0.998 7.318 1.00 0.00 C ATOM 338 C LYS A 25 -11.647 -2.518 7.370 1.00 0.00 C ATOM 339 O LYS A 25 -11.588 -3.178 6.339 1.00 0.00 O ATOM 340 CB LYS A 25 -12.426 -0.320 8.318 1.00 0.00 C ATOM 341 CG LYS A 25 -11.994 1.127 8.508 1.00 0.00 C ATOM 342 CD LYS A 25 -12.433 1.935 7.319 1.00 0.00 C ATOM 343 CE LYS A 25 -12.401 3.402 7.684 1.00 0.00 C ATOM 344 NZ LYS A 25 -13.351 3.661 8.808 1.00 0.00 N ATOM 0 H LYS A 25 -12.688 0.049 5.885 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.472 -0.729 7.568 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.455 -0.360 7.961 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -12.399 -0.847 9.272 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -12.432 1.533 9.420 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.911 1.184 8.621 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.777 1.744 6.470 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -13.439 1.644 7.016 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.391 3.693 7.974 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.671 4.008 6.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.857 4.553 8.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -14.036 2.881 8.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.822 3.729 9.701 1.00 0.00 H new ATOM 358 N ASP A 26 -11.858 -3.087 8.549 1.00 0.00 N ATOM 359 CA ASP A 26 -12.050 -4.609 8.679 1.00 0.00 C ATOM 360 C ASP A 26 -12.999 -5.063 7.574 1.00 0.00 C ATOM 361 O ASP A 26 -12.650 -5.871 6.726 1.00 0.00 O ATOM 362 CB ASP A 26 -12.654 -4.985 10.044 1.00 0.00 C ATOM 363 CG ASP A 26 -13.570 -3.876 10.588 1.00 0.00 C ATOM 364 OD1 ASP A 26 -13.051 -2.947 11.188 1.00 0.00 O ATOM 365 OD2 ASP A 26 -14.771 -3.982 10.404 1.00 0.00 O ATOM 0 H ASP A 26 -11.907 -2.576 9.430 1.00 0.00 H new ATOM 0 HA ASP A 26 -11.079 -5.097 8.594 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -13.222 -5.911 9.948 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -11.851 -5.176 10.757 1.00 0.00 H new ATOM 370 N SER A 27 -14.167 -4.474 7.559 1.00 0.00 N ATOM 371 CA SER A 27 -15.159 -4.739 6.514 1.00 0.00 C ATOM 372 C SER A 27 -15.112 -3.518 5.562 1.00 0.00 C ATOM 373 O SER A 27 -15.297 -2.400 6.015 1.00 0.00 O ATOM 374 CB SER A 27 -16.532 -4.860 7.142 1.00 0.00 C ATOM 375 OG SER A 27 -16.700 -3.852 8.138 1.00 0.00 O ATOM 0 H SER A 27 -14.469 -3.798 8.261 1.00 0.00 H new ATOM 0 HA SER A 27 -14.952 -5.666 5.979 1.00 0.00 H new ATOM 0 HB2 SER A 27 -17.302 -4.760 6.377 1.00 0.00 H new ATOM 0 HB3 SER A 27 -16.652 -5.848 7.587 1.00 0.00 H new ATOM 0 HG SER A 27 -16.239 -3.034 7.857 1.00 0.00 H new ATOM 381 N PRO A 28 -14.815 -3.750 4.276 1.00 0.00 N ATOM 382 CA PRO A 28 -14.689 -2.671 3.303 1.00 0.00 C ATOM 383 C PRO A 28 -16.049 -2.168 2.866 1.00 0.00 C ATOM 384 O PRO A 28 -17.053 -2.855 3.001 1.00 0.00 O ATOM 385 CB PRO A 28 -13.934 -3.307 2.148 1.00 0.00 C ATOM 386 CG PRO A 28 -14.154 -4.826 2.283 1.00 0.00 C ATOM 387 CD PRO A 28 -14.611 -5.086 3.704 1.00 0.00 C ATOM 0 HA PRO A 28 -14.174 -1.799 3.706 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -14.306 -2.942 1.191 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.873 -3.061 2.192 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -14.901 -5.172 1.569 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -13.233 -5.369 2.069 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -15.531 -5.671 3.724 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -13.864 -5.648 4.265 1.00 0.00 H new ATOM 395 N SER A 29 -16.077 -0.964 2.334 1.00 0.00 N ATOM 396 CA SER A 29 -17.333 -0.359 1.862 1.00 0.00 C ATOM 397 C SER A 29 -16.996 0.841 1.016 1.00 0.00 C ATOM 398 O SER A 29 -15.934 1.426 1.158 1.00 0.00 O ATOM 399 CB SER A 29 -18.190 0.070 3.052 1.00 0.00 C ATOM 400 OG SER A 29 -17.474 1.021 3.833 1.00 0.00 O ATOM 0 H SER A 29 -15.253 -0.375 2.212 1.00 0.00 H new ATOM 0 HA SER A 29 -17.896 -1.085 1.276 1.00 0.00 H new ATOM 0 HB2 SER A 29 -19.127 0.503 2.702 1.00 0.00 H new ATOM 0 HB3 SER A 29 -18.447 -0.797 3.661 1.00 0.00 H new ATOM 0 HG SER A 29 -17.557 1.908 3.425 1.00 0.00 H new ATOM 406 N VAL A 30 -17.877 1.201 0.129 1.00 0.00 N ATOM 407 CA VAL A 30 -17.639 2.342 -0.755 1.00 0.00 C ATOM 408 C VAL A 30 -18.106 3.622 -0.062 1.00 0.00 C ATOM 409 O VAL A 30 -19.296 3.904 0.029 1.00 0.00 O ATOM 410 CB VAL A 30 -18.377 2.068 -2.048 1.00 0.00 C ATOM 411 CG1 VAL A 30 -18.434 3.318 -2.929 1.00 0.00 C ATOM 412 CG2 VAL A 30 -17.611 0.966 -2.764 1.00 0.00 C ATOM 0 H VAL A 30 -18.771 0.732 -0.014 1.00 0.00 H new ATOM 0 HA VAL A 30 -16.581 2.479 -0.980 1.00 0.00 H new ATOM 0 HB VAL A 30 -19.406 1.773 -1.841 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -18.970 3.090 -3.850 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -18.952 4.115 -2.396 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -17.421 3.640 -3.169 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -18.106 0.732 -3.706 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -16.593 1.301 -2.963 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -17.584 0.075 -2.137 1.00 0.00 H new ATOM 422 N TRP A 31 -17.154 4.382 0.431 1.00 0.00 N ATOM 423 CA TRP A 31 -17.451 5.648 1.137 1.00 0.00 C ATOM 424 C TRP A 31 -17.959 6.690 0.154 1.00 0.00 C ATOM 425 O TRP A 31 -18.709 7.587 0.528 1.00 0.00 O ATOM 426 CB TRP A 31 -16.165 6.130 1.833 1.00 0.00 C ATOM 427 CG TRP A 31 -16.083 5.530 3.220 1.00 0.00 C ATOM 428 CD1 TRP A 31 -16.848 4.502 3.681 1.00 0.00 C ATOM 429 CD2 TRP A 31 -15.206 5.896 4.320 1.00 0.00 C ATOM 430 NE1 TRP A 31 -16.508 4.234 4.966 1.00 0.00 N ATOM 431 CE2 TRP A 31 -15.500 5.064 5.420 1.00 0.00 C ATOM 432 CE3 TRP A 31 -14.193 6.864 4.472 1.00 0.00 C ATOM 433 CZ2 TRP A 31 -14.826 5.187 6.628 1.00 0.00 C ATOM 434 CZ3 TRP A 31 -13.508 6.988 5.691 1.00 0.00 C ATOM 435 CH2 TRP A 31 -13.826 6.153 6.766 1.00 0.00 C ATOM 0 H TRP A 31 -16.160 4.161 0.366 1.00 0.00 H new ATOM 0 HA TRP A 31 -18.230 5.489 1.883 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -15.292 5.840 1.248 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -16.159 7.218 1.896 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -17.606 3.982 3.113 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -16.945 3.506 5.531 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -13.942 7.514 3.646 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -15.073 4.540 7.456 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -12.732 7.732 5.799 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -13.299 6.255 7.703 1.00 0.00 H new ATOM 446 N ALA A 32 -17.579 6.572 -1.111 1.00 0.00 N ATOM 447 CA ALA A 32 -18.066 7.557 -2.149 1.00 0.00 C ATOM 448 C ALA A 32 -17.480 7.255 -3.533 1.00 0.00 C ATOM 449 O ALA A 32 -16.517 7.885 -3.978 1.00 0.00 O ATOM 450 CB ALA A 32 -17.688 8.982 -1.734 1.00 0.00 C ATOM 0 H ALA A 32 -16.959 5.843 -1.465 1.00 0.00 H new ATOM 0 HA ALA A 32 -19.150 7.464 -2.212 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -18.042 9.686 -2.487 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -18.148 9.215 -0.774 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -16.604 9.060 -1.646 1.00 0.00 H new ATOM 456 N ALA A 33 -18.088 6.324 -4.236 1.00 0.00 N ATOM 457 CA ALA A 33 -17.637 5.986 -5.602 1.00 0.00 C ATOM 458 C ALA A 33 -18.764 6.313 -6.552 1.00 0.00 C ATOM 459 O ALA A 33 -19.906 5.957 -6.300 1.00 0.00 O ATOM 460 CB ALA A 33 -17.304 4.494 -5.715 1.00 0.00 C ATOM 0 H ALA A 33 -18.887 5.784 -3.905 1.00 0.00 H new ATOM 0 HA ALA A 33 -16.738 6.555 -5.841 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -16.975 4.271 -6.730 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -16.509 4.244 -5.012 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -18.191 3.905 -5.484 1.00 0.00 H new ATOM 466 N VAL A 34 -18.456 6.986 -7.650 1.00 0.00 N ATOM 467 CA VAL A 34 -19.515 7.356 -8.676 1.00 0.00 C ATOM 468 C VAL A 34 -20.404 6.092 -8.937 1.00 0.00 C ATOM 469 O VAL A 34 -19.960 5.169 -9.596 1.00 0.00 O ATOM 470 CB VAL A 34 -18.821 7.818 -9.981 1.00 0.00 C ATOM 471 CG1 VAL A 34 -19.872 8.330 -10.971 1.00 0.00 C ATOM 472 CG2 VAL A 34 -17.838 8.960 -9.657 1.00 0.00 C ATOM 0 H VAL A 34 -17.513 7.298 -7.883 1.00 0.00 H new ATOM 0 HA VAL A 34 -20.141 8.171 -8.313 1.00 0.00 H new ATOM 0 HB VAL A 34 -18.284 6.978 -10.421 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -19.380 8.654 -11.888 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -20.576 7.530 -11.200 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -20.408 9.170 -10.530 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -17.347 9.288 -10.573 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -18.383 9.796 -9.218 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -17.088 8.605 -8.951 1.00 0.00 H new ATOM 482 N PRO A 35 -21.627 6.067 -8.341 1.00 0.00 N ATOM 483 CA PRO A 35 -22.527 4.903 -8.445 1.00 0.00 C ATOM 484 C PRO A 35 -23.076 4.729 -9.850 1.00 0.00 C ATOM 485 O PRO A 35 -23.582 5.663 -10.455 1.00 0.00 O ATOM 486 CB PRO A 35 -23.650 5.202 -7.439 1.00 0.00 C ATOM 487 CG PRO A 35 -23.636 6.738 -7.222 1.00 0.00 C ATOM 488 CD PRO A 35 -22.200 7.198 -7.561 1.00 0.00 C ATOM 0 HA PRO A 35 -22.009 3.969 -8.230 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -24.615 4.872 -7.823 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -23.483 4.674 -6.500 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -24.366 7.230 -7.864 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -23.895 6.990 -6.194 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -22.204 8.120 -8.142 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -21.621 7.393 -6.658 1.00 0.00 H new ATOM 496 N GLY A 36 -22.976 3.512 -10.368 1.00 0.00 N ATOM 497 CA GLY A 36 -23.484 3.214 -11.735 1.00 0.00 C ATOM 498 C GLY A 36 -22.378 2.570 -12.576 1.00 0.00 C ATOM 499 O GLY A 36 -22.663 1.874 -13.543 1.00 0.00 O ATOM 0 H GLY A 36 -22.558 2.716 -9.886 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -24.343 2.545 -11.675 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -23.827 4.132 -12.212 1.00 0.00 H new ATOM 503 N LYS A 37 -21.109 2.823 -12.236 1.00 0.00 N ATOM 504 CA LYS A 37 -19.976 2.247 -13.050 1.00 0.00 C ATOM 505 C LYS A 37 -19.503 0.862 -12.538 1.00 0.00 C ATOM 506 O LYS A 37 -20.036 -0.153 -12.969 1.00 0.00 O ATOM 507 CB LYS A 37 -18.804 3.241 -13.082 1.00 0.00 C ATOM 508 CG LYS A 37 -19.269 4.597 -13.694 1.00 0.00 C ATOM 509 CD LYS A 37 -19.993 4.372 -15.038 1.00 0.00 C ATOM 510 CE LYS A 37 -20.365 5.722 -15.659 1.00 0.00 C ATOM 511 NZ LYS A 37 -21.371 6.413 -14.796 1.00 0.00 N ATOM 0 H LYS A 37 -20.824 3.395 -11.441 1.00 0.00 H new ATOM 0 HA LYS A 37 -20.353 2.086 -14.060 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -18.424 3.400 -12.073 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -17.984 2.830 -13.670 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -19.935 5.106 -12.998 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -18.408 5.248 -13.844 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -19.351 3.813 -15.718 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -20.890 3.773 -14.882 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -19.475 6.342 -15.765 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -20.771 5.574 -16.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -21.809 7.192 -15.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -22.105 5.735 -14.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -20.900 6.793 -13.950 1.00 0.00 H new ATOM 525 N THR A 38 -18.466 0.788 -11.671 1.00 0.00 N ATOM 526 CA THR A 38 -17.960 -0.580 -11.230 1.00 0.00 C ATOM 527 C THR A 38 -17.295 -0.554 -9.816 1.00 0.00 C ATOM 528 O THR A 38 -17.457 -1.489 -9.047 1.00 0.00 O ATOM 529 CB THR A 38 -16.953 -1.057 -12.327 1.00 0.00 C ATOM 530 OG1 THR A 38 -17.668 -1.759 -13.334 1.00 0.00 O ATOM 531 CG2 THR A 38 -15.850 -1.985 -11.767 1.00 0.00 C ATOM 0 H THR A 38 -17.975 1.588 -11.272 1.00 0.00 H new ATOM 0 HA THR A 38 -18.797 -1.271 -11.132 1.00 0.00 H new ATOM 0 HB THR A 38 -16.464 -0.168 -12.727 1.00 0.00 H new ATOM 0 HG1 THR A 38 -18.570 -1.385 -13.416 1.00 0.00 H new ATOM 0 HG21 THR A 38 -15.181 -2.284 -12.574 1.00 0.00 H new ATOM 0 HG22 THR A 38 -15.282 -1.455 -11.003 1.00 0.00 H new ATOM 0 HG23 THR A 38 -16.308 -2.872 -11.329 1.00 0.00 H new ATOM 539 N PHE A 39 -16.524 0.466 -9.508 1.00 0.00 N ATOM 540 CA PHE A 39 -15.801 0.524 -8.173 1.00 0.00 C ATOM 541 C PHE A 39 -16.756 0.498 -7.004 1.00 0.00 C ATOM 542 O PHE A 39 -16.484 -0.120 -6.004 1.00 0.00 O ATOM 543 CB PHE A 39 -15.031 1.803 -8.082 1.00 0.00 C ATOM 544 CG PHE A 39 -13.891 1.872 -9.107 1.00 0.00 C ATOM 545 CD1 PHE A 39 -13.664 0.834 -10.041 1.00 0.00 C ATOM 546 CD2 PHE A 39 -13.062 2.989 -9.108 1.00 0.00 C ATOM 547 CE1 PHE A 39 -12.622 0.935 -10.953 1.00 0.00 C ATOM 548 CE2 PHE A 39 -12.018 3.085 -10.022 1.00 0.00 C ATOM 549 CZ PHE A 39 -11.801 2.055 -10.948 1.00 0.00 C ATOM 0 H PHE A 39 -16.358 1.266 -10.118 1.00 0.00 H new ATOM 0 HA PHE A 39 -15.152 -0.350 -8.125 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -15.708 2.643 -8.238 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -14.620 1.906 -7.078 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -14.302 -0.038 -10.045 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -13.230 3.784 -8.397 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -12.450 0.143 -11.666 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -11.375 3.953 -10.018 1.00 0.00 H new ATOM 0 HZ PHE A 39 -10.993 2.133 -11.660 1.00 0.00 H new ATOM 559 N VAL A 40 -17.856 1.193 -7.119 1.00 0.00 N ATOM 560 CA VAL A 40 -18.871 1.261 -6.008 1.00 0.00 C ATOM 561 C VAL A 40 -19.310 -0.171 -5.631 1.00 0.00 C ATOM 562 O VAL A 40 -19.785 -0.414 -4.527 1.00 0.00 O ATOM 563 CB VAL A 40 -20.079 2.119 -6.458 1.00 0.00 C ATOM 564 CG1 VAL A 40 -20.486 1.727 -7.871 1.00 0.00 C ATOM 565 CG2 VAL A 40 -21.261 1.912 -5.493 1.00 0.00 C ATOM 0 H VAL A 40 -18.105 1.730 -7.950 1.00 0.00 H new ATOM 0 HA VAL A 40 -18.432 1.731 -5.128 1.00 0.00 H new ATOM 0 HB VAL A 40 -19.795 3.171 -6.446 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -21.336 2.332 -8.186 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -19.650 1.895 -8.550 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -20.764 0.673 -7.891 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -22.106 2.519 -5.817 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -21.549 0.861 -5.491 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -20.966 2.209 -4.487 1.00 0.00 H new ATOM 575 N ASN A 41 -19.130 -1.115 -6.532 1.00 0.00 N ATOM 576 CA ASN A 41 -19.489 -2.513 -6.247 1.00 0.00 C ATOM 577 C ASN A 41 -18.249 -3.225 -5.662 1.00 0.00 C ATOM 578 O ASN A 41 -18.075 -4.430 -5.828 1.00 0.00 O ATOM 579 CB ASN A 41 -19.910 -3.178 -7.540 1.00 0.00 C ATOM 580 CG ASN A 41 -21.384 -2.887 -7.802 1.00 0.00 C ATOM 581 OD1 ASN A 41 -21.720 -1.898 -8.425 1.00 0.00 O ATOM 582 ND2 ASN A 41 -22.285 -3.710 -7.352 1.00 0.00 N ATOM 0 H ASN A 41 -18.742 -0.955 -7.462 1.00 0.00 H new ATOM 0 HA ASN A 41 -20.310 -2.566 -5.532 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -19.303 -2.809 -8.366 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -19.745 -4.254 -7.479 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -23.274 -3.526 -7.522 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -22.003 -4.539 -6.830 1.00 0.00 H new ATOM 589 N ILE A 42 -17.370 -2.470 -4.981 1.00 0.00 N ATOM 590 CA ILE A 42 -16.150 -3.061 -4.406 1.00 0.00 C ATOM 591 C ILE A 42 -16.526 -3.987 -3.201 1.00 0.00 C ATOM 592 O ILE A 42 -17.644 -4.001 -2.713 1.00 0.00 O ATOM 593 CB ILE A 42 -15.172 -1.891 -4.007 1.00 0.00 C ATOM 594 CG1 ILE A 42 -14.273 -1.582 -5.218 1.00 0.00 C ATOM 595 CG2 ILE A 42 -14.278 -2.257 -2.799 1.00 0.00 C ATOM 596 CD1 ILE A 42 -13.875 -0.102 -5.217 1.00 0.00 C ATOM 0 H ILE A 42 -17.478 -1.469 -4.817 1.00 0.00 H new ATOM 0 HA ILE A 42 -15.637 -3.693 -5.130 1.00 0.00 H new ATOM 0 HB ILE A 42 -15.773 -1.028 -3.720 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -13.380 -2.206 -5.186 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -14.799 -1.824 -6.142 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -13.623 -1.418 -2.564 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -14.906 -2.480 -1.936 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -13.675 -3.131 -3.044 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -13.239 0.104 -6.078 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -14.771 0.516 -5.271 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -13.331 0.128 -4.301 1.00 0.00 H new ATOM 608 N THR A 43 -15.570 -4.759 -2.787 1.00 0.00 N ATOM 609 CA THR A 43 -15.710 -5.761 -1.665 1.00 0.00 C ATOM 610 C THR A 43 -14.277 -6.017 -1.107 1.00 0.00 C ATOM 611 O THR A 43 -13.343 -5.487 -1.661 1.00 0.00 O ATOM 612 CB THR A 43 -16.270 -7.048 -2.303 1.00 0.00 C ATOM 613 OG1 THR A 43 -15.514 -7.363 -3.453 1.00 0.00 O ATOM 614 CG2 THR A 43 -17.719 -6.816 -2.704 1.00 0.00 C ATOM 0 H THR A 43 -14.636 -4.745 -3.197 1.00 0.00 H new ATOM 0 HA THR A 43 -16.363 -5.423 -0.861 1.00 0.00 H new ATOM 0 HB THR A 43 -16.212 -7.869 -1.589 1.00 0.00 H new ATOM 0 HG1 THR A 43 -15.866 -8.181 -3.862 1.00 0.00 H new ATOM 0 HG21 THR A 43 -18.121 -7.723 -3.156 1.00 0.00 H new ATOM 0 HG22 THR A 43 -18.304 -6.560 -1.821 1.00 0.00 H new ATOM 0 HG23 THR A 43 -17.771 -5.998 -3.423 1.00 0.00 H new ATOM 622 N PRO A 44 -14.111 -6.847 -0.045 1.00 0.00 N ATOM 623 CA PRO A 44 -12.752 -7.140 0.495 1.00 0.00 C ATOM 624 C PRO A 44 -11.922 -8.009 -0.465 1.00 0.00 C ATOM 625 O PRO A 44 -10.768 -8.321 -0.193 1.00 0.00 O ATOM 626 CB PRO A 44 -13.009 -7.851 1.800 1.00 0.00 C ATOM 627 CG PRO A 44 -14.456 -8.416 1.722 1.00 0.00 C ATOM 628 CD PRO A 44 -15.203 -7.545 0.679 1.00 0.00 C ATOM 0 HA PRO A 44 -12.165 -6.231 0.626 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -12.288 -8.654 1.952 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -12.906 -7.166 2.641 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -14.449 -9.464 1.421 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -14.947 -8.366 2.694 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -15.804 -8.155 0.005 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -15.880 -6.839 1.159 1.00 0.00 H new ATOM 636 N ALA A 45 -12.493 -8.366 -1.584 1.00 0.00 N ATOM 637 CA ALA A 45 -11.773 -9.182 -2.613 1.00 0.00 C ATOM 638 C ALA A 45 -11.020 -8.230 -3.520 1.00 0.00 C ATOM 639 O ALA A 45 -9.776 -8.186 -3.544 1.00 0.00 O ATOM 640 CB ALA A 45 -12.801 -9.958 -3.430 1.00 0.00 C ATOM 0 H ALA A 45 -13.451 -8.122 -1.836 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.081 -9.881 -2.143 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -12.290 -10.557 -4.184 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -13.370 -10.613 -2.771 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -13.479 -9.259 -3.920 1.00 0.00 H new ATOM 646 N GLU A 46 -11.767 -7.443 -4.243 1.00 0.00 N ATOM 647 CA GLU A 46 -11.141 -6.410 -5.168 1.00 0.00 C ATOM 648 C GLU A 46 -10.264 -5.459 -4.318 1.00 0.00 C ATOM 649 O GLU A 46 -9.207 -5.012 -4.753 1.00 0.00 O ATOM 650 CB GLU A 46 -12.215 -5.610 -5.963 1.00 0.00 C ATOM 651 CG GLU A 46 -13.528 -5.485 -5.203 1.00 0.00 C ATOM 652 CD GLU A 46 -14.564 -6.440 -5.806 1.00 0.00 C ATOM 653 OE1 GLU A 46 -14.304 -7.633 -5.820 1.00 0.00 O ATOM 654 OE2 GLU A 46 -15.599 -5.963 -6.242 1.00 0.00 O ATOM 0 H GLU A 46 -12.787 -7.458 -4.245 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.529 -6.924 -5.909 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -11.831 -4.614 -6.185 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -12.397 -6.102 -6.918 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -13.374 -5.718 -4.149 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -13.892 -4.459 -5.252 1.00 0.00 H new ATOM 661 N VAL A 47 -10.670 -5.227 -3.078 1.00 0.00 N ATOM 662 CA VAL A 47 -9.871 -4.401 -2.116 1.00 0.00 C ATOM 663 C VAL A 47 -8.776 -5.271 -1.487 1.00 0.00 C ATOM 664 O VAL A 47 -7.742 -4.768 -1.083 1.00 0.00 O ATOM 665 CB VAL A 47 -10.837 -3.742 -1.083 1.00 0.00 C ATOM 666 CG1 VAL A 47 -10.246 -3.630 0.270 1.00 0.00 C ATOM 667 CG2 VAL A 47 -11.051 -2.290 -1.478 1.00 0.00 C ATOM 0 H VAL A 47 -11.543 -5.588 -2.693 1.00 0.00 H new ATOM 0 HA VAL A 47 -9.357 -3.584 -2.621 1.00 0.00 H new ATOM 0 HB VAL A 47 -11.733 -4.363 -1.075 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -10.965 -3.164 0.944 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -9.993 -4.624 0.640 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -9.344 -3.020 0.224 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.725 -1.815 -0.765 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -10.094 -1.768 -1.477 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -11.488 -2.245 -2.476 1.00 0.00 H new ATOM 677 N GLY A 48 -8.988 -6.573 -1.436 1.00 0.00 N ATOM 678 CA GLY A 48 -7.953 -7.502 -0.879 1.00 0.00 C ATOM 679 C GLY A 48 -6.660 -7.346 -1.676 1.00 0.00 C ATOM 680 O GLY A 48 -5.588 -7.572 -1.169 1.00 0.00 O ATOM 0 H GLY A 48 -9.841 -7.029 -1.760 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -7.775 -7.279 0.173 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.305 -8.532 -0.932 1.00 0.00 H new ATOM 684 N VAL A 49 -6.776 -6.959 -2.930 1.00 0.00 N ATOM 685 CA VAL A 49 -5.546 -6.770 -3.798 1.00 0.00 C ATOM 686 C VAL A 49 -5.136 -5.285 -3.836 1.00 0.00 C ATOM 687 O VAL A 49 -3.955 -4.960 -3.825 1.00 0.00 O ATOM 688 CB VAL A 49 -5.792 -7.311 -5.219 1.00 0.00 C ATOM 689 CG1 VAL A 49 -6.865 -6.491 -5.948 1.00 0.00 C ATOM 690 CG2 VAL A 49 -4.480 -7.239 -5.993 1.00 0.00 C ATOM 0 H VAL A 49 -7.663 -6.765 -3.394 1.00 0.00 H new ATOM 0 HA VAL A 49 -4.725 -7.339 -3.361 1.00 0.00 H new ATOM 0 HB VAL A 49 -6.146 -8.340 -5.153 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -7.016 -6.897 -6.948 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -7.801 -6.540 -5.391 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -6.541 -5.453 -6.023 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -4.632 -7.618 -7.004 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -4.142 -6.204 -6.041 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -3.726 -7.844 -5.489 1.00 0.00 H new ATOM 700 N LEU A 50 -6.100 -4.402 -3.819 1.00 0.00 N ATOM 701 CA LEU A 50 -5.826 -2.928 -3.787 1.00 0.00 C ATOM 702 C LEU A 50 -5.230 -2.520 -2.439 1.00 0.00 C ATOM 703 O LEU A 50 -4.799 -1.385 -2.265 1.00 0.00 O ATOM 704 CB LEU A 50 -7.155 -2.205 -3.915 1.00 0.00 C ATOM 705 CG LEU A 50 -7.517 -1.852 -5.337 1.00 0.00 C ATOM 706 CD1 LEU A 50 -9.033 -1.592 -5.393 1.00 0.00 C ATOM 707 CD2 LEU A 50 -6.793 -0.563 -5.721 1.00 0.00 C ATOM 0 H LEU A 50 -7.091 -4.644 -3.826 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.133 -2.679 -4.591 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -7.942 -2.831 -3.494 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -7.121 -1.292 -3.320 1.00 0.00 H new ATOM 0 HG LEU A 50 -7.236 -2.658 -6.015 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -9.321 -1.334 -6.412 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -9.568 -2.489 -5.081 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -9.286 -0.768 -4.726 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -7.046 -0.296 -6.747 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -7.100 0.240 -5.051 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.716 -0.712 -5.639 1.00 0.00 H new ATOM 719 N VAL A 51 -5.303 -3.397 -1.471 1.00 0.00 N ATOM 720 CA VAL A 51 -4.855 -3.046 -0.081 1.00 0.00 C ATOM 721 C VAL A 51 -4.233 -4.277 0.627 1.00 0.00 C ATOM 722 O VAL A 51 -3.703 -4.154 1.723 1.00 0.00 O ATOM 723 CB VAL A 51 -6.147 -2.503 0.707 1.00 0.00 C ATOM 724 CG1 VAL A 51 -7.123 -1.827 -0.269 1.00 0.00 C ATOM 725 CG2 VAL A 51 -6.918 -3.644 1.408 1.00 0.00 C ATOM 0 H VAL A 51 -5.655 -4.348 -1.580 1.00 0.00 H new ATOM 0 HA VAL A 51 -4.079 -2.281 -0.105 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.780 -1.797 1.452 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -7.993 -1.464 0.279 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -6.627 -0.989 -0.758 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -7.443 -2.548 -1.021 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -7.783 -3.233 1.928 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.252 -4.368 0.665 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.264 -4.138 2.127 1.00 0.00 H new ATOM 735 N GLY A 52 -4.304 -5.462 0.006 1.00 0.00 N ATOM 736 CA GLY A 52 -3.742 -6.701 0.610 1.00 0.00 C ATOM 737 C GLY A 52 -2.361 -6.448 1.154 1.00 0.00 C ATOM 738 O GLY A 52 -1.506 -5.872 0.492 1.00 0.00 O ATOM 0 H GLY A 52 -4.739 -5.600 -0.906 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -4.395 -7.050 1.410 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -3.704 -7.492 -0.139 1.00 0.00 H new ATOM 742 N LYS A 53 -2.142 -6.889 2.359 1.00 0.00 N ATOM 743 CA LYS A 53 -0.820 -6.719 3.024 1.00 0.00 C ATOM 744 C LYS A 53 0.289 -7.314 2.149 1.00 0.00 C ATOM 745 O LYS A 53 1.453 -6.982 2.306 1.00 0.00 O ATOM 746 CB LYS A 53 -0.832 -7.396 4.400 1.00 0.00 C ATOM 747 CG LYS A 53 -1.301 -8.854 4.268 1.00 0.00 C ATOM 748 CD LYS A 53 -0.081 -9.783 4.099 1.00 0.00 C ATOM 749 CE LYS A 53 -0.097 -10.857 5.195 1.00 0.00 C ATOM 750 NZ LYS A 53 0.248 -10.233 6.503 1.00 0.00 N ATOM 0 H LYS A 53 -2.840 -7.372 2.925 1.00 0.00 H new ATOM 0 HA LYS A 53 -0.626 -5.655 3.159 1.00 0.00 H new ATOM 0 HB2 LYS A 53 0.166 -7.365 4.838 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -1.493 -6.853 5.075 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -1.870 -9.144 5.151 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -1.968 -8.955 3.412 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -0.102 -10.252 3.115 1.00 0.00 H new ATOM 0 HD3 LYS A 53 0.841 -9.204 4.156 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -1.081 -11.322 5.250 1.00 0.00 H new ATOM 0 HE3 LYS A 53 0.616 -11.646 4.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 0.321 -10.972 7.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 1.158 -9.736 6.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -0.494 -9.555 6.771 1.00 0.00 H new ATOM 764 N ASP A 54 -0.077 -8.183 1.195 1.00 0.00 N ATOM 765 CA ASP A 54 0.908 -8.796 0.269 1.00 0.00 C ATOM 766 C ASP A 54 1.790 -7.694 -0.302 1.00 0.00 C ATOM 767 O ASP A 54 1.307 -6.658 -0.754 1.00 0.00 O ATOM 768 CB ASP A 54 0.184 -9.519 -0.842 1.00 0.00 C ATOM 769 CG ASP A 54 1.047 -10.675 -1.340 1.00 0.00 C ATOM 770 OD1 ASP A 54 2.027 -10.407 -2.012 1.00 0.00 O ATOM 771 OD2 ASP A 54 0.716 -11.807 -1.036 1.00 0.00 O ATOM 0 H ASP A 54 -1.040 -8.481 1.039 1.00 0.00 H new ATOM 0 HA ASP A 54 1.526 -9.518 0.803 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -0.774 -9.894 -0.483 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -0.029 -8.831 -1.660 1.00 0.00 H new ATOM 776 N ARG A 55 3.060 -7.892 -0.208 1.00 0.00 N ATOM 777 CA ARG A 55 4.038 -6.878 -0.645 1.00 0.00 C ATOM 778 C ARG A 55 4.834 -7.340 -1.879 1.00 0.00 C ATOM 779 O ARG A 55 6.004 -6.979 -2.031 1.00 0.00 O ATOM 780 CB ARG A 55 5.002 -6.602 0.534 1.00 0.00 C ATOM 781 CG ARG A 55 5.780 -7.894 0.891 1.00 0.00 C ATOM 782 CD ARG A 55 5.446 -8.340 2.329 1.00 0.00 C ATOM 783 NE ARG A 55 5.002 -9.767 2.325 1.00 0.00 N ATOM 784 CZ ARG A 55 5.877 -10.725 2.152 1.00 0.00 C ATOM 785 NH1 ARG A 55 6.576 -11.170 3.164 1.00 0.00 N ATOM 786 NH2 ARG A 55 6.054 -11.240 0.967 1.00 0.00 N ATOM 0 H ARG A 55 3.477 -8.744 0.167 1.00 0.00 H new ATOM 0 HA ARG A 55 3.504 -5.972 -0.932 1.00 0.00 H new ATOM 0 HB2 ARG A 55 5.700 -5.809 0.267 1.00 0.00 H new ATOM 0 HB3 ARG A 55 4.440 -6.254 1.401 1.00 0.00 H new ATOM 0 HG2 ARG A 55 5.524 -8.687 0.188 1.00 0.00 H new ATOM 0 HG3 ARG A 55 6.852 -7.719 0.797 1.00 0.00 H new ATOM 0 HD2 ARG A 55 6.321 -8.223 2.968 1.00 0.00 H new ATOM 0 HD3 ARG A 55 4.662 -7.706 2.743 1.00 0.00 H new ATOM 0 HE ARG A 55 4.017 -9.995 2.457 1.00 0.00 H new ATOM 0 HH11 ARG A 55 6.440 -10.770 4.093 1.00 0.00 H new ATOM 0 HH12 ARG A 55 7.257 -11.917 3.025 1.00 0.00 H new ATOM 0 HH21 ARG A 55 5.511 -10.896 0.175 1.00 0.00 H new ATOM 0 HH22 ARG A 55 6.736 -11.987 0.832 1.00 0.00 H new ATOM 800 N SER A 56 4.230 -8.119 -2.779 1.00 0.00 N ATOM 801 CA SER A 56 5.026 -8.558 -4.005 1.00 0.00 C ATOM 802 C SER A 56 4.186 -9.258 -5.083 1.00 0.00 C ATOM 803 O SER A 56 4.682 -9.493 -6.182 1.00 0.00 O ATOM 804 CB SER A 56 6.139 -9.491 -3.553 1.00 0.00 C ATOM 805 OG SER A 56 7.120 -9.591 -4.580 1.00 0.00 O ATOM 0 H SER A 56 3.269 -8.456 -2.725 1.00 0.00 H new ATOM 0 HA SER A 56 5.417 -7.651 -4.467 1.00 0.00 H new ATOM 0 HB2 SER A 56 6.594 -9.115 -2.636 1.00 0.00 H new ATOM 0 HB3 SER A 56 5.732 -10.477 -3.326 1.00 0.00 H new ATOM 0 HG SER A 56 6.681 -9.564 -5.456 1.00 0.00 H new ATOM 811 N SER A 57 2.959 -9.613 -4.793 1.00 0.00 N ATOM 812 CA SER A 57 2.121 -10.324 -5.800 1.00 0.00 C ATOM 813 C SER A 57 1.532 -9.337 -6.842 1.00 0.00 C ATOM 814 O SER A 57 2.177 -9.019 -7.825 1.00 0.00 O ATOM 815 CB SER A 57 1.018 -11.108 -5.073 1.00 0.00 C ATOM 816 OG SER A 57 0.458 -10.299 -4.044 1.00 0.00 O ATOM 0 H SER A 57 2.502 -9.439 -3.898 1.00 0.00 H new ATOM 0 HA SER A 57 2.744 -11.025 -6.355 1.00 0.00 H new ATOM 0 HB2 SER A 57 0.243 -11.405 -5.779 1.00 0.00 H new ATOM 0 HB3 SER A 57 1.429 -12.024 -4.647 1.00 0.00 H new ATOM 0 HG SER A 57 -0.288 -10.775 -3.624 1.00 0.00 H new ATOM 822 N PHE A 58 0.309 -8.902 -6.646 1.00 0.00 N ATOM 823 CA PHE A 58 -0.391 -7.958 -7.627 1.00 0.00 C ATOM 824 C PHE A 58 0.512 -6.889 -8.249 1.00 0.00 C ATOM 825 O PHE A 58 0.176 -6.365 -9.304 1.00 0.00 O ATOM 826 CB PHE A 58 -1.608 -7.307 -6.997 1.00 0.00 C ATOM 827 CG PHE A 58 -1.284 -6.668 -5.671 1.00 0.00 C ATOM 828 CD1 PHE A 58 -1.309 -7.431 -4.503 1.00 0.00 C ATOM 829 CD2 PHE A 58 -1.002 -5.295 -5.607 1.00 0.00 C ATOM 830 CE1 PHE A 58 -1.048 -6.827 -3.270 1.00 0.00 C ATOM 831 CE2 PHE A 58 -0.748 -4.694 -4.371 1.00 0.00 C ATOM 832 CZ PHE A 58 -0.769 -5.460 -3.205 1.00 0.00 C ATOM 0 H PHE A 58 -0.258 -9.157 -5.837 1.00 0.00 H new ATOM 0 HA PHE A 58 -0.701 -8.604 -8.449 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.007 -6.553 -7.675 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -2.388 -8.055 -6.858 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -1.530 -8.487 -4.552 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -0.981 -4.704 -6.511 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -1.062 -7.418 -2.366 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -0.535 -3.636 -4.318 1.00 0.00 H new ATOM 0 HZ PHE A 58 -0.569 -4.995 -2.251 1.00 0.00 H new ATOM 842 N TYR A 59 1.641 -6.526 -7.639 1.00 0.00 N ATOM 843 CA TYR A 59 2.509 -5.458 -8.262 1.00 0.00 C ATOM 844 C TYR A 59 3.007 -5.852 -9.661 1.00 0.00 C ATOM 845 O TYR A 59 3.690 -5.069 -10.313 1.00 0.00 O ATOM 846 CB TYR A 59 3.705 -5.117 -7.363 1.00 0.00 C ATOM 847 CG TYR A 59 3.245 -4.676 -5.997 1.00 0.00 C ATOM 848 CD1 TYR A 59 2.284 -3.679 -5.884 1.00 0.00 C ATOM 849 CD2 TYR A 59 3.812 -5.236 -4.848 1.00 0.00 C ATOM 850 CE1 TYR A 59 1.880 -3.235 -4.621 1.00 0.00 C ATOM 851 CE2 TYR A 59 3.404 -4.798 -3.582 1.00 0.00 C ATOM 852 CZ TYR A 59 2.439 -3.796 -3.469 1.00 0.00 C ATOM 853 OH TYR A 59 2.044 -3.356 -2.222 1.00 0.00 O ATOM 0 H TYR A 59 1.985 -6.915 -6.761 1.00 0.00 H new ATOM 0 HA TYR A 59 1.879 -4.575 -8.366 1.00 0.00 H new ATOM 0 HB2 TYR A 59 4.354 -5.988 -7.269 1.00 0.00 H new ATOM 0 HB3 TYR A 59 4.297 -4.327 -7.824 1.00 0.00 H new ATOM 0 HD1 TYR A 59 1.848 -3.246 -6.773 1.00 0.00 H new ATOM 0 HD2 TYR A 59 4.564 -6.006 -4.937 1.00 0.00 H new ATOM 0 HE1 TYR A 59 1.135 -2.458 -4.535 1.00 0.00 H new ATOM 0 HE2 TYR A 59 3.836 -5.235 -2.694 1.00 0.00 H new ATOM 0 HH TYR A 59 2.530 -3.852 -1.531 1.00 0.00 H new ATOM 863 N VAL A 60 2.684 -7.034 -10.122 1.00 0.00 N ATOM 864 CA VAL A 60 3.122 -7.487 -11.458 1.00 0.00 C ATOM 865 C VAL A 60 1.914 -7.865 -12.326 1.00 0.00 C ATOM 866 O VAL A 60 1.967 -7.720 -13.545 1.00 0.00 O ATOM 867 CB VAL A 60 4.059 -8.693 -11.316 1.00 0.00 C ATOM 868 CG1 VAL A 60 5.495 -8.192 -11.221 1.00 0.00 C ATOM 869 CG2 VAL A 60 3.728 -9.500 -10.037 1.00 0.00 C ATOM 0 H VAL A 60 2.122 -7.713 -9.609 1.00 0.00 H new ATOM 0 HA VAL A 60 3.654 -6.669 -11.944 1.00 0.00 H new ATOM 0 HB VAL A 60 3.931 -9.340 -12.184 1.00 0.00 H new ATOM 0 HG11 VAL A 60 6.171 -9.041 -11.120 1.00 0.00 H new ATOM 0 HG12 VAL A 60 5.746 -7.634 -12.123 1.00 0.00 H new ATOM 0 HG13 VAL A 60 5.597 -7.542 -10.352 1.00 0.00 H new ATOM 0 HG21 VAL A 60 4.405 -10.350 -9.958 1.00 0.00 H new ATOM 0 HG22 VAL A 60 3.845 -8.860 -9.162 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.700 -9.859 -10.089 1.00 0.00 H new ATOM 879 N ASN A 61 0.822 -8.363 -11.723 1.00 0.00 N ATOM 880 CA ASN A 61 -0.356 -8.749 -12.525 1.00 0.00 C ATOM 881 C ASN A 61 -1.353 -7.590 -12.616 1.00 0.00 C ATOM 882 O ASN A 61 -1.820 -7.266 -13.704 1.00 0.00 O ATOM 883 CB ASN A 61 -1.023 -9.990 -11.929 1.00 0.00 C ATOM 884 CG ASN A 61 -1.278 -9.851 -10.450 1.00 0.00 C ATOM 885 OD1 ASN A 61 -2.172 -9.139 -10.035 1.00 0.00 O ATOM 886 ND2 ASN A 61 -0.538 -10.540 -9.619 1.00 0.00 N ATOM 0 H ASN A 61 0.727 -8.505 -10.717 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.022 -8.988 -13.535 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -1.967 -10.173 -12.442 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -0.390 -10.860 -12.106 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -0.709 -10.482 -8.615 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.210 -11.135 -9.975 1.00 0.00 H new ATOM 893 N GLY A 62 -1.681 -6.952 -11.493 1.00 0.00 N ATOM 894 CA GLY A 62 -2.630 -5.820 -11.519 1.00 0.00 C ATOM 895 C GLY A 62 -3.662 -5.984 -10.399 1.00 0.00 C ATOM 896 O GLY A 62 -3.935 -7.089 -9.949 1.00 0.00 O ATOM 0 H GLY A 62 -1.318 -7.186 -10.569 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -2.092 -4.880 -11.396 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -3.132 -5.776 -12.485 1.00 0.00 H new ATOM 900 N LEU A 63 -4.235 -4.879 -9.952 1.00 0.00 N ATOM 901 CA LEU A 63 -5.266 -4.923 -8.844 1.00 0.00 C ATOM 902 C LEU A 63 -6.624 -5.278 -9.431 1.00 0.00 C ATOM 903 O LEU A 63 -6.705 -5.814 -10.526 1.00 0.00 O ATOM 904 CB LEU A 63 -5.370 -3.550 -8.128 1.00 0.00 C ATOM 905 CG LEU A 63 -4.010 -3.033 -7.733 1.00 0.00 C ATOM 906 CD1 LEU A 63 -4.172 -1.626 -7.149 1.00 0.00 C ATOM 907 CD2 LEU A 63 -3.422 -3.947 -6.680 1.00 0.00 C ATOM 0 H LEU A 63 -4.033 -3.945 -10.308 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.958 -5.676 -8.118 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.858 -2.831 -8.786 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.996 -3.647 -7.241 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.351 -3.003 -8.601 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -3.196 -1.238 -6.858 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.615 -0.970 -7.898 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -4.821 -1.668 -6.274 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.438 -3.580 -6.388 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -4.076 -3.965 -5.808 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -3.328 -4.955 -7.084 1.00 0.00 H new ATOM 919 N THR A 64 -7.697 -4.964 -8.699 1.00 0.00 N ATOM 920 CA THR A 64 -9.059 -5.259 -9.156 1.00 0.00 C ATOM 921 C THR A 64 -9.996 -4.441 -8.342 1.00 0.00 C ATOM 922 O THR A 64 -10.000 -4.537 -7.131 1.00 0.00 O ATOM 923 CB THR A 64 -9.396 -6.721 -8.915 1.00 0.00 C ATOM 924 OG1 THR A 64 -9.048 -7.072 -7.583 1.00 0.00 O ATOM 925 CG2 THR A 64 -8.627 -7.580 -9.882 1.00 0.00 C ATOM 0 H THR A 64 -7.649 -4.506 -7.789 1.00 0.00 H new ATOM 0 HA THR A 64 -9.139 -5.039 -10.220 1.00 0.00 H new ATOM 0 HB THR A 64 -10.464 -6.879 -9.064 1.00 0.00 H new ATOM 0 HG1 THR A 64 -9.239 -6.319 -6.986 1.00 0.00 H new ATOM 0 HG21 THR A 64 -8.869 -8.629 -9.709 1.00 0.00 H new ATOM 0 HG22 THR A 64 -8.896 -7.309 -10.903 1.00 0.00 H new ATOM 0 HG23 THR A 64 -7.558 -7.425 -9.736 1.00 0.00 H new ATOM 933 N LEU A 65 -10.783 -3.650 -8.987 1.00 0.00 N ATOM 934 CA LEU A 65 -11.778 -2.802 -8.272 1.00 0.00 C ATOM 935 C LEU A 65 -13.106 -2.867 -8.981 1.00 0.00 C ATOM 936 O LEU A 65 -13.279 -2.360 -10.080 1.00 0.00 O ATOM 937 CB LEU A 65 -11.297 -1.368 -8.070 1.00 0.00 C ATOM 938 CG LEU A 65 -10.331 -0.893 -9.155 1.00 0.00 C ATOM 939 CD1 LEU A 65 -10.147 0.618 -9.009 1.00 0.00 C ATOM 940 CD2 LEU A 65 -8.964 -1.574 -8.962 1.00 0.00 C ATOM 0 H LEU A 65 -10.786 -3.546 -10.002 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.903 -3.204 -7.267 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.160 -0.703 -8.046 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.808 -1.290 -7.099 1.00 0.00 H new ATOM 0 HG LEU A 65 -10.729 -1.141 -10.139 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -9.460 0.977 -9.775 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -11.110 1.115 -9.124 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -9.739 0.841 -8.023 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -8.276 -1.235 -9.736 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -8.564 -1.315 -7.982 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.083 -2.655 -9.031 1.00 0.00 H new ATOM 952 N GLY A 66 -14.042 -3.559 -8.351 1.00 0.00 N ATOM 953 CA GLY A 66 -15.392 -3.768 -8.930 1.00 0.00 C ATOM 954 C GLY A 66 -15.296 -4.872 -9.993 1.00 0.00 C ATOM 955 O GLY A 66 -16.134 -4.966 -10.879 1.00 0.00 O ATOM 0 H GLY A 66 -13.907 -3.992 -7.437 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -16.099 -4.052 -8.151 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -15.761 -2.844 -9.375 1.00 0.00 H new ATOM 959 N GLY A 67 -14.247 -5.704 -9.919 1.00 0.00 N ATOM 960 CA GLY A 67 -14.056 -6.778 -10.923 1.00 0.00 C ATOM 961 C GLY A 67 -13.274 -6.205 -12.112 1.00 0.00 C ATOM 962 O GLY A 67 -13.219 -6.821 -13.172 1.00 0.00 O ATOM 0 H GLY A 67 -13.529 -5.663 -9.195 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -13.515 -7.615 -10.483 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -15.021 -7.161 -11.255 1.00 0.00 H new ATOM 966 N GLN A 68 -12.656 -5.013 -11.948 1.00 0.00 N ATOM 967 CA GLN A 68 -11.876 -4.413 -13.085 1.00 0.00 C ATOM 968 C GLN A 68 -10.389 -4.559 -12.819 1.00 0.00 C ATOM 969 O GLN A 68 -9.792 -3.781 -12.075 1.00 0.00 O ATOM 970 CB GLN A 68 -12.235 -2.943 -13.252 1.00 0.00 C ATOM 971 CG GLN A 68 -11.261 -2.201 -14.248 1.00 0.00 C ATOM 972 CD GLN A 68 -10.912 -3.090 -15.469 1.00 0.00 C ATOM 973 OE1 GLN A 68 -9.652 -3.222 -15.834 1.00 0.00 O flip ATOM 974 NE2 GLN A 68 -11.790 -3.661 -16.089 1.00 0.00 N flip ATOM 0 H GLN A 68 -12.670 -4.461 -11.090 1.00 0.00 H new ATOM 0 HA GLN A 68 -12.128 -4.940 -14.005 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -13.258 -2.860 -13.618 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -12.203 -2.450 -12.280 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -11.725 -1.276 -14.591 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -10.346 -1.924 -13.725 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -12.764 -3.558 -15.805 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -11.551 -4.243 -16.892 1.00 0.00 H new ATOM 983 N LYS A 69 -9.793 -5.543 -13.433 1.00 0.00 N ATOM 984 CA LYS A 69 -8.358 -5.787 -13.272 1.00 0.00 C ATOM 985 C LYS A 69 -7.558 -4.634 -13.864 1.00 0.00 C ATOM 986 O LYS A 69 -7.405 -4.536 -15.080 1.00 0.00 O ATOM 987 CB LYS A 69 -7.999 -7.079 -14.003 1.00 0.00 C ATOM 988 CG LYS A 69 -6.999 -7.874 -13.180 1.00 0.00 C ATOM 989 CD LYS A 69 -7.292 -9.349 -13.348 1.00 0.00 C ATOM 990 CE LYS A 69 -6.185 -10.184 -12.682 1.00 0.00 C ATOM 991 NZ LYS A 69 -6.462 -10.304 -11.223 1.00 0.00 N ATOM 0 H LYS A 69 -10.267 -6.199 -14.054 1.00 0.00 H new ATOM 0 HA LYS A 69 -8.120 -5.871 -12.212 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -8.897 -7.673 -14.174 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -7.578 -6.849 -14.982 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -5.982 -7.652 -13.504 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -7.067 -7.593 -12.129 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -8.258 -9.589 -12.903 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -7.358 -9.597 -14.407 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -6.138 -11.174 -13.137 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -5.215 -9.714 -12.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -5.714 -10.869 -10.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -6.486 -9.356 -10.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -7.380 -10.771 -11.081 1.00 0.00 H new ATOM 1005 N CYS A 70 -6.985 -3.801 -13.014 1.00 0.00 N ATOM 1006 CA CYS A 70 -6.121 -2.704 -13.508 1.00 0.00 C ATOM 1007 C CYS A 70 -4.708 -3.151 -13.224 1.00 0.00 C ATOM 1008 O CYS A 70 -4.500 -4.214 -12.658 1.00 0.00 O ATOM 1009 CB CYS A 70 -6.448 -1.391 -12.813 1.00 0.00 C ATOM 1010 SG CYS A 70 -6.589 -1.628 -11.028 1.00 0.00 S ATOM 0 H CYS A 70 -7.088 -3.846 -12.000 1.00 0.00 H new ATOM 0 HA CYS A 70 -6.271 -2.515 -14.571 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -5.670 -0.658 -13.027 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -7.382 -0.989 -13.206 1.00 0.00 H new ATOM 0 HG CYS A 70 -7.538 -2.480 -10.777 1.00 0.00 H new ATOM 1016 N SER A 71 -3.749 -2.413 -13.646 1.00 0.00 N ATOM 1017 CA SER A 71 -2.328 -2.858 -13.457 1.00 0.00 C ATOM 1018 C SER A 71 -1.454 -1.789 -12.860 1.00 0.00 C ATOM 1019 O SER A 71 -1.085 -0.834 -13.522 1.00 0.00 O ATOM 1020 CB SER A 71 -1.793 -3.227 -14.787 1.00 0.00 C ATOM 1021 OG SER A 71 -1.735 -2.047 -15.586 1.00 0.00 O ATOM 0 H SER A 71 -3.866 -1.516 -14.117 1.00 0.00 H new ATOM 0 HA SER A 71 -2.323 -3.698 -12.762 1.00 0.00 H new ATOM 0 HB2 SER A 71 -0.801 -3.669 -14.689 1.00 0.00 H new ATOM 0 HB3 SER A 71 -2.430 -3.975 -15.259 1.00 0.00 H new ATOM 0 HG SER A 71 -1.299 -1.330 -15.080 1.00 0.00 H new ATOM 1027 N VAL A 72 -1.081 -1.970 -11.627 1.00 0.00 N ATOM 1028 CA VAL A 72 -0.185 -0.994 -10.926 1.00 0.00 C ATOM 1029 C VAL A 72 0.998 -0.643 -11.783 1.00 0.00 C ATOM 1030 O VAL A 72 1.767 -1.502 -12.208 1.00 0.00 O ATOM 1031 CB VAL A 72 0.339 -1.581 -9.634 1.00 0.00 C ATOM 1032 CG1 VAL A 72 1.027 -0.480 -8.809 1.00 0.00 C ATOM 1033 CG2 VAL A 72 -0.799 -2.188 -8.835 1.00 0.00 C ATOM 0 H VAL A 72 -1.362 -2.768 -11.058 1.00 0.00 H new ATOM 0 HA VAL A 72 -0.778 -0.103 -10.722 1.00 0.00 H new ATOM 0 HB VAL A 72 1.061 -2.364 -9.866 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.404 -0.904 -7.878 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.857 -0.062 -9.380 1.00 0.00 H new ATOM 0 HG13 VAL A 72 0.309 0.308 -8.583 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -0.409 -2.607 -7.907 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -1.533 -1.416 -8.604 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -1.273 -2.977 -9.419 1.00 0.00 H new ATOM 1043 N ILE A 73 1.158 0.620 -11.988 1.00 0.00 N ATOM 1044 CA ILE A 73 2.275 1.140 -12.751 1.00 0.00 C ATOM 1045 C ILE A 73 2.858 2.309 -11.925 1.00 0.00 C ATOM 1046 O ILE A 73 2.649 3.450 -12.186 1.00 0.00 O ATOM 1047 CB ILE A 73 1.829 1.555 -14.154 1.00 0.00 C ATOM 1048 CG1 ILE A 73 1.431 0.265 -14.953 1.00 0.00 C ATOM 1049 CG2 ILE A 73 2.972 2.283 -14.894 1.00 0.00 C ATOM 1050 CD1 ILE A 73 0.520 0.603 -16.169 1.00 0.00 C ATOM 0 H ILE A 73 0.523 1.336 -11.636 1.00 0.00 H new ATOM 0 HA ILE A 73 3.046 0.387 -12.913 1.00 0.00 H new ATOM 0 HB ILE A 73 0.980 2.234 -14.076 1.00 0.00 H new ATOM 0 HG12 ILE A 73 2.332 -0.240 -15.302 1.00 0.00 H new ATOM 0 HG13 ILE A 73 0.913 -0.428 -14.291 1.00 0.00 H new ATOM 0 HG21 ILE A 73 2.636 2.570 -15.890 1.00 0.00 H new ATOM 0 HG22 ILE A 73 3.257 3.175 -14.336 1.00 0.00 H new ATOM 0 HG23 ILE A 73 3.832 1.618 -14.979 1.00 0.00 H new ATOM 0 HD11 ILE A 73 0.265 -0.315 -16.699 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -0.392 1.085 -15.817 1.00 0.00 H new ATOM 0 HD13 ILE A 73 1.049 1.276 -16.844 1.00 0.00 H new ATOM 1062 N ARG A 74 3.538 1.934 -10.891 1.00 0.00 N ATOM 1063 CA ARG A 74 4.212 2.861 -9.881 1.00 0.00 C ATOM 1064 C ARG A 74 3.499 2.705 -8.539 1.00 0.00 C ATOM 1065 O ARG A 74 2.774 3.596 -8.090 1.00 0.00 O ATOM 1066 CB ARG A 74 4.217 4.349 -10.321 1.00 0.00 C ATOM 1067 CG ARG A 74 5.040 5.181 -9.320 1.00 0.00 C ATOM 1068 CD ARG A 74 5.982 6.129 -10.073 1.00 0.00 C ATOM 1069 NE ARG A 74 6.394 7.239 -9.163 1.00 0.00 N ATOM 1070 CZ ARG A 74 7.342 8.070 -9.522 1.00 0.00 C ATOM 1071 NH1 ARG A 74 8.477 7.615 -9.987 1.00 0.00 N ATOM 1072 NH2 ARG A 74 7.154 9.359 -9.410 1.00 0.00 N ATOM 0 H ARG A 74 3.678 0.948 -10.668 1.00 0.00 H new ATOM 0 HA ARG A 74 5.260 2.571 -9.804 1.00 0.00 H new ATOM 0 HB2 ARG A 74 4.641 4.442 -11.321 1.00 0.00 H new ATOM 0 HB3 ARG A 74 3.196 4.727 -10.371 1.00 0.00 H new ATOM 0 HG2 ARG A 74 4.373 5.754 -8.676 1.00 0.00 H new ATOM 0 HG3 ARG A 74 5.617 4.520 -8.673 1.00 0.00 H new ATOM 0 HD2 ARG A 74 6.860 5.586 -10.424 1.00 0.00 H new ATOM 0 HD3 ARG A 74 5.483 6.532 -10.954 1.00 0.00 H new ATOM 0 HE ARG A 74 5.936 7.351 -8.259 1.00 0.00 H new ATOM 0 HH11 ARG A 74 8.627 6.610 -10.071 1.00 0.00 H new ATOM 0 HH12 ARG A 74 9.212 8.266 -10.265 1.00 0.00 H new ATOM 0 HH21 ARG A 74 6.271 9.716 -9.044 1.00 0.00 H new ATOM 0 HH22 ARG A 74 7.890 10.008 -9.689 1.00 0.00 H new ATOM 1086 N ASP A 75 3.695 1.559 -7.885 1.00 0.00 N ATOM 1087 CA ASP A 75 3.030 1.332 -6.575 1.00 0.00 C ATOM 1088 C ASP A 75 3.637 2.228 -5.511 1.00 0.00 C ATOM 1089 O ASP A 75 4.667 1.931 -4.921 1.00 0.00 O ATOM 1090 CB ASP A 75 3.023 -0.196 -6.184 1.00 0.00 C ATOM 1091 CG ASP A 75 3.090 -0.421 -4.645 1.00 0.00 C ATOM 1092 OD1 ASP A 75 2.292 0.163 -3.935 1.00 0.00 O ATOM 1093 OD2 ASP A 75 3.953 -1.171 -4.217 1.00 0.00 O ATOM 0 H ASP A 75 4.283 0.793 -8.214 1.00 0.00 H new ATOM 0 HA ASP A 75 1.980 1.613 -6.659 1.00 0.00 H new ATOM 0 HB2 ASP A 75 2.120 -0.663 -6.577 1.00 0.00 H new ATOM 0 HB3 ASP A 75 3.870 -0.692 -6.657 1.00 0.00 H new ATOM 1098 N SER A 76 2.946 3.318 -5.253 1.00 0.00 N ATOM 1099 CA SER A 76 3.373 4.293 -4.197 1.00 0.00 C ATOM 1100 C SER A 76 2.198 4.471 -3.177 1.00 0.00 C ATOM 1101 O SER A 76 2.315 5.181 -2.199 1.00 0.00 O ATOM 1102 CB SER A 76 3.728 5.650 -4.835 1.00 0.00 C ATOM 1103 OG SER A 76 4.930 6.131 -4.257 1.00 0.00 O ATOM 0 H SER A 76 2.088 3.576 -5.741 1.00 0.00 H new ATOM 0 HA SER A 76 4.257 3.915 -3.684 1.00 0.00 H new ATOM 0 HB2 SER A 76 3.846 5.540 -5.913 1.00 0.00 H new ATOM 0 HB3 SER A 76 2.921 6.364 -4.674 1.00 0.00 H new ATOM 0 HG SER A 76 5.488 6.538 -4.953 1.00 0.00 H new ATOM 1109 N LEU A 77 1.070 3.782 -3.422 1.00 0.00 N ATOM 1110 CA LEU A 77 -0.157 3.821 -2.526 1.00 0.00 C ATOM 1111 C LEU A 77 0.223 3.829 -1.079 1.00 0.00 C ATOM 1112 O LEU A 77 -0.477 4.412 -0.279 1.00 0.00 O ATOM 1113 CB LEU A 77 -0.959 2.552 -2.867 1.00 0.00 C ATOM 1114 CG LEU A 77 -2.334 2.540 -2.244 1.00 0.00 C ATOM 1115 CD1 LEU A 77 -3.241 1.650 -3.109 1.00 0.00 C ATOM 1116 CD2 LEU A 77 -2.250 1.949 -0.837 1.00 0.00 C ATOM 0 H LEU A 77 0.957 3.178 -4.236 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.737 4.728 -2.694 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.056 2.469 -3.950 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.405 1.676 -2.529 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.732 3.553 -2.186 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.242 1.625 -2.679 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -3.290 2.054 -4.120 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.835 0.639 -3.142 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -3.242 1.940 -0.386 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -1.867 0.930 -0.893 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.580 2.555 -0.227 1.00 0.00 H new ATOM 1128 N LEU A 78 1.326 3.243 -0.721 1.00 0.00 N ATOM 1129 CA LEU A 78 1.727 3.288 0.688 1.00 0.00 C ATOM 1130 C LEU A 78 2.724 4.430 0.866 1.00 0.00 C ATOM 1131 O LEU A 78 3.650 4.570 0.119 1.00 0.00 O ATOM 1132 CB LEU A 78 2.215 1.938 1.102 1.00 0.00 C ATOM 1133 CG LEU A 78 1.019 0.936 0.952 1.00 0.00 C ATOM 1134 CD1 LEU A 78 1.501 -0.457 0.546 1.00 0.00 C ATOM 1135 CD2 LEU A 78 0.258 0.825 2.274 1.00 0.00 C ATOM 0 H LEU A 78 1.957 2.740 -1.345 1.00 0.00 H new ATOM 0 HA LEU A 78 0.895 3.507 1.357 1.00 0.00 H new ATOM 0 HB2 LEU A 78 3.055 1.627 0.481 1.00 0.00 H new ATOM 0 HB3 LEU A 78 2.571 1.959 2.132 1.00 0.00 H new ATOM 0 HG LEU A 78 0.366 1.324 0.170 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.645 -1.125 0.451 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.022 -0.398 -0.409 1.00 0.00 H new ATOM 0 HD13 LEU A 78 2.180 -0.843 1.306 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.571 0.127 2.159 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.931 0.465 3.052 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.129 1.805 2.554 1.00 0.00 H new ATOM 1147 N GLN A 79 2.391 5.305 1.819 1.00 0.00 N ATOM 1148 CA GLN A 79 3.089 6.572 2.119 1.00 0.00 C ATOM 1149 C GLN A 79 4.585 6.455 2.220 1.00 0.00 C ATOM 1150 O GLN A 79 5.209 6.594 3.275 1.00 0.00 O ATOM 1151 CB GLN A 79 2.512 7.167 3.430 1.00 0.00 C ATOM 1152 CG GLN A 79 2.696 6.169 4.578 1.00 0.00 C ATOM 1153 CD GLN A 79 1.367 5.468 4.870 1.00 0.00 C ATOM 1154 OE1 GLN A 79 0.445 6.077 5.379 1.00 0.00 O ATOM 1155 NE2 GLN A 79 1.226 4.210 4.562 1.00 0.00 N ATOM 0 H GLN A 79 1.592 5.148 2.434 1.00 0.00 H new ATOM 0 HA GLN A 79 2.909 7.232 1.270 1.00 0.00 H new ATOM 0 HB2 GLN A 79 3.015 8.105 3.667 1.00 0.00 H new ATOM 0 HB3 GLN A 79 1.454 7.396 3.301 1.00 0.00 H new ATOM 0 HG2 GLN A 79 3.456 5.433 4.315 1.00 0.00 H new ATOM 0 HG3 GLN A 79 3.049 6.687 5.470 1.00 0.00 H new ATOM 0 HE21 GLN A 79 1.999 3.700 4.135 1.00 0.00 H new ATOM 0 HE22 GLN A 79 0.342 3.735 4.748 1.00 0.00 H new ATOM 1164 N ASP A 80 5.144 6.359 1.073 1.00 0.00 N ATOM 1165 CA ASP A 80 6.607 6.406 0.894 1.00 0.00 C ATOM 1166 C ASP A 80 6.904 7.857 0.403 1.00 0.00 C ATOM 1167 O ASP A 80 7.875 8.105 -0.294 1.00 0.00 O ATOM 1168 CB ASP A 80 7.037 5.392 -0.177 1.00 0.00 C ATOM 1169 CG ASP A 80 8.562 5.385 -0.295 1.00 0.00 C ATOM 1170 OD1 ASP A 80 9.215 5.178 0.714 1.00 0.00 O ATOM 1171 OD2 ASP A 80 9.054 5.588 -1.395 1.00 0.00 O ATOM 0 H ASP A 80 4.624 6.244 0.203 1.00 0.00 H new ATOM 0 HA ASP A 80 7.144 6.161 1.810 1.00 0.00 H new ATOM 0 HB2 ASP A 80 6.678 4.397 0.085 1.00 0.00 H new ATOM 0 HB3 ASP A 80 6.589 5.650 -1.137 1.00 0.00 H new ATOM 1176 N GLY A 81 5.988 8.809 0.727 1.00 0.00 N ATOM 1177 CA GLY A 81 6.108 10.209 0.254 1.00 0.00 C ATOM 1178 C GLY A 81 5.204 10.360 -0.990 1.00 0.00 C ATOM 1179 O GLY A 81 5.416 11.249 -1.805 1.00 0.00 O ATOM 0 H GLY A 81 5.168 8.632 1.308 1.00 0.00 H new ATOM 0 HA2 GLY A 81 5.803 10.905 1.036 1.00 0.00 H new ATOM 0 HA3 GLY A 81 7.143 10.442 0.006 1.00 0.00 H new ATOM 1183 N GLU A 82 4.212 9.437 -1.178 1.00 0.00 N ATOM 1184 CA GLU A 82 3.359 9.483 -2.392 1.00 0.00 C ATOM 1185 C GLU A 82 1.888 8.991 -2.189 1.00 0.00 C ATOM 1186 O GLU A 82 0.957 9.629 -2.651 1.00 0.00 O ATOM 1187 CB GLU A 82 3.988 8.543 -3.394 1.00 0.00 C ATOM 1188 CG GLU A 82 5.001 9.249 -4.302 1.00 0.00 C ATOM 1189 CD GLU A 82 6.347 9.407 -3.581 1.00 0.00 C ATOM 1190 OE1 GLU A 82 6.780 8.458 -2.944 1.00 0.00 O ATOM 1191 OE2 GLU A 82 6.921 10.479 -3.678 1.00 0.00 O ATOM 0 H GLU A 82 3.994 8.682 -0.528 1.00 0.00 H new ATOM 0 HA GLU A 82 3.304 10.527 -2.699 1.00 0.00 H new ATOM 0 HB2 GLU A 82 4.484 7.730 -2.864 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.207 8.094 -4.007 1.00 0.00 H new ATOM 0 HG2 GLU A 82 5.138 8.676 -5.219 1.00 0.00 H new ATOM 0 HG3 GLU A 82 4.619 10.228 -4.591 1.00 0.00 H new ATOM 1198 N PHE A 83 1.710 7.797 -1.623 1.00 0.00 N ATOM 1199 CA PHE A 83 0.323 7.146 -1.521 1.00 0.00 C ATOM 1200 C PHE A 83 -0.456 7.336 -2.850 1.00 0.00 C ATOM 1201 O PHE A 83 -1.596 7.805 -2.877 1.00 0.00 O ATOM 1202 CB PHE A 83 -0.530 7.614 -0.362 1.00 0.00 C ATOM 1203 CG PHE A 83 -0.130 8.969 0.145 1.00 0.00 C ATOM 1204 CD1 PHE A 83 0.818 9.070 1.148 1.00 0.00 C ATOM 1205 CD2 PHE A 83 -0.724 10.123 -0.387 1.00 0.00 C ATOM 1206 CE1 PHE A 83 1.194 10.326 1.641 1.00 0.00 C ATOM 1207 CE2 PHE A 83 -0.353 11.386 0.100 1.00 0.00 C ATOM 1208 CZ PHE A 83 0.607 11.486 1.116 1.00 0.00 C ATOM 0 H PHE A 83 2.465 7.239 -1.224 1.00 0.00 H new ATOM 0 HA PHE A 83 0.523 6.092 -1.328 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -1.574 7.641 -0.673 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -0.458 6.891 0.451 1.00 0.00 H new ATOM 0 HD1 PHE A 83 1.270 8.176 1.552 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -1.464 10.040 -1.169 1.00 0.00 H new ATOM 0 HE1 PHE A 83 1.934 10.401 2.424 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -0.806 12.278 -0.307 1.00 0.00 H new ATOM 0 HZ PHE A 83 0.894 12.456 1.494 1.00 0.00 H new ATOM 1218 N SER A 84 0.177 6.958 -3.932 1.00 0.00 N ATOM 1219 CA SER A 84 -0.436 7.057 -5.292 1.00 0.00 C ATOM 1220 C SER A 84 0.073 5.878 -6.084 1.00 0.00 C ATOM 1221 O SER A 84 1.237 5.506 -5.982 1.00 0.00 O ATOM 1222 CB SER A 84 -0.034 8.367 -5.956 1.00 0.00 C ATOM 1223 OG SER A 84 1.356 8.597 -5.744 1.00 0.00 O ATOM 0 H SER A 84 1.122 6.573 -3.928 1.00 0.00 H new ATOM 0 HA SER A 84 -1.525 7.043 -5.237 1.00 0.00 H new ATOM 0 HB2 SER A 84 -0.249 8.327 -7.024 1.00 0.00 H new ATOM 0 HB3 SER A 84 -0.617 9.190 -5.544 1.00 0.00 H new ATOM 0 HG SER A 84 1.617 9.439 -6.172 1.00 0.00 H new ATOM 1229 N MET A 85 -0.803 5.255 -6.819 1.00 0.00 N ATOM 1230 CA MET A 85 -0.441 4.034 -7.590 1.00 0.00 C ATOM 1231 C MET A 85 -1.063 4.140 -8.978 1.00 0.00 C ATOM 1232 O MET A 85 -2.235 4.389 -9.090 1.00 0.00 O ATOM 1233 CB MET A 85 -1.065 2.901 -6.808 1.00 0.00 C ATOM 1234 CG MET A 85 -0.423 1.564 -7.095 1.00 0.00 C ATOM 1235 SD MET A 85 -0.028 0.765 -5.528 1.00 0.00 S ATOM 1236 CE MET A 85 -0.788 -0.808 -5.863 1.00 0.00 C ATOM 0 H MET A 85 -1.775 5.547 -6.920 1.00 0.00 H new ATOM 0 HA MET A 85 0.632 3.893 -7.716 1.00 0.00 H new ATOM 0 HB2 MET A 85 -0.985 3.115 -5.742 1.00 0.00 H new ATOM 0 HB3 MET A 85 -2.128 2.846 -7.044 1.00 0.00 H new ATOM 0 HG2 MET A 85 -1.098 0.938 -7.679 1.00 0.00 H new ATOM 0 HG3 MET A 85 0.481 1.698 -7.689 1.00 0.00 H new ATOM 0 HE1 MET A 85 -1.365 -1.125 -4.995 1.00 0.00 H new ATOM 0 HE2 MET A 85 -1.449 -0.717 -6.725 1.00 0.00 H new ATOM 0 HE3 MET A 85 -0.016 -1.547 -6.075 1.00 0.00 H new ATOM 1246 N ASP A 86 -0.295 3.984 -10.045 1.00 0.00 N ATOM 1247 CA ASP A 86 -0.897 4.122 -11.405 1.00 0.00 C ATOM 1248 C ASP A 86 -1.385 2.765 -11.919 1.00 0.00 C ATOM 1249 O ASP A 86 -0.773 2.163 -12.808 1.00 0.00 O ATOM 1250 CB ASP A 86 0.153 4.663 -12.305 1.00 0.00 C ATOM 1251 CG ASP A 86 0.104 6.190 -12.319 1.00 0.00 C ATOM 1252 OD1 ASP A 86 0.694 6.790 -11.434 1.00 0.00 O ATOM 1253 OD2 ASP A 86 -0.521 6.734 -13.212 1.00 0.00 O ATOM 0 H ASP A 86 0.702 3.771 -10.025 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.758 4.790 -11.371 1.00 0.00 H new ATOM 0 HB2 ASP A 86 1.135 4.327 -11.972 1.00 0.00 H new ATOM 0 HB3 ASP A 86 0.010 4.278 -13.315 1.00 0.00 H new ATOM 1258 N LEU A 87 -2.507 2.282 -11.418 1.00 0.00 N ATOM 1259 CA LEU A 87 -3.005 0.977 -11.911 1.00 0.00 C ATOM 1260 C LEU A 87 -4.001 1.207 -13.015 1.00 0.00 C ATOM 1261 O LEU A 87 -5.038 1.823 -12.835 1.00 0.00 O ATOM 1262 CB LEU A 87 -3.543 0.033 -10.797 1.00 0.00 C ATOM 1263 CG LEU A 87 -4.192 0.741 -9.586 1.00 0.00 C ATOM 1264 CD1 LEU A 87 -3.167 1.530 -8.787 1.00 0.00 C ATOM 1265 CD2 LEU A 87 -5.328 1.636 -10.050 1.00 0.00 C ATOM 0 H LEU A 87 -3.079 2.734 -10.705 1.00 0.00 H new ATOM 0 HA LEU A 87 -2.150 0.433 -12.312 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.277 -0.641 -11.239 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.719 -0.584 -10.437 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.599 -0.023 -8.924 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.658 2.015 -7.943 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.395 0.855 -8.418 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.712 2.287 -9.426 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.778 2.129 -9.188 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.941 2.388 -10.738 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.082 1.034 -10.557 1.00 0.00 H new ATOM 1277 N ARG A 88 -3.635 0.760 -14.203 1.00 0.00 N ATOM 1278 CA ARG A 88 -4.511 0.995 -15.421 1.00 0.00 C ATOM 1279 C ARG A 88 -5.072 -0.290 -16.031 1.00 0.00 C ATOM 1280 O ARG A 88 -4.363 -1.258 -16.251 1.00 0.00 O ATOM 1281 CB ARG A 88 -3.692 1.774 -16.508 1.00 0.00 C ATOM 1282 CG ARG A 88 -2.842 0.832 -17.432 1.00 0.00 C ATOM 1283 CD ARG A 88 -2.215 1.681 -18.535 1.00 0.00 C ATOM 1284 NE ARG A 88 -0.754 1.426 -18.586 1.00 0.00 N ATOM 1285 CZ ARG A 88 0.081 2.417 -18.739 1.00 0.00 C ATOM 1286 NH1 ARG A 88 0.114 3.385 -17.865 1.00 0.00 N ATOM 1287 NH2 ARG A 88 0.884 2.437 -19.763 1.00 0.00 N ATOM 0 H ARG A 88 -2.774 0.245 -14.386 1.00 0.00 H new ATOM 0 HA ARG A 88 -5.367 1.578 -15.082 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.378 2.355 -17.124 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -3.028 2.484 -16.015 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -2.067 0.330 -16.852 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -3.472 0.054 -17.863 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -2.670 1.442 -19.496 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -2.404 2.738 -18.347 1.00 0.00 H new ATOM 0 HE ARG A 88 -0.401 0.473 -18.501 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -0.513 3.368 -17.061 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.767 4.159 -17.986 1.00 0.00 H new ATOM 0 HH21 ARG A 88 0.860 1.679 -20.445 1.00 0.00 H new ATOM 0 HH22 ARG A 88 1.537 3.211 -19.884 1.00 0.00 H new ATOM 1301 N THR A 89 -6.348 -0.247 -16.385 1.00 0.00 N ATOM 1302 CA THR A 89 -7.011 -1.399 -17.077 1.00 0.00 C ATOM 1303 C THR A 89 -6.229 -1.635 -18.379 1.00 0.00 C ATOM 1304 O THR A 89 -6.470 -0.965 -19.380 1.00 0.00 O ATOM 1305 CB THR A 89 -8.497 -1.026 -17.409 1.00 0.00 C ATOM 1306 OG1 THR A 89 -8.568 -0.189 -18.543 1.00 0.00 O ATOM 1307 CG2 THR A 89 -9.150 -0.296 -16.226 1.00 0.00 C ATOM 0 H THR A 89 -6.959 0.552 -16.218 1.00 0.00 H new ATOM 0 HA THR A 89 -7.014 -2.292 -16.452 1.00 0.00 H new ATOM 0 HB THR A 89 -9.027 -1.957 -17.609 1.00 0.00 H new ATOM 0 HG1 THR A 89 -8.209 -0.663 -19.322 1.00 0.00 H new ATOM 0 HG21 THR A 89 -10.181 -0.046 -16.477 1.00 0.00 H new ATOM 0 HG22 THR A 89 -9.137 -0.942 -15.348 1.00 0.00 H new ATOM 0 HG23 THR A 89 -8.597 0.618 -16.012 1.00 0.00 H new ATOM 1315 N LYS A 90 -5.266 -2.521 -18.371 1.00 0.00 N ATOM 1316 CA LYS A 90 -4.471 -2.712 -19.569 1.00 0.00 C ATOM 1317 C LYS A 90 -5.234 -3.635 -20.509 1.00 0.00 C ATOM 1318 O LYS A 90 -6.064 -4.432 -20.087 1.00 0.00 O ATOM 1319 CB LYS A 90 -3.118 -3.349 -19.264 1.00 0.00 C ATOM 1320 CG LYS A 90 -2.594 -3.055 -17.870 1.00 0.00 C ATOM 1321 CD LYS A 90 -1.054 -3.374 -17.877 1.00 0.00 C ATOM 1322 CE LYS A 90 -0.776 -4.801 -18.441 1.00 0.00 C ATOM 1323 NZ LYS A 90 -1.575 -5.823 -17.690 1.00 0.00 N ATOM 0 H LYS A 90 -5.014 -3.109 -17.576 1.00 0.00 H new ATOM 0 HA LYS A 90 -4.293 -1.734 -20.017 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -3.200 -4.429 -19.389 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.390 -2.998 -19.996 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.770 -2.013 -17.604 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -3.110 -3.664 -17.128 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.529 -2.633 -18.480 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -0.659 -3.297 -16.864 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -1.031 -4.837 -19.500 1.00 0.00 H new ATOM 0 HE3 LYS A 90 0.287 -5.030 -18.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -0.989 -6.666 -17.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -1.880 -5.425 -16.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -2.411 -6.089 -18.248 1.00 0.00 H new ATOM 1337 N SER A 91 -4.932 -3.541 -21.765 1.00 0.00 N ATOM 1338 CA SER A 91 -5.588 -4.413 -22.799 1.00 0.00 C ATOM 1339 C SER A 91 -4.585 -4.730 -23.900 1.00 0.00 C ATOM 1340 O SER A 91 -3.401 -4.427 -23.777 1.00 0.00 O ATOM 1341 CB SER A 91 -6.812 -3.726 -23.376 1.00 0.00 C ATOM 1342 OG SER A 91 -7.723 -4.724 -23.823 1.00 0.00 O ATOM 0 H SER A 91 -4.245 -2.886 -22.139 1.00 0.00 H new ATOM 0 HA SER A 91 -5.913 -5.342 -22.331 1.00 0.00 H new ATOM 0 HB2 SER A 91 -7.282 -3.095 -22.622 1.00 0.00 H new ATOM 0 HB3 SER A 91 -6.527 -3.076 -24.203 1.00 0.00 H new ATOM 0 HG SER A 91 -8.642 -4.407 -23.699 1.00 0.00 H new ATOM 1348 N THR A 92 -5.040 -5.354 -24.971 1.00 0.00 N ATOM 1349 CA THR A 92 -4.097 -5.722 -26.100 1.00 0.00 C ATOM 1350 C THR A 92 -4.843 -5.834 -27.424 1.00 0.00 C ATOM 1351 O THR A 92 -6.054 -5.681 -27.487 1.00 0.00 O ATOM 1352 CB THR A 92 -3.430 -7.062 -25.784 1.00 0.00 C ATOM 1353 OG1 THR A 92 -4.430 -8.051 -25.583 1.00 0.00 O ATOM 1354 CG2 THR A 92 -2.588 -6.926 -24.518 1.00 0.00 C ATOM 0 H THR A 92 -6.013 -5.624 -25.115 1.00 0.00 H new ATOM 0 HA THR A 92 -3.347 -4.937 -26.191 1.00 0.00 H new ATOM 0 HB THR A 92 -2.790 -7.355 -26.616 1.00 0.00 H new ATOM 0 HG1 THR A 92 -4.004 -8.911 -25.382 1.00 0.00 H new ATOM 0 HG21 THR A 92 -2.113 -7.881 -24.293 1.00 0.00 H new ATOM 0 HG22 THR A 92 -1.822 -6.166 -24.671 1.00 0.00 H new ATOM 0 HG23 THR A 92 -3.228 -6.634 -23.685 1.00 0.00 H new ATOM 1362 N GLY A 93 -4.106 -6.101 -28.495 1.00 0.00 N ATOM 1363 CA GLY A 93 -4.723 -6.228 -29.853 1.00 0.00 C ATOM 1364 C GLY A 93 -5.371 -4.902 -30.231 1.00 0.00 C ATOM 1365 O GLY A 93 -6.515 -4.864 -30.666 1.00 0.00 O ATOM 0 H GLY A 93 -3.095 -6.236 -28.474 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -3.964 -6.499 -30.587 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -5.467 -7.025 -29.855 1.00 0.00 H new ATOM 1369 N GLY A 94 -4.645 -3.807 -30.051 1.00 0.00 N ATOM 1370 CA GLY A 94 -5.201 -2.451 -30.380 1.00 0.00 C ATOM 1371 C GLY A 94 -6.424 -2.180 -29.495 1.00 0.00 C ATOM 1372 O GLY A 94 -7.290 -1.392 -29.849 1.00 0.00 O ATOM 0 H GLY A 94 -3.691 -3.802 -29.690 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -4.443 -1.685 -30.218 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -5.481 -2.405 -31.432 1.00 0.00 H new ATOM 1376 N ALA A 95 -6.498 -2.840 -28.340 1.00 0.00 N ATOM 1377 CA ALA A 95 -7.657 -2.646 -27.413 1.00 0.00 C ATOM 1378 C ALA A 95 -7.561 -1.292 -26.733 1.00 0.00 C ATOM 1379 O ALA A 95 -6.524 -0.646 -26.777 1.00 0.00 O ATOM 1380 CB ALA A 95 -7.655 -3.722 -26.338 1.00 0.00 C ATOM 0 H ALA A 95 -5.796 -3.503 -28.012 1.00 0.00 H new ATOM 0 HA ALA A 95 -8.574 -2.706 -27.998 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -8.503 -3.570 -25.670 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -7.733 -4.704 -26.806 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -6.728 -3.664 -25.767 1.00 0.00 H new ATOM 1386 N PRO A 96 -8.665 -0.894 -26.108 1.00 0.00 N ATOM 1387 CA PRO A 96 -8.762 0.359 -25.413 1.00 0.00 C ATOM 1388 C PRO A 96 -8.422 0.146 -23.955 1.00 0.00 C ATOM 1389 O PRO A 96 -9.094 -0.613 -23.262 1.00 0.00 O ATOM 1390 CB PRO A 96 -10.220 0.718 -25.532 1.00 0.00 C ATOM 1391 CG PRO A 96 -10.974 -0.646 -25.663 1.00 0.00 C ATOM 1392 CD PRO A 96 -9.919 -1.675 -26.068 1.00 0.00 C ATOM 0 HA PRO A 96 -8.095 1.124 -25.809 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -10.561 1.273 -24.658 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -10.399 1.351 -26.401 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -11.447 -0.922 -24.720 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -11.765 -0.584 -26.410 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -9.859 -2.492 -25.349 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -10.145 -2.120 -27.037 1.00 0.00 H new ATOM 1400 N THR A 97 -7.425 0.822 -23.478 1.00 0.00 N ATOM 1401 CA THR A 97 -7.044 0.702 -22.036 1.00 0.00 C ATOM 1402 C THR A 97 -7.676 1.871 -21.292 1.00 0.00 C ATOM 1403 O THR A 97 -8.194 2.805 -21.894 1.00 0.00 O ATOM 1404 CB THR A 97 -5.519 0.775 -21.873 1.00 0.00 C ATOM 1405 OG1 THR A 97 -5.040 1.966 -22.483 1.00 0.00 O ATOM 1406 CG2 THR A 97 -4.860 -0.433 -22.526 1.00 0.00 C ATOM 0 H THR A 97 -6.847 1.461 -24.023 1.00 0.00 H new ATOM 0 HA THR A 97 -7.389 -0.254 -21.642 1.00 0.00 H new ATOM 0 HB THR A 97 -5.273 0.778 -20.811 1.00 0.00 H new ATOM 0 HG1 THR A 97 -4.067 2.018 -22.380 1.00 0.00 H new ATOM 0 HG21 THR A 97 -3.779 -0.368 -22.403 1.00 0.00 H new ATOM 0 HG22 THR A 97 -5.225 -1.346 -22.055 1.00 0.00 H new ATOM 0 HG23 THR A 97 -5.104 -0.451 -23.588 1.00 0.00 H new ATOM 1414 N PHE A 98 -7.608 1.830 -20.004 1.00 0.00 N ATOM 1415 CA PHE A 98 -8.158 2.904 -19.152 1.00 0.00 C ATOM 1416 C PHE A 98 -7.193 3.032 -17.990 1.00 0.00 C ATOM 1417 O PHE A 98 -6.587 2.054 -17.598 1.00 0.00 O ATOM 1418 CB PHE A 98 -9.592 2.521 -18.720 1.00 0.00 C ATOM 1419 CG PHE A 98 -10.430 2.326 -19.989 1.00 0.00 C ATOM 1420 CD1 PHE A 98 -10.624 3.407 -20.859 1.00 0.00 C ATOM 1421 CD2 PHE A 98 -10.986 1.070 -20.301 1.00 0.00 C ATOM 1422 CE1 PHE A 98 -11.368 3.247 -22.031 1.00 0.00 C ATOM 1423 CE2 PHE A 98 -11.736 0.911 -21.486 1.00 0.00 C ATOM 1424 CZ PHE A 98 -11.922 2.001 -22.346 1.00 0.00 C ATOM 0 H PHE A 98 -7.176 1.065 -19.485 1.00 0.00 H new ATOM 0 HA PHE A 98 -8.246 3.865 -19.659 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -9.580 1.607 -18.126 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -10.023 3.302 -18.094 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -10.196 4.370 -20.622 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -10.839 0.232 -19.636 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -11.516 4.086 -22.695 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -12.166 -0.049 -21.729 1.00 0.00 H new ATOM 0 HZ PHE A 98 -12.494 1.880 -23.254 1.00 0.00 H new ATOM 1434 N ASN A 99 -6.971 4.228 -17.475 1.00 0.00 N ATOM 1435 CA ASN A 99 -5.957 4.368 -16.367 1.00 0.00 C ATOM 1436 C ASN A 99 -6.614 4.892 -15.102 1.00 0.00 C ATOM 1437 O ASN A 99 -7.568 5.654 -15.138 1.00 0.00 O ATOM 1438 CB ASN A 99 -4.761 5.272 -16.795 1.00 0.00 C ATOM 1439 CG ASN A 99 -4.377 5.053 -18.279 1.00 0.00 C ATOM 1440 OD1 ASN A 99 -5.214 4.840 -19.132 1.00 0.00 O ATOM 1441 ND2 ASN A 99 -3.114 5.116 -18.615 1.00 0.00 N ATOM 0 H ASN A 99 -7.433 5.090 -17.764 1.00 0.00 H new ATOM 0 HA ASN A 99 -5.555 3.377 -16.157 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -5.022 6.319 -16.638 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -3.900 5.059 -16.162 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -2.838 4.986 -19.588 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -2.405 5.295 -17.904 1.00 0.00 H new ATOM 1448 N VAL A 100 -6.105 4.434 -13.980 1.00 0.00 N ATOM 1449 CA VAL A 100 -6.643 4.803 -12.647 1.00 0.00 C ATOM 1450 C VAL A 100 -5.478 5.122 -11.718 1.00 0.00 C ATOM 1451 O VAL A 100 -4.501 4.376 -11.673 1.00 0.00 O ATOM 1452 CB VAL A 100 -7.368 3.581 -12.034 1.00 0.00 C ATOM 1453 CG1 VAL A 100 -8.203 4.021 -10.841 1.00 0.00 C ATOM 1454 CG2 VAL A 100 -8.274 2.909 -13.087 1.00 0.00 C ATOM 0 H VAL A 100 -5.310 3.797 -13.943 1.00 0.00 H new ATOM 0 HA VAL A 100 -7.318 5.652 -12.757 1.00 0.00 H new ATOM 0 HB VAL A 100 -6.620 2.860 -11.704 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -8.711 3.156 -10.414 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -7.554 4.469 -10.088 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -8.943 4.753 -11.165 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.777 2.051 -12.640 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -9.018 3.625 -13.436 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.668 2.576 -13.929 1.00 0.00 H new ATOM 1464 N THR A 101 -5.599 6.160 -10.923 1.00 0.00 N ATOM 1465 CA THR A 101 -4.556 6.469 -9.929 1.00 0.00 C ATOM 1466 C THR A 101 -5.231 6.239 -8.617 1.00 0.00 C ATOM 1467 O THR A 101 -6.281 6.800 -8.357 1.00 0.00 O ATOM 1468 CB THR A 101 -4.073 7.914 -10.025 1.00 0.00 C ATOM 1469 OG1 THR A 101 -3.517 8.150 -11.315 1.00 0.00 O ATOM 1470 CG2 THR A 101 -3.004 8.156 -8.943 1.00 0.00 C ATOM 0 H THR A 101 -6.389 6.805 -10.931 1.00 0.00 H new ATOM 0 HA THR A 101 -3.668 5.855 -10.078 1.00 0.00 H new ATOM 0 HB THR A 101 -4.911 8.594 -9.872 1.00 0.00 H new ATOM 0 HG1 THR A 101 -2.539 8.104 -11.263 1.00 0.00 H new ATOM 0 HG21 THR A 101 -2.652 9.186 -9.003 1.00 0.00 H new ATOM 0 HG22 THR A 101 -3.436 7.977 -7.958 1.00 0.00 H new ATOM 0 HG23 THR A 101 -2.166 7.477 -9.101 1.00 0.00 H new ATOM 1478 N VAL A 102 -4.685 5.387 -7.822 1.00 0.00 N ATOM 1479 CA VAL A 102 -5.311 5.034 -6.548 1.00 0.00 C ATOM 1480 C VAL A 102 -4.441 5.526 -5.403 1.00 0.00 C ATOM 1481 O VAL A 102 -3.274 5.177 -5.299 1.00 0.00 O ATOM 1482 CB VAL A 102 -5.498 3.509 -6.574 1.00 0.00 C ATOM 1483 CG1 VAL A 102 -5.666 2.934 -5.167 1.00 0.00 C ATOM 1484 CG2 VAL A 102 -6.731 3.203 -7.388 1.00 0.00 C ATOM 0 H VAL A 102 -3.804 4.908 -8.011 1.00 0.00 H new ATOM 0 HA VAL A 102 -6.282 5.506 -6.399 1.00 0.00 H new ATOM 0 HB VAL A 102 -4.610 3.053 -7.012 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -5.796 1.853 -5.229 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -4.780 3.160 -4.573 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -6.542 3.378 -4.695 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -6.886 2.125 -7.422 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -7.597 3.680 -6.930 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -6.602 3.583 -8.401 1.00 0.00 H new ATOM 1494 N THR A 103 -5.022 6.341 -4.546 1.00 0.00 N ATOM 1495 CA THR A 103 -4.265 6.896 -3.394 1.00 0.00 C ATOM 1496 C THR A 103 -4.676 6.202 -2.112 1.00 0.00 C ATOM 1497 O THR A 103 -5.545 5.328 -2.107 1.00 0.00 O ATOM 1498 CB THR A 103 -4.486 8.403 -3.265 1.00 0.00 C ATOM 1499 OG1 THR A 103 -5.862 8.705 -3.417 1.00 0.00 O ATOM 1500 CG2 THR A 103 -3.671 9.131 -4.333 1.00 0.00 C ATOM 0 H THR A 103 -5.995 6.641 -4.604 1.00 0.00 H new ATOM 0 HA THR A 103 -3.204 6.719 -3.572 1.00 0.00 H new ATOM 0 HB THR A 103 -4.161 8.731 -2.278 1.00 0.00 H new ATOM 0 HG1 THR A 103 -6.013 9.110 -4.297 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.828 10.206 -4.241 1.00 0.00 H new ATOM 0 HG22 THR A 103 -2.613 8.907 -4.199 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.990 8.801 -5.322 1.00 0.00 H new ATOM 1508 N LYS A 104 -4.021 6.557 -1.027 1.00 0.00 N ATOM 1509 CA LYS A 104 -4.298 5.891 0.285 1.00 0.00 C ATOM 1510 C LYS A 104 -4.129 6.856 1.469 1.00 0.00 C ATOM 1511 O LYS A 104 -3.374 7.815 1.418 1.00 0.00 O ATOM 1512 CB LYS A 104 -3.269 4.774 0.414 1.00 0.00 C ATOM 1513 CG LYS A 104 -3.384 4.035 1.758 1.00 0.00 C ATOM 1514 CD LYS A 104 -4.669 3.211 1.789 1.00 0.00 C ATOM 1515 CE LYS A 104 -4.328 1.751 2.094 1.00 0.00 C ATOM 1516 NZ LYS A 104 -3.638 1.663 3.417 1.00 0.00 N ATOM 0 H LYS A 104 -3.305 7.282 -0.997 1.00 0.00 H new ATOM 0 HA LYS A 104 -5.326 5.531 0.307 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -3.401 4.064 -0.402 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -2.267 5.191 0.315 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -2.521 3.385 1.900 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -3.382 4.752 2.579 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -5.348 3.603 2.546 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -5.184 3.283 0.831 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -5.237 1.150 2.106 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -3.688 1.345 1.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -2.777 1.087 3.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -3.382 2.618 3.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -4.274 1.222 4.112 1.00 0.00 H new ATOM 1530 N THR A 105 -4.801 6.534 2.556 1.00 0.00 N ATOM 1531 CA THR A 105 -4.693 7.319 3.822 1.00 0.00 C ATOM 1532 C THR A 105 -4.422 6.291 4.951 1.00 0.00 C ATOM 1533 O THR A 105 -3.781 5.273 4.705 1.00 0.00 O ATOM 1534 CB THR A 105 -6.003 8.087 4.084 1.00 0.00 C ATOM 1535 OG1 THR A 105 -7.041 7.166 4.372 1.00 0.00 O ATOM 1536 CG2 THR A 105 -6.375 8.919 2.849 1.00 0.00 C ATOM 0 H THR A 105 -5.435 5.737 2.613 1.00 0.00 H new ATOM 0 HA THR A 105 -3.893 8.057 3.768 1.00 0.00 H new ATOM 0 HB THR A 105 -5.866 8.755 4.934 1.00 0.00 H new ATOM 0 HG1 THR A 105 -7.602 7.520 5.094 1.00 0.00 H new ATOM 0 HG21 THR A 105 -7.302 9.460 3.040 1.00 0.00 H new ATOM 0 HG22 THR A 105 -5.577 9.631 2.636 1.00 0.00 H new ATOM 0 HG23 THR A 105 -6.510 8.258 1.993 1.00 0.00 H new ATOM 1544 N ASP A 106 -4.907 6.524 6.171 1.00 0.00 N ATOM 1545 CA ASP A 106 -4.675 5.530 7.279 1.00 0.00 C ATOM 1546 C ASP A 106 -5.928 4.657 7.483 1.00 0.00 C ATOM 1547 O ASP A 106 -5.847 3.581 8.063 1.00 0.00 O ATOM 1548 CB ASP A 106 -4.345 6.248 8.565 1.00 0.00 C ATOM 1549 CG ASP A 106 -3.486 5.339 9.443 1.00 0.00 C ATOM 1550 OD1 ASP A 106 -4.034 4.405 10.006 1.00 0.00 O ATOM 1551 OD2 ASP A 106 -2.298 5.592 9.539 1.00 0.00 O ATOM 0 H ASP A 106 -5.444 7.350 6.435 1.00 0.00 H new ATOM 0 HA ASP A 106 -3.836 4.892 7.000 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -3.813 7.175 8.351 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -5.261 6.519 9.089 1.00 0.00 H new ATOM 1556 N LYS A 107 -7.096 5.117 7.014 1.00 0.00 N ATOM 1557 CA LYS A 107 -8.365 4.309 7.191 1.00 0.00 C ATOM 1558 C LYS A 107 -9.282 4.475 5.959 1.00 0.00 C ATOM 1559 O LYS A 107 -10.461 4.190 6.027 1.00 0.00 O ATOM 1560 CB LYS A 107 -9.141 4.766 8.464 1.00 0.00 C ATOM 1561 CG LYS A 107 -8.185 5.356 9.522 1.00 0.00 C ATOM 1562 CD LYS A 107 -8.939 5.573 10.848 1.00 0.00 C ATOM 1563 CE LYS A 107 -10.128 6.532 10.642 1.00 0.00 C ATOM 1564 NZ LYS A 107 -11.405 5.780 10.819 1.00 0.00 N ATOM 0 H LYS A 107 -7.215 6.004 6.525 1.00 0.00 H new ATOM 0 HA LYS A 107 -8.081 3.262 7.301 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -9.887 5.511 8.189 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -9.678 3.918 8.889 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -7.342 4.683 9.679 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -7.776 6.302 9.167 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -9.297 4.617 11.230 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -8.260 5.981 11.597 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -10.075 7.354 11.356 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -10.087 6.972 9.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -12.184 6.310 10.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -11.323 4.846 10.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -11.599 5.659 11.834 1.00 0.00 H new ATOM 1578 N THR A 108 -8.745 4.916 4.831 1.00 0.00 N ATOM 1579 CA THR A 108 -9.585 5.079 3.603 1.00 0.00 C ATOM 1580 C THR A 108 -8.751 4.629 2.396 1.00 0.00 C ATOM 1581 O THR A 108 -7.525 4.675 2.421 1.00 0.00 O ATOM 1582 CB THR A 108 -10.053 6.545 3.457 1.00 0.00 C ATOM 1583 OG1 THR A 108 -9.001 7.348 2.963 1.00 0.00 O ATOM 1584 CG2 THR A 108 -10.512 7.073 4.827 1.00 0.00 C ATOM 0 H THR A 108 -7.763 5.167 4.717 1.00 0.00 H new ATOM 0 HA THR A 108 -10.484 4.467 3.671 1.00 0.00 H new ATOM 0 HB THR A 108 -10.884 6.586 2.752 1.00 0.00 H new ATOM 0 HG1 THR A 108 -8.147 7.024 3.319 1.00 0.00 H new ATOM 0 HG21 THR A 108 -10.842 8.107 4.726 1.00 0.00 H new ATOM 0 HG22 THR A 108 -11.337 6.462 5.194 1.00 0.00 H new ATOM 0 HG23 THR A 108 -9.682 7.024 5.532 1.00 0.00 H new ATOM 1592 N LEU A 109 -9.410 4.161 1.377 1.00 0.00 N ATOM 1593 CA LEU A 109 -8.710 3.637 0.151 1.00 0.00 C ATOM 1594 C LEU A 109 -9.278 4.454 -1.034 1.00 0.00 C ATOM 1595 O LEU A 109 -10.339 4.126 -1.538 1.00 0.00 O ATOM 1596 CB LEU A 109 -9.137 2.140 0.051 1.00 0.00 C ATOM 1597 CG LEU A 109 -8.074 1.169 -0.523 1.00 0.00 C ATOM 1598 CD1 LEU A 109 -8.345 0.870 -1.976 1.00 0.00 C ATOM 1599 CD2 LEU A 109 -6.645 1.667 -0.339 1.00 0.00 C ATOM 0 H LEU A 109 -10.428 4.114 1.332 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.623 3.719 0.167 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -9.416 1.795 1.046 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.031 2.078 -0.570 1.00 0.00 H new ATOM 0 HG LEU A 109 -8.162 0.248 0.053 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -7.585 0.187 -2.355 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -9.328 0.410 -2.076 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -8.318 1.797 -2.549 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -5.950 0.942 -0.762 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -6.525 2.624 -0.847 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -6.437 1.792 0.724 1.00 0.00 H new ATOM 1611 N VAL A 110 -8.611 5.548 -1.468 1.00 0.00 N ATOM 1612 CA VAL A 110 -9.194 6.376 -2.558 1.00 0.00 C ATOM 1613 C VAL A 110 -8.754 5.832 -3.911 1.00 0.00 C ATOM 1614 O VAL A 110 -7.648 5.341 -4.065 1.00 0.00 O ATOM 1615 CB VAL A 110 -8.727 7.873 -2.370 1.00 0.00 C ATOM 1616 CG1 VAL A 110 -8.770 8.634 -3.704 1.00 0.00 C ATOM 1617 CG2 VAL A 110 -9.663 8.596 -1.365 1.00 0.00 C ATOM 0 H VAL A 110 -7.714 5.870 -1.105 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.283 6.338 -2.517 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.704 7.858 -1.995 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -8.444 9.662 -3.547 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -8.108 8.149 -4.421 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -9.789 8.632 -4.091 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -9.335 9.628 -1.240 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -10.684 8.583 -1.745 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.628 8.085 -0.403 1.00 0.00 H new ATOM 1627 N LEU A 111 -9.614 5.972 -4.890 1.00 0.00 N ATOM 1628 CA LEU A 111 -9.293 5.550 -6.266 1.00 0.00 C ATOM 1629 C LEU A 111 -9.687 6.697 -7.186 1.00 0.00 C ATOM 1630 O LEU A 111 -10.588 7.474 -6.885 1.00 0.00 O ATOM 1631 CB LEU A 111 -10.064 4.259 -6.689 1.00 0.00 C ATOM 1632 CG LEU A 111 -10.195 3.273 -5.514 1.00 0.00 C ATOM 1633 CD1 LEU A 111 -11.190 2.150 -5.874 1.00 0.00 C ATOM 1634 CD2 LEU A 111 -8.847 2.649 -5.203 1.00 0.00 C ATOM 0 H LEU A 111 -10.545 6.373 -4.778 1.00 0.00 H new ATOM 0 HA LEU A 111 -8.230 5.316 -6.329 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -11.056 4.528 -7.052 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -9.542 3.776 -7.515 1.00 0.00 H new ATOM 0 HG LEU A 111 -10.556 3.821 -4.644 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -11.276 1.458 -5.037 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -12.167 2.584 -6.088 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -10.831 1.614 -6.753 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -8.951 1.953 -4.370 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -8.483 2.113 -6.080 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -8.137 3.431 -4.935 1.00 0.00 H new ATOM 1646 N LEU A 112 -9.027 6.804 -8.287 1.00 0.00 N ATOM 1647 CA LEU A 112 -9.328 7.865 -9.270 1.00 0.00 C ATOM 1648 C LEU A 112 -9.419 7.179 -10.583 1.00 0.00 C ATOM 1649 O LEU A 112 -8.412 6.793 -11.145 1.00 0.00 O ATOM 1650 CB LEU A 112 -8.179 8.876 -9.306 1.00 0.00 C ATOM 1651 CG LEU A 112 -8.579 10.268 -9.897 1.00 0.00 C ATOM 1652 CD1 LEU A 112 -9.726 10.178 -10.941 1.00 0.00 C ATOM 1653 CD2 LEU A 112 -8.985 11.176 -8.746 1.00 0.00 C ATOM 0 H LEU A 112 -8.266 6.181 -8.558 1.00 0.00 H new ATOM 0 HA LEU A 112 -10.245 8.399 -9.021 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.800 9.017 -8.294 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -7.362 8.462 -9.897 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.717 10.671 -10.429 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.958 11.176 -11.314 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.414 9.544 -11.771 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.612 9.751 -10.472 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -9.268 12.154 -9.136 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.831 10.737 -8.217 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -8.147 11.289 -8.058 1.00 0.00 H new ATOM 1665 N MET A 113 -10.585 6.979 -11.086 1.00 0.00 N ATOM 1666 CA MET A 113 -10.668 6.249 -12.383 1.00 0.00 C ATOM 1667 C MET A 113 -10.645 7.205 -13.494 1.00 0.00 C ATOM 1668 O MET A 113 -11.102 8.322 -13.368 1.00 0.00 O ATOM 1669 CB MET A 113 -11.907 5.409 -12.473 1.00 0.00 C ATOM 1670 CG MET A 113 -11.692 4.268 -13.491 1.00 0.00 C ATOM 1671 SD MET A 113 -12.932 4.389 -14.797 1.00 0.00 S ATOM 1672 CE MET A 113 -13.302 2.626 -14.926 1.00 0.00 C ATOM 0 H MET A 113 -11.472 7.276 -10.678 1.00 0.00 H new ATOM 0 HA MET A 113 -9.806 5.585 -12.443 1.00 0.00 H new ATOM 0 HB2 MET A 113 -12.149 4.995 -11.494 1.00 0.00 H new ATOM 0 HB3 MET A 113 -12.754 6.025 -12.776 1.00 0.00 H new ATOM 0 HG2 MET A 113 -10.691 4.330 -13.918 1.00 0.00 H new ATOM 0 HG3 MET A 113 -11.766 3.302 -12.992 1.00 0.00 H new ATOM 0 HE1 MET A 113 -14.061 2.469 -15.692 1.00 0.00 H new ATOM 0 HE2 MET A 113 -12.396 2.083 -15.196 1.00 0.00 H new ATOM 0 HE3 MET A 113 -13.672 2.261 -13.968 1.00 0.00 H new ATOM 1682 N GLY A 114 -10.091 6.774 -14.589 1.00 0.00 N ATOM 1683 CA GLY A 114 -9.998 7.620 -15.772 1.00 0.00 C ATOM 1684 C GLY A 114 -10.070 6.784 -17.030 1.00 0.00 C ATOM 1685 O GLY A 114 -9.651 5.631 -17.072 1.00 0.00 O ATOM 0 H GLY A 114 -9.692 5.842 -14.701 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -10.807 8.351 -15.768 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -9.063 8.179 -15.753 1.00 0.00 H new ATOM 1689 N LYS A 115 -10.550 7.402 -18.063 1.00 0.00 N ATOM 1690 CA LYS A 115 -10.649 6.779 -19.391 1.00 0.00 C ATOM 1691 C LYS A 115 -9.966 7.740 -20.360 1.00 0.00 C ATOM 1692 O LYS A 115 -9.697 8.852 -20.011 1.00 0.00 O ATOM 1693 CB LYS A 115 -12.107 6.535 -19.775 1.00 0.00 C ATOM 1694 CG LYS A 115 -12.585 5.242 -19.092 1.00 0.00 C ATOM 1695 CD LYS A 115 -13.708 4.582 -19.905 1.00 0.00 C ATOM 1696 CE LYS A 115 -14.241 3.374 -19.121 1.00 0.00 C ATOM 1697 NZ LYS A 115 -15.114 2.541 -19.999 1.00 0.00 N ATOM 0 H LYS A 115 -10.893 8.362 -18.032 1.00 0.00 H new ATOM 0 HA LYS A 115 -10.168 5.801 -19.409 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -12.726 7.377 -19.465 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -12.204 6.449 -20.857 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -11.750 4.550 -18.988 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -12.941 5.466 -18.086 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -14.510 5.296 -20.090 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -13.333 4.265 -20.878 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -13.409 2.776 -18.749 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -14.804 3.714 -18.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -15.471 1.726 -19.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -15.916 3.112 -20.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -14.565 2.204 -20.815 1.00 0.00 H new ATOM 1711 N GLU A 116 -9.662 7.279 -21.525 1.00 0.00 N ATOM 1712 CA GLU A 116 -8.881 8.054 -22.611 1.00 0.00 C ATOM 1713 C GLU A 116 -8.763 9.571 -22.469 1.00 0.00 C ATOM 1714 O GLU A 116 -9.460 10.241 -21.734 1.00 0.00 O ATOM 1715 CB GLU A 116 -9.554 7.768 -23.764 1.00 0.00 C ATOM 1716 CG GLU A 116 -8.777 8.176 -25.030 1.00 0.00 C ATOM 1717 CD GLU A 116 -9.333 7.410 -26.229 1.00 0.00 C ATOM 1718 OE1 GLU A 116 -10.310 7.868 -26.798 1.00 0.00 O ATOM 1719 OE2 GLU A 116 -8.773 6.379 -26.559 1.00 0.00 O ATOM 0 H GLU A 116 -9.924 6.339 -21.822 1.00 0.00 H new ATOM 0 HA GLU A 116 -7.840 7.735 -22.556 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -9.763 6.699 -23.801 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -10.516 8.280 -23.754 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -8.866 9.250 -25.196 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -7.716 7.960 -24.905 1.00 0.00 H new ATOM 1726 N GLY A 117 -7.662 10.061 -23.091 1.00 0.00 N ATOM 1727 CA GLY A 117 -7.231 11.454 -22.880 1.00 0.00 C ATOM 1728 C GLY A 117 -6.660 11.375 -21.428 1.00 0.00 C ATOM 1729 O GLY A 117 -6.488 12.357 -20.731 1.00 0.00 O ATOM 0 H GLY A 117 -7.073 9.523 -23.727 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -6.477 11.766 -23.603 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -8.059 12.158 -22.959 1.00 0.00 H new ATOM 1733 N VAL A 118 -6.484 10.092 -20.968 1.00 0.00 N ATOM 1734 CA VAL A 118 -6.078 9.770 -19.644 1.00 0.00 C ATOM 1735 C VAL A 118 -4.589 9.386 -19.567 1.00 0.00 C ATOM 1736 O VAL A 118 -4.217 8.231 -19.743 1.00 0.00 O ATOM 1737 CB VAL A 118 -7.081 8.651 -19.223 1.00 0.00 C ATOM 1738 CG1 VAL A 118 -6.638 7.250 -19.541 1.00 0.00 C ATOM 1739 CG2 VAL A 118 -7.389 8.745 -17.713 1.00 0.00 C ATOM 0 H VAL A 118 -6.635 9.271 -21.554 1.00 0.00 H new ATOM 0 HA VAL A 118 -6.122 10.610 -18.950 1.00 0.00 H new ATOM 0 HB VAL A 118 -7.972 8.837 -19.823 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -7.400 6.544 -19.211 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -6.492 7.150 -20.616 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -5.701 7.039 -19.026 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -8.090 7.958 -17.435 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -6.466 8.626 -17.145 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -7.829 9.717 -17.491 1.00 0.00 H new ATOM 1749 N HIS A 119 -3.735 10.349 -19.286 1.00 0.00 N ATOM 1750 CA HIS A 119 -2.282 10.042 -19.166 1.00 0.00 C ATOM 1751 C HIS A 119 -2.034 9.378 -17.806 1.00 0.00 C ATOM 1752 O HIS A 119 -1.069 8.646 -17.632 1.00 0.00 O ATOM 1753 CB HIS A 119 -1.465 11.316 -19.284 1.00 0.00 C ATOM 1754 CG HIS A 119 -0.030 10.949 -19.497 1.00 0.00 C ATOM 1755 ND1 HIS A 119 1.003 11.565 -18.814 1.00 0.00 N ATOM 1756 CD2 HIS A 119 0.558 10.022 -20.317 1.00 0.00 C ATOM 1757 CE1 HIS A 119 2.154 11.006 -19.236 1.00 0.00 C ATOM 1758 NE2 HIS A 119 1.936 10.058 -20.151 1.00 0.00 N ATOM 0 H HIS A 119 -3.987 11.326 -19.137 1.00 0.00 H new ATOM 0 HA HIS A 119 -1.979 9.368 -19.968 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -1.827 11.921 -20.115 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -1.571 11.918 -18.381 1.00 0.00 H new ATOM 0 HD2 HIS A 119 0.030 9.363 -20.990 1.00 0.00 H new ATOM 0 HE1 HIS A 119 3.133 11.290 -18.878 1.00 0.00 H new ATOM 0 HE2 HIS A 119 2.632 9.484 -20.626 1.00 0.00 H new ATOM 1766 N GLY A 120 -2.922 9.623 -16.841 1.00 0.00 N ATOM 1767 CA GLY A 120 -2.783 9.017 -15.491 1.00 0.00 C ATOM 1768 C GLY A 120 -1.949 9.942 -14.574 1.00 0.00 C ATOM 1769 O GLY A 120 -1.932 9.761 -13.363 1.00 0.00 O ATOM 0 H GLY A 120 -3.737 10.226 -16.953 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -3.768 8.853 -15.055 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -2.303 8.042 -15.570 1.00 0.00 H new ATOM 1773 N GLY A 121 -1.258 10.936 -15.147 1.00 0.00 N ATOM 1774 CA GLY A 121 -0.430 11.878 -14.316 1.00 0.00 C ATOM 1775 C GLY A 121 -1.332 12.983 -13.762 1.00 0.00 C ATOM 1776 O GLY A 121 -1.179 13.408 -12.632 1.00 0.00 O ATOM 0 H GLY A 121 -1.241 11.122 -16.150 1.00 0.00 H new ATOM 0 HA2 GLY A 121 0.048 11.338 -13.499 1.00 0.00 H new ATOM 0 HA3 GLY A 121 0.367 12.311 -14.920 1.00 0.00 H new ATOM 1780 N LEU A 122 -2.296 13.423 -14.556 1.00 0.00 N ATOM 1781 CA LEU A 122 -3.268 14.495 -14.102 1.00 0.00 C ATOM 1782 C LEU A 122 -4.195 13.861 -13.135 1.00 0.00 C ATOM 1783 O LEU A 122 -4.557 14.451 -12.159 1.00 0.00 O ATOM 1784 CB LEU A 122 -4.108 15.044 -15.276 1.00 0.00 C ATOM 1785 CG LEU A 122 -3.281 15.133 -16.575 1.00 0.00 C ATOM 1786 CD1 LEU A 122 -4.036 14.432 -17.710 1.00 0.00 C ATOM 1787 CD2 LEU A 122 -3.061 16.601 -16.935 1.00 0.00 C ATOM 0 H LEU A 122 -2.453 13.084 -15.505 1.00 0.00 H new ATOM 0 HA LEU A 122 -2.706 15.323 -13.669 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -4.972 14.400 -15.438 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.490 16.032 -15.019 1.00 0.00 H new ATOM 0 HG LEU A 122 -2.317 14.647 -16.429 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -3.452 14.495 -18.628 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -4.193 13.385 -17.450 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -5.000 14.917 -17.860 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -2.477 16.667 -17.853 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -4.025 17.088 -17.083 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -2.524 17.097 -16.127 1.00 0.00 H new ATOM 1799 N ILE A 123 -4.567 12.632 -13.408 1.00 0.00 N ATOM 1800 CA ILE A 123 -5.462 11.878 -12.505 1.00 0.00 C ATOM 1801 C ILE A 123 -4.686 11.628 -11.226 1.00 0.00 C ATOM 1802 O ILE A 123 -5.239 11.675 -10.152 1.00 0.00 O ATOM 1803 CB ILE A 123 -5.822 10.581 -13.202 1.00 0.00 C ATOM 1804 CG1 ILE A 123 -6.802 10.932 -14.377 1.00 0.00 C ATOM 1805 CG2 ILE A 123 -6.473 9.547 -12.212 1.00 0.00 C ATOM 1806 CD1 ILE A 123 -7.514 9.686 -14.886 1.00 0.00 C ATOM 0 H ILE A 123 -4.275 12.119 -14.240 1.00 0.00 H new ATOM 0 HA ILE A 123 -6.382 12.412 -12.267 1.00 0.00 H new ATOM 0 HB ILE A 123 -4.919 10.106 -13.586 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -7.537 11.661 -14.036 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -6.247 11.396 -15.192 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -6.716 8.631 -12.751 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -5.771 9.320 -11.409 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.383 9.972 -11.789 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -8.187 9.958 -15.699 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -6.778 8.969 -15.248 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -8.088 9.238 -14.075 1.00 0.00 H new ATOM 1818 N ASN A 124 -3.385 11.393 -11.351 1.00 0.00 N ATOM 1819 CA ASN A 124 -2.532 11.188 -10.149 1.00 0.00 C ATOM 1820 C ASN A 124 -2.491 12.503 -9.379 1.00 0.00 C ATOM 1821 O ASN A 124 -2.306 12.520 -8.172 1.00 0.00 O ATOM 1822 CB ASN A 124 -1.117 10.787 -10.578 1.00 0.00 C ATOM 1823 CG ASN A 124 -0.259 10.528 -9.339 1.00 0.00 C ATOM 1824 OD1 ASN A 124 -0.022 9.393 -8.972 1.00 0.00 O ATOM 1825 ND2 ASN A 124 0.217 11.543 -8.674 1.00 0.00 N ATOM 0 H ASN A 124 -2.892 11.337 -12.242 1.00 0.00 H new ATOM 0 HA ASN A 124 -2.938 10.394 -9.522 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -1.154 9.893 -11.200 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -0.672 11.577 -11.182 1.00 0.00 H new ATOM 0 HD21 ASN A 124 0.789 11.386 -7.844 1.00 0.00 H new ATOM 0 HD22 ASN A 124 0.017 12.494 -8.983 1.00 0.00 H new ATOM 1832 N LYS A 125 -2.688 13.608 -10.083 1.00 0.00 N ATOM 1833 CA LYS A 125 -2.693 14.963 -9.423 1.00 0.00 C ATOM 1834 C LYS A 125 -4.090 15.197 -8.791 1.00 0.00 C ATOM 1835 O LYS A 125 -4.223 15.860 -7.764 1.00 0.00 O ATOM 1836 CB LYS A 125 -2.416 16.030 -10.499 1.00 0.00 C ATOM 1837 CG LYS A 125 -1.018 15.812 -11.091 1.00 0.00 C ATOM 1838 CD LYS A 125 0.009 16.709 -10.372 1.00 0.00 C ATOM 1839 CE LYS A 125 1.073 15.842 -9.673 1.00 0.00 C ATOM 1840 NZ LYS A 125 2.435 16.301 -10.074 1.00 0.00 N ATOM 0 H LYS A 125 -2.846 13.625 -11.091 1.00 0.00 H new ATOM 0 HA LYS A 125 -1.929 15.022 -8.647 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -3.168 15.972 -11.286 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -2.486 17.027 -10.064 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -0.731 14.765 -10.990 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -1.027 16.039 -12.157 1.00 0.00 H new ATOM 0 HD2 LYS A 125 0.487 17.376 -11.090 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -0.496 17.339 -9.640 1.00 0.00 H new ATOM 0 HE2 LYS A 125 0.959 15.910 -8.591 1.00 0.00 H new ATOM 0 HE3 LYS A 125 0.937 14.795 -9.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 3.152 15.715 -9.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 2.541 16.214 -11.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 2.562 17.295 -9.796 1.00 0.00 H new ATOM 1854 N LYS A 126 -5.125 14.626 -9.401 1.00 0.00 N ATOM 1855 CA LYS A 126 -6.528 14.763 -8.875 1.00 0.00 C ATOM 1856 C LYS A 126 -6.814 13.651 -7.844 1.00 0.00 C ATOM 1857 O LYS A 126 -7.776 13.725 -7.098 1.00 0.00 O ATOM 1858 CB LYS A 126 -7.515 14.672 -10.037 1.00 0.00 C ATOM 1859 CG LYS A 126 -7.773 16.080 -10.593 1.00 0.00 C ATOM 1860 CD LYS A 126 -6.791 16.385 -11.738 1.00 0.00 C ATOM 1861 CE LYS A 126 -7.181 15.594 -13.000 1.00 0.00 C ATOM 1862 NZ LYS A 126 -7.745 16.529 -14.016 1.00 0.00 N ATOM 0 H LYS A 126 -5.047 14.066 -10.250 1.00 0.00 H new ATOM 0 HA LYS A 126 -6.640 15.730 -8.384 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -7.115 14.027 -10.819 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -8.450 14.224 -9.701 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -8.799 16.155 -10.954 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -7.660 16.819 -9.800 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -6.794 17.453 -11.954 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -5.777 16.124 -11.436 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -6.309 15.082 -13.406 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -7.913 14.827 -12.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -8.237 15.985 -14.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -8.417 17.176 -13.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -6.975 17.079 -14.447 1.00 0.00 H new ATOM 1876 N CYS A 127 -5.935 12.659 -7.763 1.00 0.00 N ATOM 1877 CA CYS A 127 -6.070 11.565 -6.738 1.00 0.00 C ATOM 1878 C CYS A 127 -5.323 12.051 -5.517 1.00 0.00 C ATOM 1879 O CYS A 127 -5.665 11.746 -4.400 1.00 0.00 O ATOM 1880 CB CYS A 127 -5.422 10.268 -7.237 1.00 0.00 C ATOM 1881 SG CYS A 127 -6.112 8.865 -6.323 1.00 0.00 S ATOM 0 H CYS A 127 -5.123 12.566 -8.374 1.00 0.00 H new ATOM 0 HA CYS A 127 -7.119 11.354 -6.531 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -5.602 10.145 -8.305 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -4.342 10.311 -7.099 1.00 0.00 H new ATOM 0 HG CYS A 127 -6.227 7.843 -7.118 1.00 0.00 H new ATOM 1887 N TYR A 128 -4.296 12.841 -5.762 1.00 0.00 N ATOM 1888 CA TYR A 128 -3.487 13.437 -4.693 1.00 0.00 C ATOM 1889 C TYR A 128 -4.372 14.473 -3.983 1.00 0.00 C ATOM 1890 O TYR A 128 -4.287 14.653 -2.782 1.00 0.00 O ATOM 1891 CB TYR A 128 -2.286 14.116 -5.386 1.00 0.00 C ATOM 1892 CG TYR A 128 -1.097 14.362 -4.474 1.00 0.00 C ATOM 1893 CD1 TYR A 128 -0.911 13.659 -3.263 1.00 0.00 C ATOM 1894 CD2 TYR A 128 -0.158 15.312 -4.877 1.00 0.00 C ATOM 1895 CE1 TYR A 128 0.218 13.922 -2.473 1.00 0.00 C ATOM 1896 CE2 TYR A 128 0.967 15.575 -4.086 1.00 0.00 C ATOM 1897 CZ TYR A 128 1.155 14.881 -2.885 1.00 0.00 C ATOM 1898 OH TYR A 128 2.267 15.138 -2.108 1.00 0.00 O ATOM 0 H TYR A 128 -3.992 13.093 -6.702 1.00 0.00 H new ATOM 0 HA TYR A 128 -3.129 12.713 -3.961 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -1.965 13.495 -6.223 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -2.613 15.069 -5.803 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -1.635 12.922 -2.947 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -0.300 15.847 -5.804 1.00 0.00 H new ATOM 0 HE1 TYR A 128 0.366 13.386 -1.547 1.00 0.00 H new ATOM 0 HE2 TYR A 128 1.689 16.313 -4.402 1.00 0.00 H new ATOM 0 HH TYR A 128 2.814 15.828 -2.538 1.00 0.00 H new ATOM 1908 N GLU A 129 -5.252 15.144 -4.750 1.00 0.00 N ATOM 1909 CA GLU A 129 -6.188 16.173 -4.145 1.00 0.00 C ATOM 1910 C GLU A 129 -7.382 15.454 -3.479 1.00 0.00 C ATOM 1911 O GLU A 129 -7.856 15.849 -2.415 1.00 0.00 O ATOM 1912 CB GLU A 129 -6.710 17.103 -5.244 1.00 0.00 C ATOM 1913 CG GLU A 129 -5.612 18.093 -5.639 1.00 0.00 C ATOM 1914 CD GLU A 129 -6.246 19.342 -6.255 1.00 0.00 C ATOM 1915 OE1 GLU A 129 -7.018 19.192 -7.188 1.00 0.00 O ATOM 1916 OE2 GLU A 129 -5.951 20.428 -5.783 1.00 0.00 O ATOM 0 H GLU A 129 -5.352 15.016 -5.757 1.00 0.00 H new ATOM 0 HA GLU A 129 -5.648 16.757 -3.400 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -7.018 16.520 -6.112 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -7.590 17.641 -4.892 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -5.022 18.366 -4.764 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -4.930 17.630 -6.352 1.00 0.00 H new ATOM 1923 N MET A 130 -7.852 14.388 -4.098 1.00 0.00 N ATOM 1924 CA MET A 130 -9.003 13.588 -3.539 1.00 0.00 C ATOM 1925 C MET A 130 -8.566 13.088 -2.119 1.00 0.00 C ATOM 1926 O MET A 130 -9.291 13.205 -1.105 1.00 0.00 O ATOM 1927 CB MET A 130 -9.230 12.389 -4.508 1.00 0.00 C ATOM 1928 CG MET A 130 -10.711 11.965 -4.561 1.00 0.00 C ATOM 1929 SD MET A 130 -10.837 10.365 -5.387 1.00 0.00 S ATOM 1930 CE MET A 130 -12.570 10.035 -4.988 1.00 0.00 C ATOM 0 H MET A 130 -7.482 14.033 -4.980 1.00 0.00 H new ATOM 0 HA MET A 130 -9.925 14.163 -3.450 1.00 0.00 H new ATOM 0 HB2 MET A 130 -8.895 12.662 -5.508 1.00 0.00 H new ATOM 0 HB3 MET A 130 -8.622 11.543 -4.188 1.00 0.00 H new ATOM 0 HG2 MET A 130 -11.120 11.901 -3.553 1.00 0.00 H new ATOM 0 HG3 MET A 130 -11.297 12.712 -5.096 1.00 0.00 H new ATOM 0 HE1 MET A 130 -12.688 8.985 -4.719 1.00 0.00 H new ATOM 0 HE2 MET A 130 -12.876 10.661 -4.150 1.00 0.00 H new ATOM 0 HE3 MET A 130 -13.192 10.259 -5.855 1.00 0.00 H new ATOM 1940 N ALA A 131 -7.351 12.586 -2.051 1.00 0.00 N ATOM 1941 CA ALA A 131 -6.767 12.103 -0.764 1.00 0.00 C ATOM 1942 C ALA A 131 -6.222 13.287 0.016 1.00 0.00 C ATOM 1943 O ALA A 131 -6.014 13.184 1.205 1.00 0.00 O ATOM 1944 CB ALA A 131 -5.631 11.122 -1.054 1.00 0.00 C ATOM 0 H ALA A 131 -6.730 12.491 -2.855 1.00 0.00 H new ATOM 0 HA ALA A 131 -7.539 11.602 -0.180 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.205 10.770 -0.114 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -6.018 10.273 -1.617 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.858 11.622 -1.637 1.00 0.00 H new ATOM 1950 N SER A 132 -5.998 14.443 -0.641 1.00 0.00 N ATOM 1951 CA SER A 132 -5.487 15.649 0.102 1.00 0.00 C ATOM 1952 C SER A 132 -6.491 15.972 1.176 1.00 0.00 C ATOM 1953 O SER A 132 -6.123 16.383 2.273 1.00 0.00 O ATOM 1954 CB SER A 132 -5.337 16.853 -0.830 1.00 0.00 C ATOM 1955 OG SER A 132 -4.098 16.764 -1.524 1.00 0.00 O ATOM 0 H SER A 132 -6.150 14.582 -1.640 1.00 0.00 H new ATOM 0 HA SER A 132 -4.505 15.432 0.523 1.00 0.00 H new ATOM 0 HB2 SER A 132 -6.163 16.881 -1.541 1.00 0.00 H new ATOM 0 HB3 SER A 132 -5.379 17.778 -0.256 1.00 0.00 H new ATOM 0 HG SER A 132 -3.916 15.828 -1.749 1.00 0.00 H new ATOM 1961 N HIS A 133 -7.785 15.752 0.889 1.00 0.00 N ATOM 1962 CA HIS A 133 -8.806 16.010 1.925 1.00 0.00 C ATOM 1963 C HIS A 133 -8.856 14.841 2.847 1.00 0.00 C ATOM 1964 O HIS A 133 -9.016 15.032 4.020 1.00 0.00 O ATOM 1965 CB HIS A 133 -10.190 16.257 1.372 1.00 0.00 C ATOM 1966 CG HIS A 133 -10.972 16.924 2.469 1.00 0.00 C ATOM 1967 ND1 HIS A 133 -11.076 18.240 2.854 1.00 0.00 N flip ATOM 1968 CD2 HIS A 133 -11.758 16.206 3.359 1.00 0.00 C flip ATOM 1969 CE1 HIS A 133 -11.909 18.339 3.964 1.00 0.00 C flip ATOM 1970 NE2 HIS A 133 -12.293 17.086 4.229 1.00 0.00 N flip ATOM 0 H HIS A 133 -8.140 15.413 -0.005 1.00 0.00 H new ATOM 0 HA HIS A 133 -8.509 16.924 2.440 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -10.147 16.890 0.486 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -10.662 15.321 1.073 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -11.913 15.137 3.355 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -12.186 19.236 4.498 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -12.914 16.828 4.995 1.00 0.00 H new ATOM 1978 N LEU A 134 -8.720 13.593 2.340 1.00 0.00 N ATOM 1979 CA LEU A 134 -8.755 12.418 3.289 1.00 0.00 C ATOM 1980 C LEU A 134 -7.547 12.434 4.225 1.00 0.00 C ATOM 1981 O LEU A 134 -7.537 11.744 5.237 1.00 0.00 O ATOM 1982 CB LEU A 134 -8.796 11.126 2.518 1.00 0.00 C ATOM 1983 CG LEU A 134 -10.222 10.890 2.020 1.00 0.00 C ATOM 1984 CD1 LEU A 134 -10.316 11.162 0.520 1.00 0.00 C ATOM 1985 CD2 LEU A 134 -10.629 9.445 2.304 1.00 0.00 C ATOM 0 H LEU A 134 -8.593 13.365 1.354 1.00 0.00 H new ATOM 0 HA LEU A 134 -9.657 12.499 3.895 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -8.105 11.168 1.676 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -8.477 10.299 3.152 1.00 0.00 H new ATOM 0 HG LEU A 134 -10.894 11.571 2.542 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -11.338 10.989 0.182 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -10.038 12.197 0.320 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -9.640 10.495 -0.014 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -11.646 9.277 1.949 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -9.948 8.767 1.789 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -10.584 9.258 3.377 1.00 0.00 H new ATOM 1997 N ARG A 135 -6.569 13.243 3.930 1.00 0.00 N ATOM 1998 CA ARG A 135 -5.374 13.372 4.831 1.00 0.00 C ATOM 1999 C ARG A 135 -5.691 14.493 5.783 1.00 0.00 C ATOM 2000 O ARG A 135 -5.446 14.402 6.980 1.00 0.00 O ATOM 2001 CB ARG A 135 -4.125 13.689 4.012 1.00 0.00 C ATOM 2002 CG ARG A 135 -3.689 12.433 3.258 1.00 0.00 C ATOM 2003 CD ARG A 135 -2.189 12.499 2.980 1.00 0.00 C ATOM 2004 NE ARG A 135 -1.452 12.624 4.270 1.00 0.00 N ATOM 2005 CZ ARG A 135 -0.526 13.532 4.407 1.00 0.00 C ATOM 2006 NH1 ARG A 135 -0.741 14.752 3.992 1.00 0.00 N ATOM 2007 NH2 ARG A 135 0.614 13.219 4.958 1.00 0.00 N ATOM 0 H ARG A 135 -6.540 13.829 3.096 1.00 0.00 H new ATOM 0 HA ARG A 135 -5.173 12.446 5.369 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -4.331 14.497 3.310 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -3.323 14.032 4.666 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -3.922 11.545 3.845 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -4.240 12.349 2.321 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -1.866 11.603 2.449 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -1.964 13.349 2.336 1.00 0.00 H new ATOM 0 HE ARG A 135 -1.672 11.999 5.046 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -1.633 14.994 3.561 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -0.017 15.462 4.099 1.00 0.00 H new ATOM 0 HH21 ARG A 135 0.780 12.266 5.281 1.00 0.00 H new ATOM 0 HH22 ARG A 135 1.340 13.928 5.066 1.00 0.00 H new ATOM 2021 N ARG A 136 -6.323 15.533 5.257 1.00 0.00 N ATOM 2022 CA ARG A 136 -6.775 16.657 6.109 1.00 0.00 C ATOM 2023 C ARG A 136 -8.079 16.221 6.831 1.00 0.00 C ATOM 2024 O ARG A 136 -8.606 16.941 7.665 1.00 0.00 O ATOM 2025 CB ARG A 136 -7.063 17.885 5.238 1.00 0.00 C ATOM 2026 CG ARG A 136 -5.753 18.575 4.842 1.00 0.00 C ATOM 2027 CD ARG A 136 -6.035 19.552 3.694 1.00 0.00 C ATOM 2028 NE ARG A 136 -4.877 20.470 3.504 1.00 0.00 N ATOM 2029 CZ ARG A 136 -4.946 21.433 2.614 1.00 0.00 C ATOM 2030 NH1 ARG A 136 -5.469 22.587 2.936 1.00 0.00 N ATOM 2031 NH2 ARG A 136 -4.502 21.237 1.401 1.00 0.00 N ATOM 0 H ARG A 136 -6.538 15.635 4.265 1.00 0.00 H new ATOM 0 HA ARG A 136 -6.003 16.912 6.835 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -7.609 17.585 4.343 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -7.700 18.583 5.781 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -5.334 19.107 5.696 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -5.015 17.835 4.534 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -6.225 18.999 2.774 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -6.934 20.129 3.910 1.00 0.00 H new ATOM 0 HE ARG A 136 -4.033 20.351 4.064 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -5.824 22.740 3.880 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -5.522 23.334 2.243 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -4.101 20.335 1.144 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -4.556 21.986 0.711 1.00 0.00 H new ATOM 2045 N SER A 137 -8.585 15.016 6.508 1.00 0.00 N ATOM 2046 CA SER A 137 -9.816 14.487 7.140 1.00 0.00 C ATOM 2047 C SER A 137 -9.454 13.899 8.517 1.00 0.00 C ATOM 2048 O SER A 137 -10.327 13.651 9.334 1.00 0.00 O ATOM 2049 CB SER A 137 -10.423 13.390 6.215 1.00 0.00 C ATOM 2050 OG SER A 137 -9.694 12.170 6.349 1.00 0.00 O ATOM 0 H SER A 137 -8.167 14.392 5.819 1.00 0.00 H new ATOM 0 HA SER A 137 -10.552 15.280 7.277 1.00 0.00 H new ATOM 0 HB2 SER A 137 -11.470 13.226 6.472 1.00 0.00 H new ATOM 0 HB3 SER A 137 -10.398 13.725 5.178 1.00 0.00 H new ATOM 0 HG SER A 137 -10.109 11.616 7.042 1.00 0.00 H new ATOM 2056 N GLN A 138 -8.147 13.666 8.772 1.00 0.00 N ATOM 2057 CA GLN A 138 -7.694 13.084 10.094 1.00 0.00 C ATOM 2058 C GLN A 138 -7.971 11.578 10.106 1.00 0.00 C ATOM 2059 O GLN A 138 -8.068 10.961 11.164 1.00 0.00 O ATOM 2060 CB GLN A 138 -8.433 13.765 11.270 1.00 0.00 C ATOM 2061 CG GLN A 138 -7.474 13.942 12.449 1.00 0.00 C ATOM 2062 CD GLN A 138 -8.262 13.887 13.757 1.00 0.00 C ATOM 2063 OE1 GLN A 138 -8.467 12.826 14.312 1.00 0.00 O ATOM 2064 NE2 GLN A 138 -8.718 14.995 14.276 1.00 0.00 N ATOM 0 H GLN A 138 -7.393 13.859 8.113 1.00 0.00 H new ATOM 0 HA GLN A 138 -6.625 13.261 10.211 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -8.821 14.734 10.956 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -9.289 13.162 11.572 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -6.715 13.159 12.436 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -6.951 14.895 12.367 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -8.545 15.886 13.809 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -9.247 14.970 15.148 1.00 0.00 H new ATOM 2073 N TYR A 139 -8.081 10.975 8.925 1.00 0.00 N ATOM 2074 CA TYR A 139 -8.329 9.510 8.834 1.00 0.00 C ATOM 2075 C TYR A 139 -7.054 8.835 8.327 1.00 0.00 C ATOM 2076 O TYR A 139 -6.284 8.397 9.155 1.00 0.00 O ATOM 2077 CB TYR A 139 -9.507 9.233 7.868 1.00 0.00 C ATOM 2078 CG TYR A 139 -10.760 9.985 8.318 1.00 0.00 C ATOM 2079 CD1 TYR A 139 -11.047 10.156 9.690 1.00 0.00 C ATOM 2080 CD2 TYR A 139 -11.634 10.502 7.357 1.00 0.00 C ATOM 2081 CE1 TYR A 139 -12.199 10.844 10.081 1.00 0.00 C ATOM 2082 CE2 TYR A 139 -12.788 11.190 7.755 1.00 0.00 C ATOM 2083 CZ TYR A 139 -13.070 11.359 9.116 1.00 0.00 C ATOM 2084 OH TYR A 139 -14.204 12.040 9.505 1.00 0.00 O ATOM 2085 OXT TYR A 139 -6.858 8.790 7.120 1.00 0.00 O ATOM 0 H TYR A 139 -8.007 11.452 8.027 1.00 0.00 H new ATOM 0 HA TYR A 139 -8.592 9.111 9.814 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -9.236 9.539 6.858 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -9.712 8.163 7.833 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -10.377 9.756 10.436 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -11.419 10.371 6.307 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -12.417 10.978 11.130 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -13.461 11.590 7.011 1.00 0.00 H new ATOM 0 HH TYR A 139 -14.699 12.332 8.711 1.00 0.00 H new TER 2095 TYR A 139