USER MOD reduce.3.24.130724 H: found=0, std=0, add=1173, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1172 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 20 THR OG1 : rot 180:sc= -1 USER MOD Set 1.2: A 108 MET CE :methyl -144:sc= -3.55 (180deg=-7.38!) USER MOD Set 2.1: A 96 THR OG1 : rot 180:sc= -0.215 USER MOD Set 2.2: A 97 ASN : amide:sc= 0 K(o=-0.22,f=0.44) USER MOD Set 3.1: A 31 LYS NZ :NH3+ -139:sc= 0 (180deg=-0.06) USER MOD Set 3.2: A 34 GLN : amide:sc= -3.43! X(o=-3.3!,f=-3.3) USER MOD Set 3.3: A 79 SER OG : rot 113:sc= 0.108! USER MOD Set 4.1: A 27 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 112 HIS : no HE2:sc= -2.14! C(o=-2.1!,f=-11!) USER MOD Set 5.1: A 12 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 107 THR OG1 : rot 180:sc= 0.0567 USER MOD Single : A 1 PHE N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 165:sc= -1.38 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -148:sc= 0.866 (180deg=0.109) USER MOD Single : A 29 GLN : amide:sc= -0.447 K(o=-0.45,f=-1.4) USER MOD Single : A 30 ASN : amide:sc=-0.00594 K(o=-0.0059,f=-1.1) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= -0.0202 X(o=-0.02,f=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.181) USER MOD Single : A 51 MET CE :methyl -167:sc= -4.61! (180deg=-4.82!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -1.68 K(o=-1.7,f=-3.1!) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 161:sc= -0.707 (180deg=-1.6) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0.121 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 131:sc= -0.225 (180deg=-1.12) USER MOD Single : A 73 THR OG1 : rot -18:sc= -0.0077! USER MOD Single : A 75 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000134) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 THR OG1 : rot -90:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= -1.29 USER MOD Single : A 84 ASN : amide:sc= -0.112 K(o=-0.11,f=-1.1) USER MOD Single : A 87 ASN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 92 ASN : amide:sc=-0.00594 X(o=-0.0059,f=0) USER MOD Single : A 98 THR OG1 : rot -120:sc= -0.183 USER MOD Single : A 103 SER OG : rot -74:sc= 0.216 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 118 CYS SG : rot 24:sc= 0.392 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : B 1 GLN N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 THR OG1 : rot 180:sc= 0 USER MOD Single : B 5 THR OG1 : rot 180:sc= 0.0191 USER MOD Single : B 9 SER OG : rot 180:sc= 0 USER MOD Single : B 10 SER OG : rot 180:sc= 0 USER MOD Single : B 21 THR OG1 : rot -59:sc= 0.418 USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 1 -15.908 -40.345 11.736 1.00 0.00 N ATOM 2 CA PHE A 1 -15.380 -40.484 10.349 1.00 0.00 C ATOM 3 C PHE A 1 -15.043 -39.101 9.767 1.00 0.00 C ATOM 4 O PHE A 1 -15.752 -38.593 8.917 1.00 0.00 O ATOM 5 CB PHE A 1 -16.514 -41.141 9.559 1.00 0.00 C ATOM 6 CG PHE A 1 -15.991 -41.614 8.224 1.00 0.00 C ATOM 7 CD1 PHE A 1 -15.102 -42.693 8.163 1.00 0.00 C ATOM 8 CD2 PHE A 1 -16.396 -40.974 7.047 1.00 0.00 C ATOM 9 CE1 PHE A 1 -14.616 -43.131 6.924 1.00 0.00 C ATOM 10 CE2 PHE A 1 -15.912 -41.412 5.809 1.00 0.00 C ATOM 11 CZ PHE A 1 -15.021 -42.491 5.747 1.00 0.00 C ATOM 0 H1 PHE A 1 -16.132 -41.286 12.118 1.00 0.00 H new ATOM 0 H2 PHE A 1 -15.191 -39.889 12.336 1.00 0.00 H new ATOM 0 H3 PHE A 1 -16.770 -39.763 11.723 1.00 0.00 H new ATOM 0 HA PHE A 1 -14.464 -41.073 10.312 1.00 0.00 H new ATOM 0 HB2 PHE A 1 -16.922 -41.982 10.120 1.00 0.00 H new ATOM 0 HB3 PHE A 1 -17.328 -40.431 9.412 1.00 0.00 H new ATOM 0 HD1 PHE A 1 -14.791 -43.188 9.071 1.00 0.00 H new ATOM 0 HD2 PHE A 1 -17.082 -40.142 7.094 1.00 0.00 H new ATOM 0 HE1 PHE A 1 -13.929 -43.963 6.877 1.00 0.00 H new ATOM 0 HE2 PHE A 1 -16.226 -40.918 4.901 1.00 0.00 H new ATOM 0 HZ PHE A 1 -14.647 -42.829 4.792 1.00 0.00 H new ATOM 23 N ALA A 2 -13.967 -38.485 10.216 1.00 0.00 N ATOM 24 CA ALA A 2 -13.598 -37.139 9.683 1.00 0.00 C ATOM 25 C ALA A 2 -12.148 -37.147 9.173 1.00 0.00 C ATOM 26 O ALA A 2 -11.241 -36.747 9.878 1.00 0.00 O ATOM 27 CB ALA A 2 -13.741 -36.189 10.873 1.00 0.00 C ATOM 0 H ALA A 2 -13.336 -38.859 10.925 1.00 0.00 H new ATOM 0 HA ALA A 2 -14.228 -36.841 8.844 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -13.486 -35.176 10.562 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -14.769 -36.210 11.234 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -13.069 -36.503 11.672 1.00 0.00 H new ATOM 33 N LYS A 3 -11.919 -37.599 7.956 1.00 0.00 N ATOM 34 CA LYS A 3 -10.527 -37.627 7.418 1.00 0.00 C ATOM 35 C LYS A 3 -10.503 -37.091 5.978 1.00 0.00 C ATOM 36 O LYS A 3 -10.495 -37.855 5.031 1.00 0.00 O ATOM 37 CB LYS A 3 -10.120 -39.101 7.448 1.00 0.00 C ATOM 38 CG LYS A 3 -8.595 -39.207 7.508 1.00 0.00 C ATOM 39 CD LYS A 3 -8.152 -40.543 6.907 1.00 0.00 C ATOM 40 CE LYS A 3 -8.107 -41.608 8.005 1.00 0.00 C ATOM 41 NZ LYS A 3 -6.691 -41.626 8.465 1.00 0.00 N ATOM 0 H LYS A 3 -12.637 -37.947 7.320 1.00 0.00 H new ATOM 0 HA LYS A 3 -9.847 -37.004 8.000 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -10.564 -39.595 8.313 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -10.496 -39.611 6.561 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -8.141 -38.381 6.960 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -8.255 -39.130 8.541 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -8.842 -40.846 6.120 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -7.170 -40.439 6.447 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -8.785 -41.361 8.822 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -8.410 -42.583 7.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -6.580 -42.333 9.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -6.070 -41.870 7.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -6.433 -40.687 8.830 1.00 0.00 H new ATOM 55 N LEU A 4 -10.491 -35.784 5.801 1.00 0.00 N ATOM 56 CA LEU A 4 -10.469 -35.216 4.420 1.00 0.00 C ATOM 57 C LEU A 4 -9.378 -34.139 4.307 1.00 0.00 C ATOM 58 O LEU A 4 -8.590 -33.956 5.217 1.00 0.00 O ATOM 59 CB LEU A 4 -11.855 -34.598 4.223 1.00 0.00 C ATOM 60 CG LEU A 4 -12.733 -35.552 3.412 1.00 0.00 C ATOM 61 CD1 LEU A 4 -14.193 -35.397 3.844 1.00 0.00 C ATOM 62 CD2 LEU A 4 -12.605 -35.220 1.924 1.00 0.00 C ATOM 0 H LEU A 4 -10.496 -35.095 6.553 1.00 0.00 H new ATOM 0 HA LEU A 4 -10.249 -35.972 3.666 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -12.316 -34.398 5.190 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -11.768 -33.642 3.708 1.00 0.00 H new ATOM 0 HG LEU A 4 -12.410 -36.578 3.586 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -14.818 -36.077 3.265 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -14.286 -35.632 4.904 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -14.517 -34.371 3.670 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -13.230 -35.899 1.345 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -12.928 -34.193 1.751 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -11.566 -35.331 1.615 1.00 0.00 H new ATOM 74 N VAL A 5 -9.322 -33.425 3.200 1.00 0.00 N ATOM 75 CA VAL A 5 -8.279 -32.365 3.045 1.00 0.00 C ATOM 76 C VAL A 5 -8.942 -30.979 2.983 1.00 0.00 C ATOM 77 O VAL A 5 -9.180 -30.452 1.912 1.00 0.00 O ATOM 78 CB VAL A 5 -7.570 -32.684 1.724 1.00 0.00 C ATOM 79 CG1 VAL A 5 -6.458 -31.661 1.475 1.00 0.00 C ATOM 80 CG2 VAL A 5 -6.957 -34.086 1.794 1.00 0.00 C ATOM 0 H VAL A 5 -9.952 -33.534 2.405 1.00 0.00 H new ATOM 0 HA VAL A 5 -7.581 -32.349 3.882 1.00 0.00 H new ATOM 0 HB VAL A 5 -8.295 -32.641 0.911 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -5.956 -31.891 0.535 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -6.889 -30.661 1.421 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -5.737 -31.702 2.291 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -6.454 -34.310 0.854 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -6.236 -34.128 2.610 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -7.745 -34.819 1.968 1.00 0.00 H new ATOM 90 N ARG A 6 -9.244 -30.383 4.119 1.00 0.00 N ATOM 91 CA ARG A 6 -9.890 -29.037 4.110 1.00 0.00 C ATOM 92 C ARG A 6 -9.126 -28.076 5.039 1.00 0.00 C ATOM 93 O ARG A 6 -9.651 -27.646 6.047 1.00 0.00 O ATOM 94 CB ARG A 6 -11.310 -29.277 4.627 1.00 0.00 C ATOM 95 CG ARG A 6 -12.266 -28.276 3.977 1.00 0.00 C ATOM 96 CD ARG A 6 -13.627 -28.341 4.674 1.00 0.00 C ATOM 97 NE ARG A 6 -14.405 -27.207 4.105 1.00 0.00 N ATOM 98 CZ ARG A 6 -14.633 -26.144 4.825 1.00 0.00 C ATOM 99 NH1 ARG A 6 -13.641 -25.380 5.196 1.00 0.00 N ATOM 100 NH2 ARG A 6 -15.854 -25.845 5.177 1.00 0.00 N ATOM 0 H ARG A 6 -9.069 -30.774 5.045 1.00 0.00 H new ATOM 0 HA ARG A 6 -9.891 -28.583 3.119 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -11.624 -30.296 4.400 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -11.337 -29.170 5.711 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -11.857 -27.268 4.048 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -12.378 -28.500 2.916 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -14.122 -29.294 4.485 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -13.522 -28.245 5.755 1.00 0.00 H new ATOM 0 HE ARG A 6 -14.760 -27.261 3.150 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -12.687 -25.615 4.923 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -13.820 -24.549 5.759 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -16.629 -26.443 4.889 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -16.033 -25.014 5.740 1.00 0.00 H new ATOM 114 N PRO A 7 -7.898 -27.765 4.674 1.00 0.00 N ATOM 115 CA PRO A 7 -7.081 -26.847 5.505 1.00 0.00 C ATOM 116 C PRO A 7 -7.590 -25.402 5.368 1.00 0.00 C ATOM 117 O PRO A 7 -8.373 -25.112 4.485 1.00 0.00 O ATOM 118 CB PRO A 7 -5.676 -26.985 4.924 1.00 0.00 C ATOM 119 CG PRO A 7 -5.882 -27.435 3.513 1.00 0.00 C ATOM 120 CD PRO A 7 -7.165 -28.223 3.481 1.00 0.00 C ATOM 0 HA PRO A 7 -7.121 -27.085 6.568 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -5.139 -26.037 4.961 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -5.086 -27.708 5.487 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -5.939 -26.579 2.840 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -5.045 -28.048 3.178 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -7.729 -28.030 2.568 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -6.975 -29.296 3.517 1.00 0.00 H new ATOM 128 N PRO A 8 -7.131 -24.533 6.246 1.00 0.00 N ATOM 129 CA PRO A 8 -7.565 -23.115 6.193 1.00 0.00 C ATOM 130 C PRO A 8 -6.916 -22.404 4.995 1.00 0.00 C ATOM 131 O PRO A 8 -6.190 -23.013 4.232 1.00 0.00 O ATOM 132 CB PRO A 8 -7.060 -22.533 7.511 1.00 0.00 C ATOM 133 CG PRO A 8 -5.911 -23.403 7.906 1.00 0.00 C ATOM 134 CD PRO A 8 -6.186 -24.776 7.350 1.00 0.00 C ATOM 0 HA PRO A 8 -8.642 -23.000 6.070 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -6.746 -21.496 7.390 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -7.841 -22.542 8.271 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -4.975 -23.008 7.512 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -5.810 -23.439 8.991 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -5.272 -25.253 6.995 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -6.616 -25.433 8.106 1.00 0.00 H new ATOM 142 N VAL A 9 -7.169 -21.122 4.821 1.00 0.00 N ATOM 143 CA VAL A 9 -6.560 -20.390 3.667 1.00 0.00 C ATOM 144 C VAL A 9 -5.758 -19.180 4.174 1.00 0.00 C ATOM 145 O VAL A 9 -6.280 -18.343 4.887 1.00 0.00 O ATOM 146 CB VAL A 9 -7.744 -19.934 2.809 1.00 0.00 C ATOM 147 CG1 VAL A 9 -7.229 -19.186 1.576 1.00 0.00 C ATOM 148 CG2 VAL A 9 -8.551 -21.154 2.355 1.00 0.00 C ATOM 0 H VAL A 9 -7.767 -20.559 5.426 1.00 0.00 H new ATOM 0 HA VAL A 9 -5.870 -21.014 3.100 1.00 0.00 H new ATOM 0 HB VAL A 9 -8.379 -19.273 3.399 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -8.074 -18.863 0.967 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -6.655 -18.315 1.892 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -6.591 -19.847 0.989 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -9.393 -20.827 1.745 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -7.913 -21.815 1.768 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -8.923 -21.690 3.228 1.00 0.00 H new ATOM 158 N GLN A 10 -4.495 -19.079 3.814 1.00 0.00 N ATOM 159 CA GLN A 10 -3.671 -17.923 4.279 1.00 0.00 C ATOM 160 C GLN A 10 -2.711 -17.479 3.163 1.00 0.00 C ATOM 161 O GLN A 10 -2.091 -18.304 2.524 1.00 0.00 O ATOM 162 CB GLN A 10 -2.894 -18.458 5.485 1.00 0.00 C ATOM 163 CG GLN A 10 -3.588 -18.023 6.777 1.00 0.00 C ATOM 164 CD GLN A 10 -3.221 -18.993 7.907 1.00 0.00 C ATOM 165 OE1 GLN A 10 -3.949 -19.930 8.173 1.00 0.00 O ATOM 166 NE2 GLN A 10 -2.117 -18.815 8.590 1.00 0.00 N ATOM 0 H GLN A 10 -4.005 -19.748 3.220 1.00 0.00 H new ATOM 0 HA GLN A 10 -4.275 -17.054 4.539 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -2.836 -19.546 5.440 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -1.871 -18.083 5.466 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -3.286 -17.010 7.041 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -4.668 -18.007 6.634 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -1.503 -18.031 8.371 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -1.872 -19.461 9.341 1.00 0.00 H new ATOM 175 N ILE A 11 -2.584 -16.184 2.922 1.00 0.00 N ATOM 176 CA ILE A 11 -1.665 -15.684 1.842 1.00 0.00 C ATOM 177 C ILE A 11 -2.037 -16.303 0.478 1.00 0.00 C ATOM 178 O ILE A 11 -1.834 -17.479 0.241 1.00 0.00 O ATOM 179 CB ILE A 11 -0.254 -16.089 2.276 1.00 0.00 C ATOM 180 CG1 ILE A 11 0.102 -15.371 3.580 1.00 0.00 C ATOM 181 CG2 ILE A 11 0.742 -15.684 1.193 1.00 0.00 C ATOM 182 CD1 ILE A 11 -0.417 -16.175 4.770 1.00 0.00 C ATOM 0 H ILE A 11 -3.081 -15.453 3.431 1.00 0.00 H new ATOM 0 HA ILE A 11 -1.740 -14.604 1.714 1.00 0.00 H new ATOM 0 HB ILE A 11 -0.215 -17.168 2.428 1.00 0.00 H new ATOM 0 HG12 ILE A 11 1.182 -15.248 3.655 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -0.333 -14.372 3.587 1.00 0.00 H new ATOM 0 HG21 ILE A 11 1.748 -15.971 1.498 1.00 0.00 H new ATOM 0 HG22 ILE A 11 0.489 -16.187 0.260 1.00 0.00 H new ATOM 0 HG23 ILE A 11 0.701 -14.605 1.046 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -0.161 -15.660 5.696 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -1.500 -16.275 4.697 1.00 0.00 H new ATOM 0 HD13 ILE A 11 0.039 -17.165 4.767 1.00 0.00 H new ATOM 194 N TYR A 12 -2.607 -15.518 -0.414 1.00 0.00 N ATOM 195 CA TYR A 12 -3.029 -16.063 -1.752 1.00 0.00 C ATOM 196 C TYR A 12 -2.922 -14.967 -2.823 1.00 0.00 C ATOM 197 O TYR A 12 -3.900 -14.315 -3.141 1.00 0.00 O ATOM 198 CB TYR A 12 -4.513 -16.523 -1.614 1.00 0.00 C ATOM 199 CG TYR A 12 -5.163 -15.936 -0.369 1.00 0.00 C ATOM 200 CD1 TYR A 12 -4.916 -16.526 0.873 1.00 0.00 C ATOM 201 CD2 TYR A 12 -5.967 -14.794 -0.453 1.00 0.00 C ATOM 202 CE1 TYR A 12 -5.463 -15.984 2.030 1.00 0.00 C ATOM 203 CE2 TYR A 12 -6.522 -14.247 0.711 1.00 0.00 C ATOM 204 CZ TYR A 12 -6.268 -14.841 1.955 1.00 0.00 C ATOM 205 OH TYR A 12 -6.814 -14.303 3.103 1.00 0.00 O ATOM 0 H TYR A 12 -2.798 -14.526 -0.274 1.00 0.00 H new ATOM 0 HA TYR A 12 -2.389 -16.894 -2.050 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -5.074 -16.218 -2.497 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -4.556 -17.611 -1.570 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -4.296 -17.408 0.934 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -6.159 -14.336 -1.412 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -5.267 -16.445 2.987 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -7.146 -13.367 0.650 1.00 0.00 H new ATOM 0 HH TYR A 12 -7.345 -13.512 2.873 1.00 0.00 H new ATOM 215 N GLY A 13 -1.747 -14.751 -3.383 1.00 0.00 N ATOM 216 CA GLY A 13 -1.603 -13.696 -4.420 1.00 0.00 C ATOM 217 C GLY A 13 -0.462 -12.752 -4.029 1.00 0.00 C ATOM 218 O GLY A 13 -0.517 -12.114 -2.996 1.00 0.00 O ATOM 0 H GLY A 13 -0.893 -15.262 -3.161 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -1.399 -14.149 -5.390 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -2.534 -13.138 -4.519 1.00 0.00 H new ATOM 222 N ILE A 14 0.576 -12.659 -4.843 1.00 0.00 N ATOM 223 CA ILE A 14 1.738 -11.738 -4.512 1.00 0.00 C ATOM 224 C ILE A 14 1.237 -10.360 -4.021 1.00 0.00 C ATOM 225 O ILE A 14 1.851 -9.749 -3.167 1.00 0.00 O ATOM 226 CB ILE A 14 2.556 -11.575 -5.812 1.00 0.00 C ATOM 227 CG1 ILE A 14 3.748 -10.634 -5.573 1.00 0.00 C ATOM 228 CG2 ILE A 14 1.669 -10.984 -6.911 1.00 0.00 C ATOM 229 CD1 ILE A 14 4.659 -11.201 -4.478 1.00 0.00 C ATOM 0 H ILE A 14 0.673 -13.175 -5.717 1.00 0.00 H new ATOM 0 HA ILE A 14 2.343 -12.160 -3.710 1.00 0.00 H new ATOM 0 HB ILE A 14 2.922 -12.555 -6.119 1.00 0.00 H new ATOM 0 HG12 ILE A 14 4.313 -10.508 -6.497 1.00 0.00 H new ATOM 0 HG13 ILE A 14 3.389 -9.647 -5.282 1.00 0.00 H new ATOM 0 HG21 ILE A 14 2.250 -10.871 -7.826 1.00 0.00 H new ATOM 0 HG22 ILE A 14 0.827 -11.650 -7.096 1.00 0.00 H new ATOM 0 HG23 ILE A 14 1.298 -10.009 -6.594 1.00 0.00 H new ATOM 0 HD11 ILE A 14 5.499 -10.526 -4.318 1.00 0.00 H new ATOM 0 HD12 ILE A 14 4.094 -11.303 -3.551 1.00 0.00 H new ATOM 0 HD13 ILE A 14 5.032 -12.178 -4.785 1.00 0.00 H new ATOM 241 N GLU A 15 0.119 -9.874 -4.537 1.00 0.00 N ATOM 242 CA GLU A 15 -0.408 -8.539 -4.062 1.00 0.00 C ATOM 243 C GLU A 15 -0.523 -8.537 -2.525 1.00 0.00 C ATOM 244 O GLU A 15 -0.284 -7.529 -1.888 1.00 0.00 O ATOM 245 CB GLU A 15 -1.796 -8.352 -4.699 1.00 0.00 C ATOM 246 CG GLU A 15 -1.671 -7.476 -5.948 1.00 0.00 C ATOM 247 CD GLU A 15 -1.583 -8.364 -7.191 1.00 0.00 C ATOM 248 OE1 GLU A 15 -0.551 -8.987 -7.378 1.00 0.00 O ATOM 249 OE2 GLU A 15 -2.549 -8.405 -7.936 1.00 0.00 O ATOM 0 H GLU A 15 -0.442 -10.335 -5.254 1.00 0.00 H new ATOM 0 HA GLU A 15 0.262 -7.728 -4.349 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -2.220 -9.321 -4.962 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -2.477 -7.890 -3.984 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -2.530 -6.810 -6.025 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -0.785 -6.846 -5.875 1.00 0.00 H new ATOM 256 N GLY A 16 -0.867 -9.658 -1.921 1.00 0.00 N ATOM 257 CA GLY A 16 -0.962 -9.700 -0.432 1.00 0.00 C ATOM 258 C GLY A 16 0.450 -9.570 0.159 1.00 0.00 C ATOM 259 O GLY A 16 0.652 -8.871 1.134 1.00 0.00 O ATOM 0 H GLY A 16 -1.083 -10.534 -2.396 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -1.598 -8.891 -0.072 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -1.421 -10.634 -0.110 1.00 0.00 H new ATOM 263 N ARG A 17 1.435 -10.225 -0.429 1.00 0.00 N ATOM 264 CA ARG A 17 2.838 -10.110 0.112 1.00 0.00 C ATOM 265 C ARG A 17 3.289 -8.642 0.134 1.00 0.00 C ATOM 266 O ARG A 17 4.073 -8.259 0.980 1.00 0.00 O ATOM 267 CB ARG A 17 3.746 -10.930 -0.818 1.00 0.00 C ATOM 268 CG ARG A 17 3.715 -12.402 -0.398 1.00 0.00 C ATOM 269 CD ARG A 17 4.044 -13.285 -1.603 1.00 0.00 C ATOM 270 NE ARG A 17 4.341 -14.625 -1.028 1.00 0.00 N ATOM 271 CZ ARG A 17 3.626 -15.659 -1.378 1.00 0.00 C ATOM 272 NH1 ARG A 17 3.496 -15.965 -2.639 1.00 0.00 N ATOM 273 NH2 ARG A 17 3.042 -16.388 -0.467 1.00 0.00 N ATOM 0 H ARG A 17 1.331 -10.825 -1.247 1.00 0.00 H new ATOM 0 HA ARG A 17 2.887 -10.483 1.135 1.00 0.00 H new ATOM 0 HB2 ARG A 17 3.412 -10.829 -1.851 1.00 0.00 H new ATOM 0 HB3 ARG A 17 4.767 -10.550 -0.774 1.00 0.00 H new ATOM 0 HG2 ARG A 17 4.434 -12.578 0.402 1.00 0.00 H new ATOM 0 HG3 ARG A 17 2.731 -12.658 -0.004 1.00 0.00 H new ATOM 0 HD2 ARG A 17 3.207 -13.331 -2.299 1.00 0.00 H new ATOM 0 HD3 ARG A 17 4.898 -12.895 -2.157 1.00 0.00 H new ATOM 0 HE ARG A 17 5.104 -14.735 -0.360 1.00 0.00 H new ATOM 0 HH11 ARG A 17 3.953 -15.396 -3.352 1.00 0.00 H new ATOM 0 HH12 ARG A 17 2.937 -16.773 -2.913 1.00 0.00 H new ATOM 0 HH21 ARG A 17 3.144 -16.150 0.520 1.00 0.00 H new ATOM 0 HH22 ARG A 17 2.483 -17.196 -0.741 1.00 0.00 H new ATOM 287 N TYR A 18 2.804 -7.805 -0.771 1.00 0.00 N ATOM 288 CA TYR A 18 3.231 -6.353 -0.748 1.00 0.00 C ATOM 289 C TYR A 18 3.001 -5.768 0.655 1.00 0.00 C ATOM 290 O TYR A 18 3.804 -4.994 1.143 1.00 0.00 O ATOM 291 CB TYR A 18 2.358 -5.606 -1.773 1.00 0.00 C ATOM 292 CG TYR A 18 3.103 -5.449 -3.078 1.00 0.00 C ATOM 293 CD1 TYR A 18 3.686 -6.563 -3.694 1.00 0.00 C ATOM 294 CD2 TYR A 18 3.202 -4.186 -3.675 1.00 0.00 C ATOM 295 CE1 TYR A 18 4.369 -6.413 -4.907 1.00 0.00 C ATOM 296 CE2 TYR A 18 3.884 -4.038 -4.888 1.00 0.00 C ATOM 297 CZ TYR A 18 4.468 -5.150 -5.504 1.00 0.00 C ATOM 298 OH TYR A 18 5.140 -5.003 -6.701 1.00 0.00 O ATOM 0 H TYR A 18 2.146 -8.057 -1.509 1.00 0.00 H new ATOM 0 HA TYR A 18 4.288 -6.254 -0.993 1.00 0.00 H new ATOM 0 HB2 TYR A 18 1.430 -6.154 -1.939 1.00 0.00 H new ATOM 0 HB3 TYR A 18 2.084 -4.626 -1.382 1.00 0.00 H new ATOM 0 HD1 TYR A 18 3.609 -7.537 -3.234 1.00 0.00 H new ATOM 0 HD2 TYR A 18 2.752 -3.327 -3.200 1.00 0.00 H new ATOM 0 HE1 TYR A 18 4.820 -7.272 -5.382 1.00 0.00 H new ATOM 0 HE2 TYR A 18 3.960 -3.064 -5.349 1.00 0.00 H new ATOM 0 HH TYR A 18 5.114 -4.063 -6.977 1.00 0.00 H new ATOM 308 N ALA A 19 1.925 -6.148 1.319 1.00 0.00 N ATOM 309 CA ALA A 19 1.689 -5.613 2.704 1.00 0.00 C ATOM 310 C ALA A 19 2.664 -6.281 3.682 1.00 0.00 C ATOM 311 O ALA A 19 3.166 -5.639 4.585 1.00 0.00 O ATOM 312 CB ALA A 19 0.241 -5.951 3.088 1.00 0.00 C ATOM 0 H ALA A 19 1.215 -6.792 0.969 1.00 0.00 H new ATOM 0 HA ALA A 19 1.849 -4.535 2.740 1.00 0.00 H new ATOM 0 HB1 ALA A 19 0.034 -5.577 4.090 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -0.442 -5.485 2.378 1.00 0.00 H new ATOM 0 HB3 ALA A 19 0.102 -7.032 3.068 1.00 0.00 H new ATOM 318 N THR A 20 2.945 -7.562 3.516 1.00 0.00 N ATOM 319 CA THR A 20 3.903 -8.227 4.462 1.00 0.00 C ATOM 320 C THR A 20 5.338 -7.806 4.143 1.00 0.00 C ATOM 321 O THR A 20 6.130 -7.599 5.045 1.00 0.00 O ATOM 322 CB THR A 20 3.721 -9.749 4.320 1.00 0.00 C ATOM 323 OG1 THR A 20 2.772 -10.028 3.296 1.00 0.00 O ATOM 324 CG2 THR A 20 3.222 -10.308 5.655 1.00 0.00 C ATOM 0 H THR A 20 2.561 -8.160 2.784 1.00 0.00 H new ATOM 0 HA THR A 20 3.702 -7.928 5.491 1.00 0.00 H new ATOM 0 HB THR A 20 4.671 -10.213 4.054 1.00 0.00 H new ATOM 0 HG1 THR A 20 2.661 -10.998 3.208 1.00 0.00 H new ATOM 0 HG21 THR A 20 3.088 -11.386 5.571 1.00 0.00 H new ATOM 0 HG22 THR A 20 3.952 -10.093 6.435 1.00 0.00 H new ATOM 0 HG23 THR A 20 2.270 -9.843 5.911 1.00 0.00 H new ATOM 332 N ALA A 21 5.683 -7.636 2.882 1.00 0.00 N ATOM 333 CA ALA A 21 7.078 -7.181 2.573 1.00 0.00 C ATOM 334 C ALA A 21 7.247 -5.702 2.962 1.00 0.00 C ATOM 335 O ALA A 21 8.359 -5.233 3.103 1.00 0.00 O ATOM 336 CB ALA A 21 7.292 -7.373 1.063 1.00 0.00 C ATOM 0 H ALA A 21 5.076 -7.788 2.076 1.00 0.00 H new ATOM 0 HA ALA A 21 7.812 -7.756 3.137 1.00 0.00 H new ATOM 0 HB1 ALA A 21 8.299 -7.053 0.795 1.00 0.00 H new ATOM 0 HB2 ALA A 21 7.166 -8.425 0.809 1.00 0.00 H new ATOM 0 HB3 ALA A 21 6.563 -6.777 0.514 1.00 0.00 H new ATOM 342 N LEU A 22 6.166 -4.962 3.170 1.00 0.00 N ATOM 343 CA LEU A 22 6.321 -3.530 3.582 1.00 0.00 C ATOM 344 C LEU A 22 6.163 -3.441 5.096 1.00 0.00 C ATOM 345 O LEU A 22 6.946 -2.792 5.765 1.00 0.00 O ATOM 346 CB LEU A 22 5.211 -2.743 2.874 1.00 0.00 C ATOM 347 CG LEU A 22 5.325 -1.255 3.238 1.00 0.00 C ATOM 348 CD1 LEU A 22 5.935 -0.481 2.067 1.00 0.00 C ATOM 349 CD2 LEU A 22 3.936 -0.693 3.549 1.00 0.00 C ATOM 0 H LEU A 22 5.205 -5.288 3.072 1.00 0.00 H new ATOM 0 HA LEU A 22 7.297 -3.127 3.313 1.00 0.00 H new ATOM 0 HB2 LEU A 22 5.292 -2.871 1.795 1.00 0.00 H new ATOM 0 HB3 LEU A 22 4.234 -3.126 3.169 1.00 0.00 H new ATOM 0 HG LEU A 22 5.965 -1.150 4.114 1.00 0.00 H new ATOM 0 HD11 LEU A 22 6.014 0.574 2.330 1.00 0.00 H new ATOM 0 HD12 LEU A 22 6.927 -0.875 1.848 1.00 0.00 H new ATOM 0 HD13 LEU A 22 5.299 -0.589 1.188 1.00 0.00 H new ATOM 0 HD21 LEU A 22 4.020 0.363 3.807 1.00 0.00 H new ATOM 0 HD22 LEU A 22 3.295 -0.803 2.674 1.00 0.00 H new ATOM 0 HD23 LEU A 22 3.502 -1.238 4.388 1.00 0.00 H new ATOM 361 N TYR A 23 5.179 -4.116 5.653 1.00 0.00 N ATOM 362 CA TYR A 23 5.024 -4.082 7.130 1.00 0.00 C ATOM 363 C TYR A 23 6.047 -5.044 7.785 1.00 0.00 C ATOM 364 O TYR A 23 6.286 -4.940 8.969 1.00 0.00 O ATOM 365 CB TYR A 23 3.531 -4.428 7.424 1.00 0.00 C ATOM 366 CG TYR A 23 3.366 -5.738 8.161 1.00 0.00 C ATOM 367 CD1 TYR A 23 3.766 -5.841 9.493 1.00 0.00 C ATOM 368 CD2 TYR A 23 2.835 -6.844 7.501 1.00 0.00 C ATOM 369 CE1 TYR A 23 3.628 -7.050 10.174 1.00 0.00 C ATOM 370 CE2 TYR A 23 2.701 -8.056 8.171 1.00 0.00 C ATOM 371 CZ TYR A 23 3.094 -8.165 9.513 1.00 0.00 C ATOM 372 OH TYR A 23 2.961 -9.366 10.178 1.00 0.00 O ATOM 0 H TYR A 23 4.492 -4.678 5.150 1.00 0.00 H new ATOM 0 HA TYR A 23 5.241 -3.105 7.562 1.00 0.00 H new ATOM 0 HB2 TYR A 23 3.087 -3.626 8.014 1.00 0.00 H new ATOM 0 HB3 TYR A 23 2.982 -4.474 6.484 1.00 0.00 H new ATOM 0 HD1 TYR A 23 4.184 -4.983 9.998 1.00 0.00 H new ATOM 0 HD2 TYR A 23 2.527 -6.761 6.469 1.00 0.00 H new ATOM 0 HE1 TYR A 23 3.932 -7.127 11.208 1.00 0.00 H new ATOM 0 HE2 TYR A 23 2.294 -8.914 7.657 1.00 0.00 H new ATOM 0 HH TYR A 23 2.370 -9.958 9.668 1.00 0.00 H new ATOM 382 N SER A 24 6.681 -5.960 7.040 1.00 0.00 N ATOM 383 CA SER A 24 7.705 -6.868 7.695 1.00 0.00 C ATOM 384 C SER A 24 8.705 -5.997 8.473 1.00 0.00 C ATOM 385 O SER A 24 9.060 -6.303 9.596 1.00 0.00 O ATOM 386 CB SER A 24 8.414 -7.632 6.569 1.00 0.00 C ATOM 387 OG SER A 24 9.760 -7.890 6.950 1.00 0.00 O ATOM 0 H SER A 24 6.535 -6.109 6.042 1.00 0.00 H new ATOM 0 HA SER A 24 7.244 -7.570 8.390 1.00 0.00 H new ATOM 0 HB2 SER A 24 7.895 -8.569 6.367 1.00 0.00 H new ATOM 0 HB3 SER A 24 8.390 -7.050 5.648 1.00 0.00 H new ATOM 0 HG SER A 24 10.215 -8.379 6.233 1.00 0.00 H new ATOM 393 N ALA A 25 9.097 -4.869 7.909 1.00 0.00 N ATOM 394 CA ALA A 25 9.997 -3.942 8.665 1.00 0.00 C ATOM 395 C ALA A 25 9.128 -3.225 9.710 1.00 0.00 C ATOM 396 O ALA A 25 9.529 -3.056 10.846 1.00 0.00 O ATOM 397 CB ALA A 25 10.573 -2.939 7.652 1.00 0.00 C ATOM 0 H ALA A 25 8.835 -4.559 6.973 1.00 0.00 H new ATOM 0 HA ALA A 25 10.816 -4.459 9.165 1.00 0.00 H new ATOM 0 HB1 ALA A 25 11.237 -2.243 8.166 1.00 0.00 H new ATOM 0 HB2 ALA A 25 11.133 -3.476 6.886 1.00 0.00 H new ATOM 0 HB3 ALA A 25 9.759 -2.385 7.185 1.00 0.00 H new ATOM 403 N ALA A 26 7.917 -2.824 9.339 1.00 0.00 N ATOM 404 CA ALA A 26 7.012 -2.143 10.340 1.00 0.00 C ATOM 405 C ALA A 26 6.824 -3.037 11.582 1.00 0.00 C ATOM 406 O ALA A 26 6.757 -2.545 12.691 1.00 0.00 O ATOM 407 CB ALA A 26 5.658 -1.931 9.640 1.00 0.00 C ATOM 0 H ALA A 26 7.525 -2.937 8.404 1.00 0.00 H new ATOM 0 HA ALA A 26 7.439 -1.196 10.670 1.00 0.00 H new ATOM 0 HB1 ALA A 26 4.967 -1.440 10.325 1.00 0.00 H new ATOM 0 HB2 ALA A 26 5.798 -1.307 8.757 1.00 0.00 H new ATOM 0 HB3 ALA A 26 5.248 -2.896 9.341 1.00 0.00 H new ATOM 413 N SER A 27 6.749 -4.350 11.413 1.00 0.00 N ATOM 414 CA SER A 27 6.576 -5.255 12.616 1.00 0.00 C ATOM 415 C SER A 27 7.693 -4.971 13.633 1.00 0.00 C ATOM 416 O SER A 27 7.450 -4.900 14.823 1.00 0.00 O ATOM 417 CB SER A 27 6.688 -6.700 12.102 1.00 0.00 C ATOM 418 OG SER A 27 6.537 -7.599 13.193 1.00 0.00 O ATOM 0 H SER A 27 6.799 -4.827 10.513 1.00 0.00 H new ATOM 0 HA SER A 27 5.616 -5.089 13.106 1.00 0.00 H new ATOM 0 HB2 SER A 27 5.923 -6.891 11.350 1.00 0.00 H new ATOM 0 HB3 SER A 27 7.654 -6.853 11.620 1.00 0.00 H new ATOM 0 HG SER A 27 6.606 -8.521 12.869 1.00 0.00 H new ATOM 424 N LYS A 28 8.915 -4.780 13.168 1.00 0.00 N ATOM 425 CA LYS A 28 10.034 -4.469 14.127 1.00 0.00 C ATOM 426 C LYS A 28 9.836 -3.051 14.686 1.00 0.00 C ATOM 427 O LYS A 28 10.057 -2.810 15.859 1.00 0.00 O ATOM 428 CB LYS A 28 11.344 -4.549 13.327 1.00 0.00 C ATOM 429 CG LYS A 28 12.511 -4.805 14.284 1.00 0.00 C ATOM 430 CD LYS A 28 13.831 -4.704 13.518 1.00 0.00 C ATOM 431 CE LYS A 28 14.210 -3.232 13.343 1.00 0.00 C ATOM 432 NZ LYS A 28 14.836 -2.840 14.636 1.00 0.00 N ATOM 0 H LYS A 28 9.181 -4.825 12.184 1.00 0.00 H new ATOM 0 HA LYS A 28 10.055 -5.168 14.963 1.00 0.00 H new ATOM 0 HB2 LYS A 28 11.283 -5.348 12.588 1.00 0.00 H new ATOM 0 HB3 LYS A 28 11.506 -3.620 12.779 1.00 0.00 H new ATOM 0 HG2 LYS A 28 12.494 -4.080 15.097 1.00 0.00 H new ATOM 0 HG3 LYS A 28 12.415 -5.792 14.735 1.00 0.00 H new ATOM 0 HD2 LYS A 28 14.618 -5.231 14.058 1.00 0.00 H new ATOM 0 HD3 LYS A 28 13.736 -5.184 12.544 1.00 0.00 H new ATOM 0 HE2 LYS A 28 14.903 -3.099 12.512 1.00 0.00 H new ATOM 0 HE3 LYS A 28 13.333 -2.621 13.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 14.636 -1.838 14.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 14.445 -3.424 15.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 15.865 -2.984 14.581 1.00 0.00 H new ATOM 446 N GLN A 29 9.399 -2.111 13.865 1.00 0.00 N ATOM 447 CA GLN A 29 9.169 -0.716 14.382 1.00 0.00 C ATOM 448 C GLN A 29 7.794 -0.594 15.081 1.00 0.00 C ATOM 449 O GLN A 29 7.467 0.457 15.598 1.00 0.00 O ATOM 450 CB GLN A 29 9.227 0.215 13.162 1.00 0.00 C ATOM 451 CG GLN A 29 10.632 0.176 12.556 1.00 0.00 C ATOM 452 CD GLN A 29 10.539 0.368 11.037 1.00 0.00 C ATOM 453 OE1 GLN A 29 11.117 -0.392 10.286 1.00 0.00 O ATOM 454 NE2 GLN A 29 9.837 1.359 10.545 1.00 0.00 N ATOM 0 H GLN A 29 9.195 -2.249 12.875 1.00 0.00 H new ATOM 0 HA GLN A 29 9.924 -0.455 15.124 1.00 0.00 H new ATOM 0 HB2 GLN A 29 8.491 -0.094 12.420 1.00 0.00 H new ATOM 0 HB3 GLN A 29 8.975 1.234 13.456 1.00 0.00 H new ATOM 0 HG2 GLN A 29 11.251 0.959 12.995 1.00 0.00 H new ATOM 0 HG3 GLN A 29 11.112 -0.776 12.784 1.00 0.00 H new ATOM 0 HE21 GLN A 29 9.350 2.000 11.172 1.00 0.00 H new ATOM 0 HE22 GLN A 29 9.777 1.490 9.535 1.00 0.00 H new ATOM 463 N ASN A 30 6.974 -1.643 15.104 1.00 0.00 N ATOM 464 CA ASN A 30 5.630 -1.564 15.768 1.00 0.00 C ATOM 465 C ASN A 30 4.714 -0.623 14.982 1.00 0.00 C ATOM 466 O ASN A 30 3.966 0.145 15.559 1.00 0.00 O ATOM 467 CB ASN A 30 5.860 -1.042 17.197 1.00 0.00 C ATOM 468 CG ASN A 30 4.709 -1.501 18.101 1.00 0.00 C ATOM 469 OD1 ASN A 30 3.596 -1.661 17.644 1.00 0.00 O ATOM 470 ND2 ASN A 30 4.927 -1.723 19.375 1.00 0.00 N ATOM 0 H ASN A 30 7.190 -2.548 14.687 1.00 0.00 H new ATOM 0 HA ASN A 30 5.147 -2.540 15.797 1.00 0.00 H new ATOM 0 HB2 ASN A 30 6.810 -1.413 17.583 1.00 0.00 H new ATOM 0 HB3 ASN A 30 5.921 0.046 17.193 1.00 0.00 H new ATOM 0 HD21 ASN A 30 4.163 -2.029 19.977 1.00 0.00 H new ATOM 0 HD22 ASN A 30 5.861 -1.590 19.763 1.00 0.00 H new ATOM 477 N LYS A 31 4.751 -0.686 13.665 1.00 0.00 N ATOM 478 CA LYS A 31 3.860 0.200 12.854 1.00 0.00 C ATOM 479 C LYS A 31 2.680 -0.590 12.241 1.00 0.00 C ATOM 480 O LYS A 31 2.000 -0.081 11.373 1.00 0.00 O ATOM 481 CB LYS A 31 4.750 0.778 11.751 1.00 0.00 C ATOM 482 CG LYS A 31 5.304 2.135 12.194 1.00 0.00 C ATOM 483 CD LYS A 31 6.709 1.951 12.773 1.00 0.00 C ATOM 484 CE LYS A 31 7.250 3.304 13.242 1.00 0.00 C ATOM 485 NZ LYS A 31 6.661 3.504 14.594 1.00 0.00 N ATOM 0 H LYS A 31 5.355 -1.307 13.127 1.00 0.00 H new ATOM 0 HA LYS A 31 3.415 0.980 13.472 1.00 0.00 H new ATOM 0 HB2 LYS A 31 5.570 0.093 11.535 1.00 0.00 H new ATOM 0 HB3 LYS A 31 4.178 0.891 10.830 1.00 0.00 H new ATOM 0 HG2 LYS A 31 5.335 2.820 11.347 1.00 0.00 H new ATOM 0 HG3 LYS A 31 4.647 2.581 12.941 1.00 0.00 H new ATOM 0 HD2 LYS A 31 6.681 1.250 13.607 1.00 0.00 H new ATOM 0 HD3 LYS A 31 7.371 1.524 12.020 1.00 0.00 H new ATOM 0 HE2 LYS A 31 8.339 3.302 13.282 1.00 0.00 H new ATOM 0 HE3 LYS A 31 6.958 4.104 12.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 6.365 4.495 14.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 5.835 2.882 14.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 7.370 3.275 15.319 1.00 0.00 H new ATOM 499 N LEU A 32 2.410 -1.817 12.688 1.00 0.00 N ATOM 500 CA LEU A 32 1.243 -2.602 12.119 1.00 0.00 C ATOM 501 C LEU A 32 -0.014 -1.719 12.087 1.00 0.00 C ATOM 502 O LEU A 32 -0.765 -1.744 11.134 1.00 0.00 O ATOM 503 CB LEU A 32 1.046 -3.805 13.070 1.00 0.00 C ATOM 504 CG LEU A 32 1.933 -4.998 12.651 1.00 0.00 C ATOM 505 CD1 LEU A 32 1.284 -5.711 11.467 1.00 0.00 C ATOM 506 CD2 LEU A 32 3.352 -4.540 12.266 1.00 0.00 C ATOM 0 H LEU A 32 2.942 -2.299 13.412 1.00 0.00 H new ATOM 0 HA LEU A 32 1.429 -2.933 11.097 1.00 0.00 H new ATOM 0 HB2 LEU A 32 1.288 -3.509 14.091 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -0.001 -4.108 13.066 1.00 0.00 H new ATOM 0 HG LEU A 32 2.021 -5.676 13.500 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.905 -6.555 11.166 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.297 -6.072 11.756 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.186 -5.016 10.633 1.00 0.00 H new ATOM 0 HD21 LEU A 32 3.948 -5.406 11.977 1.00 0.00 H new ATOM 0 HD22 LEU A 32 3.295 -3.843 11.430 1.00 0.00 H new ATOM 0 HD23 LEU A 32 3.819 -4.047 13.118 1.00 0.00 H new ATOM 518 N GLU A 33 -0.214 -0.894 13.096 1.00 0.00 N ATOM 519 CA GLU A 33 -1.398 0.029 13.064 1.00 0.00 C ATOM 520 C GLU A 33 -1.071 1.176 12.094 1.00 0.00 C ATOM 521 O GLU A 33 -1.893 1.566 11.287 1.00 0.00 O ATOM 522 CB GLU A 33 -1.595 0.559 14.492 1.00 0.00 C ATOM 523 CG GLU A 33 -3.061 0.946 14.697 1.00 0.00 C ATOM 524 CD GLU A 33 -3.160 2.015 15.788 1.00 0.00 C ATOM 525 OE1 GLU A 33 -2.602 3.083 15.595 1.00 0.00 O ATOM 526 OE2 GLU A 33 -3.792 1.746 16.796 1.00 0.00 O ATOM 0 H GLU A 33 0.379 -0.821 13.923 1.00 0.00 H new ATOM 0 HA GLU A 33 -2.309 -0.468 12.730 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -1.304 -0.202 15.217 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -0.953 1.423 14.662 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.482 1.323 13.765 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -3.644 0.069 14.979 1.00 0.00 H new ATOM 533 N GLN A 34 0.142 1.700 12.149 1.00 0.00 N ATOM 534 CA GLN A 34 0.529 2.802 11.196 1.00 0.00 C ATOM 535 C GLN A 34 0.379 2.328 9.740 1.00 0.00 C ATOM 536 O GLN A 34 0.154 3.132 8.854 1.00 0.00 O ATOM 537 CB GLN A 34 2.001 3.143 11.489 1.00 0.00 C ATOM 538 CG GLN A 34 2.140 3.660 12.932 1.00 0.00 C ATOM 539 CD GLN A 34 2.735 5.075 12.927 1.00 0.00 C ATOM 540 OE1 GLN A 34 3.883 5.260 13.279 1.00 0.00 O ATOM 541 NE2 GLN A 34 2.002 6.092 12.542 1.00 0.00 N ATOM 0 H GLN A 34 0.870 1.416 12.804 1.00 0.00 H new ATOM 0 HA GLN A 34 -0.113 3.673 11.328 1.00 0.00 H new ATOM 0 HB2 GLN A 34 2.623 2.259 11.348 1.00 0.00 H new ATOM 0 HB3 GLN A 34 2.356 3.898 10.787 1.00 0.00 H new ATOM 0 HG2 GLN A 34 1.165 3.668 13.420 1.00 0.00 H new ATOM 0 HG3 GLN A 34 2.779 2.990 13.507 1.00 0.00 H new ATOM 0 HE21 GLN A 34 1.038 5.942 12.245 1.00 0.00 H new ATOM 0 HE22 GLN A 34 2.396 7.033 12.539 1.00 0.00 H new ATOM 550 N VAL A 35 0.516 1.042 9.470 1.00 0.00 N ATOM 551 CA VAL A 35 0.392 0.568 8.053 1.00 0.00 C ATOM 552 C VAL A 35 -0.953 -0.150 7.822 1.00 0.00 C ATOM 553 O VAL A 35 -1.587 0.053 6.807 1.00 0.00 O ATOM 554 CB VAL A 35 1.561 -0.413 7.805 1.00 0.00 C ATOM 555 CG1 VAL A 35 1.830 -0.497 6.302 1.00 0.00 C ATOM 556 CG2 VAL A 35 2.852 0.047 8.517 1.00 0.00 C ATOM 0 H VAL A 35 0.705 0.315 10.160 1.00 0.00 H new ATOM 0 HA VAL A 35 0.428 1.415 7.367 1.00 0.00 H new ATOM 0 HB VAL A 35 1.277 -1.386 8.206 1.00 0.00 H new ATOM 0 HG11 VAL A 35 2.653 -1.187 6.118 1.00 0.00 H new ATOM 0 HG12 VAL A 35 0.936 -0.855 5.792 1.00 0.00 H new ATOM 0 HG13 VAL A 35 2.093 0.491 5.924 1.00 0.00 H new ATOM 0 HG21 VAL A 35 3.651 -0.668 8.319 1.00 0.00 H new ATOM 0 HG22 VAL A 35 3.143 1.029 8.144 1.00 0.00 H new ATOM 0 HG23 VAL A 35 2.674 0.105 9.591 1.00 0.00 H new ATOM 566 N GLU A 36 -1.392 -0.996 8.737 1.00 0.00 N ATOM 567 CA GLU A 36 -2.700 -1.723 8.515 1.00 0.00 C ATOM 568 C GLU A 36 -3.892 -0.750 8.489 1.00 0.00 C ATOM 569 O GLU A 36 -4.877 -1.011 7.823 1.00 0.00 O ATOM 570 CB GLU A 36 -2.867 -2.710 9.683 1.00 0.00 C ATOM 571 CG GLU A 36 -3.907 -3.774 9.315 1.00 0.00 C ATOM 572 CD GLU A 36 -5.254 -3.429 9.958 1.00 0.00 C ATOM 573 OE1 GLU A 36 -5.541 -2.250 10.089 1.00 0.00 O ATOM 574 OE2 GLU A 36 -5.973 -4.349 10.309 1.00 0.00 O ATOM 0 H GLU A 36 -0.914 -1.213 9.611 1.00 0.00 H new ATOM 0 HA GLU A 36 -2.680 -2.233 7.552 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -1.912 -3.184 9.911 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.180 -2.177 10.581 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -4.015 -3.831 8.232 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -3.573 -4.755 9.654 1.00 0.00 H new ATOM 581 N LYS A 37 -3.833 0.357 9.205 1.00 0.00 N ATOM 582 CA LYS A 37 -5.001 1.304 9.196 1.00 0.00 C ATOM 583 C LYS A 37 -4.868 2.332 8.069 1.00 0.00 C ATOM 584 O LYS A 37 -5.857 2.701 7.460 1.00 0.00 O ATOM 585 CB LYS A 37 -5.007 2.000 10.565 1.00 0.00 C ATOM 586 CG LYS A 37 -6.341 2.722 10.764 1.00 0.00 C ATOM 587 CD LYS A 37 -6.534 3.037 12.249 1.00 0.00 C ATOM 588 CE LYS A 37 -7.980 3.474 12.496 1.00 0.00 C ATOM 589 NZ LYS A 37 -8.024 3.859 13.935 1.00 0.00 N ATOM 0 H LYS A 37 -3.042 0.640 9.784 1.00 0.00 H new ATOM 0 HA LYS A 37 -5.933 0.767 9.021 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -4.856 1.268 11.358 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -4.183 2.711 10.627 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -6.359 3.643 10.181 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -7.161 2.100 10.404 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -6.301 2.159 12.851 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -5.847 3.826 12.556 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -8.255 4.311 11.854 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -8.679 2.666 12.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -8.985 4.171 14.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -7.764 3.040 14.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -7.353 4.635 14.107 1.00 0.00 H new ATOM 603 N GLU A 38 -3.672 2.794 7.764 1.00 0.00 N ATOM 604 CA GLU A 38 -3.545 3.787 6.647 1.00 0.00 C ATOM 605 C GLU A 38 -3.722 3.063 5.303 1.00 0.00 C ATOM 606 O GLU A 38 -4.321 3.598 4.389 1.00 0.00 O ATOM 607 CB GLU A 38 -2.153 4.415 6.770 1.00 0.00 C ATOM 608 CG GLU A 38 -2.207 5.547 7.799 1.00 0.00 C ATOM 609 CD GLU A 38 -2.329 4.958 9.207 1.00 0.00 C ATOM 610 OE1 GLU A 38 -3.435 4.618 9.592 1.00 0.00 O ATOM 611 OE2 GLU A 38 -1.314 4.860 9.876 1.00 0.00 O ATOM 0 H GLU A 38 -2.801 2.534 8.227 1.00 0.00 H new ATOM 0 HA GLU A 38 -4.307 4.565 6.700 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -1.426 3.663 7.076 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.827 4.800 5.804 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -1.309 6.160 7.727 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -3.055 6.199 7.592 1.00 0.00 H new ATOM 618 N LEU A 39 -3.236 1.840 5.174 1.00 0.00 N ATOM 619 CA LEU A 39 -3.425 1.098 3.873 1.00 0.00 C ATOM 620 C LEU A 39 -4.924 0.994 3.542 1.00 0.00 C ATOM 621 O LEU A 39 -5.307 1.060 2.388 1.00 0.00 O ATOM 622 CB LEU A 39 -2.837 -0.311 4.062 1.00 0.00 C ATOM 623 CG LEU A 39 -1.394 -0.334 3.559 1.00 0.00 C ATOM 624 CD1 LEU A 39 -0.729 -1.650 3.970 1.00 0.00 C ATOM 625 CD2 LEU A 39 -1.390 -0.215 2.034 1.00 0.00 C ATOM 0 H LEU A 39 -2.727 1.333 5.898 1.00 0.00 H new ATOM 0 HA LEU A 39 -2.929 1.621 3.055 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -2.871 -0.592 5.115 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -3.435 -1.042 3.517 1.00 0.00 H new ATOM 0 HG LEU A 39 -0.843 0.500 3.993 1.00 0.00 H new ATOM 0 HD11 LEU A 39 0.300 -1.665 3.611 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -0.735 -1.737 5.056 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -1.277 -2.486 3.536 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -0.363 -0.231 1.671 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -1.941 -1.051 1.602 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -1.864 0.722 1.741 1.00 0.00 H new ATOM 637 N LEU A 40 -5.783 0.838 4.538 1.00 0.00 N ATOM 638 CA LEU A 40 -7.261 0.742 4.238 1.00 0.00 C ATOM 639 C LEU A 40 -7.729 1.972 3.438 1.00 0.00 C ATOM 640 O LEU A 40 -8.612 1.869 2.606 1.00 0.00 O ATOM 641 CB LEU A 40 -7.985 0.688 5.593 1.00 0.00 C ATOM 642 CG LEU A 40 -8.133 -0.768 6.035 1.00 0.00 C ATOM 643 CD1 LEU A 40 -8.576 -0.817 7.498 1.00 0.00 C ATOM 644 CD2 LEU A 40 -9.182 -1.462 5.164 1.00 0.00 C ATOM 0 H LEU A 40 -5.531 0.774 5.524 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.478 -0.142 3.639 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -7.424 1.250 6.340 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -8.966 1.156 5.512 1.00 0.00 H new ATOM 0 HG LEU A 40 -7.175 -1.277 5.928 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -8.681 -1.856 7.812 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -7.830 -0.324 8.121 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -9.533 -0.307 7.606 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -9.288 -2.500 5.479 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -10.139 -0.951 5.271 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -8.868 -1.430 4.121 1.00 0.00 H new ATOM 656 N ARG A 41 -7.152 3.137 3.677 1.00 0.00 N ATOM 657 CA ARG A 41 -7.591 4.358 2.908 1.00 0.00 C ATOM 658 C ARG A 41 -7.368 4.142 1.403 1.00 0.00 C ATOM 659 O ARG A 41 -8.223 4.464 0.599 1.00 0.00 O ATOM 660 CB ARG A 41 -6.733 5.532 3.406 1.00 0.00 C ATOM 661 CG ARG A 41 -7.382 6.151 4.645 1.00 0.00 C ATOM 662 CD ARG A 41 -6.294 6.631 5.608 1.00 0.00 C ATOM 663 NE ARG A 41 -6.822 6.328 6.967 1.00 0.00 N ATOM 664 CZ ARG A 41 -7.360 7.278 7.683 1.00 0.00 C ATOM 665 NH1 ARG A 41 -8.481 7.826 7.302 1.00 0.00 N ATOM 666 NH2 ARG A 41 -6.778 7.677 8.781 1.00 0.00 N ATOM 0 H ARG A 41 -6.410 3.293 4.359 1.00 0.00 H new ATOM 0 HA ARG A 41 -8.651 4.557 3.063 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -5.727 5.186 3.644 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -6.634 6.282 2.621 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -8.020 6.986 4.355 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -8.021 5.418 5.138 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -5.351 6.115 5.427 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -6.103 7.697 5.488 1.00 0.00 H new ATOM 0 HE ARG A 41 -6.763 5.380 7.338 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -8.937 7.512 6.445 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -8.902 8.568 7.861 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -5.903 7.247 9.080 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -7.198 8.419 9.340 1.00 0.00 H new ATOM 680 N VAL A 42 -6.233 3.593 1.010 1.00 0.00 N ATOM 681 CA VAL A 42 -5.994 3.364 -0.460 1.00 0.00 C ATOM 682 C VAL A 42 -7.035 2.369 -1.001 1.00 0.00 C ATOM 683 O VAL A 42 -7.538 2.534 -2.096 1.00 0.00 O ATOM 684 CB VAL A 42 -4.570 2.792 -0.594 1.00 0.00 C ATOM 685 CG1 VAL A 42 -4.260 2.513 -2.069 1.00 0.00 C ATOM 686 CG2 VAL A 42 -3.559 3.805 -0.044 1.00 0.00 C ATOM 0 H VAL A 42 -5.477 3.299 1.629 1.00 0.00 H new ATOM 0 HA VAL A 42 -6.089 4.287 -1.032 1.00 0.00 H new ATOM 0 HB VAL A 42 -4.501 1.862 -0.029 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -3.252 2.109 -2.159 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -4.977 1.791 -2.461 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -4.331 3.440 -2.637 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.551 3.401 -0.138 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -3.632 4.735 -0.608 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -3.775 4.001 1.006 1.00 0.00 H new ATOM 696 N GLY A 43 -7.372 1.344 -0.242 1.00 0.00 N ATOM 697 CA GLY A 43 -8.386 0.360 -0.721 1.00 0.00 C ATOM 698 C GLY A 43 -9.744 1.063 -0.857 1.00 0.00 C ATOM 699 O GLY A 43 -10.426 0.908 -1.852 1.00 0.00 O ATOM 0 H GLY A 43 -6.986 1.154 0.683 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -8.081 -0.057 -1.681 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -8.462 -0.472 -0.021 1.00 0.00 H new ATOM 703 N GLN A 44 -10.142 1.845 0.130 1.00 0.00 N ATOM 704 CA GLN A 44 -11.465 2.559 0.025 1.00 0.00 C ATOM 705 C GLN A 44 -11.419 3.563 -1.138 1.00 0.00 C ATOM 706 O GLN A 44 -12.372 3.697 -1.881 1.00 0.00 O ATOM 707 CB GLN A 44 -11.679 3.301 1.356 1.00 0.00 C ATOM 708 CG GLN A 44 -12.385 2.378 2.356 1.00 0.00 C ATOM 709 CD GLN A 44 -13.876 2.734 2.428 1.00 0.00 C ATOM 710 OE1 GLN A 44 -14.422 2.875 3.504 1.00 0.00 O ATOM 711 NE2 GLN A 44 -14.567 2.889 1.324 1.00 0.00 N ATOM 0 H GLN A 44 -9.618 2.017 0.988 1.00 0.00 H new ATOM 0 HA GLN A 44 -12.279 1.859 -0.163 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -10.720 3.625 1.761 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -12.276 4.198 1.191 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -12.264 1.338 2.053 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -11.930 2.478 3.341 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -14.114 2.772 0.418 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -15.558 3.127 1.372 1.00 0.00 H new ATOM 720 N ILE A 45 -10.315 4.267 -1.307 1.00 0.00 N ATOM 721 CA ILE A 45 -10.227 5.259 -2.442 1.00 0.00 C ATOM 722 C ILE A 45 -10.405 4.521 -3.781 1.00 0.00 C ATOM 723 O ILE A 45 -11.082 5.007 -4.668 1.00 0.00 O ATOM 724 CB ILE A 45 -8.828 5.909 -2.343 1.00 0.00 C ATOM 725 CG1 ILE A 45 -8.752 6.749 -1.064 1.00 0.00 C ATOM 726 CG2 ILE A 45 -8.566 6.819 -3.549 1.00 0.00 C ATOM 727 CD1 ILE A 45 -7.289 6.940 -0.665 1.00 0.00 C ATOM 0 H ILE A 45 -9.484 4.201 -0.720 1.00 0.00 H new ATOM 0 HA ILE A 45 -11.005 6.021 -2.384 1.00 0.00 H new ATOM 0 HB ILE A 45 -8.078 5.119 -2.326 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -9.226 7.718 -1.224 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -9.298 6.256 -0.260 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -7.576 7.266 -3.459 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -8.617 6.232 -4.466 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -9.319 7.607 -3.581 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -7.235 7.538 0.245 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -6.830 5.967 -0.488 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -6.757 7.452 -1.467 1.00 0.00 H new ATOM 739 N LEU A 46 -9.821 3.349 -3.931 1.00 0.00 N ATOM 740 CA LEU A 46 -9.996 2.598 -5.222 1.00 0.00 C ATOM 741 C LEU A 46 -11.385 1.940 -5.257 1.00 0.00 C ATOM 742 O LEU A 46 -12.006 1.862 -6.301 1.00 0.00 O ATOM 743 CB LEU A 46 -8.902 1.519 -5.262 1.00 0.00 C ATOM 744 CG LEU A 46 -8.565 1.150 -6.715 1.00 0.00 C ATOM 745 CD1 LEU A 46 -9.817 0.655 -7.448 1.00 0.00 C ATOM 746 CD2 LEU A 46 -8.002 2.376 -7.442 1.00 0.00 C ATOM 0 H LEU A 46 -9.242 2.888 -3.230 1.00 0.00 H new ATOM 0 HA LEU A 46 -9.916 3.266 -6.080 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -8.007 1.881 -4.755 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -9.237 0.633 -4.723 1.00 0.00 H new ATOM 0 HG LEU A 46 -7.822 0.353 -6.707 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -9.559 0.398 -8.476 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -10.211 -0.226 -6.942 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -10.573 1.441 -7.449 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.764 2.111 -8.472 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -8.743 3.175 -7.435 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -7.098 2.715 -6.937 1.00 0.00 H new ATOM 758 N LYS A 47 -11.884 1.475 -4.129 1.00 0.00 N ATOM 759 CA LYS A 47 -13.243 0.838 -4.126 1.00 0.00 C ATOM 760 C LYS A 47 -14.335 1.914 -4.212 1.00 0.00 C ATOM 761 O LYS A 47 -15.420 1.645 -4.694 1.00 0.00 O ATOM 762 CB LYS A 47 -13.366 0.061 -2.805 1.00 0.00 C ATOM 763 CG LYS A 47 -14.569 -0.881 -2.877 1.00 0.00 C ATOM 764 CD LYS A 47 -15.792 -0.201 -2.258 1.00 0.00 C ATOM 765 CE LYS A 47 -15.818 -0.468 -0.752 1.00 0.00 C ATOM 766 NZ LYS A 47 -17.264 -0.555 -0.403 1.00 0.00 N ATOM 0 H LYS A 47 -11.415 1.509 -3.224 1.00 0.00 H new ATOM 0 HA LYS A 47 -13.365 0.175 -4.983 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -12.455 -0.509 -2.620 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -13.483 0.755 -1.972 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -14.774 -1.146 -3.914 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -14.349 -1.808 -2.348 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -15.759 0.872 -2.447 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -16.704 -0.578 -2.721 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -15.296 -1.392 -0.506 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -15.326 0.333 -0.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -17.365 -0.737 0.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -17.734 0.342 -0.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -17.704 -1.330 -0.938 1.00 0.00 H new ATOM 780 N GLU A 48 -14.078 3.133 -3.752 1.00 0.00 N ATOM 781 CA GLU A 48 -15.149 4.188 -3.832 1.00 0.00 C ATOM 782 C GLU A 48 -15.656 4.321 -5.284 1.00 0.00 C ATOM 783 O GLU A 48 -14.861 4.372 -6.198 1.00 0.00 O ATOM 784 CB GLU A 48 -14.508 5.510 -3.378 1.00 0.00 C ATOM 785 CG GLU A 48 -14.710 5.683 -1.871 1.00 0.00 C ATOM 786 CD GLU A 48 -14.891 7.167 -1.546 1.00 0.00 C ATOM 787 OE1 GLU A 48 -15.964 7.684 -1.806 1.00 0.00 O ATOM 788 OE2 GLU A 48 -13.952 7.761 -1.042 1.00 0.00 O ATOM 0 H GLU A 48 -13.196 3.431 -3.336 1.00 0.00 H new ATOM 0 HA GLU A 48 -16.000 3.927 -3.202 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -13.444 5.511 -3.616 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -14.956 6.347 -3.914 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -15.584 5.119 -1.544 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -13.852 5.284 -1.330 1.00 0.00 H new ATOM 795 N PRO A 49 -16.961 4.364 -5.461 1.00 0.00 N ATOM 796 CA PRO A 49 -17.528 4.482 -6.832 1.00 0.00 C ATOM 797 C PRO A 49 -17.275 5.882 -7.420 1.00 0.00 C ATOM 798 O PRO A 49 -17.081 6.021 -8.613 1.00 0.00 O ATOM 799 CB PRO A 49 -19.019 4.237 -6.629 1.00 0.00 C ATOM 800 CG PRO A 49 -19.279 4.608 -5.206 1.00 0.00 C ATOM 801 CD PRO A 49 -18.019 4.311 -4.438 1.00 0.00 C ATOM 0 HA PRO A 49 -17.076 3.782 -7.535 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -19.615 4.843 -7.311 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -19.278 3.195 -6.819 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -19.541 5.663 -5.124 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -20.118 4.039 -4.806 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -17.849 5.044 -3.649 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -18.064 3.333 -3.960 1.00 0.00 H new ATOM 809 N LYS A 50 -17.256 6.919 -6.604 1.00 0.00 N ATOM 810 CA LYS A 50 -16.988 8.294 -7.157 1.00 0.00 C ATOM 811 C LYS A 50 -15.482 8.454 -7.421 1.00 0.00 C ATOM 812 O LYS A 50 -15.083 9.123 -8.356 1.00 0.00 O ATOM 813 CB LYS A 50 -17.455 9.299 -6.091 1.00 0.00 C ATOM 814 CG LYS A 50 -17.958 10.572 -6.774 1.00 0.00 C ATOM 815 CD LYS A 50 -18.564 11.509 -5.727 1.00 0.00 C ATOM 816 CE LYS A 50 -19.730 12.284 -6.347 1.00 0.00 C ATOM 817 NZ LYS A 50 -19.095 13.226 -7.310 1.00 0.00 N ATOM 0 H LYS A 50 -17.412 6.875 -5.597 1.00 0.00 H new ATOM 0 HA LYS A 50 -17.515 8.458 -8.097 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -18.249 8.861 -5.486 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -16.633 9.537 -5.415 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -17.137 11.069 -7.290 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -18.704 10.322 -7.529 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -18.911 10.935 -4.868 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -17.806 12.202 -5.362 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -20.426 11.614 -6.851 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -20.297 12.820 -5.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -19.792 13.937 -7.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -18.291 13.701 -6.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -18.758 12.699 -8.140 1.00 0.00 H new ATOM 831 N MET A 51 -14.640 7.834 -6.614 1.00 0.00 N ATOM 832 CA MET A 51 -13.162 7.946 -6.840 1.00 0.00 C ATOM 833 C MET A 51 -12.669 6.832 -7.785 1.00 0.00 C ATOM 834 O MET A 51 -11.715 7.026 -8.516 1.00 0.00 O ATOM 835 CB MET A 51 -12.518 7.805 -5.453 1.00 0.00 C ATOM 836 CG MET A 51 -10.997 7.934 -5.575 1.00 0.00 C ATOM 837 SD MET A 51 -10.455 9.551 -4.960 1.00 0.00 S ATOM 838 CE MET A 51 -8.724 9.413 -5.468 1.00 0.00 C ATOM 0 H MET A 51 -14.914 7.261 -5.816 1.00 0.00 H new ATOM 0 HA MET A 51 -12.899 8.894 -7.310 1.00 0.00 H new ATOM 0 HB2 MET A 51 -12.905 8.572 -4.782 1.00 0.00 H new ATOM 0 HB3 MET A 51 -12.777 6.840 -5.017 1.00 0.00 H new ATOM 0 HG2 MET A 51 -10.511 7.140 -5.009 1.00 0.00 H new ATOM 0 HG3 MET A 51 -10.697 7.813 -6.616 1.00 0.00 H new ATOM 0 HE1 MET A 51 -8.140 10.199 -4.989 1.00 0.00 H new ATOM 0 HE2 MET A 51 -8.334 8.439 -5.171 1.00 0.00 H new ATOM 0 HE3 MET A 51 -8.653 9.517 -6.551 1.00 0.00 H new ATOM 848 N ALA A 52 -13.297 5.667 -7.786 1.00 0.00 N ATOM 849 CA ALA A 52 -12.826 4.565 -8.705 1.00 0.00 C ATOM 850 C ALA A 52 -12.839 5.051 -10.163 1.00 0.00 C ATOM 851 O ALA A 52 -11.940 4.750 -10.925 1.00 0.00 O ATOM 852 CB ALA A 52 -13.806 3.393 -8.530 1.00 0.00 C ATOM 0 H ALA A 52 -14.100 5.435 -7.202 1.00 0.00 H new ATOM 0 HA ALA A 52 -11.807 4.263 -8.464 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -13.506 2.568 -9.177 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -13.796 3.062 -7.492 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -14.812 3.717 -8.798 1.00 0.00 H new ATOM 858 N ALA A 53 -13.845 5.809 -10.557 1.00 0.00 N ATOM 859 CA ALA A 53 -13.883 6.315 -11.979 1.00 0.00 C ATOM 860 C ALA A 53 -12.602 7.108 -12.299 1.00 0.00 C ATOM 861 O ALA A 53 -12.118 7.076 -13.414 1.00 0.00 O ATOM 862 CB ALA A 53 -15.111 7.233 -12.089 1.00 0.00 C ATOM 0 H ALA A 53 -14.628 6.095 -9.969 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.945 5.487 -12.685 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -15.182 7.626 -13.103 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -16.012 6.665 -11.856 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -15.011 8.060 -11.386 1.00 0.00 H new ATOM 868 N SER A 54 -12.045 7.820 -11.333 1.00 0.00 N ATOM 869 CA SER A 54 -10.791 8.605 -11.617 1.00 0.00 C ATOM 870 C SER A 54 -9.581 7.663 -11.713 1.00 0.00 C ATOM 871 O SER A 54 -8.881 7.656 -12.708 1.00 0.00 O ATOM 872 CB SER A 54 -10.607 9.581 -10.444 1.00 0.00 C ATOM 873 OG SER A 54 -11.670 10.525 -10.448 1.00 0.00 O ATOM 0 H SER A 54 -12.398 7.890 -10.379 1.00 0.00 H new ATOM 0 HA SER A 54 -10.871 9.137 -12.565 1.00 0.00 H new ATOM 0 HB2 SER A 54 -10.593 9.035 -9.500 1.00 0.00 H new ATOM 0 HB3 SER A 54 -9.649 10.094 -10.529 1.00 0.00 H new ATOM 0 HG SER A 54 -11.557 11.148 -9.700 1.00 0.00 H new ATOM 879 N LEU A 55 -9.321 6.867 -10.693 1.00 0.00 N ATOM 880 CA LEU A 55 -8.134 5.937 -10.762 1.00 0.00 C ATOM 881 C LEU A 55 -8.241 4.994 -11.977 1.00 0.00 C ATOM 882 O LEU A 55 -7.235 4.542 -12.492 1.00 0.00 O ATOM 883 CB LEU A 55 -8.125 5.130 -9.454 1.00 0.00 C ATOM 884 CG LEU A 55 -7.592 6.012 -8.315 1.00 0.00 C ATOM 885 CD1 LEU A 55 -8.763 6.534 -7.479 1.00 0.00 C ATOM 886 CD2 LEU A 55 -6.654 5.193 -7.423 1.00 0.00 C ATOM 0 H LEU A 55 -9.866 6.820 -9.832 1.00 0.00 H new ATOM 0 HA LEU A 55 -7.210 6.503 -10.880 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -9.132 4.784 -9.220 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -7.501 4.243 -9.565 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.044 6.854 -8.739 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -8.383 7.160 -6.671 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -9.428 7.122 -8.111 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -9.313 5.692 -7.058 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.278 5.822 -6.616 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -7.199 4.348 -7.001 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -5.817 4.825 -8.016 1.00 0.00 H new ATOM 898 N LEU A 56 -9.437 4.690 -12.448 1.00 0.00 N ATOM 899 CA LEU A 56 -9.561 3.774 -13.635 1.00 0.00 C ATOM 900 C LEU A 56 -9.660 4.576 -14.951 1.00 0.00 C ATOM 901 O LEU A 56 -9.264 4.092 -15.994 1.00 0.00 O ATOM 902 CB LEU A 56 -10.843 2.960 -13.409 1.00 0.00 C ATOM 903 CG LEU A 56 -11.016 1.945 -14.543 1.00 0.00 C ATOM 904 CD1 LEU A 56 -11.663 0.672 -13.994 1.00 0.00 C ATOM 905 CD2 LEU A 56 -11.909 2.544 -15.634 1.00 0.00 C ATOM 0 H LEU A 56 -10.319 5.032 -12.067 1.00 0.00 H new ATOM 0 HA LEU A 56 -8.685 3.132 -13.725 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -10.793 2.444 -12.450 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -11.705 3.625 -13.369 1.00 0.00 H new ATOM 0 HG LEU A 56 -10.041 1.703 -14.966 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -11.786 -0.051 -14.801 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -11.026 0.245 -13.219 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -12.638 0.913 -13.571 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -12.032 1.822 -16.441 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -12.885 2.787 -15.213 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -11.447 3.450 -16.026 1.00 0.00 H new ATOM 917 N ASN A 57 -10.193 5.788 -14.927 1.00 0.00 N ATOM 918 CA ASN A 57 -10.314 6.583 -16.208 1.00 0.00 C ATOM 919 C ASN A 57 -8.970 6.643 -16.955 1.00 0.00 C ATOM 920 O ASN A 57 -7.925 6.643 -16.338 1.00 0.00 O ATOM 921 CB ASN A 57 -10.747 8.005 -15.810 1.00 0.00 C ATOM 922 CG ASN A 57 -12.270 8.133 -15.939 1.00 0.00 C ATOM 923 OD1 ASN A 57 -12.983 7.162 -15.780 1.00 0.00 O ATOM 924 ND2 ASN A 57 -12.808 9.294 -16.221 1.00 0.00 N ATOM 0 H ASN A 57 -10.544 6.254 -14.090 1.00 0.00 H new ATOM 0 HA ASN A 57 -11.037 6.113 -16.875 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -10.439 8.217 -14.786 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -10.255 8.738 -16.449 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -13.821 9.380 -16.306 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -12.214 10.112 -16.355 1.00 0.00 H new ATOM 931 N PRO A 58 -9.041 6.719 -18.273 1.00 0.00 N ATOM 932 CA PRO A 58 -7.805 6.810 -19.088 1.00 0.00 C ATOM 933 C PRO A 58 -7.240 8.253 -19.118 1.00 0.00 C ATOM 934 O PRO A 58 -6.217 8.493 -19.732 1.00 0.00 O ATOM 935 CB PRO A 58 -8.264 6.392 -20.480 1.00 0.00 C ATOM 936 CG PRO A 58 -9.730 6.698 -20.531 1.00 0.00 C ATOM 937 CD PRO A 58 -10.249 6.721 -19.115 1.00 0.00 C ATOM 0 HA PRO A 58 -7.003 6.190 -18.689 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -7.723 6.939 -21.252 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -8.079 5.332 -20.652 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -9.902 7.659 -21.016 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -10.257 5.945 -21.118 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -10.858 7.606 -18.931 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -10.876 5.854 -18.909 1.00 0.00 H new ATOM 945 N TYR A 59 -7.880 9.216 -18.471 1.00 0.00 N ATOM 946 CA TYR A 59 -7.345 10.618 -18.487 1.00 0.00 C ATOM 947 C TYR A 59 -6.371 10.829 -17.317 1.00 0.00 C ATOM 948 O TYR A 59 -5.397 11.548 -17.447 1.00 0.00 O ATOM 949 CB TYR A 59 -8.570 11.534 -18.344 1.00 0.00 C ATOM 950 CG TYR A 59 -9.498 11.305 -19.515 1.00 0.00 C ATOM 951 CD1 TYR A 59 -9.338 12.049 -20.690 1.00 0.00 C ATOM 952 CD2 TYR A 59 -10.509 10.340 -19.429 1.00 0.00 C ATOM 953 CE1 TYR A 59 -10.193 11.830 -21.777 1.00 0.00 C ATOM 954 CE2 TYR A 59 -11.360 10.119 -20.515 1.00 0.00 C ATOM 955 CZ TYR A 59 -11.203 10.864 -21.691 1.00 0.00 C ATOM 956 OH TYR A 59 -12.043 10.647 -22.763 1.00 0.00 O ATOM 0 H TYR A 59 -8.741 9.087 -17.939 1.00 0.00 H new ATOM 0 HA TYR A 59 -6.794 10.831 -19.403 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -9.088 11.326 -17.408 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -8.257 12.578 -18.310 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -8.556 12.791 -20.758 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -10.631 9.766 -18.522 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -10.073 12.407 -22.682 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -12.139 9.374 -20.448 1.00 0.00 H new ATOM 0 HH TYR A 59 -12.686 9.943 -22.537 1.00 0.00 H new ATOM 966 N VAL A 60 -6.611 10.208 -16.173 1.00 0.00 N ATOM 967 CA VAL A 60 -5.659 10.396 -15.012 1.00 0.00 C ATOM 968 C VAL A 60 -4.212 10.035 -15.425 1.00 0.00 C ATOM 969 O VAL A 60 -3.267 10.556 -14.866 1.00 0.00 O ATOM 970 CB VAL A 60 -6.152 9.471 -13.882 1.00 0.00 C ATOM 971 CG1 VAL A 60 -5.203 9.552 -12.682 1.00 0.00 C ATOM 972 CG2 VAL A 60 -7.548 9.917 -13.443 1.00 0.00 C ATOM 0 H VAL A 60 -7.405 9.593 -15.994 1.00 0.00 H new ATOM 0 HA VAL A 60 -5.644 11.436 -14.685 1.00 0.00 H new ATOM 0 HB VAL A 60 -6.181 8.445 -14.248 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -5.561 8.895 -11.890 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -4.204 9.242 -12.987 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -5.168 10.578 -12.314 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -7.903 9.267 -12.644 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -7.505 10.945 -13.083 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -8.232 9.858 -14.290 1.00 0.00 H new ATOM 982 N LYS A 61 -4.022 9.154 -16.397 1.00 0.00 N ATOM 983 CA LYS A 61 -2.634 8.782 -16.829 1.00 0.00 C ATOM 984 C LYS A 61 -1.825 8.234 -15.643 1.00 0.00 C ATOM 985 O LYS A 61 -2.360 8.019 -14.571 1.00 0.00 O ATOM 986 CB LYS A 61 -2.001 10.075 -17.362 1.00 0.00 C ATOM 987 CG LYS A 61 -1.186 9.769 -18.622 1.00 0.00 C ATOM 988 CD LYS A 61 -1.293 10.942 -19.599 1.00 0.00 C ATOM 989 CE LYS A 61 -0.203 11.969 -19.286 1.00 0.00 C ATOM 990 NZ LYS A 61 -0.848 13.293 -19.506 1.00 0.00 N ATOM 0 H LYS A 61 -4.771 8.682 -16.904 1.00 0.00 H new ATOM 0 HA LYS A 61 -2.649 8.000 -17.588 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -2.778 10.805 -17.588 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.359 10.518 -16.601 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -0.143 9.595 -18.359 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -1.553 8.856 -19.092 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -1.188 10.586 -20.624 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -2.277 11.405 -19.521 1.00 0.00 H new ATOM 0 HE2 LYS A 61 0.152 11.868 -18.260 1.00 0.00 H new ATOM 0 HE3 LYS A 61 0.662 11.838 -19.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -0.162 14.050 -19.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -1.170 13.363 -20.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -1.664 13.392 -18.868 1.00 0.00 H new ATOM 1004 N ARG A 62 -0.538 8.006 -15.822 1.00 0.00 N ATOM 1005 CA ARG A 62 0.292 7.473 -14.695 1.00 0.00 C ATOM 1006 C ARG A 62 1.177 8.587 -14.120 1.00 0.00 C ATOM 1007 O ARG A 62 1.130 8.867 -12.937 1.00 0.00 O ATOM 1008 CB ARG A 62 1.153 6.361 -15.305 1.00 0.00 C ATOM 1009 CG ARG A 62 1.915 5.637 -14.193 1.00 0.00 C ATOM 1010 CD ARG A 62 1.000 4.603 -13.535 1.00 0.00 C ATOM 1011 NE ARG A 62 1.118 3.388 -14.388 1.00 0.00 N ATOM 1012 CZ ARG A 62 0.295 3.207 -15.385 1.00 0.00 C ATOM 1013 NH1 ARG A 62 -0.964 2.954 -15.154 1.00 0.00 N ATOM 1014 NH2 ARG A 62 0.732 3.280 -16.613 1.00 0.00 N ATOM 0 H ARG A 62 -0.034 8.166 -16.694 1.00 0.00 H new ATOM 0 HA ARG A 62 -0.324 7.097 -13.878 1.00 0.00 H new ATOM 0 HB2 ARG A 62 0.524 5.656 -15.848 1.00 0.00 H new ATOM 0 HB3 ARG A 62 1.854 6.783 -16.025 1.00 0.00 H new ATOM 0 HG2 ARG A 62 2.799 5.148 -14.603 1.00 0.00 H new ATOM 0 HG3 ARG A 62 2.264 6.354 -13.450 1.00 0.00 H new ATOM 0 HD2 ARG A 62 1.309 4.398 -12.510 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -0.030 4.957 -13.492 1.00 0.00 H new ATOM 0 HE ARG A 62 1.842 2.697 -14.193 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -1.305 2.898 -14.194 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -1.607 2.813 -15.933 1.00 0.00 H new ATOM 0 HH21 ARG A 62 1.716 3.478 -16.793 1.00 0.00 H new ATOM 0 HH22 ARG A 62 0.089 3.139 -17.392 1.00 0.00 H new ATOM 1028 N SER A 63 1.982 9.237 -14.943 1.00 0.00 N ATOM 1029 CA SER A 63 2.861 10.343 -14.410 1.00 0.00 C ATOM 1030 C SER A 63 1.992 11.409 -13.723 1.00 0.00 C ATOM 1031 O SER A 63 2.336 11.904 -12.666 1.00 0.00 O ATOM 1032 CB SER A 63 3.593 10.954 -15.615 1.00 0.00 C ATOM 1033 OG SER A 63 4.388 12.047 -15.177 1.00 0.00 O ATOM 0 H SER A 63 2.068 9.054 -15.943 1.00 0.00 H new ATOM 0 HA SER A 63 3.573 9.963 -13.678 1.00 0.00 H new ATOM 0 HB2 SER A 63 4.220 10.202 -16.093 1.00 0.00 H new ATOM 0 HB3 SER A 63 2.872 11.289 -16.361 1.00 0.00 H new ATOM 0 HG SER A 63 4.857 12.438 -15.943 1.00 0.00 H new ATOM 1039 N VAL A 64 0.858 11.751 -14.303 1.00 0.00 N ATOM 1040 CA VAL A 64 -0.031 12.774 -13.648 1.00 0.00 C ATOM 1041 C VAL A 64 -0.594 12.187 -12.344 1.00 0.00 C ATOM 1042 O VAL A 64 -0.663 12.865 -11.336 1.00 0.00 O ATOM 1043 CB VAL A 64 -1.167 13.074 -14.642 1.00 0.00 C ATOM 1044 CG1 VAL A 64 -2.125 14.106 -14.040 1.00 0.00 C ATOM 1045 CG2 VAL A 64 -0.572 13.632 -15.937 1.00 0.00 C ATOM 0 H VAL A 64 0.514 11.373 -15.186 1.00 0.00 H new ATOM 0 HA VAL A 64 0.511 13.688 -13.403 1.00 0.00 H new ATOM 0 HB VAL A 64 -1.713 12.155 -14.852 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -2.927 14.314 -14.748 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.550 13.713 -13.116 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -1.581 15.026 -13.827 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -1.374 13.846 -16.643 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -0.025 14.550 -15.720 1.00 0.00 H new ATOM 0 HG23 VAL A 64 0.108 12.899 -16.371 1.00 0.00 H new ATOM 1055 N LYS A 65 -0.985 10.927 -12.348 1.00 0.00 N ATOM 1056 CA LYS A 65 -1.530 10.311 -11.084 1.00 0.00 C ATOM 1057 C LYS A 65 -0.468 10.362 -9.971 1.00 0.00 C ATOM 1058 O LYS A 65 -0.797 10.554 -8.814 1.00 0.00 O ATOM 1059 CB LYS A 65 -1.877 8.851 -11.413 1.00 0.00 C ATOM 1060 CG LYS A 65 -2.628 8.226 -10.236 1.00 0.00 C ATOM 1061 CD LYS A 65 -2.995 6.780 -10.575 1.00 0.00 C ATOM 1062 CE LYS A 65 -4.303 6.407 -9.872 1.00 0.00 C ATOM 1063 NZ LYS A 65 -4.956 5.421 -10.777 1.00 0.00 N ATOM 0 H LYS A 65 -0.952 10.307 -13.157 1.00 0.00 H new ATOM 0 HA LYS A 65 -2.409 10.852 -10.734 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -2.489 8.806 -12.314 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.967 8.287 -11.618 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -2.009 8.255 -9.339 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -3.529 8.800 -10.020 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -3.104 6.664 -11.653 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -2.196 6.108 -10.261 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -4.114 5.976 -8.889 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -4.934 7.283 -9.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -5.670 4.883 -10.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -5.415 5.923 -11.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -4.240 4.768 -11.154 1.00 0.00 H new ATOM 1077 N VAL A 66 0.803 10.197 -10.300 1.00 0.00 N ATOM 1078 CA VAL A 66 1.862 10.245 -9.224 1.00 0.00 C ATOM 1079 C VAL A 66 1.812 11.608 -8.509 1.00 0.00 C ATOM 1080 O VAL A 66 1.949 11.677 -7.303 1.00 0.00 O ATOM 1081 CB VAL A 66 3.226 10.049 -9.918 1.00 0.00 C ATOM 1082 CG1 VAL A 66 4.353 10.086 -8.878 1.00 0.00 C ATOM 1083 CG2 VAL A 66 3.245 8.693 -10.633 1.00 0.00 C ATOM 0 H VAL A 66 1.147 10.035 -11.246 1.00 0.00 H new ATOM 0 HA VAL A 66 1.701 9.468 -8.477 1.00 0.00 H new ATOM 0 HB VAL A 66 3.376 10.851 -10.641 1.00 0.00 H new ATOM 0 HG11 VAL A 66 5.312 9.947 -9.376 1.00 0.00 H new ATOM 0 HG12 VAL A 66 4.345 11.049 -8.367 1.00 0.00 H new ATOM 0 HG13 VAL A 66 4.203 9.288 -8.150 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.208 8.554 -11.124 1.00 0.00 H new ATOM 0 HG22 VAL A 66 3.090 7.896 -9.906 1.00 0.00 H new ATOM 0 HG23 VAL A 66 2.451 8.664 -11.379 1.00 0.00 H new ATOM 1093 N LYS A 67 1.609 12.689 -9.238 1.00 0.00 N ATOM 1094 CA LYS A 67 1.546 14.033 -8.559 1.00 0.00 C ATOM 1095 C LYS A 67 0.286 14.106 -7.685 1.00 0.00 C ATOM 1096 O LYS A 67 0.330 14.601 -6.574 1.00 0.00 O ATOM 1097 CB LYS A 67 1.487 15.093 -9.671 1.00 0.00 C ATOM 1098 CG LYS A 67 1.824 16.466 -9.085 1.00 0.00 C ATOM 1099 CD LYS A 67 1.453 17.557 -10.092 1.00 0.00 C ATOM 1100 CE LYS A 67 2.563 17.686 -11.138 1.00 0.00 C ATOM 1101 NZ LYS A 67 2.199 18.888 -11.938 1.00 0.00 N ATOM 0 H LYS A 67 1.487 12.701 -10.251 1.00 0.00 H new ATOM 0 HA LYS A 67 2.412 14.197 -7.918 1.00 0.00 H new ATOM 0 HB2 LYS A 67 2.190 14.842 -10.465 1.00 0.00 H new ATOM 0 HB3 LYS A 67 0.493 15.111 -10.119 1.00 0.00 H new ATOM 0 HG2 LYS A 67 1.281 16.618 -8.152 1.00 0.00 H new ATOM 0 HG3 LYS A 67 2.887 16.521 -8.848 1.00 0.00 H new ATOM 0 HD2 LYS A 67 0.508 17.312 -10.577 1.00 0.00 H new ATOM 0 HD3 LYS A 67 1.311 18.508 -9.578 1.00 0.00 H new ATOM 0 HE2 LYS A 67 3.538 17.806 -10.666 1.00 0.00 H new ATOM 0 HE3 LYS A 67 2.620 16.796 -11.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 2.914 19.043 -12.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 1.269 18.742 -12.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 2.159 19.720 -11.316 1.00 0.00 H new ATOM 1115 N SER A 68 -0.835 13.606 -8.167 1.00 0.00 N ATOM 1116 CA SER A 68 -2.086 13.647 -7.329 1.00 0.00 C ATOM 1117 C SER A 68 -1.907 12.758 -6.088 1.00 0.00 C ATOM 1118 O SER A 68 -2.342 13.109 -5.007 1.00 0.00 O ATOM 1119 CB SER A 68 -3.228 13.111 -8.207 1.00 0.00 C ATOM 1120 OG SER A 68 -2.903 13.313 -9.575 1.00 0.00 O ATOM 0 H SER A 68 -0.938 13.179 -9.087 1.00 0.00 H new ATOM 0 HA SER A 68 -2.302 14.660 -6.989 1.00 0.00 H new ATOM 0 HB2 SER A 68 -3.385 12.050 -8.012 1.00 0.00 H new ATOM 0 HB3 SER A 68 -4.160 13.622 -7.963 1.00 0.00 H new ATOM 0 HG SER A 68 -3.629 12.971 -10.138 1.00 0.00 H new ATOM 1126 N LEU A 69 -1.268 11.610 -6.228 1.00 0.00 N ATOM 1127 CA LEU A 69 -1.072 10.719 -5.028 1.00 0.00 C ATOM 1128 C LEU A 69 -0.188 11.428 -3.992 1.00 0.00 C ATOM 1129 O LEU A 69 -0.447 11.355 -2.804 1.00 0.00 O ATOM 1130 CB LEU A 69 -0.380 9.442 -5.529 1.00 0.00 C ATOM 1131 CG LEU A 69 -1.429 8.488 -6.102 1.00 0.00 C ATOM 1132 CD1 LEU A 69 -0.729 7.334 -6.820 1.00 0.00 C ATOM 1133 CD2 LEU A 69 -2.288 7.933 -4.963 1.00 0.00 C ATOM 0 H LEU A 69 -0.881 11.258 -7.103 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.024 10.483 -4.553 1.00 0.00 H new ATOM 0 HB2 LEU A 69 0.358 9.690 -6.292 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.157 8.961 -4.711 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.063 9.025 -6.808 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.476 6.653 -7.229 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -0.115 7.728 -7.630 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.096 6.796 -6.114 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -3.036 7.253 -5.370 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -1.654 7.395 -4.258 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.786 8.755 -4.449 1.00 0.00 H new ATOM 1145 N SER A 70 0.850 12.120 -4.423 1.00 0.00 N ATOM 1146 CA SER A 70 1.729 12.833 -3.426 1.00 0.00 C ATOM 1147 C SER A 70 0.938 13.974 -2.772 1.00 0.00 C ATOM 1148 O SER A 70 1.019 14.176 -1.575 1.00 0.00 O ATOM 1149 CB SER A 70 2.929 13.391 -4.206 1.00 0.00 C ATOM 1150 OG SER A 70 3.982 13.685 -3.297 1.00 0.00 O ATOM 0 H SER A 70 1.123 12.221 -5.401 1.00 0.00 H new ATOM 0 HA SER A 70 2.066 12.160 -2.638 1.00 0.00 H new ATOM 0 HB2 SER A 70 3.265 12.666 -4.948 1.00 0.00 H new ATOM 0 HB3 SER A 70 2.639 14.291 -4.748 1.00 0.00 H new ATOM 0 HG SER A 70 4.751 14.040 -3.791 1.00 0.00 H new ATOM 1156 N ASP A 71 0.162 14.712 -3.541 1.00 0.00 N ATOM 1157 CA ASP A 71 -0.643 15.830 -2.928 1.00 0.00 C ATOM 1158 C ASP A 71 -1.770 15.272 -2.032 1.00 0.00 C ATOM 1159 O ASP A 71 -2.301 15.990 -1.203 1.00 0.00 O ATOM 1160 CB ASP A 71 -1.238 16.639 -4.090 1.00 0.00 C ATOM 1161 CG ASP A 71 -1.524 18.068 -3.625 1.00 0.00 C ATOM 1162 OD1 ASP A 71 -2.471 18.249 -2.878 1.00 0.00 O ATOM 1163 OD2 ASP A 71 -0.789 18.958 -4.022 1.00 0.00 O ATOM 0 H ASP A 71 0.051 14.593 -4.548 1.00 0.00 H new ATOM 0 HA ASP A 71 -0.011 16.454 -2.296 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -0.545 16.651 -4.931 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -2.157 16.169 -4.441 1.00 0.00 H new ATOM 1168 N MET A 72 -2.126 14.003 -2.155 1.00 0.00 N ATOM 1169 CA MET A 72 -3.196 13.444 -1.264 1.00 0.00 C ATOM 1170 C MET A 72 -2.516 12.904 -0.004 1.00 0.00 C ATOM 1171 O MET A 72 -2.949 13.162 1.101 1.00 0.00 O ATOM 1172 CB MET A 72 -3.875 12.311 -2.046 1.00 0.00 C ATOM 1173 CG MET A 72 -5.138 11.866 -1.308 1.00 0.00 C ATOM 1174 SD MET A 72 -5.478 10.129 -1.687 1.00 0.00 S ATOM 1175 CE MET A 72 -4.113 9.419 -0.732 1.00 0.00 C ATOM 0 H MET A 72 -1.726 13.345 -2.824 1.00 0.00 H new ATOM 0 HA MET A 72 -3.937 14.189 -0.974 1.00 0.00 H new ATOM 0 HB2 MET A 72 -4.129 12.650 -3.051 1.00 0.00 H new ATOM 0 HB3 MET A 72 -3.190 11.470 -2.156 1.00 0.00 H new ATOM 0 HG2 MET A 72 -5.009 11.996 -0.234 1.00 0.00 H new ATOM 0 HG3 MET A 72 -5.983 12.486 -1.605 1.00 0.00 H new ATOM 0 HE1 MET A 72 -4.490 8.612 -0.104 1.00 0.00 H new ATOM 0 HE2 MET A 72 -3.358 9.027 -1.413 1.00 0.00 H new ATOM 0 HE3 MET A 72 -3.669 10.191 -0.103 1.00 0.00 H new ATOM 1185 N THR A 73 -1.423 12.184 -0.165 1.00 0.00 N ATOM 1186 CA THR A 73 -0.687 11.665 1.036 1.00 0.00 C ATOM 1187 C THR A 73 -0.176 12.871 1.867 1.00 0.00 C ATOM 1188 O THR A 73 -0.164 12.821 3.082 1.00 0.00 O ATOM 1189 CB THR A 73 0.471 10.779 0.477 1.00 0.00 C ATOM 1190 OG1 THR A 73 0.017 9.439 0.369 1.00 0.00 O ATOM 1191 CG2 THR A 73 1.705 10.814 1.382 1.00 0.00 C ATOM 0 H THR A 73 -1.015 11.937 -1.066 1.00 0.00 H new ATOM 0 HA THR A 73 -1.310 11.069 1.703 1.00 0.00 H new ATOM 0 HB THR A 73 0.756 11.174 -0.498 1.00 0.00 H new ATOM 0 HG1 THR A 73 -0.784 9.320 0.920 1.00 0.00 H new ATOM 0 HG21 THR A 73 2.486 10.184 0.956 1.00 0.00 H new ATOM 0 HG22 THR A 73 2.068 11.839 1.463 1.00 0.00 H new ATOM 0 HG23 THR A 73 1.440 10.444 2.373 1.00 0.00 H new ATOM 1199 N ALA A 74 0.237 13.953 1.225 1.00 0.00 N ATOM 1200 CA ALA A 74 0.731 15.142 2.014 1.00 0.00 C ATOM 1201 C ALA A 74 -0.428 15.762 2.814 1.00 0.00 C ATOM 1202 O ALA A 74 -0.249 16.175 3.944 1.00 0.00 O ATOM 1203 CB ALA A 74 1.275 16.157 0.998 1.00 0.00 C ATOM 0 H ALA A 74 0.253 14.062 0.211 1.00 0.00 H new ATOM 0 HA ALA A 74 1.505 14.847 2.722 1.00 0.00 H new ATOM 0 HB1 ALA A 74 1.645 17.037 1.525 1.00 0.00 H new ATOM 0 HB2 ALA A 74 2.089 15.704 0.432 1.00 0.00 H new ATOM 0 HB3 ALA A 74 0.478 16.451 0.315 1.00 0.00 H new ATOM 1209 N LYS A 75 -1.618 15.823 2.246 1.00 0.00 N ATOM 1210 CA LYS A 75 -2.779 16.413 3.002 1.00 0.00 C ATOM 1211 C LYS A 75 -3.469 15.339 3.868 1.00 0.00 C ATOM 1212 O LYS A 75 -4.027 15.650 4.904 1.00 0.00 O ATOM 1213 CB LYS A 75 -3.754 16.951 1.945 1.00 0.00 C ATOM 1214 CG LYS A 75 -4.875 17.732 2.635 1.00 0.00 C ATOM 1215 CD LYS A 75 -4.294 18.985 3.294 1.00 0.00 C ATOM 1216 CE LYS A 75 -5.433 19.908 3.731 1.00 0.00 C ATOM 1217 NZ LYS A 75 -5.893 19.358 5.037 1.00 0.00 N ATOM 0 H LYS A 75 -1.833 15.494 1.305 1.00 0.00 H new ATOM 0 HA LYS A 75 -2.446 17.203 3.675 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -3.226 17.596 1.243 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.173 16.127 1.368 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -5.638 18.011 1.909 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -5.361 17.106 3.384 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -3.686 18.707 4.155 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -3.638 19.505 2.596 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.090 20.937 3.835 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -6.240 19.914 2.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -6.664 19.948 5.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -6.236 18.385 4.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -5.101 19.356 5.711 1.00 0.00 H new ATOM 1231 N GLU A 76 -3.436 14.079 3.465 1.00 0.00 N ATOM 1232 CA GLU A 76 -4.099 13.010 4.299 1.00 0.00 C ATOM 1233 C GLU A 76 -3.315 12.716 5.597 1.00 0.00 C ATOM 1234 O GLU A 76 -3.808 12.008 6.455 1.00 0.00 O ATOM 1235 CB GLU A 76 -4.156 11.746 3.425 1.00 0.00 C ATOM 1236 CG GLU A 76 -5.246 10.809 3.951 1.00 0.00 C ATOM 1237 CD GLU A 76 -4.847 9.358 3.677 1.00 0.00 C ATOM 1238 OE1 GLU A 76 -4.190 8.775 4.524 1.00 0.00 O ATOM 1239 OE2 GLU A 76 -5.206 8.854 2.625 1.00 0.00 O ATOM 0 H GLU A 76 -2.987 13.750 2.610 1.00 0.00 H new ATOM 0 HA GLU A 76 -5.091 13.342 4.605 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -4.363 12.016 2.389 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -3.191 11.240 3.436 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -5.387 10.963 5.021 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -6.197 11.033 3.468 1.00 0.00 H new ATOM 1246 N LYS A 77 -2.102 13.230 5.766 1.00 0.00 N ATOM 1247 CA LYS A 77 -1.325 12.945 7.017 1.00 0.00 C ATOM 1248 C LYS A 77 -1.148 11.430 7.184 1.00 0.00 C ATOM 1249 O LYS A 77 -1.392 10.886 8.243 1.00 0.00 O ATOM 1250 CB LYS A 77 -2.142 13.530 8.179 1.00 0.00 C ATOM 1251 CG LYS A 77 -1.598 14.913 8.543 1.00 0.00 C ATOM 1252 CD LYS A 77 -2.387 15.478 9.727 1.00 0.00 C ATOM 1253 CE LYS A 77 -3.653 16.167 9.212 1.00 0.00 C ATOM 1254 NZ LYS A 77 -3.295 17.610 9.122 1.00 0.00 N ATOM 0 H LYS A 77 -1.628 13.829 5.091 1.00 0.00 H new ATOM 0 HA LYS A 77 -0.330 13.389 6.984 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -3.192 13.604 7.898 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -2.089 12.868 9.043 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -0.540 14.844 8.797 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -1.677 15.583 7.687 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -2.651 14.677 10.418 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -1.773 16.188 10.282 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -3.950 15.772 8.240 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -4.492 16.010 9.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -4.114 18.150 8.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -3.023 17.960 10.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -2.498 17.730 8.465 1.00 0.00 H new ATOM 1268 N PHE A 78 -0.730 10.741 6.136 1.00 0.00 N ATOM 1269 CA PHE A 78 -0.543 9.245 6.243 1.00 0.00 C ATOM 1270 C PHE A 78 0.409 8.902 7.401 1.00 0.00 C ATOM 1271 O PHE A 78 0.791 9.761 8.173 1.00 0.00 O ATOM 1272 CB PHE A 78 0.036 8.755 4.897 1.00 0.00 C ATOM 1273 CG PHE A 78 -1.063 8.081 4.103 1.00 0.00 C ATOM 1274 CD1 PHE A 78 -1.810 7.047 4.683 1.00 0.00 C ATOM 1275 CD2 PHE A 78 -1.345 8.499 2.798 1.00 0.00 C ATOM 1276 CE1 PHE A 78 -2.840 6.434 3.959 1.00 0.00 C ATOM 1277 CE2 PHE A 78 -2.372 7.883 2.071 1.00 0.00 C ATOM 1278 CZ PHE A 78 -3.120 6.850 2.652 1.00 0.00 C ATOM 0 H PHE A 78 -0.513 11.142 5.224 1.00 0.00 H new ATOM 0 HA PHE A 78 -1.494 8.754 6.450 1.00 0.00 H new ATOM 0 HB2 PHE A 78 0.445 9.595 4.335 1.00 0.00 H new ATOM 0 HB3 PHE A 78 0.856 8.058 5.071 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -1.591 6.722 5.690 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -0.771 9.297 2.351 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -3.418 5.640 4.409 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -2.587 8.204 1.063 1.00 0.00 H new ATOM 0 HZ PHE A 78 -3.912 6.375 2.092 1.00 0.00 H new ATOM 1288 N SER A 79 0.797 7.651 7.528 1.00 0.00 N ATOM 1289 CA SER A 79 1.715 7.262 8.631 1.00 0.00 C ATOM 1290 C SER A 79 3.131 7.148 8.076 1.00 0.00 C ATOM 1291 O SER A 79 3.338 7.370 6.899 1.00 0.00 O ATOM 1292 CB SER A 79 1.201 5.902 9.135 1.00 0.00 C ATOM 1293 OG SER A 79 0.675 6.056 10.444 1.00 0.00 O ATOM 0 H SER A 79 0.513 6.889 6.912 1.00 0.00 H new ATOM 0 HA SER A 79 1.739 7.989 9.443 1.00 0.00 H new ATOM 0 HB2 SER A 79 0.432 5.520 8.464 1.00 0.00 H new ATOM 0 HB3 SER A 79 2.011 5.173 9.140 1.00 0.00 H new ATOM 0 HG SER A 79 -0.294 5.909 10.427 1.00 0.00 H new ATOM 1299 N PRO A 80 4.073 6.808 8.923 1.00 0.00 N ATOM 1300 CA PRO A 80 5.468 6.677 8.450 1.00 0.00 C ATOM 1301 C PRO A 80 5.664 5.468 7.516 1.00 0.00 C ATOM 1302 O PRO A 80 6.695 5.363 6.875 1.00 0.00 O ATOM 1303 CB PRO A 80 6.269 6.521 9.731 1.00 0.00 C ATOM 1304 CG PRO A 80 5.307 5.975 10.732 1.00 0.00 C ATOM 1305 CD PRO A 80 3.956 6.519 10.367 1.00 0.00 C ATOM 0 HA PRO A 80 5.778 7.534 7.852 1.00 0.00 H new ATOM 0 HB2 PRO A 80 7.113 5.846 9.588 1.00 0.00 H new ATOM 0 HB3 PRO A 80 6.677 7.477 10.059 1.00 0.00 H new ATOM 0 HG2 PRO A 80 5.304 4.885 10.713 1.00 0.00 H new ATOM 0 HG3 PRO A 80 5.586 6.275 11.742 1.00 0.00 H new ATOM 0 HD2 PRO A 80 3.166 5.796 10.568 1.00 0.00 H new ATOM 0 HD3 PRO A 80 3.719 7.417 10.937 1.00 0.00 H new ATOM 1313 N LEU A 81 4.703 4.566 7.400 1.00 0.00 N ATOM 1314 CA LEU A 81 4.893 3.417 6.473 1.00 0.00 C ATOM 1315 C LEU A 81 3.806 3.419 5.392 1.00 0.00 C ATOM 1316 O LEU A 81 3.494 2.381 4.837 1.00 0.00 O ATOM 1317 CB LEU A 81 4.776 2.172 7.346 1.00 0.00 C ATOM 1318 CG LEU A 81 6.182 1.716 7.757 1.00 0.00 C ATOM 1319 CD1 LEU A 81 6.129 1.004 9.107 1.00 0.00 C ATOM 1320 CD2 LEU A 81 6.737 0.757 6.698 1.00 0.00 C ATOM 0 H LEU A 81 3.815 4.584 7.902 1.00 0.00 H new ATOM 0 HA LEU A 81 5.853 3.462 5.958 1.00 0.00 H new ATOM 0 HB2 LEU A 81 4.177 2.387 8.231 1.00 0.00 H new ATOM 0 HB3 LEU A 81 4.267 1.377 6.802 1.00 0.00 H new ATOM 0 HG LEU A 81 6.829 2.589 7.839 1.00 0.00 H new ATOM 0 HD11 LEU A 81 7.132 0.684 9.389 1.00 0.00 H new ATOM 0 HD12 LEU A 81 5.739 1.686 9.863 1.00 0.00 H new ATOM 0 HD13 LEU A 81 5.478 0.133 9.034 1.00 0.00 H new ATOM 0 HD21 LEU A 81 7.736 0.432 6.989 1.00 0.00 H new ATOM 0 HD22 LEU A 81 6.083 -0.111 6.615 1.00 0.00 H new ATOM 0 HD23 LEU A 81 6.787 1.267 5.736 1.00 0.00 H new ATOM 1332 N THR A 82 3.226 4.565 5.072 1.00 0.00 N ATOM 1333 CA THR A 82 2.179 4.583 4.018 1.00 0.00 C ATOM 1334 C THR A 82 2.473 5.633 2.925 1.00 0.00 C ATOM 1335 O THR A 82 1.603 5.955 2.137 1.00 0.00 O ATOM 1336 CB THR A 82 0.861 4.871 4.745 1.00 0.00 C ATOM 1337 OG1 THR A 82 0.879 4.226 6.014 1.00 0.00 O ATOM 1338 CG2 THR A 82 -0.287 4.300 3.908 1.00 0.00 C ATOM 0 H THR A 82 3.438 5.468 5.496 1.00 0.00 H new ATOM 0 HA THR A 82 2.140 3.631 3.489 1.00 0.00 H new ATOM 0 HB THR A 82 0.731 5.944 4.882 1.00 0.00 H new ATOM 0 HG1 THR A 82 0.508 3.323 5.927 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.235 4.495 4.409 1.00 0.00 H new ATOM 0 HG22 THR A 82 -0.292 4.773 2.926 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.153 3.225 3.792 1.00 0.00 H new ATOM 1346 N SER A 83 3.697 6.129 2.823 1.00 0.00 N ATOM 1347 CA SER A 83 4.020 7.094 1.730 1.00 0.00 C ATOM 1348 C SER A 83 5.150 6.478 0.895 1.00 0.00 C ATOM 1349 O SER A 83 6.136 7.110 0.570 1.00 0.00 O ATOM 1350 CB SER A 83 4.458 8.387 2.415 1.00 0.00 C ATOM 1351 OG SER A 83 3.311 9.075 2.895 1.00 0.00 O ATOM 0 H SER A 83 4.471 5.904 3.448 1.00 0.00 H new ATOM 0 HA SER A 83 3.180 7.303 1.068 1.00 0.00 H new ATOM 0 HB2 SER A 83 5.134 8.164 3.240 1.00 0.00 H new ATOM 0 HB3 SER A 83 5.007 9.016 1.714 1.00 0.00 H new ATOM 0 HG SER A 83 3.588 9.905 3.337 1.00 0.00 H new ATOM 1357 N ASN A 84 4.977 5.228 0.552 1.00 0.00 N ATOM 1358 CA ASN A 84 5.980 4.476 -0.267 1.00 0.00 C ATOM 1359 C ASN A 84 5.209 3.352 -0.964 1.00 0.00 C ATOM 1360 O ASN A 84 5.123 3.299 -2.177 1.00 0.00 O ATOM 1361 CB ASN A 84 6.992 3.914 0.733 1.00 0.00 C ATOM 1362 CG ASN A 84 8.405 4.013 0.146 1.00 0.00 C ATOM 1363 OD1 ASN A 84 8.569 4.023 -1.059 1.00 0.00 O ATOM 1364 ND2 ASN A 84 9.442 4.085 0.943 1.00 0.00 N ATOM 0 H ASN A 84 4.158 4.679 0.813 1.00 0.00 H new ATOM 0 HA ASN A 84 6.494 5.078 -1.016 1.00 0.00 H new ATOM 0 HB2 ASN A 84 6.937 4.467 1.671 1.00 0.00 H new ATOM 0 HB3 ASN A 84 6.754 2.875 0.961 1.00 0.00 H new ATOM 0 HD21 ASN A 84 10.382 4.149 0.552 1.00 0.00 H new ATOM 0 HD22 ASN A 84 9.309 4.077 1.954 1.00 0.00 H new ATOM 1371 N LEU A 85 4.563 2.497 -0.182 1.00 0.00 N ATOM 1372 CA LEU A 85 3.703 1.434 -0.794 1.00 0.00 C ATOM 1373 C LEU A 85 2.638 2.112 -1.692 1.00 0.00 C ATOM 1374 O LEU A 85 2.189 1.523 -2.657 1.00 0.00 O ATOM 1375 CB LEU A 85 3.033 0.681 0.382 1.00 0.00 C ATOM 1376 CG LEU A 85 2.049 -0.371 -0.149 1.00 0.00 C ATOM 1377 CD1 LEU A 85 2.792 -1.388 -1.019 1.00 0.00 C ATOM 1378 CD2 LEU A 85 1.399 -1.099 1.031 1.00 0.00 C ATOM 0 H LEU A 85 4.599 2.496 0.837 1.00 0.00 H new ATOM 0 HA LEU A 85 4.275 0.741 -1.411 1.00 0.00 H new ATOM 0 HB2 LEU A 85 3.795 0.199 0.995 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.508 1.389 1.024 1.00 0.00 H new ATOM 0 HG LEU A 85 1.284 0.125 -0.747 1.00 0.00 H new ATOM 0 HD11 LEU A 85 2.087 -2.131 -1.392 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.258 -0.875 -1.860 1.00 0.00 H new ATOM 0 HD13 LEU A 85 3.560 -1.883 -0.425 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.700 -1.847 0.657 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.170 -1.589 1.626 1.00 0.00 H new ATOM 0 HD23 LEU A 85 0.864 -0.380 1.652 1.00 0.00 H new ATOM 1390 N ILE A 86 2.244 3.360 -1.406 1.00 0.00 N ATOM 1391 CA ILE A 86 1.232 4.028 -2.299 1.00 0.00 C ATOM 1392 C ILE A 86 1.844 4.169 -3.710 1.00 0.00 C ATOM 1393 O ILE A 86 1.181 3.925 -4.701 1.00 0.00 O ATOM 1394 CB ILE A 86 0.893 5.410 -1.647 1.00 0.00 C ATOM 1395 CG1 ILE A 86 -0.315 5.250 -0.712 1.00 0.00 C ATOM 1396 CG2 ILE A 86 0.539 6.473 -2.703 1.00 0.00 C ATOM 1397 CD1 ILE A 86 -0.012 4.218 0.376 1.00 0.00 C ATOM 0 H ILE A 86 2.574 3.917 -0.618 1.00 0.00 H new ATOM 0 HA ILE A 86 0.311 3.454 -2.403 1.00 0.00 H new ATOM 0 HB ILE A 86 1.778 5.738 -1.101 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -0.559 6.209 -0.255 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -1.188 4.938 -1.285 1.00 0.00 H new ATOM 0 HG21 ILE A 86 0.311 7.416 -2.207 1.00 0.00 H new ATOM 0 HG22 ILE A 86 1.385 6.612 -3.377 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -0.329 6.144 -3.274 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -0.877 4.115 1.031 1.00 0.00 H new ATOM 0 HD12 ILE A 86 0.209 3.256 -0.086 1.00 0.00 H new ATOM 0 HD13 ILE A 86 0.848 4.546 0.960 1.00 0.00 H new ATOM 1409 N ASN A 87 3.106 4.548 -3.807 1.00 0.00 N ATOM 1410 CA ASN A 87 3.739 4.683 -5.169 1.00 0.00 C ATOM 1411 C ASN A 87 3.702 3.324 -5.884 1.00 0.00 C ATOM 1412 O ASN A 87 3.239 3.224 -7.003 1.00 0.00 O ATOM 1413 CB ASN A 87 5.194 5.125 -4.944 1.00 0.00 C ATOM 1414 CG ASN A 87 5.219 6.580 -4.463 1.00 0.00 C ATOM 1415 OD1 ASN A 87 4.973 6.849 -3.303 1.00 0.00 O ATOM 1416 ND2 ASN A 87 5.507 7.543 -5.305 1.00 0.00 N ATOM 0 H ASN A 87 3.714 4.766 -3.018 1.00 0.00 H new ATOM 0 HA ASN A 87 3.208 5.408 -5.786 1.00 0.00 H new ATOM 0 HB2 ASN A 87 5.671 4.479 -4.207 1.00 0.00 H new ATOM 0 HB3 ASN A 87 5.762 5.027 -5.869 1.00 0.00 H new ATOM 0 HD21 ASN A 87 5.524 8.512 -4.986 1.00 0.00 H new ATOM 0 HD22 ASN A 87 5.714 7.324 -6.279 1.00 0.00 H new ATOM 1423 N LEU A 88 4.173 2.268 -5.241 1.00 0.00 N ATOM 1424 CA LEU A 88 4.147 0.906 -5.899 1.00 0.00 C ATOM 1425 C LEU A 88 2.731 0.596 -6.408 1.00 0.00 C ATOM 1426 O LEU A 88 2.562 0.064 -7.490 1.00 0.00 O ATOM 1427 CB LEU A 88 4.548 -0.114 -4.823 1.00 0.00 C ATOM 1428 CG LEU A 88 6.057 -0.050 -4.589 1.00 0.00 C ATOM 1429 CD1 LEU A 88 6.363 -0.406 -3.132 1.00 0.00 C ATOM 1430 CD2 LEU A 88 6.758 -1.048 -5.513 1.00 0.00 C ATOM 0 H LEU A 88 4.569 2.288 -4.301 1.00 0.00 H new ATOM 0 HA LEU A 88 4.828 0.870 -6.750 1.00 0.00 H new ATOM 0 HB2 LEU A 88 4.017 0.095 -3.894 1.00 0.00 H new ATOM 0 HB3 LEU A 88 4.261 -1.118 -5.135 1.00 0.00 H new ATOM 0 HG LEU A 88 6.415 0.958 -4.801 1.00 0.00 H new ATOM 0 HD11 LEU A 88 7.439 -0.361 -2.965 1.00 0.00 H new ATOM 0 HD12 LEU A 88 5.863 0.302 -2.472 1.00 0.00 H new ATOM 0 HD13 LEU A 88 6.005 -1.414 -2.921 1.00 0.00 H new ATOM 0 HD21 LEU A 88 7.834 -1.003 -5.347 1.00 0.00 H new ATOM 0 HD22 LEU A 88 6.399 -2.055 -5.300 1.00 0.00 H new ATOM 0 HD23 LEU A 88 6.540 -0.798 -6.551 1.00 0.00 H new ATOM 1442 N LEU A 89 1.708 0.939 -5.647 1.00 0.00 N ATOM 1443 CA LEU A 89 0.306 0.667 -6.123 1.00 0.00 C ATOM 1444 C LEU A 89 0.060 1.432 -7.429 1.00 0.00 C ATOM 1445 O LEU A 89 -0.515 0.903 -8.362 1.00 0.00 O ATOM 1446 CB LEU A 89 -0.646 1.164 -5.021 1.00 0.00 C ATOM 1447 CG LEU A 89 -0.729 0.115 -3.913 1.00 0.00 C ATOM 1448 CD1 LEU A 89 -1.555 0.664 -2.746 1.00 0.00 C ATOM 1449 CD2 LEU A 89 -1.397 -1.146 -4.464 1.00 0.00 C ATOM 0 H LEU A 89 1.781 1.387 -4.734 1.00 0.00 H new ATOM 0 HA LEU A 89 0.145 -0.394 -6.314 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -0.288 2.110 -4.615 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -1.636 1.349 -5.437 1.00 0.00 H new ATOM 0 HG LEU A 89 0.274 -0.125 -3.561 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.613 -0.086 -1.957 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -1.081 1.565 -2.357 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -2.560 0.904 -3.093 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -1.459 -1.898 -3.678 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -2.400 -0.903 -4.814 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -0.808 -1.537 -5.294 1.00 0.00 H new ATOM 1461 N ALA A 90 0.516 2.665 -7.517 1.00 0.00 N ATOM 1462 CA ALA A 90 0.329 3.438 -8.781 1.00 0.00 C ATOM 1463 C ALA A 90 1.662 3.526 -9.549 1.00 0.00 C ATOM 1464 O ALA A 90 1.899 4.481 -10.264 1.00 0.00 O ATOM 1465 CB ALA A 90 -0.136 4.830 -8.348 1.00 0.00 C ATOM 0 H ALA A 90 1.005 3.161 -6.772 1.00 0.00 H new ATOM 0 HA ALA A 90 -0.394 2.965 -9.446 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -0.293 5.452 -9.229 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -1.070 4.745 -7.793 1.00 0.00 H new ATOM 0 HB3 ALA A 90 0.623 5.286 -7.713 1.00 0.00 H new ATOM 1471 N GLU A 91 2.535 2.537 -9.420 1.00 0.00 N ATOM 1472 CA GLU A 91 3.837 2.592 -10.165 1.00 0.00 C ATOM 1473 C GLU A 91 3.745 1.740 -11.441 1.00 0.00 C ATOM 1474 O GLU A 91 4.138 2.175 -12.507 1.00 0.00 O ATOM 1475 CB GLU A 91 4.900 2.024 -9.213 1.00 0.00 C ATOM 1476 CG GLU A 91 6.273 2.071 -9.887 1.00 0.00 C ATOM 1477 CD GLU A 91 7.263 1.223 -9.086 1.00 0.00 C ATOM 1478 OE1 GLU A 91 7.234 1.306 -7.869 1.00 0.00 O ATOM 1479 OE2 GLU A 91 8.034 0.508 -9.703 1.00 0.00 O ATOM 0 H GLU A 91 2.399 1.710 -8.839 1.00 0.00 H new ATOM 0 HA GLU A 91 4.086 3.609 -10.468 1.00 0.00 H new ATOM 0 HB2 GLU A 91 4.918 2.600 -8.288 1.00 0.00 H new ATOM 0 HB3 GLU A 91 4.651 0.997 -8.945 1.00 0.00 H new ATOM 0 HG2 GLU A 91 6.202 1.698 -10.909 1.00 0.00 H new ATOM 0 HG3 GLU A 91 6.625 3.101 -9.948 1.00 0.00 H new ATOM 1486 N ASN A 92 3.227 0.530 -11.346 1.00 0.00 N ATOM 1487 CA ASN A 92 3.116 -0.328 -12.564 1.00 0.00 C ATOM 1488 C ASN A 92 1.659 -0.771 -12.790 1.00 0.00 C ATOM 1489 O ASN A 92 1.415 -1.858 -13.282 1.00 0.00 O ATOM 1490 CB ASN A 92 4.002 -1.540 -12.273 1.00 0.00 C ATOM 1491 CG ASN A 92 5.475 -1.154 -12.459 1.00 0.00 C ATOM 1492 OD1 ASN A 92 5.913 -0.922 -13.569 1.00 0.00 O ATOM 1493 ND2 ASN A 92 6.267 -1.074 -11.418 1.00 0.00 N ATOM 0 H ASN A 92 2.881 0.109 -10.484 1.00 0.00 H new ATOM 0 HA ASN A 92 3.423 0.203 -13.465 1.00 0.00 H new ATOM 0 HB2 ASN A 92 3.833 -1.891 -11.255 1.00 0.00 H new ATOM 0 HB3 ASN A 92 3.743 -2.362 -12.941 1.00 0.00 H new ATOM 0 HD21 ASN A 92 7.247 -0.818 -11.541 1.00 0.00 H new ATOM 0 HD22 ASN A 92 5.904 -1.268 -10.485 1.00 0.00 H new ATOM 1500 N GLY A 93 0.687 0.050 -12.436 1.00 0.00 N ATOM 1501 CA GLY A 93 -0.734 -0.347 -12.638 1.00 0.00 C ATOM 1502 C GLY A 93 -1.141 -1.309 -11.520 1.00 0.00 C ATOM 1503 O GLY A 93 -1.686 -2.366 -11.779 1.00 0.00 O ATOM 0 H GLY A 93 0.826 0.971 -12.019 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -1.377 0.533 -12.631 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -0.858 -0.824 -13.610 1.00 0.00 H new ATOM 1507 N ARG A 94 -0.880 -0.959 -10.275 1.00 0.00 N ATOM 1508 CA ARG A 94 -1.259 -1.875 -9.157 1.00 0.00 C ATOM 1509 C ARG A 94 -2.461 -1.328 -8.365 1.00 0.00 C ATOM 1510 O ARG A 94 -2.610 -1.626 -7.194 1.00 0.00 O ATOM 1511 CB ARG A 94 -0.019 -1.964 -8.259 1.00 0.00 C ATOM 1512 CG ARG A 94 0.836 -3.174 -8.669 1.00 0.00 C ATOM 1513 CD ARG A 94 1.038 -4.102 -7.465 1.00 0.00 C ATOM 1514 NE ARG A 94 0.908 -5.480 -8.016 1.00 0.00 N ATOM 1515 CZ ARG A 94 1.928 -6.050 -8.596 1.00 0.00 C ATOM 1516 NH1 ARG A 94 2.246 -5.729 -9.820 1.00 0.00 N ATOM 1517 NH2 ARG A 94 2.630 -6.941 -7.951 1.00 0.00 N ATOM 0 H ARG A 94 -0.427 -0.089 -9.994 1.00 0.00 H new ATOM 0 HA ARG A 94 -1.561 -2.852 -9.534 1.00 0.00 H new ATOM 0 HB2 ARG A 94 0.567 -1.049 -8.341 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -0.320 -2.057 -7.216 1.00 0.00 H new ATOM 0 HG2 ARG A 94 0.349 -3.716 -9.480 1.00 0.00 H new ATOM 0 HG3 ARG A 94 1.802 -2.837 -9.046 1.00 0.00 H new ATOM 0 HD2 ARG A 94 2.016 -3.950 -7.009 1.00 0.00 H new ATOM 0 HD3 ARG A 94 0.293 -3.914 -6.692 1.00 0.00 H new ATOM 0 HE ARG A 94 0.021 -5.978 -7.940 1.00 0.00 H new ATOM 0 HH11 ARG A 94 1.697 -5.032 -10.324 1.00 0.00 H new ATOM 0 HH12 ARG A 94 3.044 -6.175 -10.273 1.00 0.00 H new ATOM 0 HH21 ARG A 94 2.381 -7.191 -6.994 1.00 0.00 H new ATOM 0 HH22 ARG A 94 3.428 -7.387 -8.404 1.00 0.00 H new ATOM 1531 N LEU A 95 -3.338 -0.557 -8.986 1.00 0.00 N ATOM 1532 CA LEU A 95 -4.531 -0.044 -8.239 1.00 0.00 C ATOM 1533 C LEU A 95 -5.803 -0.779 -8.712 1.00 0.00 C ATOM 1534 O LEU A 95 -6.892 -0.241 -8.657 1.00 0.00 O ATOM 1535 CB LEU A 95 -4.601 1.453 -8.549 1.00 0.00 C ATOM 1536 CG LEU A 95 -3.513 2.186 -7.757 1.00 0.00 C ATOM 1537 CD1 LEU A 95 -3.438 3.643 -8.213 1.00 0.00 C ATOM 1538 CD2 LEU A 95 -3.847 2.136 -6.263 1.00 0.00 C ATOM 0 H LEU A 95 -3.276 -0.268 -9.962 1.00 0.00 H new ATOM 0 HA LEU A 95 -4.453 -0.214 -7.165 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -4.465 1.622 -9.617 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -5.584 1.845 -8.287 1.00 0.00 H new ATOM 0 HG LEU A 95 -2.552 1.702 -7.932 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -2.663 4.162 -7.648 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -3.198 3.680 -9.276 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -4.399 4.128 -8.041 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -3.073 2.657 -5.700 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -4.809 2.618 -6.089 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -3.897 1.097 -5.936 1.00 0.00 H new ATOM 1550 N THR A 96 -5.673 -2.022 -9.138 1.00 0.00 N ATOM 1551 CA THR A 96 -6.868 -2.812 -9.569 1.00 0.00 C ATOM 1552 C THR A 96 -7.139 -3.853 -8.478 1.00 0.00 C ATOM 1553 O THR A 96 -8.225 -3.927 -7.936 1.00 0.00 O ATOM 1554 CB THR A 96 -6.476 -3.485 -10.889 1.00 0.00 C ATOM 1555 OG1 THR A 96 -5.356 -4.331 -10.674 1.00 0.00 O ATOM 1556 CG2 THR A 96 -6.119 -2.414 -11.920 1.00 0.00 C ATOM 0 H THR A 96 -4.785 -2.519 -9.203 1.00 0.00 H new ATOM 0 HA THR A 96 -7.765 -2.209 -9.711 1.00 0.00 H new ATOM 0 HB THR A 96 -7.312 -4.078 -11.258 1.00 0.00 H new ATOM 0 HG1 THR A 96 -5.106 -4.763 -11.517 1.00 0.00 H new ATOM 0 HG21 THR A 96 -5.840 -2.892 -12.859 1.00 0.00 H new ATOM 0 HG22 THR A 96 -6.980 -1.766 -12.084 1.00 0.00 H new ATOM 0 HG23 THR A 96 -5.282 -1.820 -11.553 1.00 0.00 H new ATOM 1564 N ASN A 97 -6.127 -4.621 -8.104 1.00 0.00 N ATOM 1565 CA ASN A 97 -6.300 -5.605 -6.999 1.00 0.00 C ATOM 1566 C ASN A 97 -5.648 -5.031 -5.722 1.00 0.00 C ATOM 1567 O ASN A 97 -5.068 -5.760 -4.941 1.00 0.00 O ATOM 1568 CB ASN A 97 -5.566 -6.871 -7.454 1.00 0.00 C ATOM 1569 CG ASN A 97 -6.250 -7.438 -8.704 1.00 0.00 C ATOM 1570 OD1 ASN A 97 -7.273 -8.087 -8.604 1.00 0.00 O ATOM 1571 ND2 ASN A 97 -5.729 -7.224 -9.888 1.00 0.00 N ATOM 0 H ASN A 97 -5.197 -4.600 -8.522 1.00 0.00 H new ATOM 0 HA ASN A 97 -7.347 -5.817 -6.781 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -4.523 -6.641 -7.670 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -5.570 -7.613 -6.656 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -6.182 -7.601 -10.720 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -4.871 -6.680 -9.977 1.00 0.00 H new ATOM 1578 N THR A 98 -5.739 -3.722 -5.503 1.00 0.00 N ATOM 1579 CA THR A 98 -5.117 -3.125 -4.275 1.00 0.00 C ATOM 1580 C THR A 98 -5.822 -3.557 -2.963 1.00 0.00 C ATOM 1581 O THR A 98 -5.144 -3.680 -1.960 1.00 0.00 O ATOM 1582 CB THR A 98 -5.149 -1.589 -4.445 1.00 0.00 C ATOM 1583 OG1 THR A 98 -4.383 -0.990 -3.410 1.00 0.00 O ATOM 1584 CG2 THR A 98 -6.584 -1.063 -4.379 1.00 0.00 C ATOM 0 H THR A 98 -6.212 -3.059 -6.118 1.00 0.00 H new ATOM 0 HA THR A 98 -4.094 -3.490 -4.180 1.00 0.00 H new ATOM 0 HB THR A 98 -4.731 -1.337 -5.420 1.00 0.00 H new ATOM 0 HG1 THR A 98 -4.955 -0.395 -2.882 1.00 0.00 H new ATOM 0 HG21 THR A 98 -6.580 0.020 -4.501 1.00 0.00 H new ATOM 0 HG22 THR A 98 -7.175 -1.516 -5.175 1.00 0.00 H new ATOM 0 HG23 THR A 98 -7.021 -1.318 -3.413 1.00 0.00 H new ATOM 1592 N PRO A 99 -7.137 -3.786 -2.960 1.00 0.00 N ATOM 1593 CA PRO A 99 -7.792 -4.203 -1.689 1.00 0.00 C ATOM 1594 C PRO A 99 -7.227 -5.555 -1.220 1.00 0.00 C ATOM 1595 O PRO A 99 -7.057 -5.773 -0.035 1.00 0.00 O ATOM 1596 CB PRO A 99 -9.276 -4.286 -2.041 1.00 0.00 C ATOM 1597 CG PRO A 99 -9.297 -4.485 -3.516 1.00 0.00 C ATOM 1598 CD PRO A 99 -8.129 -3.705 -4.057 1.00 0.00 C ATOM 0 HA PRO A 99 -7.618 -3.512 -0.864 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -9.762 -5.112 -1.522 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -9.803 -3.376 -1.755 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -9.211 -5.542 -3.768 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -10.235 -4.131 -3.944 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -7.746 -4.140 -4.980 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -8.401 -2.673 -4.280 1.00 0.00 H new ATOM 1606 N ALA A 100 -6.903 -6.457 -2.131 1.00 0.00 N ATOM 1607 CA ALA A 100 -6.313 -7.776 -1.694 1.00 0.00 C ATOM 1608 C ALA A 100 -5.015 -7.522 -0.901 1.00 0.00 C ATOM 1609 O ALA A 100 -4.728 -8.216 0.056 1.00 0.00 O ATOM 1610 CB ALA A 100 -6.004 -8.571 -2.972 1.00 0.00 C ATOM 0 H ALA A 100 -7.019 -6.341 -3.138 1.00 0.00 H new ATOM 0 HA ALA A 100 -7.002 -8.326 -1.053 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -5.574 -9.536 -2.705 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -6.924 -8.727 -3.535 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -5.294 -8.014 -3.584 1.00 0.00 H new ATOM 1616 N VAL A 101 -4.233 -6.524 -1.282 1.00 0.00 N ATOM 1617 CA VAL A 101 -2.962 -6.237 -0.519 1.00 0.00 C ATOM 1618 C VAL A 101 -3.304 -5.903 0.945 1.00 0.00 C ATOM 1619 O VAL A 101 -2.600 -6.305 1.853 1.00 0.00 O ATOM 1620 CB VAL A 101 -2.293 -5.020 -1.194 1.00 0.00 C ATOM 1621 CG1 VAL A 101 -0.993 -4.670 -0.461 1.00 0.00 C ATOM 1622 CG2 VAL A 101 -1.973 -5.345 -2.660 1.00 0.00 C ATOM 0 H VAL A 101 -4.416 -5.907 -2.073 1.00 0.00 H new ATOM 0 HA VAL A 101 -2.295 -7.099 -0.528 1.00 0.00 H new ATOM 0 HB VAL A 101 -2.977 -4.173 -1.151 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -0.525 -3.811 -0.941 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -1.215 -4.429 0.578 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -0.314 -5.521 -0.499 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -1.501 -4.482 -3.129 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -1.295 -6.198 -2.704 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -2.895 -5.587 -3.189 1.00 0.00 H new ATOM 1632 N ILE A 102 -4.377 -5.172 1.183 1.00 0.00 N ATOM 1633 CA ILE A 102 -4.742 -4.825 2.603 1.00 0.00 C ATOM 1634 C ILE A 102 -5.292 -6.067 3.329 1.00 0.00 C ATOM 1635 O ILE A 102 -5.023 -6.267 4.498 1.00 0.00 O ATOM 1636 CB ILE A 102 -5.824 -3.732 2.529 1.00 0.00 C ATOM 1637 CG1 ILE A 102 -5.286 -2.526 1.748 1.00 0.00 C ATOM 1638 CG2 ILE A 102 -6.207 -3.289 3.944 1.00 0.00 C ATOM 1639 CD1 ILE A 102 -6.408 -1.916 0.900 1.00 0.00 C ATOM 0 H ILE A 102 -5.006 -4.806 0.468 1.00 0.00 H new ATOM 0 HA ILE A 102 -3.870 -4.476 3.157 1.00 0.00 H new ATOM 0 HB ILE A 102 -6.703 -4.132 2.023 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -4.892 -1.780 2.438 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -4.460 -2.835 1.107 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -6.973 -2.515 3.888 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -6.593 -4.143 4.500 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -5.328 -2.893 4.452 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -6.022 -1.060 0.347 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -6.781 -2.663 0.199 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -7.220 -1.591 1.550 1.00 0.00 H new ATOM 1651 N SER A 103 -6.061 -6.903 2.653 1.00 0.00 N ATOM 1652 CA SER A 103 -6.615 -8.126 3.340 1.00 0.00 C ATOM 1653 C SER A 103 -5.461 -9.013 3.825 1.00 0.00 C ATOM 1654 O SER A 103 -5.431 -9.421 4.970 1.00 0.00 O ATOM 1655 CB SER A 103 -7.463 -8.878 2.302 1.00 0.00 C ATOM 1656 OG SER A 103 -6.627 -9.757 1.561 1.00 0.00 O ATOM 0 H SER A 103 -6.325 -6.794 1.674 1.00 0.00 H new ATOM 0 HA SER A 103 -7.218 -7.853 4.206 1.00 0.00 H new ATOM 0 HB2 SER A 103 -8.252 -9.441 2.800 1.00 0.00 H new ATOM 0 HB3 SER A 103 -7.951 -8.170 1.632 1.00 0.00 H new ATOM 0 HG SER A 103 -6.077 -9.238 0.938 1.00 0.00 H new ATOM 1662 N ALA A 104 -4.498 -9.303 2.970 1.00 0.00 N ATOM 1663 CA ALA A 104 -3.335 -10.159 3.419 1.00 0.00 C ATOM 1664 C ALA A 104 -2.660 -9.521 4.651 1.00 0.00 C ATOM 1665 O ALA A 104 -2.189 -10.218 5.529 1.00 0.00 O ATOM 1666 CB ALA A 104 -2.346 -10.214 2.243 1.00 0.00 C ATOM 0 H ALA A 104 -4.464 -8.992 1.999 1.00 0.00 H new ATOM 0 HA ALA A 104 -3.665 -11.160 3.698 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -1.485 -10.823 2.519 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -2.837 -10.653 1.375 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -2.013 -9.205 2.000 1.00 0.00 H new ATOM 1672 N PHE A 105 -2.618 -8.201 4.730 1.00 0.00 N ATOM 1673 CA PHE A 105 -1.979 -7.539 5.924 1.00 0.00 C ATOM 1674 C PHE A 105 -2.690 -7.990 7.208 1.00 0.00 C ATOM 1675 O PHE A 105 -2.050 -8.345 8.180 1.00 0.00 O ATOM 1676 CB PHE A 105 -2.167 -6.022 5.731 1.00 0.00 C ATOM 1677 CG PHE A 105 -1.178 -5.256 6.579 1.00 0.00 C ATOM 1678 CD1 PHE A 105 -1.194 -5.380 7.975 1.00 0.00 C ATOM 1679 CD2 PHE A 105 -0.250 -4.407 5.967 1.00 0.00 C ATOM 1680 CE1 PHE A 105 -0.283 -4.661 8.750 1.00 0.00 C ATOM 1681 CE2 PHE A 105 0.660 -3.688 6.746 1.00 0.00 C ATOM 1682 CZ PHE A 105 0.644 -3.817 8.136 1.00 0.00 C ATOM 0 H PHE A 105 -2.994 -7.563 4.028 1.00 0.00 H new ATOM 0 HA PHE A 105 -0.925 -7.802 6.009 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -2.032 -5.763 4.681 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -3.184 -5.738 6.001 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -1.911 -6.032 8.451 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -0.237 -4.307 4.892 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -0.295 -4.758 9.826 1.00 0.00 H new ATOM 0 HE2 PHE A 105 1.376 -3.032 6.273 1.00 0.00 H new ATOM 0 HZ PHE A 105 1.350 -3.263 8.737 1.00 0.00 H new ATOM 1692 N SER A 106 -4.008 -7.976 7.223 1.00 0.00 N ATOM 1693 CA SER A 106 -4.739 -8.405 8.468 1.00 0.00 C ATOM 1694 C SER A 106 -4.466 -9.888 8.757 1.00 0.00 C ATOM 1695 O SER A 106 -4.319 -10.276 9.903 1.00 0.00 O ATOM 1696 CB SER A 106 -6.236 -8.181 8.207 1.00 0.00 C ATOM 1697 OG SER A 106 -6.496 -6.786 8.140 1.00 0.00 O ATOM 0 H SER A 106 -4.600 -7.692 6.443 1.00 0.00 H new ATOM 0 HA SER A 106 -4.406 -7.832 9.333 1.00 0.00 H new ATOM 0 HB2 SER A 106 -6.531 -8.663 7.275 1.00 0.00 H new ATOM 0 HB3 SER A 106 -6.828 -8.635 9.002 1.00 0.00 H new ATOM 0 HG SER A 106 -7.450 -6.639 7.972 1.00 0.00 H new ATOM 1703 N THR A 107 -4.389 -10.723 7.739 1.00 0.00 N ATOM 1704 CA THR A 107 -4.115 -12.179 8.001 1.00 0.00 C ATOM 1705 C THR A 107 -2.641 -12.379 8.361 1.00 0.00 C ATOM 1706 O THR A 107 -2.324 -13.176 9.224 1.00 0.00 O ATOM 1707 CB THR A 107 -4.467 -12.941 6.713 1.00 0.00 C ATOM 1708 OG1 THR A 107 -5.375 -12.168 5.941 1.00 0.00 O ATOM 1709 CG2 THR A 107 -5.109 -14.283 7.069 1.00 0.00 C ATOM 0 H THR A 107 -4.501 -10.466 6.758 1.00 0.00 H new ATOM 0 HA THR A 107 -4.709 -12.547 8.837 1.00 0.00 H new ATOM 0 HB THR A 107 -3.559 -13.119 6.136 1.00 0.00 H new ATOM 0 HG1 THR A 107 -5.599 -12.652 5.119 1.00 0.00 H new ATOM 0 HG21 THR A 107 -5.358 -14.821 6.154 1.00 0.00 H new ATOM 0 HG22 THR A 107 -4.410 -14.875 7.660 1.00 0.00 H new ATOM 0 HG23 THR A 107 -6.017 -14.110 7.647 1.00 0.00 H new ATOM 1717 N MET A 108 -1.732 -11.649 7.740 1.00 0.00 N ATOM 1718 CA MET A 108 -0.291 -11.819 8.117 1.00 0.00 C ATOM 1719 C MET A 108 -0.045 -11.137 9.472 1.00 0.00 C ATOM 1720 O MET A 108 0.766 -11.598 10.254 1.00 0.00 O ATOM 1721 CB MET A 108 0.547 -11.169 7.009 1.00 0.00 C ATOM 1722 CG MET A 108 0.711 -12.155 5.847 1.00 0.00 C ATOM 1723 SD MET A 108 1.752 -13.546 6.368 1.00 0.00 S ATOM 1724 CE MET A 108 2.703 -13.714 4.838 1.00 0.00 C ATOM 0 H MET A 108 -1.922 -10.963 7.010 1.00 0.00 H new ATOM 0 HA MET A 108 -0.018 -12.870 8.216 1.00 0.00 H new ATOM 0 HB2 MET A 108 0.063 -10.257 6.660 1.00 0.00 H new ATOM 0 HB3 MET A 108 1.524 -10.883 7.398 1.00 0.00 H new ATOM 0 HG2 MET A 108 -0.265 -12.519 5.526 1.00 0.00 H new ATOM 0 HG3 MET A 108 1.161 -11.652 4.991 1.00 0.00 H new ATOM 0 HE1 MET A 108 2.907 -14.768 4.650 1.00 0.00 H new ATOM 0 HE2 MET A 108 2.131 -13.301 4.007 1.00 0.00 H new ATOM 0 HE3 MET A 108 3.645 -13.174 4.934 1.00 0.00 H new ATOM 1734 N MET A 109 -0.757 -10.059 9.784 1.00 0.00 N ATOM 1735 CA MET A 109 -0.555 -9.399 11.124 1.00 0.00 C ATOM 1736 C MET A 109 -0.810 -10.431 12.232 1.00 0.00 C ATOM 1737 O MET A 109 -0.086 -10.482 13.200 1.00 0.00 O ATOM 1738 CB MET A 109 -1.579 -8.255 11.219 1.00 0.00 C ATOM 1739 CG MET A 109 -1.385 -7.503 12.538 1.00 0.00 C ATOM 1740 SD MET A 109 -2.447 -6.039 12.560 1.00 0.00 S ATOM 1741 CE MET A 109 -3.648 -6.646 13.770 1.00 0.00 C ATOM 0 H MET A 109 -1.452 -9.621 9.180 1.00 0.00 H new ATOM 0 HA MET A 109 0.459 -9.014 11.235 1.00 0.00 H new ATOM 0 HB2 MET A 109 -1.457 -7.573 10.378 1.00 0.00 H new ATOM 0 HB3 MET A 109 -2.592 -8.654 11.161 1.00 0.00 H new ATOM 0 HG2 MET A 109 -1.627 -8.153 13.379 1.00 0.00 H new ATOM 0 HG3 MET A 109 -0.341 -7.210 12.652 1.00 0.00 H new ATOM 0 HE1 MET A 109 -4.411 -5.886 13.938 1.00 0.00 H new ATOM 0 HE2 MET A 109 -4.118 -7.554 13.392 1.00 0.00 H new ATOM 0 HE3 MET A 109 -3.140 -6.864 14.709 1.00 0.00 H new ATOM 1751 N SER A 110 -1.809 -11.283 12.096 1.00 0.00 N ATOM 1752 CA SER A 110 -2.036 -12.318 13.178 1.00 0.00 C ATOM 1753 C SER A 110 -0.754 -13.146 13.394 1.00 0.00 C ATOM 1754 O SER A 110 -0.448 -13.535 14.506 1.00 0.00 O ATOM 1755 CB SER A 110 -3.170 -13.224 12.696 1.00 0.00 C ATOM 1756 OG SER A 110 -3.319 -14.312 13.599 1.00 0.00 O ATOM 0 H SER A 110 -2.460 -11.311 11.311 1.00 0.00 H new ATOM 0 HA SER A 110 -2.292 -11.843 14.125 1.00 0.00 H new ATOM 0 HB2 SER A 110 -4.100 -12.659 12.633 1.00 0.00 H new ATOM 0 HB3 SER A 110 -2.954 -13.595 11.694 1.00 0.00 H new ATOM 0 HG SER A 110 -4.046 -14.894 13.293 1.00 0.00 H new ATOM 1762 N VAL A 111 0.005 -13.409 12.346 1.00 0.00 N ATOM 1763 CA VAL A 111 1.273 -14.202 12.525 1.00 0.00 C ATOM 1764 C VAL A 111 2.373 -13.354 13.200 1.00 0.00 C ATOM 1765 O VAL A 111 3.334 -13.902 13.708 1.00 0.00 O ATOM 1766 CB VAL A 111 1.725 -14.638 11.120 1.00 0.00 C ATOM 1767 CG1 VAL A 111 2.971 -15.519 11.229 1.00 0.00 C ATOM 1768 CG2 VAL A 111 0.603 -15.431 10.445 1.00 0.00 C ATOM 0 H VAL A 111 -0.195 -13.114 11.390 1.00 0.00 H new ATOM 0 HA VAL A 111 1.095 -15.062 13.171 1.00 0.00 H new ATOM 0 HB VAL A 111 1.957 -13.753 10.527 1.00 0.00 H new ATOM 0 HG11 VAL A 111 3.288 -15.826 10.232 1.00 0.00 H new ATOM 0 HG12 VAL A 111 3.773 -14.957 11.708 1.00 0.00 H new ATOM 0 HG13 VAL A 111 2.741 -16.403 11.824 1.00 0.00 H new ATOM 0 HG21 VAL A 111 0.923 -15.740 9.450 1.00 0.00 H new ATOM 0 HG22 VAL A 111 0.371 -16.313 11.042 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -0.286 -14.805 10.362 1.00 0.00 H new ATOM 1778 N HIS A 112 2.251 -12.034 13.236 1.00 0.00 N ATOM 1779 CA HIS A 112 3.303 -11.216 13.907 1.00 0.00 C ATOM 1780 C HIS A 112 3.027 -11.148 15.431 1.00 0.00 C ATOM 1781 O HIS A 112 3.930 -10.892 16.206 1.00 0.00 O ATOM 1782 CB HIS A 112 3.257 -9.826 13.204 1.00 0.00 C ATOM 1783 CG HIS A 112 2.598 -8.772 14.059 1.00 0.00 C ATOM 1784 ND1 HIS A 112 1.284 -8.846 14.474 1.00 0.00 N ATOM 1785 CD2 HIS A 112 3.089 -7.630 14.594 1.00 0.00 C ATOM 1786 CE1 HIS A 112 1.033 -7.771 15.231 1.00 0.00 C ATOM 1787 NE2 HIS A 112 2.106 -6.988 15.340 1.00 0.00 N ATOM 0 H HIS A 112 1.477 -11.506 12.833 1.00 0.00 H new ATOM 0 HA HIS A 112 4.303 -11.641 13.817 1.00 0.00 H new ATOM 0 HB2 HIS A 112 4.272 -9.511 12.961 1.00 0.00 H new ATOM 0 HB3 HIS A 112 2.717 -9.916 12.262 1.00 0.00 H new ATOM 0 HD1 HIS A 112 0.622 -9.588 14.245 1.00 0.00 H new ATOM 0 HD2 HIS A 112 4.098 -7.269 14.461 1.00 0.00 H new ATOM 0 HE1 HIS A 112 0.080 -7.564 15.695 1.00 0.00 H new ATOM 1795 N ARG A 113 1.794 -11.373 15.871 1.00 0.00 N ATOM 1796 CA ARG A 113 1.517 -11.307 17.342 1.00 0.00 C ATOM 1797 C ARG A 113 1.585 -12.714 17.970 1.00 0.00 C ATOM 1798 O ARG A 113 2.006 -12.865 19.102 1.00 0.00 O ATOM 1799 CB ARG A 113 0.103 -10.725 17.484 1.00 0.00 C ATOM 1800 CG ARG A 113 0.059 -9.766 18.675 1.00 0.00 C ATOM 1801 CD ARG A 113 -1.214 -8.920 18.602 1.00 0.00 C ATOM 1802 NE ARG A 113 -1.427 -8.423 19.991 1.00 0.00 N ATOM 1803 CZ ARG A 113 -1.523 -7.142 20.217 1.00 0.00 C ATOM 1804 NH1 ARG A 113 -2.686 -6.553 20.152 1.00 0.00 N ATOM 1805 NH2 ARG A 113 -0.457 -6.447 20.508 1.00 0.00 N ATOM 0 H ARG A 113 0.991 -11.594 15.282 1.00 0.00 H new ATOM 0 HA ARG A 113 2.255 -10.691 17.856 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -0.178 -10.200 16.571 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -0.619 -11.529 17.625 1.00 0.00 H new ATOM 0 HG2 ARG A 113 0.082 -10.328 19.609 1.00 0.00 H new ATOM 0 HG3 ARG A 113 0.938 -9.121 18.669 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -1.099 -8.094 17.900 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -2.063 -9.513 18.260 1.00 0.00 H new ATOM 0 HE ARG A 113 -1.498 -9.084 20.764 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -3.520 -7.095 19.924 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -2.761 -5.551 20.329 1.00 0.00 H new ATOM 0 HH21 ARG A 113 0.453 -6.906 20.559 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -0.534 -5.445 20.684 1.00 0.00 H new ATOM 1819 N GLY A 114 1.171 -13.745 17.254 1.00 0.00 N ATOM 1820 CA GLY A 114 1.216 -15.123 17.830 1.00 0.00 C ATOM 1821 C GLY A 114 2.659 -15.656 17.826 1.00 0.00 C ATOM 1822 O GLY A 114 3.057 -16.362 18.735 1.00 0.00 O ATOM 0 H GLY A 114 0.808 -13.684 16.303 1.00 0.00 H new ATOM 0 HA2 GLY A 114 0.828 -15.112 18.849 1.00 0.00 H new ATOM 0 HA3 GLY A 114 0.574 -15.787 17.252 1.00 0.00 H new ATOM 1826 N GLU A 115 3.450 -15.335 16.819 1.00 0.00 N ATOM 1827 CA GLU A 115 4.861 -15.844 16.789 1.00 0.00 C ATOM 1828 C GLU A 115 5.840 -14.735 17.212 1.00 0.00 C ATOM 1829 O GLU A 115 6.703 -14.341 16.450 1.00 0.00 O ATOM 1830 CB GLU A 115 5.120 -16.268 15.337 1.00 0.00 C ATOM 1831 CG GLU A 115 4.391 -17.582 15.051 1.00 0.00 C ATOM 1832 CD GLU A 115 5.338 -18.757 15.300 1.00 0.00 C ATOM 1833 OE1 GLU A 115 6.087 -18.695 16.260 1.00 0.00 O ATOM 1834 OE2 GLU A 115 5.299 -19.699 14.525 1.00 0.00 O ATOM 0 H GLU A 115 3.180 -14.750 16.028 1.00 0.00 H new ATOM 0 HA GLU A 115 5.005 -16.675 17.480 1.00 0.00 H new ATOM 0 HB2 GLU A 115 4.775 -15.492 14.653 1.00 0.00 H new ATOM 0 HB3 GLU A 115 6.190 -16.389 15.168 1.00 0.00 H new ATOM 0 HG2 GLU A 115 3.512 -17.669 15.689 1.00 0.00 H new ATOM 0 HG3 GLU A 115 4.039 -17.598 14.020 1.00 0.00 H new ATOM 1841 N VAL A 116 5.717 -14.230 18.425 1.00 0.00 N ATOM 1842 CA VAL A 116 6.648 -13.153 18.885 1.00 0.00 C ATOM 1843 C VAL A 116 6.871 -13.253 20.407 1.00 0.00 C ATOM 1844 O VAL A 116 6.387 -12.424 21.154 1.00 0.00 O ATOM 1845 CB VAL A 116 5.949 -11.837 18.512 1.00 0.00 C ATOM 1846 CG1 VAL A 116 4.582 -11.746 19.212 1.00 0.00 C ATOM 1847 CG2 VAL A 116 6.829 -10.656 18.937 1.00 0.00 C ATOM 0 H VAL A 116 5.016 -14.518 19.107 1.00 0.00 H new ATOM 0 HA VAL A 116 7.633 -13.229 18.424 1.00 0.00 H new ATOM 0 HB VAL A 116 5.794 -11.807 17.434 1.00 0.00 H new ATOM 0 HG11 VAL A 116 4.096 -10.809 18.940 1.00 0.00 H new ATOM 0 HG12 VAL A 116 3.957 -12.583 18.900 1.00 0.00 H new ATOM 0 HG13 VAL A 116 4.723 -11.781 20.292 1.00 0.00 H new ATOM 0 HG21 VAL A 116 6.335 -9.721 18.673 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.989 -10.691 20.015 1.00 0.00 H new ATOM 0 HG23 VAL A 116 7.790 -10.716 18.426 1.00 0.00 H new ATOM 1857 N PRO A 117 7.597 -14.268 20.827 1.00 0.00 N ATOM 1858 CA PRO A 117 7.866 -14.449 22.276 1.00 0.00 C ATOM 1859 C PRO A 117 8.852 -13.384 22.779 1.00 0.00 C ATOM 1860 O PRO A 117 9.999 -13.357 22.370 1.00 0.00 O ATOM 1861 CB PRO A 117 8.482 -15.844 22.358 1.00 0.00 C ATOM 1862 CG PRO A 117 9.071 -16.086 21.005 1.00 0.00 C ATOM 1863 CD PRO A 117 8.229 -15.323 20.017 1.00 0.00 C ATOM 0 HA PRO A 117 6.972 -14.347 22.891 1.00 0.00 H new ATOM 0 HB2 PRO A 117 9.245 -15.894 23.135 1.00 0.00 H new ATOM 0 HB3 PRO A 117 7.730 -16.594 22.601 1.00 0.00 H new ATOM 0 HG2 PRO A 117 10.107 -15.750 20.970 1.00 0.00 H new ATOM 0 HG3 PRO A 117 9.073 -17.150 20.770 1.00 0.00 H new ATOM 0 HD2 PRO A 117 8.837 -14.901 19.216 1.00 0.00 H new ATOM 0 HD3 PRO A 117 7.484 -15.966 19.547 1.00 0.00 H new ATOM 1871 N CYS A 118 8.421 -12.504 23.661 1.00 0.00 N ATOM 1872 CA CYS A 118 9.344 -11.449 24.180 1.00 0.00 C ATOM 1873 C CYS A 118 9.052 -11.171 25.664 1.00 0.00 C ATOM 1874 O CYS A 118 8.854 -10.037 26.057 1.00 0.00 O ATOM 1875 CB CYS A 118 9.044 -10.213 23.331 1.00 0.00 C ATOM 1876 SG CYS A 118 10.007 -10.284 21.800 1.00 0.00 S ATOM 0 H CYS A 118 7.474 -12.475 24.039 1.00 0.00 H new ATOM 0 HA CYS A 118 10.391 -11.745 24.115 1.00 0.00 H new ATOM 0 HB2 CYS A 118 7.979 -10.166 23.102 1.00 0.00 H new ATOM 0 HB3 CYS A 118 9.291 -9.308 23.887 1.00 0.00 H new ATOM 0 HG CYS A 118 10.313 -11.520 21.537 1.00 0.00 H new ATOM 1882 N THR A 119 9.024 -12.195 26.494 1.00 0.00 N ATOM 1883 CA THR A 119 8.744 -11.976 27.945 1.00 0.00 C ATOM 1884 C THR A 119 9.865 -12.586 28.802 1.00 0.00 C ATOM 1885 O THR A 119 9.776 -13.726 29.217 1.00 0.00 O ATOM 1886 CB THR A 119 7.419 -12.694 28.205 1.00 0.00 C ATOM 1887 OG1 THR A 119 6.433 -12.203 27.308 1.00 0.00 O ATOM 1888 CG2 THR A 119 6.973 -12.442 29.646 1.00 0.00 C ATOM 0 H THR A 119 9.183 -13.166 26.225 1.00 0.00 H new ATOM 0 HA THR A 119 8.692 -10.917 28.200 1.00 0.00 H new ATOM 0 HB THR A 119 7.549 -13.765 28.051 1.00 0.00 H new ATOM 0 HG1 THR A 119 5.583 -12.663 27.472 1.00 0.00 H new ATOM 0 HG21 THR A 119 6.029 -12.954 29.829 1.00 0.00 H new ATOM 0 HG22 THR A 119 7.730 -12.820 30.333 1.00 0.00 H new ATOM 0 HG23 THR A 119 6.842 -11.372 29.804 1.00 0.00 H new ATOM 1896 N VAL A 120 10.917 -11.839 29.072 1.00 0.00 N ATOM 1897 CA VAL A 120 12.031 -12.389 29.903 1.00 0.00 C ATOM 1898 C VAL A 120 12.581 -11.303 30.836 1.00 0.00 C ATOM 1899 O VAL A 120 12.640 -10.159 30.412 1.00 0.00 O ATOM 1900 CB VAL A 120 13.094 -12.843 28.893 1.00 0.00 C ATOM 1901 CG1 VAL A 120 13.561 -11.651 28.050 1.00 0.00 C ATOM 1902 CG2 VAL A 120 14.292 -13.436 29.641 1.00 0.00 C ATOM 1903 OXT VAL A 120 12.933 -11.634 31.956 1.00 0.00 O ATOM 0 H VAL A 120 11.047 -10.879 28.753 1.00 0.00 H new ATOM 0 HA VAL A 120 11.709 -13.212 30.541 1.00 0.00 H new ATOM 0 HB VAL A 120 12.660 -13.598 28.237 1.00 0.00 H new ATOM 0 HG11 VAL A 120 14.315 -11.983 27.336 1.00 0.00 H new ATOM 0 HG12 VAL A 120 12.711 -11.231 27.511 1.00 0.00 H new ATOM 0 HG13 VAL A 120 13.989 -10.890 28.702 1.00 0.00 H new ATOM 0 HG21 VAL A 120 15.046 -13.758 28.923 1.00 0.00 H new ATOM 0 HG22 VAL A 120 14.719 -12.681 30.301 1.00 0.00 H new ATOM 0 HG23 VAL A 120 13.965 -14.292 30.232 1.00 0.00 H new TER 1913 VAL A 120 ATOM 1914 N GLN B 1 15.684 -4.803 -17.318 1.00 0.00 N ATOM 1915 CA GLN B 1 16.350 -3.655 -17.998 1.00 0.00 C ATOM 1916 C GLN B 1 15.548 -2.364 -17.767 1.00 0.00 C ATOM 1917 O GLN B 1 16.085 -1.374 -17.304 1.00 0.00 O ATOM 1918 CB GLN B 1 16.358 -4.023 -19.481 1.00 0.00 C ATOM 1919 CG GLN B 1 17.621 -4.826 -19.802 1.00 0.00 C ATOM 1920 CD GLN B 1 17.577 -5.287 -21.264 1.00 0.00 C ATOM 1921 OE1 GLN B 1 17.324 -4.494 -22.150 1.00 0.00 O ATOM 1922 NE2 GLN B 1 17.816 -6.541 -21.563 1.00 0.00 N ATOM 0 H1 GLN B 1 16.235 -5.670 -17.481 1.00 0.00 H new ATOM 0 H2 GLN B 1 15.627 -4.616 -16.297 1.00 0.00 H new ATOM 0 H3 GLN B 1 14.725 -4.925 -17.702 1.00 0.00 H new ATOM 0 HA GLN B 1 17.356 -3.477 -17.618 1.00 0.00 H new ATOM 0 HB2 GLN B 1 15.471 -4.607 -19.726 1.00 0.00 H new ATOM 0 HB3 GLN B 1 16.324 -3.120 -20.091 1.00 0.00 H new ATOM 0 HG2 GLN B 1 18.507 -4.215 -19.629 1.00 0.00 H new ATOM 0 HG3 GLN B 1 17.694 -5.689 -19.140 1.00 0.00 H new ATOM 0 HE21 GLN B 1 18.029 -7.210 -20.823 1.00 0.00 H new ATOM 0 HE22 GLN B 1 17.789 -6.847 -22.536 1.00 0.00 H new ATOM 1933 N LYS B 2 14.269 -2.361 -18.085 1.00 0.00 N ATOM 1934 CA LYS B 2 13.449 -1.129 -17.880 1.00 0.00 C ATOM 1935 C LYS B 2 12.331 -1.399 -16.861 1.00 0.00 C ATOM 1936 O LYS B 2 12.247 -0.739 -15.842 1.00 0.00 O ATOM 1937 CB LYS B 2 12.856 -0.813 -19.254 1.00 0.00 C ATOM 1938 CG LYS B 2 12.812 0.703 -19.455 1.00 0.00 C ATOM 1939 CD LYS B 2 12.684 1.017 -20.946 1.00 0.00 C ATOM 1940 CE LYS B 2 14.031 0.786 -21.635 1.00 0.00 C ATOM 1941 NZ LYS B 2 13.687 0.318 -23.005 1.00 0.00 N ATOM 0 H LYS B 2 13.765 -3.157 -18.475 1.00 0.00 H new ATOM 0 HA LYS B 2 14.041 -0.300 -17.491 1.00 0.00 H new ATOM 0 HB2 LYS B 2 13.457 -1.277 -20.036 1.00 0.00 H new ATOM 0 HB3 LYS B 2 11.852 -1.230 -19.333 1.00 0.00 H new ATOM 0 HG2 LYS B 2 11.970 1.128 -18.909 1.00 0.00 H new ATOM 0 HG3 LYS B 2 13.716 1.160 -19.053 1.00 0.00 H new ATOM 0 HD2 LYS B 2 11.920 0.384 -21.397 1.00 0.00 H new ATOM 0 HD3 LYS B 2 12.365 2.050 -21.085 1.00 0.00 H new ATOM 0 HE2 LYS B 2 14.620 1.702 -21.667 1.00 0.00 H new ATOM 0 HE3 LYS B 2 14.625 0.044 -21.102 1.00 0.00 H new ATOM 0 HZ1 LYS B 2 14.561 0.138 -23.540 1.00 0.00 H new ATOM 0 HZ2 LYS B 2 13.132 -0.559 -22.943 1.00 0.00 H new ATOM 0 HZ3 LYS B 2 13.128 1.048 -23.491 1.00 0.00 H new ATOM 1955 N THR B 3 11.469 -2.362 -17.123 1.00 0.00 N ATOM 1956 CA THR B 3 10.365 -2.660 -16.162 1.00 0.00 C ATOM 1957 C THR B 3 10.508 -4.089 -15.615 1.00 0.00 C ATOM 1958 O THR B 3 10.347 -5.052 -16.343 1.00 0.00 O ATOM 1959 CB THR B 3 9.080 -2.525 -16.979 1.00 0.00 C ATOM 1960 OG1 THR B 3 9.124 -1.320 -17.734 1.00 0.00 O ATOM 1961 CG2 THR B 3 7.875 -2.496 -16.038 1.00 0.00 C ATOM 0 H THR B 3 11.487 -2.948 -17.958 1.00 0.00 H new ATOM 0 HA THR B 3 10.374 -1.989 -15.303 1.00 0.00 H new ATOM 0 HB THR B 3 8.989 -3.375 -17.656 1.00 0.00 H new ATOM 0 HG1 THR B 3 8.301 -1.233 -18.260 1.00 0.00 H new ATOM 0 HG21 THR B 3 6.960 -2.400 -16.622 1.00 0.00 H new ATOM 0 HG22 THR B 3 7.842 -3.420 -15.461 1.00 0.00 H new ATOM 0 HG23 THR B 3 7.964 -1.647 -15.360 1.00 0.00 H new ATOM 1969 N GLY B 4 10.809 -4.239 -14.340 1.00 0.00 N ATOM 1970 CA GLY B 4 10.958 -5.608 -13.763 1.00 0.00 C ATOM 1971 C GLY B 4 9.968 -5.786 -12.604 1.00 0.00 C ATOM 1972 O GLY B 4 9.830 -4.915 -11.765 1.00 0.00 O ATOM 0 H GLY B 4 10.956 -3.473 -13.683 1.00 0.00 H new ATOM 0 HA2 GLY B 4 10.774 -6.360 -14.531 1.00 0.00 H new ATOM 0 HA3 GLY B 4 11.978 -5.756 -13.410 1.00 0.00 H new ATOM 1976 N THR B 5 9.275 -6.908 -12.545 1.00 0.00 N ATOM 1977 CA THR B 5 8.300 -7.127 -11.436 1.00 0.00 C ATOM 1978 C THR B 5 8.728 -8.335 -10.585 1.00 0.00 C ATOM 1979 O THR B 5 8.105 -9.380 -10.629 1.00 0.00 O ATOM 1980 CB THR B 5 6.965 -7.400 -12.132 1.00 0.00 C ATOM 1981 OG1 THR B 5 7.205 -8.031 -13.381 1.00 0.00 O ATOM 1982 CG2 THR B 5 6.224 -6.082 -12.357 1.00 0.00 C ATOM 0 H THR B 5 9.347 -7.672 -13.216 1.00 0.00 H new ATOM 0 HA THR B 5 8.238 -6.273 -10.762 1.00 0.00 H new ATOM 0 HB THR B 5 6.356 -8.052 -11.506 1.00 0.00 H new ATOM 0 HG1 THR B 5 6.351 -8.208 -13.827 1.00 0.00 H new ATOM 0 HG21 THR B 5 5.274 -6.279 -12.853 1.00 0.00 H new ATOM 0 HG22 THR B 5 6.039 -5.600 -11.397 1.00 0.00 H new ATOM 0 HG23 THR B 5 6.830 -5.426 -12.982 1.00 0.00 H new ATOM 1990 N ALA B 6 9.784 -8.203 -9.808 1.00 0.00 N ATOM 1991 CA ALA B 6 10.240 -9.348 -8.962 1.00 0.00 C ATOM 1992 C ALA B 6 10.304 -8.923 -7.486 1.00 0.00 C ATOM 1993 O ALA B 6 11.372 -8.818 -6.912 1.00 0.00 O ATOM 1994 CB ALA B 6 11.635 -9.695 -9.486 1.00 0.00 C ATOM 0 H ALA B 6 10.344 -7.354 -9.727 1.00 0.00 H new ATOM 0 HA ALA B 6 9.563 -10.200 -9.016 1.00 0.00 H new ATOM 0 HB1 ALA B 6 12.041 -10.530 -8.915 1.00 0.00 H new ATOM 0 HB2 ALA B 6 11.570 -9.973 -10.538 1.00 0.00 H new ATOM 0 HB3 ALA B 6 12.289 -8.830 -9.379 1.00 0.00 H new ATOM 2000 N GLU B 7 9.167 -8.669 -6.859 1.00 0.00 N ATOM 2001 CA GLU B 7 9.165 -8.246 -5.420 1.00 0.00 C ATOM 2002 C GLU B 7 10.066 -7.017 -5.224 1.00 0.00 C ATOM 2003 O GLU B 7 10.813 -6.937 -4.268 1.00 0.00 O ATOM 2004 CB GLU B 7 9.703 -9.445 -4.630 1.00 0.00 C ATOM 2005 CG GLU B 7 8.798 -10.657 -4.857 1.00 0.00 C ATOM 2006 CD GLU B 7 8.771 -11.520 -3.595 1.00 0.00 C ATOM 2007 OE1 GLU B 7 8.582 -10.964 -2.525 1.00 0.00 O ATOM 2008 OE2 GLU B 7 8.941 -12.722 -3.717 1.00 0.00 O ATOM 0 H GLU B 7 8.244 -8.738 -7.287 1.00 0.00 H new ATOM 0 HA GLU B 7 8.167 -7.965 -5.083 1.00 0.00 H new ATOM 0 HB2 GLU B 7 10.721 -9.674 -4.946 1.00 0.00 H new ATOM 0 HB3 GLU B 7 9.745 -9.204 -3.568 1.00 0.00 H new ATOM 0 HG2 GLU B 7 7.789 -10.329 -5.107 1.00 0.00 H new ATOM 0 HG3 GLU B 7 9.161 -11.242 -5.702 1.00 0.00 H new ATOM 2015 N VAL B 8 10.002 -6.053 -6.125 1.00 0.00 N ATOM 2016 CA VAL B 8 10.871 -4.825 -5.970 1.00 0.00 C ATOM 2017 C VAL B 8 10.643 -4.171 -4.593 1.00 0.00 C ATOM 2018 O VAL B 8 11.557 -3.605 -4.021 1.00 0.00 O ATOM 2019 CB VAL B 8 10.494 -3.842 -7.098 1.00 0.00 C ATOM 2020 CG1 VAL B 8 10.738 -4.497 -8.460 1.00 0.00 C ATOM 2021 CG2 VAL B 8 9.017 -3.439 -6.984 1.00 0.00 C ATOM 0 H VAL B 8 9.398 -6.060 -6.947 1.00 0.00 H new ATOM 0 HA VAL B 8 11.925 -5.097 -6.035 1.00 0.00 H new ATOM 0 HB VAL B 8 11.114 -2.951 -7.004 1.00 0.00 H new ATOM 0 HG11 VAL B 8 10.470 -3.799 -9.253 1.00 0.00 H new ATOM 0 HG12 VAL B 8 11.791 -4.764 -8.552 1.00 0.00 H new ATOM 0 HG13 VAL B 8 10.127 -5.396 -8.546 1.00 0.00 H new ATOM 0 HG21 VAL B 8 8.766 -2.745 -7.787 1.00 0.00 H new ATOM 0 HG22 VAL B 8 8.390 -4.327 -7.063 1.00 0.00 H new ATOM 0 HG23 VAL B 8 8.844 -2.958 -6.021 1.00 0.00 H new ATOM 2031 N SER B 9 9.444 -4.250 -4.046 1.00 0.00 N ATOM 2032 CA SER B 9 9.209 -3.632 -2.693 1.00 0.00 C ATOM 2033 C SER B 9 10.000 -4.406 -1.628 1.00 0.00 C ATOM 2034 O SER B 9 10.532 -3.818 -0.704 1.00 0.00 O ATOM 2035 CB SER B 9 7.701 -3.727 -2.415 1.00 0.00 C ATOM 2036 OG SER B 9 7.462 -3.470 -1.037 1.00 0.00 O ATOM 0 H SER B 9 8.635 -4.706 -4.468 1.00 0.00 H new ATOM 0 HA SER B 9 9.539 -2.594 -2.667 1.00 0.00 H new ATOM 0 HB2 SER B 9 7.160 -3.008 -3.030 1.00 0.00 H new ATOM 0 HB3 SER B 9 7.332 -4.717 -2.682 1.00 0.00 H new ATOM 0 HG SER B 9 6.501 -3.528 -0.855 1.00 0.00 H new ATOM 2042 N SER B 10 10.090 -5.719 -1.744 1.00 0.00 N ATOM 2043 CA SER B 10 10.865 -6.504 -0.718 1.00 0.00 C ATOM 2044 C SER B 10 12.351 -6.123 -0.780 1.00 0.00 C ATOM 2045 O SER B 10 12.956 -5.835 0.235 1.00 0.00 O ATOM 2046 CB SER B 10 10.682 -7.991 -1.061 1.00 0.00 C ATOM 2047 OG SER B 10 11.607 -8.763 -0.308 1.00 0.00 O ATOM 0 H SER B 10 9.668 -6.271 -2.491 1.00 0.00 H new ATOM 0 HA SER B 10 10.508 -6.292 0.290 1.00 0.00 H new ATOM 0 HB2 SER B 10 9.662 -8.305 -0.838 1.00 0.00 H new ATOM 0 HB3 SER B 10 10.839 -8.152 -2.127 1.00 0.00 H new ATOM 0 HG SER B 10 11.492 -9.712 -0.523 1.00 0.00 H new ATOM 2053 N ILE B 11 12.948 -6.113 -1.958 1.00 0.00 N ATOM 2054 CA ILE B 11 14.406 -5.735 -2.040 1.00 0.00 C ATOM 2055 C ILE B 11 14.601 -4.282 -1.564 1.00 0.00 C ATOM 2056 O ILE B 11 15.597 -3.969 -0.938 1.00 0.00 O ATOM 2057 CB ILE B 11 14.846 -5.908 -3.511 1.00 0.00 C ATOM 2058 CG1 ILE B 11 16.351 -5.658 -3.619 1.00 0.00 C ATOM 2059 CG2 ILE B 11 14.104 -4.924 -4.421 1.00 0.00 C ATOM 2060 CD1 ILE B 11 16.924 -6.481 -4.775 1.00 0.00 C ATOM 0 H ILE B 11 12.502 -6.344 -2.846 1.00 0.00 H new ATOM 0 HA ILE B 11 15.014 -6.370 -1.395 1.00 0.00 H new ATOM 0 HB ILE B 11 14.608 -6.923 -3.829 1.00 0.00 H new ATOM 0 HG12 ILE B 11 16.543 -4.598 -3.783 1.00 0.00 H new ATOM 0 HG13 ILE B 11 16.843 -5.930 -2.686 1.00 0.00 H new ATOM 0 HG21 ILE B 11 14.430 -5.065 -5.451 1.00 0.00 H new ATOM 0 HG22 ILE B 11 13.031 -5.103 -4.352 1.00 0.00 H new ATOM 0 HG23 ILE B 11 14.322 -3.903 -4.107 1.00 0.00 H new ATOM 0 HD11 ILE B 11 17.997 -6.303 -4.852 1.00 0.00 H new ATOM 0 HD12 ILE B 11 16.744 -7.540 -4.592 1.00 0.00 H new ATOM 0 HD13 ILE B 11 16.440 -6.187 -5.706 1.00 0.00 H new ATOM 2072 N LEU B 12 13.660 -3.394 -1.838 1.00 0.00 N ATOM 2073 CA LEU B 12 13.825 -1.973 -1.366 1.00 0.00 C ATOM 2074 C LEU B 12 13.831 -1.934 0.171 1.00 0.00 C ATOM 2075 O LEU B 12 14.562 -1.166 0.767 1.00 0.00 O ATOM 2076 CB LEU B 12 12.628 -1.178 -1.913 1.00 0.00 C ATOM 2077 CG LEU B 12 13.013 0.296 -2.046 1.00 0.00 C ATOM 2078 CD1 LEU B 12 13.794 0.506 -3.344 1.00 0.00 C ATOM 2079 CD2 LEU B 12 11.745 1.152 -2.071 1.00 0.00 C ATOM 0 H LEU B 12 12.803 -3.588 -2.357 1.00 0.00 H new ATOM 0 HA LEU B 12 14.765 -1.547 -1.717 1.00 0.00 H new ATOM 0 HB2 LEU B 12 12.326 -1.575 -2.882 1.00 0.00 H new ATOM 0 HB3 LEU B 12 11.773 -1.283 -1.246 1.00 0.00 H new ATOM 0 HG LEU B 12 13.634 0.587 -1.198 1.00 0.00 H new ATOM 0 HD11 LEU B 12 14.068 1.557 -3.438 1.00 0.00 H new ATOM 0 HD12 LEU B 12 14.697 -0.104 -3.328 1.00 0.00 H new ATOM 0 HD13 LEU B 12 13.175 0.215 -4.192 1.00 0.00 H new ATOM 0 HD21 LEU B 12 12.017 2.203 -2.166 1.00 0.00 H new ATOM 0 HD22 LEU B 12 11.125 0.860 -2.919 1.00 0.00 H new ATOM 0 HD23 LEU B 12 11.188 1.004 -1.146 1.00 0.00 H new ATOM 2091 N GLU B 13 13.031 -2.760 0.825 1.00 0.00 N ATOM 2092 CA GLU B 13 13.020 -2.753 2.335 1.00 0.00 C ATOM 2093 C GLU B 13 14.439 -2.997 2.879 1.00 0.00 C ATOM 2094 O GLU B 13 14.817 -2.441 3.893 1.00 0.00 O ATOM 2095 CB GLU B 13 12.084 -3.890 2.776 1.00 0.00 C ATOM 2096 CG GLU B 13 10.624 -3.473 2.553 1.00 0.00 C ATOM 2097 CD GLU B 13 9.963 -3.164 3.900 1.00 0.00 C ATOM 2098 OE1 GLU B 13 9.971 -4.033 4.755 1.00 0.00 O ATOM 2099 OE2 GLU B 13 9.456 -2.064 4.049 1.00 0.00 O ATOM 0 H GLU B 13 12.396 -3.427 0.387 1.00 0.00 H new ATOM 0 HA GLU B 13 12.679 -1.791 2.718 1.00 0.00 H new ATOM 0 HB2 GLU B 13 12.304 -4.795 2.211 1.00 0.00 H new ATOM 0 HB3 GLU B 13 12.249 -4.123 3.828 1.00 0.00 H new ATOM 0 HG2 GLU B 13 10.581 -2.597 1.906 1.00 0.00 H new ATOM 0 HG3 GLU B 13 10.082 -4.271 2.045 1.00 0.00 H new ATOM 2106 N GLU B 14 15.237 -3.818 2.215 1.00 0.00 N ATOM 2107 CA GLU B 14 16.639 -4.070 2.719 1.00 0.00 C ATOM 2108 C GLU B 14 17.391 -2.736 2.884 1.00 0.00 C ATOM 2109 O GLU B 14 18.166 -2.572 3.808 1.00 0.00 O ATOM 2110 CB GLU B 14 17.340 -4.942 1.666 1.00 0.00 C ATOM 2111 CG GLU B 14 18.727 -5.340 2.172 1.00 0.00 C ATOM 2112 CD GLU B 14 19.684 -5.481 0.988 1.00 0.00 C ATOM 2113 OE1 GLU B 14 19.796 -4.535 0.225 1.00 0.00 O ATOM 2114 OE2 GLU B 14 20.289 -6.534 0.862 1.00 0.00 O ATOM 0 H GLU B 14 14.984 -4.316 1.361 1.00 0.00 H new ATOM 0 HA GLU B 14 16.621 -4.565 3.690 1.00 0.00 H new ATOM 0 HB2 GLU B 14 16.746 -5.833 1.463 1.00 0.00 H new ATOM 0 HB3 GLU B 14 17.427 -4.396 0.726 1.00 0.00 H new ATOM 0 HG2 GLU B 14 19.101 -4.588 2.867 1.00 0.00 H new ATOM 0 HG3 GLU B 14 18.669 -6.281 2.720 1.00 0.00 H new ATOM 2121 N ARG B 15 17.167 -1.779 2.001 1.00 0.00 N ATOM 2122 CA ARG B 15 17.882 -0.456 2.136 1.00 0.00 C ATOM 2123 C ARG B 15 17.585 0.174 3.511 1.00 0.00 C ATOM 2124 O ARG B 15 18.444 0.800 4.102 1.00 0.00 O ATOM 2125 CB ARG B 15 17.352 0.453 1.016 1.00 0.00 C ATOM 2126 CG ARG B 15 17.913 -0.015 -0.328 1.00 0.00 C ATOM 2127 CD ARG B 15 18.119 1.194 -1.244 1.00 0.00 C ATOM 2128 NE ARG B 15 18.828 0.655 -2.438 1.00 0.00 N ATOM 2129 CZ ARG B 15 20.132 0.661 -2.481 1.00 0.00 C ATOM 2130 NH1 ARG B 15 20.782 1.789 -2.391 1.00 0.00 N ATOM 2131 NH2 ARG B 15 20.787 -0.459 -2.614 1.00 0.00 N ATOM 0 H ARG B 15 16.532 -1.853 1.206 1.00 0.00 H new ATOM 0 HA ARG B 15 18.961 -0.588 2.057 1.00 0.00 H new ATOM 0 HB2 ARG B 15 16.262 0.427 0.997 1.00 0.00 H new ATOM 0 HB3 ARG B 15 17.643 1.487 1.204 1.00 0.00 H new ATOM 0 HG2 ARG B 15 18.858 -0.536 -0.178 1.00 0.00 H new ATOM 0 HG3 ARG B 15 17.228 -0.724 -0.793 1.00 0.00 H new ATOM 0 HD2 ARG B 15 17.167 1.646 -1.521 1.00 0.00 H new ATOM 0 HD3 ARG B 15 18.708 1.967 -0.751 1.00 0.00 H new ATOM 0 HE ARG B 15 18.294 0.281 -3.222 1.00 0.00 H new ATOM 0 HH11 ARG B 15 20.271 2.665 -2.287 1.00 0.00 H new ATOM 0 HH12 ARG B 15 21.801 1.794 -2.425 1.00 0.00 H new ATOM 0 HH21 ARG B 15 20.280 -1.341 -2.685 1.00 0.00 H new ATOM 0 HH22 ARG B 15 21.806 -0.453 -2.647 1.00 0.00 H new ATOM 2145 N ILE B 16 16.380 0.012 4.030 1.00 0.00 N ATOM 2146 CA ILE B 16 16.062 0.609 5.373 1.00 0.00 C ATOM 2147 C ILE B 16 16.402 -0.398 6.483 1.00 0.00 C ATOM 2148 O ILE B 16 17.016 -0.048 7.473 1.00 0.00 O ATOM 2149 CB ILE B 16 14.555 0.913 5.375 1.00 0.00 C ATOM 2150 CG1 ILE B 16 14.207 1.822 4.193 1.00 0.00 C ATOM 2151 CG2 ILE B 16 14.180 1.617 6.679 1.00 0.00 C ATOM 2152 CD1 ILE B 16 12.687 1.983 4.104 1.00 0.00 C ATOM 0 H ILE B 16 15.617 -0.500 3.588 1.00 0.00 H new ATOM 0 HA ILE B 16 16.642 1.514 5.553 1.00 0.00 H new ATOM 0 HB ILE B 16 14.001 -0.022 5.288 1.00 0.00 H new ATOM 0 HG12 ILE B 16 14.680 2.796 4.318 1.00 0.00 H new ATOM 0 HG13 ILE B 16 14.593 1.396 3.267 1.00 0.00 H new ATOM 0 HG21 ILE B 16 13.112 1.833 6.682 1.00 0.00 H new ATOM 0 HG22 ILE B 16 14.422 0.972 7.523 1.00 0.00 H new ATOM 0 HG23 ILE B 16 14.739 2.549 6.763 1.00 0.00 H new ATOM 0 HD11 ILE B 16 12.438 2.630 3.263 1.00 0.00 H new ATOM 0 HD12 ILE B 16 12.226 1.006 3.959 1.00 0.00 H new ATOM 0 HD13 ILE B 16 12.314 2.428 5.026 1.00 0.00 H new ATOM 2164 N LEU B 17 16.012 -1.649 6.329 1.00 0.00 N ATOM 2165 CA LEU B 17 16.319 -2.667 7.377 1.00 0.00 C ATOM 2166 C LEU B 17 17.231 -3.760 6.800 1.00 0.00 C ATOM 2167 O LEU B 17 16.768 -4.660 6.124 1.00 0.00 O ATOM 2168 CB LEU B 17 14.963 -3.253 7.773 1.00 0.00 C ATOM 2169 CG LEU B 17 14.350 -2.414 8.896 1.00 0.00 C ATOM 2170 CD1 LEU B 17 13.561 -1.251 8.292 1.00 0.00 C ATOM 2171 CD2 LEU B 17 13.411 -3.288 9.729 1.00 0.00 C ATOM 0 H LEU B 17 15.496 -2.001 5.522 1.00 0.00 H new ATOM 0 HA LEU B 17 16.840 -2.236 8.232 1.00 0.00 H new ATOM 0 HB2 LEU B 17 14.296 -3.268 6.911 1.00 0.00 H new ATOM 0 HB3 LEU B 17 15.083 -4.286 8.101 1.00 0.00 H new ATOM 0 HG LEU B 17 15.144 -2.023 9.532 1.00 0.00 H new ATOM 0 HD11 LEU B 17 13.124 -0.653 9.092 1.00 0.00 H new ATOM 0 HD12 LEU B 17 14.229 -0.628 7.697 1.00 0.00 H new ATOM 0 HD13 LEU B 17 12.767 -1.642 7.656 1.00 0.00 H new ATOM 0 HD21 LEU B 17 12.973 -2.692 10.530 1.00 0.00 H new ATOM 0 HD22 LEU B 17 12.617 -3.679 9.092 1.00 0.00 H new ATOM 0 HD23 LEU B 17 13.972 -4.117 10.160 1.00 0.00 H new ATOM 2183 N GLY B 18 18.523 -3.694 7.055 1.00 0.00 N ATOM 2184 CA GLY B 18 19.447 -4.732 6.513 1.00 0.00 C ATOM 2185 C GLY B 18 19.947 -5.627 7.656 1.00 0.00 C ATOM 2186 O GLY B 18 19.648 -6.806 7.697 1.00 0.00 O ATOM 0 H GLY B 18 18.969 -2.966 7.614 1.00 0.00 H new ATOM 0 HA2 GLY B 18 18.933 -5.335 5.764 1.00 0.00 H new ATOM 0 HA3 GLY B 18 20.292 -4.256 6.014 1.00 0.00 H new ATOM 2190 N ALA B 19 20.707 -5.083 8.586 1.00 0.00 N ATOM 2191 CA ALA B 19 21.219 -5.915 9.716 1.00 0.00 C ATOM 2192 C ALA B 19 20.668 -5.395 11.053 1.00 0.00 C ATOM 2193 O ALA B 19 20.649 -4.203 11.295 1.00 0.00 O ATOM 2194 CB ALA B 19 22.739 -5.759 9.666 1.00 0.00 C ATOM 0 H ALA B 19 20.990 -4.103 8.606 1.00 0.00 H new ATOM 0 HA ALA B 19 20.913 -6.958 9.632 1.00 0.00 H new ATOM 0 HB1 ALA B 19 23.191 -6.343 10.468 1.00 0.00 H new ATOM 0 HB2 ALA B 19 23.110 -6.115 8.705 1.00 0.00 H new ATOM 0 HB3 ALA B 19 23.001 -4.708 9.790 1.00 0.00 H new ATOM 2200 N ASP B 20 20.221 -6.276 11.926 1.00 0.00 N ATOM 2201 CA ASP B 20 19.678 -5.819 13.240 1.00 0.00 C ATOM 2202 C ASP B 20 20.092 -6.795 14.355 1.00 0.00 C ATOM 2203 O ASP B 20 19.310 -7.098 15.236 1.00 0.00 O ATOM 2204 CB ASP B 20 18.159 -5.823 13.063 1.00 0.00 C ATOM 2205 CG ASP B 20 17.691 -4.429 12.639 1.00 0.00 C ATOM 2206 OD1 ASP B 20 17.863 -4.096 11.477 1.00 0.00 O ATOM 2207 OD2 ASP B 20 17.170 -3.718 13.482 1.00 0.00 O ATOM 0 H ASP B 20 20.211 -7.286 11.780 1.00 0.00 H new ATOM 0 HA ASP B 20 20.054 -4.836 13.522 1.00 0.00 H new ATOM 0 HB2 ASP B 20 17.872 -6.559 12.312 1.00 0.00 H new ATOM 0 HB3 ASP B 20 17.674 -6.113 13.995 1.00 0.00 H new ATOM 2212 N THR B 21 21.313 -7.291 14.326 1.00 0.00 N ATOM 2213 CA THR B 21 21.760 -8.242 15.388 1.00 0.00 C ATOM 2214 C THR B 21 23.248 -8.019 15.715 1.00 0.00 C ATOM 2215 O THR B 21 24.067 -8.900 15.522 1.00 0.00 O ATOM 2216 CB THR B 21 21.534 -9.641 14.797 1.00 0.00 C ATOM 2217 OG1 THR B 21 21.962 -10.620 15.732 1.00 0.00 O ATOM 2218 CG2 THR B 21 22.327 -9.799 13.495 1.00 0.00 C ATOM 0 H THR B 21 22.011 -7.076 13.614 1.00 0.00 H new ATOM 0 HA THR B 21 21.211 -8.105 16.320 1.00 0.00 H new ATOM 0 HB THR B 21 20.473 -9.771 14.584 1.00 0.00 H new ATOM 0 HG1 THR B 21 22.911 -10.486 15.935 1.00 0.00 H new ATOM 0 HG21 THR B 21 22.159 -10.795 13.085 1.00 0.00 H new ATOM 0 HG22 THR B 21 21.997 -9.050 12.775 1.00 0.00 H new ATOM 0 HG23 THR B 21 23.390 -9.665 13.698 1.00 0.00 H new ATOM 2226 N SER B 22 23.607 -6.851 16.208 1.00 0.00 N ATOM 2227 CA SER B 22 25.038 -6.586 16.540 1.00 0.00 C ATOM 2228 C SER B 22 25.187 -6.277 18.040 1.00 0.00 C ATOM 2229 O SER B 22 25.473 -5.155 18.420 1.00 0.00 O ATOM 2230 CB SER B 22 25.421 -5.369 15.697 1.00 0.00 C ATOM 2231 OG SER B 22 25.943 -5.808 14.449 1.00 0.00 O ATOM 0 H SER B 22 22.969 -6.077 16.392 1.00 0.00 H new ATOM 0 HA SER B 22 25.678 -7.443 16.330 1.00 0.00 H new ATOM 0 HB2 SER B 22 24.550 -4.734 15.537 1.00 0.00 H new ATOM 0 HB3 SER B 22 26.162 -4.767 16.223 1.00 0.00 H new ATOM 0 HG SER B 22 26.188 -5.030 13.905 1.00 0.00 H new ATOM 2237 N VAL B 23 24.993 -7.259 18.899 1.00 0.00 N ATOM 2238 CA VAL B 23 25.126 -7.008 20.367 1.00 0.00 C ATOM 2239 C VAL B 23 25.741 -8.233 21.065 1.00 0.00 C ATOM 2240 O VAL B 23 25.229 -8.700 22.064 1.00 0.00 O ATOM 2241 CB VAL B 23 23.697 -6.761 20.866 1.00 0.00 C ATOM 2242 CG1 VAL B 23 23.131 -5.514 20.186 1.00 0.00 C ATOM 2243 CG2 VAL B 23 22.807 -7.966 20.538 1.00 0.00 C ATOM 0 H VAL B 23 24.750 -8.216 18.643 1.00 0.00 H new ATOM 0 HA VAL B 23 25.780 -6.162 20.580 1.00 0.00 H new ATOM 0 HB VAL B 23 23.718 -6.617 21.946 1.00 0.00 H new ATOM 0 HG11 VAL B 23 22.115 -5.336 20.539 1.00 0.00 H new ATOM 0 HG12 VAL B 23 23.755 -4.653 20.427 1.00 0.00 H new ATOM 0 HG13 VAL B 23 23.119 -5.662 19.106 1.00 0.00 H new ATOM 0 HG21 VAL B 23 21.795 -7.779 20.897 1.00 0.00 H new ATOM 0 HG22 VAL B 23 22.787 -8.120 19.459 1.00 0.00 H new ATOM 0 HG23 VAL B 23 23.206 -8.856 21.024 1.00 0.00 H new ATOM 2253 N ASP B 24 26.836 -8.756 20.550 1.00 0.00 N ATOM 2254 CA ASP B 24 27.471 -9.946 21.193 1.00 0.00 C ATOM 2255 C ASP B 24 28.993 -9.753 21.284 1.00 0.00 C ATOM 2256 O ASP B 24 29.750 -10.679 21.062 1.00 0.00 O ATOM 2257 CB ASP B 24 27.134 -11.120 20.272 1.00 0.00 C ATOM 2258 CG ASP B 24 25.633 -11.409 20.342 1.00 0.00 C ATOM 2259 OD1 ASP B 24 25.198 -11.938 21.351 1.00 0.00 O ATOM 2260 OD2 ASP B 24 24.945 -11.097 19.384 1.00 0.00 O ATOM 0 H ASP B 24 27.311 -8.408 19.717 1.00 0.00 H new ATOM 0 HA ASP B 24 27.111 -10.107 22.209 1.00 0.00 H new ATOM 0 HB2 ASP B 24 27.423 -10.887 19.247 1.00 0.00 H new ATOM 0 HB3 ASP B 24 27.699 -12.003 20.569 1.00 0.00 H new ATOM 2265 N LEU B 25 29.449 -8.559 21.609 1.00 0.00 N ATOM 2266 CA LEU B 25 30.921 -8.324 21.710 1.00 0.00 C ATOM 2267 C LEU B 25 31.228 -7.377 22.874 1.00 0.00 C ATOM 2268 O LEU B 25 30.958 -6.195 22.737 1.00 0.00 O ATOM 2269 CB LEU B 25 31.312 -7.680 20.379 1.00 0.00 C ATOM 2270 CG LEU B 25 32.736 -8.096 20.008 1.00 0.00 C ATOM 2271 CD1 LEU B 25 32.747 -9.565 19.586 1.00 0.00 C ATOM 2272 CD2 LEU B 25 33.233 -7.229 18.849 1.00 0.00 C ATOM 2273 OXT LEU B 25 31.725 -7.851 23.882 1.00 0.00 O ATOM 0 H LEU B 25 28.865 -7.746 21.806 1.00 0.00 H new ATOM 0 HA LEU B 25 31.474 -9.245 21.896 1.00 0.00 H new ATOM 0 HB2 LEU B 25 30.617 -7.986 19.597 1.00 0.00 H new ATOM 0 HB3 LEU B 25 31.247 -6.595 20.455 1.00 0.00 H new ATOM 0 HG LEU B 25 33.389 -7.962 20.870 1.00 0.00 H new ATOM 0 HD11 LEU B 25 33.763 -9.860 19.322 1.00 0.00 H new ATOM 0 HD12 LEU B 25 32.392 -10.183 20.411 1.00 0.00 H new ATOM 0 HD13 LEU B 25 32.094 -9.701 18.724 1.00 0.00 H new ATOM 0 HD21 LEU B 25 34.248 -7.524 18.583 1.00 0.00 H new ATOM 0 HD22 LEU B 25 32.579 -7.363 17.988 1.00 0.00 H new ATOM 0 HD23 LEU B 25 33.227 -6.181 19.150 1.00 0.00 H new TER 2285 LEU B 25