USER MOD reduce.3.24.130724 H: found=0, std=0, add=1668, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1668 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 5 SER OG : rot -46:sc= 0.776 USER MOD Set 1.2: B 40 TYR OH : rot -153:sc= 1.96 USER MOD Set 2.1: A 5 SER OG : rot -28:sc= 0.781 USER MOD Set 2.2: A 40 TYR OH : rot -149:sc= 1.76 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -158:sc= -0.0744 (180deg=-0.693) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 GLN : amide:sc= -1.13 K(o=-1.1,f=-4!) USER MOD Single : A 17 CYS SG : rot -34:sc= -0.296 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot -18:sc= 0.562 USER MOD Single : A 21 SER OG : rot 150:sc= 0.511 USER MOD Single : A 23 LYS NZ :NH3+ -103:sc= -1.01 (180deg=-3.51!) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.135 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot -160:sc= -2.11 USER MOD Single : A 42 LYS NZ :NH3+ -152:sc= -0.152 (180deg=-0.691) USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 45 MET CE :methyl -101:sc=-0.00262 (180deg=-1.52) USER MOD Single : A 52 GLN : amide:sc= -0.0604 K(o=-0.06,f=-1.2) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 GLN : amide:sc= -1.35 X(o=-1.3,f=-1.2) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 THR OG1 : rot 180:sc= -0.619 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.214) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=-0.051) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= -2.46 K(o=-2.5,f=-6.2!) USER MOD Single : A 80 MET CE :methyl -153:sc= 0 (180deg=-0.66) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 165:sc= -0.0332 (180deg=-0.402) USER MOD Single : A 88 ASN :FLIP amide:sc= -2.06 F(o=-3.3!,f=-2.1) USER MOD Single : A 89 SER OG : rot -81:sc= 0.742 USER MOD Single : A 92 SER OG : rot -42:sc= -0.563 USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0.098) USER MOD Single : B 1 ALA 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 LYS NZ :NH3+ -162:sc= -0.107 (180deg=-0.681) USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 GLN : amide:sc= -1.32 K(o=-1.3,f=-4.4!) USER MOD Single : B 17 CYS SG : rot -22:sc= -0.82 USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot -17:sc= 0.805 USER MOD Single : B 21 SER OG : rot 99:sc= 0.576 USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 THR OG1 : rot 180:sc= -0.254 USER MOD Single : B 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 28 TYR OH : rot 180:sc= 0 USER MOD Single : B 31 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 33 SER OG : rot 180:sc= 0 USER MOD Single : B 34 TYR OH : rot 180:sc= 0 USER MOD Single : B 37 THR OG1 : rot -160:sc= -1.2 USER MOD Single : B 42 LYS NZ :NH3+ -158:sc= -0.0268 (180deg=-0.239) USER MOD Single : B 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 45 MET CE :methyl -169:sc= -0.19 (180deg=-0.408) USER MOD Single : B 52 GLN : amide:sc= -0.0578 K(o=-0.058,f=-1.3) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 GLN :FLIP amide:sc= -1.28 F(o=-5!,f=-1.3) USER MOD Single : B 57 TYR OH : rot 180:sc= 0 USER MOD Single : B 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 60 THR OG1 : rot 180:sc= -0.696 USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 LYS NZ :NH3+ -163:sc= -0.014 (180deg=-0.223) USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 79 ASN : amide:sc= -0.211 K(o=-0.21,f=-2.3) USER MOD Single : B 80 MET CE :methyl 159:sc=-0.000177 (180deg=-0.413) USER MOD Single : B 82 GLN : amide:sc= 0 X(o=0,f=-0.0055) USER MOD Single : B 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 86 LYS NZ :NH3+ 167:sc=-0.00214 (180deg=-0.271) USER MOD Single : B 88 ASN :FLIP amide:sc= -2.08 F(o=-3.1!,f=-2.1) USER MOD Single : B 89 SER OG : rot -70:sc= 0.694 USER MOD Single : B 92 SER OG : rot -36:sc= -1.49! USER MOD Single : B 95 GLN : amide:sc= 0 X(o=0,f=0.078) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -16.708 14.268 11.733 1.00 5.35 N ATOM 2 CA ALA A 1 -16.818 14.847 10.365 1.00 4.76 C ATOM 3 C ALA A 1 -16.447 13.785 9.330 1.00 4.12 C ATOM 4 O ALA A 1 -15.592 13.991 8.491 1.00 3.94 O ATOM 5 CB ALA A 1 -15.865 16.037 10.238 1.00 4.81 C ATOM 0 H1 ALA A 1 -16.960 14.991 12.437 1.00 5.35 H new ATOM 0 H2 ALA A 1 -17.355 13.458 11.820 1.00 5.35 H new ATOM 0 H3 ALA A 1 -15.732 13.950 11.898 1.00 5.35 H new ATOM 0 HA ALA A 1 -17.841 15.180 10.193 1.00 4.76 H new ATOM 0 HB1 ALA A 1 -15.945 16.462 9.237 1.00 4.81 H new ATOM 0 HB2 ALA A 1 -16.129 16.795 10.976 1.00 4.81 H new ATOM 0 HB3 ALA A 1 -14.842 15.704 10.410 1.00 4.81 H new ATOM 13 N LYS A 2 -17.084 12.647 9.381 1.00 4.22 N ATOM 14 CA LYS A 2 -16.767 11.571 8.399 1.00 4.07 C ATOM 15 C LYS A 2 -17.522 11.832 7.094 1.00 3.66 C ATOM 16 O LYS A 2 -18.514 12.533 7.071 1.00 4.35 O ATOM 17 CB LYS A 2 -17.190 10.218 8.973 1.00 4.82 C ATOM 18 CG LYS A 2 -16.956 10.212 10.486 1.00 5.66 C ATOM 19 CD LYS A 2 -17.130 8.790 11.025 1.00 6.60 C ATOM 20 CE LYS A 2 -16.774 8.762 12.513 1.00 7.50 C ATOM 21 NZ LYS A 2 -15.469 8.068 12.699 1.00 7.90 N ATOM 0 H LYS A 2 -17.810 12.416 10.060 1.00 4.22 H new ATOM 0 HA LYS A 2 -15.695 11.563 8.201 1.00 4.07 H new ATOM 0 HB2 LYS A 2 -18.242 10.031 8.756 1.00 4.82 H new ATOM 0 HB3 LYS A 2 -16.620 9.417 8.503 1.00 4.82 H new ATOM 0 HG2 LYS A 2 -15.954 10.577 10.711 1.00 5.66 H new ATOM 0 HG3 LYS A 2 -17.659 10.886 10.976 1.00 5.66 H new ATOM 0 HD2 LYS A 2 -18.158 8.458 10.880 1.00 6.60 H new ATOM 0 HD3 LYS A 2 -16.491 8.100 10.474 1.00 6.60 H new ATOM 0 HE2 LYS A 2 -16.716 9.778 12.903 1.00 7.50 H new ATOM 0 HE3 LYS A 2 -17.554 8.249 13.075 1.00 7.50 H new ATOM 0 HZ1 LYS A 2 -15.227 8.049 13.710 1.00 7.90 H new ATOM 0 HZ2 LYS A 2 -15.540 7.094 12.341 1.00 7.90 H new ATOM 0 HZ3 LYS A 2 -14.728 8.576 12.175 1.00 7.90 H new ATOM 35 N LYS A 3 -17.062 11.266 6.010 1.00 2.85 N ATOM 36 CA LYS A 3 -17.745 11.468 4.701 1.00 2.88 C ATOM 37 C LYS A 3 -17.048 10.610 3.643 1.00 2.35 C ATOM 38 O LYS A 3 -17.648 9.729 3.063 1.00 2.83 O ATOM 39 CB LYS A 3 -17.685 12.947 4.288 1.00 3.31 C ATOM 40 CG LYS A 3 -16.235 13.446 4.287 1.00 3.76 C ATOM 41 CD LYS A 3 -16.215 14.950 4.572 1.00 4.46 C ATOM 42 CE LYS A 3 -14.800 15.492 4.368 1.00 5.18 C ATOM 43 NZ LYS A 3 -13.823 14.610 5.068 1.00 5.69 N ATOM 0 H LYS A 3 -16.236 10.668 5.976 1.00 2.85 H new ATOM 0 HA LYS A 3 -18.791 11.176 4.791 1.00 2.88 H new ATOM 0 HB2 LYS A 3 -18.119 13.072 3.296 1.00 3.31 H new ATOM 0 HB3 LYS A 3 -18.282 13.547 4.975 1.00 3.31 H new ATOM 0 HG2 LYS A 3 -15.655 12.914 5.041 1.00 3.76 H new ATOM 0 HG3 LYS A 3 -15.769 13.241 3.323 1.00 3.76 H new ATOM 0 HD2 LYS A 3 -16.911 15.465 3.910 1.00 4.46 H new ATOM 0 HD3 LYS A 3 -16.545 15.141 5.593 1.00 4.46 H new ATOM 0 HE2 LYS A 3 -14.567 15.538 3.304 1.00 5.18 H new ATOM 0 HE3 LYS A 3 -14.730 16.509 4.754 1.00 5.18 H new ATOM 0 HZ1 LYS A 3 -12.948 15.141 5.255 1.00 5.69 H new ATOM 0 HZ2 LYS A 3 -14.231 14.286 5.968 1.00 5.69 H new ATOM 0 HZ3 LYS A 3 -13.608 13.787 4.470 1.00 5.69 H new ATOM 57 N LYS A 4 -15.784 10.863 3.408 1.00 1.83 N ATOM 58 CA LYS A 4 -15.000 10.078 2.403 1.00 1.71 C ATOM 59 C LYS A 4 -15.637 10.181 1.013 1.00 1.52 C ATOM 60 O LYS A 4 -15.023 10.681 0.094 1.00 2.02 O ATOM 61 CB LYS A 4 -14.910 8.609 2.834 1.00 2.12 C ATOM 62 CG LYS A 4 -14.066 8.506 4.113 1.00 2.54 C ATOM 63 CD LYS A 4 -12.602 8.868 3.828 1.00 3.17 C ATOM 64 CE LYS A 4 -11.692 8.107 4.794 1.00 3.65 C ATOM 65 NZ LYS A 4 -10.276 8.514 4.569 1.00 4.24 N ATOM 0 H LYS A 4 -15.252 11.595 3.879 1.00 1.83 H new ATOM 0 HA LYS A 4 -13.995 10.496 2.351 1.00 1.71 H new ATOM 0 HB2 LYS A 4 -15.908 8.208 3.010 1.00 2.12 H new ATOM 0 HB3 LYS A 4 -14.462 8.012 2.040 1.00 2.12 H new ATOM 0 HG2 LYS A 4 -14.469 9.173 4.875 1.00 2.54 H new ATOM 0 HG3 LYS A 4 -14.124 7.494 4.512 1.00 2.54 H new ATOM 0 HD2 LYS A 4 -12.348 8.617 2.798 1.00 3.17 H new ATOM 0 HD3 LYS A 4 -12.453 9.942 3.941 1.00 3.17 H new ATOM 0 HE2 LYS A 4 -11.982 8.315 5.824 1.00 3.65 H new ATOM 0 HE3 LYS A 4 -11.801 7.033 4.643 1.00 3.65 H new ATOM 0 HZ1 LYS A 4 -9.658 7.997 5.226 1.00 4.24 H new ATOM 0 HZ2 LYS A 4 -10.003 8.294 3.590 1.00 4.24 H new ATOM 0 HZ3 LYS A 4 -10.178 9.536 4.734 1.00 4.24 H new ATOM 79 N SER A 5 -16.849 9.707 0.856 1.00 1.49 N ATOM 80 CA SER A 5 -17.534 9.771 -0.472 1.00 1.72 C ATOM 81 C SER A 5 -17.069 8.613 -1.349 1.00 1.51 C ATOM 82 O SER A 5 -17.195 8.648 -2.557 1.00 1.76 O ATOM 83 CB SER A 5 -17.216 11.078 -1.172 1.00 2.08 C ATOM 84 OG SER A 5 -18.325 11.467 -1.972 1.00 2.67 O ATOM 0 H SER A 5 -17.398 9.274 1.599 1.00 1.49 H new ATOM 0 HA SER A 5 -18.609 9.705 -0.308 1.00 1.72 H new ATOM 0 HB2 SER A 5 -16.994 11.852 -0.437 1.00 2.08 H new ATOM 0 HB3 SER A 5 -16.328 10.964 -1.793 1.00 2.08 H new ATOM 0 HG SER A 5 -18.818 10.670 -2.258 1.00 2.67 H new ATOM 90 N LYS A 6 -16.530 7.589 -0.755 1.00 1.38 N ATOM 91 CA LYS A 6 -16.053 6.426 -1.554 1.00 1.30 C ATOM 92 C LYS A 6 -15.374 5.431 -0.616 1.00 1.16 C ATOM 93 O LYS A 6 -15.336 4.246 -0.876 1.00 1.17 O ATOM 94 CB LYS A 6 -15.049 6.906 -2.609 1.00 1.59 C ATOM 95 CG LYS A 6 -14.102 5.762 -2.981 1.00 2.31 C ATOM 96 CD LYS A 6 -13.446 6.063 -4.330 1.00 2.60 C ATOM 97 CE LYS A 6 -12.082 5.374 -4.398 1.00 3.41 C ATOM 98 NZ LYS A 6 -11.521 5.519 -5.772 1.00 3.78 N ATOM 0 H LYS A 6 -16.398 7.505 0.253 1.00 1.38 H new ATOM 0 HA LYS A 6 -16.895 5.948 -2.054 1.00 1.30 H new ATOM 0 HB2 LYS A 6 -15.578 7.255 -3.496 1.00 1.59 H new ATOM 0 HB3 LYS A 6 -14.479 7.752 -2.224 1.00 1.59 H new ATOM 0 HG2 LYS A 6 -13.339 5.642 -2.212 1.00 2.31 H new ATOM 0 HG3 LYS A 6 -14.652 4.822 -3.033 1.00 2.31 H new ATOM 0 HD2 LYS A 6 -14.083 5.713 -5.142 1.00 2.60 H new ATOM 0 HD3 LYS A 6 -13.329 7.139 -4.457 1.00 2.60 H new ATOM 0 HE2 LYS A 6 -11.403 5.815 -3.668 1.00 3.41 H new ATOM 0 HE3 LYS A 6 -12.182 4.319 -4.144 1.00 3.41 H new ATOM 0 HZ1 LYS A 6 -10.594 5.051 -5.819 1.00 3.78 H new ATOM 0 HZ2 LYS A 6 -12.166 5.079 -6.459 1.00 3.78 H new ATOM 0 HZ3 LYS A 6 -11.411 6.528 -5.997 1.00 3.78 H new ATOM 112 N LEU A 7 -14.832 5.908 0.469 1.00 1.10 N ATOM 113 CA LEU A 7 -14.152 4.988 1.426 1.00 1.09 C ATOM 114 C LEU A 7 -15.105 4.608 2.567 1.00 1.01 C ATOM 115 O LEU A 7 -15.481 3.460 2.722 1.00 0.97 O ATOM 116 CB LEU A 7 -12.920 5.684 2.008 1.00 1.23 C ATOM 117 CG LEU A 7 -11.725 4.727 1.977 1.00 1.37 C ATOM 118 CD1 LEU A 7 -11.210 4.590 0.544 1.00 2.05 C ATOM 119 CD2 LEU A 7 -10.608 5.283 2.865 1.00 1.67 C ATOM 0 H LEU A 7 -14.830 6.893 0.735 1.00 1.10 H new ATOM 0 HA LEU A 7 -13.854 4.083 0.896 1.00 1.09 H new ATOM 0 HB2 LEU A 7 -12.693 6.583 1.435 1.00 1.23 H new ATOM 0 HB3 LEU A 7 -13.119 6.000 3.032 1.00 1.23 H new ATOM 0 HG LEU A 7 -12.036 3.749 2.344 1.00 1.37 H new ATOM 0 HD11 LEU A 7 -10.360 3.908 0.527 1.00 2.05 H new ATOM 0 HD12 LEU A 7 -12.003 4.197 -0.092 1.00 2.05 H new ATOM 0 HD13 LEU A 7 -10.899 5.567 0.174 1.00 2.05 H new ATOM 0 HD21 LEU A 7 -9.756 4.604 2.845 1.00 1.67 H new ATOM 0 HD22 LEU A 7 -10.301 6.261 2.494 1.00 1.67 H new ATOM 0 HD23 LEU A 7 -10.971 5.380 3.888 1.00 1.67 H new ATOM 131 N GLU A 8 -15.469 5.557 3.387 1.00 1.07 N ATOM 132 CA GLU A 8 -16.361 5.232 4.541 1.00 1.16 C ATOM 133 C GLU A 8 -17.818 5.107 4.092 1.00 1.10 C ATOM 134 O GLU A 8 -18.370 4.035 4.088 1.00 1.03 O ATOM 135 CB GLU A 8 -16.254 6.335 5.601 1.00 1.37 C ATOM 136 CG GLU A 8 -17.381 6.188 6.632 1.00 1.46 C ATOM 137 CD GLU A 8 -17.538 4.719 7.031 1.00 1.74 C ATOM 138 OE1 GLU A 8 -16.569 4.147 7.502 1.00 2.33 O ATOM 139 OE2 GLU A 8 -18.624 4.191 6.858 1.00 2.13 O ATOM 0 H GLU A 8 -15.191 6.535 3.311 1.00 1.07 H new ATOM 0 HA GLU A 8 -16.042 4.277 4.959 1.00 1.16 H new ATOM 0 HB2 GLU A 8 -15.286 6.279 6.099 1.00 1.37 H new ATOM 0 HB3 GLU A 8 -16.311 7.314 5.125 1.00 1.37 H new ATOM 0 HG2 GLU A 8 -17.160 6.791 7.513 1.00 1.46 H new ATOM 0 HG3 GLU A 8 -18.316 6.562 6.216 1.00 1.46 H new ATOM 146 N ILE A 9 -18.424 6.193 3.688 1.00 1.18 N ATOM 147 CA ILE A 9 -19.853 6.126 3.236 1.00 1.23 C ATOM 148 C ILE A 9 -20.050 4.767 2.547 1.00 1.11 C ATOM 149 O ILE A 9 -21.017 4.064 2.759 1.00 1.20 O ATOM 150 CB ILE A 9 -20.136 7.301 2.276 1.00 1.31 C ATOM 151 CG1 ILE A 9 -21.180 8.224 2.908 1.00 1.91 C ATOM 152 CG2 ILE A 9 -20.659 6.810 0.919 1.00 1.86 C ATOM 153 CD1 ILE A 9 -20.621 8.827 4.199 1.00 2.19 C ATOM 0 H ILE A 9 -17.998 7.119 3.650 1.00 1.18 H new ATOM 0 HA ILE A 9 -20.549 6.211 4.071 1.00 1.23 H new ATOM 0 HB ILE A 9 -19.200 7.834 2.108 1.00 1.31 H new ATOM 0 HG12 ILE A 9 -21.448 9.018 2.211 1.00 1.91 H new ATOM 0 HG13 ILE A 9 -22.092 7.666 3.121 1.00 1.91 H new ATOM 0 HG21 ILE A 9 -20.847 7.666 0.270 1.00 1.86 H new ATOM 0 HG22 ILE A 9 -19.916 6.160 0.456 1.00 1.86 H new ATOM 0 HG23 ILE A 9 -21.586 6.255 1.065 1.00 1.86 H new ATOM 0 HD11 ILE A 9 -21.367 9.484 4.647 1.00 2.19 H new ATOM 0 HD12 ILE A 9 -20.376 8.027 4.898 1.00 2.19 H new ATOM 0 HD13 ILE A 9 -19.722 9.400 3.973 1.00 2.19 H new ATOM 165 N ILE A 10 -19.109 4.425 1.727 1.00 0.96 N ATOM 166 CA ILE A 10 -19.154 3.134 0.980 1.00 0.91 C ATOM 167 C ILE A 10 -19.213 1.973 1.976 1.00 0.82 C ATOM 168 O ILE A 10 -20.103 1.148 1.937 1.00 0.85 O ATOM 169 CB ILE A 10 -17.903 3.014 0.090 1.00 0.92 C ATOM 170 CG1 ILE A 10 -18.228 3.514 -1.329 1.00 1.11 C ATOM 171 CG2 ILE A 10 -17.406 1.560 0.026 1.00 0.92 C ATOM 172 CD1 ILE A 10 -19.206 2.567 -2.047 1.00 1.39 C ATOM 0 H ILE A 10 -18.286 4.996 1.533 1.00 0.96 H new ATOM 0 HA ILE A 10 -20.041 3.102 0.347 1.00 0.91 H new ATOM 0 HB ILE A 10 -17.113 3.626 0.525 1.00 0.92 H new ATOM 0 HG12 ILE A 10 -18.660 4.513 -1.274 1.00 1.11 H new ATOM 0 HG13 ILE A 10 -17.308 3.596 -1.907 1.00 1.11 H new ATOM 0 HG21 ILE A 10 -16.522 1.505 -0.609 1.00 0.92 H new ATOM 0 HG22 ILE A 10 -17.154 1.217 1.029 1.00 0.92 H new ATOM 0 HG23 ILE A 10 -18.190 0.925 -0.388 1.00 0.92 H new ATOM 0 HD11 ILE A 10 -19.415 2.949 -3.046 1.00 1.39 H new ATOM 0 HD12 ILE A 10 -18.762 1.575 -2.123 1.00 1.39 H new ATOM 0 HD13 ILE A 10 -20.135 2.506 -1.481 1.00 1.39 H new ATOM 184 N GLN A 11 -18.255 1.899 2.857 1.00 0.77 N ATOM 185 CA GLN A 11 -18.234 0.787 3.846 1.00 0.74 C ATOM 186 C GLN A 11 -19.483 0.838 4.731 1.00 0.80 C ATOM 187 O GLN A 11 -19.974 -0.179 5.177 1.00 0.78 O ATOM 188 CB GLN A 11 -16.985 0.913 4.721 1.00 0.77 C ATOM 189 CG GLN A 11 -15.892 -0.017 4.190 1.00 1.36 C ATOM 190 CD GLN A 11 -16.258 -1.468 4.505 1.00 1.62 C ATOM 191 OE1 GLN A 11 -16.556 -2.239 3.613 1.00 2.31 O ATOM 192 NE2 GLN A 11 -16.250 -1.876 5.744 1.00 1.94 N ATOM 0 H GLN A 11 -17.484 2.562 2.935 1.00 0.77 H new ATOM 0 HA GLN A 11 -18.219 -0.163 3.312 1.00 0.74 H new ATOM 0 HB2 GLN A 11 -16.631 1.944 4.721 1.00 0.77 H new ATOM 0 HB3 GLN A 11 -17.224 0.658 5.753 1.00 0.77 H new ATOM 0 HG2 GLN A 11 -15.779 0.115 3.114 1.00 1.36 H new ATOM 0 HG3 GLN A 11 -14.934 0.234 4.645 1.00 1.36 H new ATOM 0 HE21 GLN A 11 -16.000 -1.229 6.492 1.00 1.94 H new ATOM 0 HE22 GLN A 11 -16.494 -2.842 5.965 1.00 1.94 H new ATOM 201 N ALA A 12 -20.012 2.005 4.985 1.00 0.90 N ATOM 202 CA ALA A 12 -21.237 2.103 5.833 1.00 0.98 C ATOM 203 C ALA A 12 -22.438 1.487 5.107 1.00 0.94 C ATOM 204 O ALA A 12 -23.260 0.818 5.699 1.00 0.94 O ATOM 205 CB ALA A 12 -21.529 3.575 6.134 1.00 1.11 C ATOM 0 H ALA A 12 -19.650 2.895 4.642 1.00 0.90 H new ATOM 0 HA ALA A 12 -21.068 1.559 6.762 1.00 0.98 H new ATOM 0 HB1 ALA A 12 -22.423 3.649 6.753 1.00 1.11 H new ATOM 0 HB2 ALA A 12 -20.683 4.013 6.664 1.00 1.11 H new ATOM 0 HB3 ALA A 12 -21.689 4.113 5.199 1.00 1.11 H new ATOM 211 N ILE A 13 -22.542 1.715 3.826 1.00 0.90 N ATOM 212 CA ILE A 13 -23.690 1.151 3.058 1.00 0.86 C ATOM 213 C ILE A 13 -23.515 -0.361 2.909 1.00 0.75 C ATOM 214 O ILE A 13 -24.457 -1.121 3.021 1.00 0.72 O ATOM 215 CB ILE A 13 -23.754 1.805 1.675 1.00 0.87 C ATOM 216 CG1 ILE A 13 -23.931 3.317 1.836 1.00 1.03 C ATOM 217 CG2 ILE A 13 -24.944 1.241 0.895 1.00 0.85 C ATOM 218 CD1 ILE A 13 -23.498 4.022 0.550 1.00 1.06 C ATOM 0 H ILE A 13 -21.882 2.267 3.278 1.00 0.90 H new ATOM 0 HA ILE A 13 -24.618 1.353 3.593 1.00 0.86 H new ATOM 0 HB ILE A 13 -22.831 1.597 1.134 1.00 0.87 H new ATOM 0 HG12 ILE A 13 -24.972 3.550 2.058 1.00 1.03 H new ATOM 0 HG13 ILE A 13 -23.338 3.676 2.677 1.00 1.03 H new ATOM 0 HG21 ILE A 13 -24.988 1.708 -0.089 1.00 0.85 H new ATOM 0 HG22 ILE A 13 -24.826 0.163 0.781 1.00 0.85 H new ATOM 0 HG23 ILE A 13 -25.866 1.450 1.437 1.00 0.85 H new ATOM 0 HD11 ILE A 13 -23.624 5.099 0.665 1.00 1.06 H new ATOM 0 HD12 ILE A 13 -22.450 3.799 0.348 1.00 1.06 H new ATOM 0 HD13 ILE A 13 -24.110 3.672 -0.281 1.00 1.06 H new ATOM 230 N LEU A 14 -22.319 -0.798 2.647 1.00 0.74 N ATOM 231 CA LEU A 14 -22.071 -2.257 2.476 1.00 0.65 C ATOM 232 C LEU A 14 -22.361 -2.998 3.781 1.00 0.67 C ATOM 233 O LEU A 14 -22.957 -4.056 3.789 1.00 0.64 O ATOM 234 CB LEU A 14 -20.601 -2.464 2.108 1.00 0.65 C ATOM 235 CG LEU A 14 -20.494 -3.231 0.792 1.00 0.67 C ATOM 236 CD1 LEU A 14 -19.024 -3.319 0.378 1.00 0.61 C ATOM 237 CD2 LEU A 14 -21.057 -4.641 0.980 1.00 1.04 C ATOM 0 H LEU A 14 -21.495 -0.205 2.543 1.00 0.74 H new ATOM 0 HA LEU A 14 -22.722 -2.644 1.692 1.00 0.65 H new ATOM 0 HB2 LEU A 14 -20.101 -1.500 2.018 1.00 0.65 H new ATOM 0 HB3 LEU A 14 -20.093 -3.013 2.901 1.00 0.65 H new ATOM 0 HG LEU A 14 -21.061 -2.714 0.018 1.00 0.67 H new ATOM 0 HD11 LEU A 14 -18.943 -3.866 -0.561 1.00 0.61 H new ATOM 0 HD12 LEU A 14 -18.622 -2.314 0.249 1.00 0.61 H new ATOM 0 HD13 LEU A 14 -18.459 -3.840 1.151 1.00 0.61 H new ATOM 0 HD21 LEU A 14 -20.982 -5.191 0.042 1.00 1.04 H new ATOM 0 HD22 LEU A 14 -20.488 -5.160 1.751 1.00 1.04 H new ATOM 0 HD23 LEU A 14 -22.103 -4.578 1.281 1.00 1.04 H new ATOM 249 N GLU A 15 -21.925 -2.457 4.880 1.00 0.75 N ATOM 250 CA GLU A 15 -22.155 -3.133 6.182 1.00 0.80 C ATOM 251 C GLU A 15 -23.633 -3.088 6.571 1.00 0.83 C ATOM 252 O GLU A 15 -24.161 -4.017 7.142 1.00 0.85 O ATOM 253 CB GLU A 15 -21.323 -2.455 7.271 1.00 0.87 C ATOM 254 CG GLU A 15 -20.338 -3.469 7.851 1.00 0.89 C ATOM 255 CD GLU A 15 -19.656 -2.874 9.085 1.00 1.01 C ATOM 256 OE1 GLU A 15 -20.254 -2.017 9.713 1.00 1.43 O ATOM 257 OE2 GLU A 15 -18.547 -3.287 9.380 1.00 1.53 O ATOM 0 H GLU A 15 -21.418 -1.574 4.933 1.00 0.75 H new ATOM 0 HA GLU A 15 -21.854 -4.176 6.081 1.00 0.80 H new ATOM 0 HB2 GLU A 15 -20.785 -1.602 6.857 1.00 0.87 H new ATOM 0 HB3 GLU A 15 -21.973 -2.071 8.057 1.00 0.87 H new ATOM 0 HG2 GLU A 15 -20.861 -4.387 8.119 1.00 0.89 H new ATOM 0 HG3 GLU A 15 -19.591 -3.735 7.103 1.00 0.89 H new ATOM 264 N ALA A 16 -24.313 -2.021 6.278 1.00 0.85 N ATOM 265 CA ALA A 16 -25.744 -1.950 6.656 1.00 0.88 C ATOM 266 C ALA A 16 -26.513 -3.001 5.873 1.00 0.83 C ATOM 267 O ALA A 16 -27.437 -3.611 6.371 1.00 0.86 O ATOM 268 CB ALA A 16 -26.290 -0.565 6.325 1.00 0.91 C ATOM 0 H ALA A 16 -23.943 -1.201 5.797 1.00 0.85 H new ATOM 0 HA ALA A 16 -25.854 -2.133 7.725 1.00 0.88 H new ATOM 0 HB1 ALA A 16 -27.343 -0.513 6.603 1.00 0.91 H new ATOM 0 HB2 ALA A 16 -25.731 0.189 6.879 1.00 0.91 H new ATOM 0 HB3 ALA A 16 -26.188 -0.380 5.256 1.00 0.91 H new ATOM 274 N CYS A 17 -26.147 -3.209 4.642 1.00 0.76 N ATOM 275 CA CYS A 17 -26.862 -4.204 3.823 1.00 0.72 C ATOM 276 C CYS A 17 -26.426 -5.623 4.210 1.00 0.71 C ATOM 277 O CYS A 17 -27.054 -6.594 3.838 1.00 0.71 O ATOM 278 CB CYS A 17 -26.549 -3.947 2.353 1.00 0.65 C ATOM 279 SG CYS A 17 -24.888 -4.555 1.969 1.00 0.81 S ATOM 0 H CYS A 17 -25.380 -2.728 4.172 1.00 0.76 H new ATOM 0 HA CYS A 17 -27.935 -4.115 3.995 1.00 0.72 H new ATOM 0 HB2 CYS A 17 -27.284 -4.446 1.722 1.00 0.65 H new ATOM 0 HB3 CYS A 17 -26.615 -2.880 2.138 1.00 0.65 H new ATOM 0 HG CYS A 17 -24.116 -4.390 3.002 1.00 0.81 H new ATOM 285 N LYS A 18 -25.349 -5.753 4.941 1.00 0.72 N ATOM 286 CA LYS A 18 -24.866 -7.110 5.341 1.00 0.73 C ATOM 287 C LYS A 18 -26.000 -7.953 5.941 1.00 0.83 C ATOM 288 O LYS A 18 -25.800 -9.104 6.276 1.00 0.87 O ATOM 289 CB LYS A 18 -23.734 -6.973 6.364 1.00 0.78 C ATOM 290 CG LYS A 18 -24.302 -6.967 7.788 1.00 1.34 C ATOM 291 CD LYS A 18 -23.251 -6.422 8.758 1.00 1.96 C ATOM 292 CE LYS A 18 -22.062 -7.382 8.826 1.00 2.36 C ATOM 293 NZ LYS A 18 -21.209 -7.034 9.998 1.00 2.97 N ATOM 0 H LYS A 18 -24.781 -4.976 5.279 1.00 0.72 H new ATOM 0 HA LYS A 18 -24.501 -7.616 4.447 1.00 0.73 H new ATOM 0 HB2 LYS A 18 -23.030 -7.797 6.250 1.00 0.78 H new ATOM 0 HB3 LYS A 18 -23.180 -6.052 6.182 1.00 0.78 H new ATOM 0 HG2 LYS A 18 -25.202 -6.353 7.829 1.00 1.34 H new ATOM 0 HG3 LYS A 18 -24.591 -7.977 8.079 1.00 1.34 H new ATOM 0 HD2 LYS A 18 -22.917 -5.437 8.431 1.00 1.96 H new ATOM 0 HD3 LYS A 18 -23.687 -6.298 9.749 1.00 1.96 H new ATOM 0 HE2 LYS A 18 -22.415 -8.410 8.912 1.00 2.36 H new ATOM 0 HE3 LYS A 18 -21.479 -7.321 7.907 1.00 2.36 H new ATOM 0 HZ1 LYS A 18 -20.400 -7.686 10.045 1.00 2.97 H new ATOM 0 HZ2 LYS A 18 -20.862 -6.059 9.897 1.00 2.97 H new ATOM 0 HZ3 LYS A 18 -21.769 -7.114 10.871 1.00 2.97 H new ATOM 307 N SER A 19 -27.182 -7.415 6.098 1.00 0.88 N ATOM 308 CA SER A 19 -28.272 -8.242 6.696 1.00 0.99 C ATOM 309 C SER A 19 -29.653 -7.705 6.303 1.00 1.05 C ATOM 310 O SER A 19 -30.616 -7.882 7.022 1.00 1.21 O ATOM 311 CB SER A 19 -28.138 -8.221 8.218 1.00 1.07 C ATOM 312 OG SER A 19 -26.866 -8.738 8.586 1.00 1.10 O ATOM 0 H SER A 19 -27.437 -6.460 5.844 1.00 0.88 H new ATOM 0 HA SER A 19 -28.180 -9.261 6.320 1.00 0.99 H new ATOM 0 HB2 SER A 19 -28.251 -7.203 8.590 1.00 1.07 H new ATOM 0 HB3 SER A 19 -28.930 -8.816 8.672 1.00 1.07 H new ATOM 0 HG SER A 19 -26.489 -9.243 7.836 1.00 1.10 H new ATOM 318 N GLY A 20 -29.774 -7.063 5.172 1.00 0.94 N ATOM 319 CA GLY A 20 -31.110 -6.543 4.760 1.00 1.01 C ATOM 320 C GLY A 20 -31.518 -5.410 5.698 1.00 1.07 C ATOM 321 O GLY A 20 -31.911 -5.637 6.825 1.00 1.15 O ATOM 0 H GLY A 20 -29.012 -6.877 4.520 1.00 0.94 H new ATOM 0 HA2 GLY A 20 -31.073 -6.184 3.731 1.00 1.01 H new ATOM 0 HA3 GLY A 20 -31.850 -7.342 4.792 1.00 1.01 H new ATOM 325 N SER A 21 -31.387 -4.190 5.261 1.00 1.06 N ATOM 326 CA SER A 21 -31.724 -3.049 6.153 1.00 1.14 C ATOM 327 C SER A 21 -32.188 -1.851 5.302 1.00 1.14 C ATOM 328 O SER A 21 -31.502 -1.468 4.377 1.00 1.07 O ATOM 329 CB SER A 21 -30.456 -2.663 6.914 1.00 1.14 C ATOM 330 OG SER A 21 -29.671 -3.828 7.128 1.00 1.09 O ATOM 0 H SER A 21 -31.062 -3.935 4.328 1.00 1.06 H new ATOM 0 HA SER A 21 -32.521 -3.326 6.843 1.00 1.14 H new ATOM 0 HB2 SER A 21 -29.888 -1.925 6.348 1.00 1.14 H new ATOM 0 HB3 SER A 21 -30.715 -2.203 7.868 1.00 1.14 H new ATOM 0 HG SER A 21 -28.722 -3.584 7.148 1.00 1.09 H new ATOM 336 N PRO A 22 -33.333 -1.252 5.593 1.00 1.23 N ATOM 337 CA PRO A 22 -33.825 -0.082 4.806 1.00 1.26 C ATOM 338 C PRO A 22 -32.756 1.004 4.672 1.00 1.26 C ATOM 339 O PRO A 22 -31.793 1.029 5.410 1.00 1.25 O ATOM 340 CB PRO A 22 -35.008 0.457 5.614 1.00 1.35 C ATOM 341 CG PRO A 22 -35.457 -0.662 6.494 1.00 1.47 C ATOM 342 CD PRO A 22 -34.271 -1.609 6.676 1.00 1.34 C ATOM 0 HA PRO A 22 -34.093 -0.374 3.791 1.00 1.26 H new ATOM 0 HB2 PRO A 22 -34.712 1.323 6.206 1.00 1.35 H new ATOM 0 HB3 PRO A 22 -35.814 0.781 4.955 1.00 1.35 H new ATOM 0 HG2 PRO A 22 -35.794 -0.280 7.458 1.00 1.47 H new ATOM 0 HG3 PRO A 22 -36.301 -1.187 6.046 1.00 1.47 H new ATOM 0 HD2 PRO A 22 -33.810 -1.482 7.656 1.00 1.34 H new ATOM 0 HD3 PRO A 22 -34.582 -2.651 6.602 1.00 1.34 H new ATOM 350 N LYS A 23 -32.918 1.908 3.741 1.00 1.27 N ATOM 351 CA LYS A 23 -31.909 2.991 3.573 1.00 1.28 C ATOM 352 C LYS A 23 -31.844 3.809 4.869 1.00 1.33 C ATOM 353 O LYS A 23 -30.834 4.403 5.190 1.00 1.35 O ATOM 354 CB LYS A 23 -32.322 3.901 2.404 1.00 1.31 C ATOM 355 CG LYS A 23 -31.157 4.823 1.996 1.00 1.27 C ATOM 356 CD LYS A 23 -31.608 6.282 2.085 1.00 1.83 C ATOM 357 CE LYS A 23 -32.724 6.535 1.068 1.00 1.76 C ATOM 358 NZ LYS A 23 -32.293 7.592 0.108 1.00 2.13 N ATOM 0 H LYS A 23 -33.704 1.942 3.092 1.00 1.27 H new ATOM 0 HA LYS A 23 -30.931 2.560 3.359 1.00 1.28 H new ATOM 0 HB2 LYS A 23 -32.626 3.292 1.552 1.00 1.31 H new ATOM 0 HB3 LYS A 23 -33.185 4.502 2.691 1.00 1.31 H new ATOM 0 HG2 LYS A 23 -30.300 4.655 2.649 1.00 1.27 H new ATOM 0 HG3 LYS A 23 -30.834 4.592 0.981 1.00 1.27 H new ATOM 0 HD2 LYS A 23 -31.962 6.503 3.092 1.00 1.83 H new ATOM 0 HD3 LYS A 23 -30.766 6.946 1.890 1.00 1.83 H new ATOM 0 HE2 LYS A 23 -32.957 5.615 0.532 1.00 1.76 H new ATOM 0 HE3 LYS A 23 -33.635 6.844 1.581 1.00 1.76 H new ATOM 0 HZ1 LYS A 23 -32.755 8.491 0.351 1.00 2.13 H new ATOM 0 HZ2 LYS A 23 -31.261 7.708 0.160 1.00 2.13 H new ATOM 0 HZ3 LYS A 23 -32.562 7.315 -0.858 1.00 2.13 H new ATOM 372 N THR A 24 -32.918 3.833 5.619 1.00 1.35 N ATOM 373 CA THR A 24 -32.936 4.597 6.904 1.00 1.41 C ATOM 374 C THR A 24 -31.998 3.957 7.937 1.00 1.43 C ATOM 375 O THR A 24 -31.299 4.640 8.658 1.00 1.48 O ATOM 376 CB THR A 24 -34.362 4.612 7.459 1.00 1.40 C ATOM 377 OG1 THR A 24 -34.789 3.278 7.705 1.00 1.42 O ATOM 378 CG2 THR A 24 -35.298 5.271 6.445 1.00 1.42 C ATOM 0 H THR A 24 -33.789 3.352 5.394 1.00 1.35 H new ATOM 0 HA THR A 24 -32.594 5.613 6.709 1.00 1.41 H new ATOM 0 HB THR A 24 -34.383 5.177 8.391 1.00 1.40 H new ATOM 0 HG1 THR A 24 -35.702 3.287 8.062 1.00 1.42 H new ATOM 0 HG21 THR A 24 -36.314 5.282 6.841 1.00 1.42 H new ATOM 0 HG22 THR A 24 -34.971 6.294 6.259 1.00 1.42 H new ATOM 0 HG23 THR A 24 -35.278 4.708 5.512 1.00 1.42 H new ATOM 386 N ARG A 25 -31.985 2.652 8.022 1.00 1.40 N ATOM 387 CA ARG A 25 -31.105 1.965 9.016 1.00 1.43 C ATOM 388 C ARG A 25 -29.642 2.277 8.691 1.00 1.44 C ATOM 389 O ARG A 25 -28.739 1.977 9.447 1.00 1.47 O ATOM 390 CB ARG A 25 -31.347 0.451 8.914 1.00 1.39 C ATOM 391 CG ARG A 25 -31.566 -0.162 10.305 1.00 1.72 C ATOM 392 CD ARG A 25 -30.238 -0.195 11.060 1.00 1.56 C ATOM 393 NE ARG A 25 -30.451 -0.774 12.417 1.00 2.13 N ATOM 394 CZ ARG A 25 -31.081 -0.086 13.328 1.00 2.45 C ATOM 395 NH1 ARG A 25 -31.531 1.107 13.051 1.00 2.53 N ATOM 396 NH2 ARG A 25 -31.264 -0.591 14.519 1.00 3.15 N ATOM 0 H ARG A 25 -32.548 2.029 7.443 1.00 1.40 H new ATOM 0 HA ARG A 25 -31.329 2.309 10.026 1.00 1.43 H new ATOM 0 HB2 ARG A 25 -32.217 0.259 8.286 1.00 1.39 H new ATOM 0 HB3 ARG A 25 -30.494 -0.026 8.432 1.00 1.39 H new ATOM 0 HG2 ARG A 25 -32.299 0.423 10.861 1.00 1.72 H new ATOM 0 HG3 ARG A 25 -31.969 -1.171 10.211 1.00 1.72 H new ATOM 0 HD2 ARG A 25 -29.509 -0.790 10.509 1.00 1.56 H new ATOM 0 HD3 ARG A 25 -29.830 0.812 11.143 1.00 1.56 H new ATOM 0 HE ARG A 25 -30.104 -1.708 12.633 1.00 2.13 H new ATOM 0 HH11 ARG A 25 -31.390 1.502 12.121 1.00 2.53 H new ATOM 0 HH12 ARG A 25 -32.024 1.645 13.764 1.00 2.53 H new ATOM 0 HH21 ARG A 25 -30.914 -1.524 14.737 1.00 3.15 H new ATOM 0 HH22 ARG A 25 -31.757 -0.052 15.231 1.00 3.15 H new ATOM 410 N ILE A 26 -29.418 2.880 7.566 1.00 1.41 N ATOM 411 CA ILE A 26 -28.035 3.220 7.172 1.00 1.41 C ATOM 412 C ILE A 26 -27.671 4.586 7.759 1.00 1.49 C ATOM 413 O ILE A 26 -26.513 4.928 7.895 1.00 1.50 O ATOM 414 CB ILE A 26 -27.941 3.192 5.651 1.00 1.34 C ATOM 415 CG1 ILE A 26 -28.632 1.912 5.170 1.00 1.28 C ATOM 416 CG2 ILE A 26 -26.469 3.174 5.232 1.00 1.34 C ATOM 417 CD1 ILE A 26 -28.233 1.591 3.727 1.00 0.96 C ATOM 0 H ILE A 26 -30.139 3.153 6.899 1.00 1.41 H new ATOM 0 HA ILE A 26 -27.320 2.496 7.563 1.00 1.41 H new ATOM 0 HB ILE A 26 -28.417 4.071 5.216 1.00 1.34 H new ATOM 0 HG12 ILE A 26 -28.362 1.080 5.821 1.00 1.28 H new ATOM 0 HG13 ILE A 26 -29.714 2.030 5.236 1.00 1.28 H new ATOM 0 HG21 ILE A 26 -26.401 3.154 4.144 1.00 1.34 H new ATOM 0 HG22 ILE A 26 -25.972 4.067 5.610 1.00 1.34 H new ATOM 0 HG23 ILE A 26 -25.985 2.288 5.642 1.00 1.34 H new ATOM 0 HD11 ILE A 26 -28.735 0.678 3.405 1.00 0.96 H new ATOM 0 HD12 ILE A 26 -28.526 2.415 3.077 1.00 0.96 H new ATOM 0 HD13 ILE A 26 -27.154 1.451 3.671 1.00 0.96 H new ATOM 429 N MET A 27 -28.657 5.353 8.140 1.00 1.55 N ATOM 430 CA MET A 27 -28.375 6.679 8.760 1.00 1.64 C ATOM 431 C MET A 27 -27.654 6.450 10.091 1.00 1.70 C ATOM 432 O MET A 27 -26.708 7.135 10.422 1.00 1.74 O ATOM 433 CB MET A 27 -29.685 7.444 8.966 1.00 1.72 C ATOM 434 CG MET A 27 -29.402 8.860 9.459 1.00 2.02 C ATOM 435 SD MET A 27 -30.941 9.604 10.057 1.00 2.29 S ATOM 436 CE MET A 27 -31.356 10.511 8.547 1.00 1.90 C ATOM 0 H MET A 27 -29.645 5.118 8.049 1.00 1.55 H new ATOM 0 HA MET A 27 -27.739 7.277 8.108 1.00 1.64 H new ATOM 0 HB2 MET A 27 -30.242 7.483 8.030 1.00 1.72 H new ATOM 0 HB3 MET A 27 -30.311 6.919 9.688 1.00 1.72 H new ATOM 0 HG2 MET A 27 -28.661 8.838 10.258 1.00 2.02 H new ATOM 0 HG3 MET A 27 -28.983 9.461 8.652 1.00 2.02 H new ATOM 0 HE1 MET A 27 -32.290 11.054 8.694 1.00 1.90 H new ATOM 0 HE2 MET A 27 -30.558 11.217 8.316 1.00 1.90 H new ATOM 0 HE3 MET A 27 -31.470 9.809 7.721 1.00 1.90 H new ATOM 446 N TYR A 28 -28.082 5.473 10.844 1.00 1.72 N ATOM 447 CA TYR A 28 -27.407 5.177 12.140 1.00 1.80 C ATOM 448 C TYR A 28 -25.988 4.689 11.843 1.00 1.78 C ATOM 449 O TYR A 28 -25.183 4.482 12.728 1.00 2.09 O ATOM 450 CB TYR A 28 -28.179 4.080 12.872 1.00 1.82 C ATOM 451 CG TYR A 28 -27.464 3.727 14.155 1.00 2.02 C ATOM 452 CD1 TYR A 28 -27.685 4.486 15.310 1.00 2.25 C ATOM 453 CD2 TYR A 28 -26.582 2.640 14.188 1.00 2.64 C ATOM 454 CE1 TYR A 28 -27.022 4.159 16.500 1.00 2.48 C ATOM 455 CE2 TYR A 28 -25.920 2.313 15.378 1.00 3.00 C ATOM 456 CZ TYR A 28 -26.140 3.072 16.533 1.00 2.69 C ATOM 457 OH TYR A 28 -25.488 2.748 17.706 1.00 3.10 O ATOM 0 H TYR A 28 -28.870 4.867 10.617 1.00 1.72 H new ATOM 0 HA TYR A 28 -27.375 6.071 12.763 1.00 1.80 H new ATOM 0 HB2 TYR A 28 -29.192 4.418 13.090 1.00 1.82 H new ATOM 0 HB3 TYR A 28 -28.266 3.198 12.238 1.00 1.82 H new ATOM 0 HD1 TYR A 28 -28.366 5.323 15.284 1.00 2.25 H new ATOM 0 HD2 TYR A 28 -26.412 2.054 13.297 1.00 2.64 H new ATOM 0 HE1 TYR A 28 -27.191 4.745 17.391 1.00 2.48 H new ATOM 0 HE2 TYR A 28 -25.239 1.475 15.404 1.00 3.00 H new ATOM 0 HH TYR A 28 -24.914 1.968 17.557 1.00 3.10 H new ATOM 467 N GLY A 29 -25.689 4.521 10.588 1.00 1.51 N ATOM 468 CA GLY A 29 -24.329 4.058 10.188 1.00 1.48 C ATOM 469 C GLY A 29 -23.468 5.275 9.852 1.00 1.54 C ATOM 470 O GLY A 29 -22.259 5.192 9.764 1.00 1.61 O ATOM 0 H GLY A 29 -26.332 4.685 9.814 1.00 1.51 H new ATOM 0 HA2 GLY A 29 -23.873 3.486 10.996 1.00 1.48 H new ATOM 0 HA3 GLY A 29 -24.396 3.394 9.326 1.00 1.48 H new ATOM 474 N ALA A 30 -24.091 6.405 9.663 1.00 1.57 N ATOM 475 CA ALA A 30 -23.335 7.643 9.329 1.00 1.67 C ATOM 476 C ALA A 30 -24.315 8.679 8.785 1.00 1.71 C ATOM 477 O ALA A 30 -25.368 8.335 8.286 1.00 1.72 O ATOM 478 CB ALA A 30 -22.285 7.332 8.256 1.00 1.66 C ATOM 0 H ALA A 30 -25.102 6.524 9.727 1.00 1.57 H new ATOM 0 HA ALA A 30 -22.837 8.024 10.220 1.00 1.67 H new ATOM 0 HB1 ALA A 30 -21.733 8.240 8.013 1.00 1.66 H new ATOM 0 HB2 ALA A 30 -21.594 6.577 8.631 1.00 1.66 H new ATOM 0 HB3 ALA A 30 -22.780 6.958 7.360 1.00 1.66 H new ATOM 484 N ASN A 31 -23.985 9.941 8.861 1.00 1.82 N ATOM 485 CA ASN A 31 -24.913 10.973 8.321 1.00 1.87 C ATOM 486 C ASN A 31 -25.321 10.532 6.917 1.00 1.82 C ATOM 487 O ASN A 31 -24.512 10.509 6.013 1.00 2.17 O ATOM 488 CB ASN A 31 -24.195 12.324 8.248 1.00 2.00 C ATOM 489 CG ASN A 31 -24.812 13.293 9.260 1.00 2.22 C ATOM 490 OD1 ASN A 31 -24.397 13.341 10.402 1.00 2.79 O ATOM 491 ND2 ASN A 31 -25.789 14.073 8.887 1.00 2.38 N ATOM 0 H ASN A 31 -23.121 10.298 9.270 1.00 1.82 H new ATOM 0 HA ASN A 31 -25.788 11.079 8.962 1.00 1.87 H new ATOM 0 HB2 ASN A 31 -23.133 12.194 8.456 1.00 2.00 H new ATOM 0 HB3 ASN A 31 -24.275 12.735 7.242 1.00 2.00 H new ATOM 0 HD21 ASN A 31 -26.205 14.724 9.553 1.00 2.38 H new ATOM 0 HD22 ASN A 31 -26.137 14.032 7.929 1.00 2.38 H new ATOM 498 N LEU A 32 -26.552 10.141 6.723 1.00 1.81 N ATOM 499 CA LEU A 32 -26.947 9.664 5.374 1.00 1.70 C ATOM 500 C LEU A 32 -27.168 10.828 4.427 1.00 1.72 C ATOM 501 O LEU A 32 -28.100 11.597 4.527 1.00 1.84 O ATOM 502 CB LEU A 32 -28.222 8.816 5.472 1.00 1.75 C ATOM 503 CG LEU A 32 -28.025 7.412 4.853 1.00 1.74 C ATOM 504 CD1 LEU A 32 -27.953 7.519 3.330 1.00 1.67 C ATOM 505 CD2 LEU A 32 -26.737 6.740 5.367 1.00 1.69 C ATOM 0 H LEU A 32 -27.288 10.132 7.429 1.00 1.81 H new ATOM 0 HA LEU A 32 -26.137 9.053 4.977 1.00 1.70 H new ATOM 0 HB2 LEU A 32 -28.512 8.715 6.518 1.00 1.75 H new ATOM 0 HB3 LEU A 32 -29.039 9.327 4.962 1.00 1.75 H new ATOM 0 HG LEU A 32 -28.878 6.801 5.149 1.00 1.74 H new ATOM 0 HD11 LEU A 32 -27.814 6.526 2.902 1.00 1.67 H new ATOM 0 HD12 LEU A 32 -28.879 7.951 2.951 1.00 1.67 H new ATOM 0 HD13 LEU A 32 -27.114 8.156 3.049 1.00 1.67 H new ATOM 0 HD21 LEU A 32 -26.633 5.756 4.910 1.00 1.69 H new ATOM 0 HD22 LEU A 32 -25.876 7.355 5.105 1.00 1.69 H new ATOM 0 HD23 LEU A 32 -26.790 6.633 6.450 1.00 1.69 H new ATOM 517 N SER A 33 -26.309 10.877 3.460 1.00 1.63 N ATOM 518 CA SER A 33 -26.379 11.878 2.378 1.00 1.66 C ATOM 519 C SER A 33 -27.578 11.511 1.504 1.00 1.68 C ATOM 520 O SER A 33 -27.687 11.957 0.393 1.00 1.69 O ATOM 521 CB SER A 33 -25.084 11.857 1.561 1.00 1.58 C ATOM 522 OG SER A 33 -24.587 13.183 1.436 1.00 1.75 O ATOM 0 H SER A 33 -25.524 10.231 3.374 1.00 1.63 H new ATOM 0 HA SER A 33 -26.496 12.884 2.780 1.00 1.66 H new ATOM 0 HB2 SER A 33 -24.343 11.223 2.048 1.00 1.58 H new ATOM 0 HB3 SER A 33 -25.269 11.431 0.575 1.00 1.58 H new ATOM 0 HG SER A 33 -23.757 13.174 0.915 1.00 1.75 H new ATOM 528 N TYR A 34 -28.404 10.598 1.988 1.00 1.70 N ATOM 529 CA TYR A 34 -29.560 10.040 1.203 1.00 1.73 C ATOM 530 C TYR A 34 -29.979 10.935 0.046 1.00 1.77 C ATOM 531 O TYR A 34 -30.204 10.445 -1.042 1.00 1.71 O ATOM 532 CB TYR A 34 -30.762 9.904 2.134 1.00 1.92 C ATOM 533 CG TYR A 34 -31.458 11.239 2.272 1.00 1.73 C ATOM 534 CD1 TYR A 34 -32.442 11.615 1.350 1.00 1.94 C ATOM 535 CD2 TYR A 34 -31.119 12.102 3.321 1.00 2.49 C ATOM 536 CE1 TYR A 34 -33.086 12.851 1.476 1.00 2.57 C ATOM 537 CE2 TYR A 34 -31.763 13.339 3.447 1.00 3.01 C ATOM 538 CZ TYR A 34 -32.745 13.714 2.525 1.00 2.95 C ATOM 539 OH TYR A 34 -33.380 14.933 2.649 1.00 3.85 O ATOM 0 H TYR A 34 -28.317 10.207 2.926 1.00 1.70 H new ATOM 0 HA TYR A 34 -29.236 9.083 0.795 1.00 1.73 H new ATOM 0 HB2 TYR A 34 -31.456 9.161 1.741 1.00 1.92 H new ATOM 0 HB3 TYR A 34 -30.437 9.550 3.113 1.00 1.92 H new ATOM 0 HD1 TYR A 34 -32.704 10.950 0.540 1.00 1.94 H new ATOM 0 HD2 TYR A 34 -30.360 11.813 4.033 1.00 2.49 H new ATOM 0 HE1 TYR A 34 -33.846 13.139 0.765 1.00 2.57 H new ATOM 0 HE2 TYR A 34 -31.501 14.004 4.257 1.00 3.01 H new ATOM 0 HH TYR A 34 -33.027 15.408 3.430 1.00 3.85 H new ATOM 549 N ALA A 35 -30.062 12.216 0.220 1.00 1.88 N ATOM 550 CA ALA A 35 -30.430 13.048 -0.950 1.00 1.95 C ATOM 551 C ALA A 35 -29.453 12.677 -2.069 1.00 1.82 C ATOM 552 O ALA A 35 -29.828 12.414 -3.194 1.00 1.78 O ATOM 553 CB ALA A 35 -30.286 14.532 -0.601 1.00 2.11 C ATOM 0 H ALA A 35 -29.897 12.714 1.095 1.00 1.88 H new ATOM 0 HA ALA A 35 -31.463 12.874 -1.252 1.00 1.95 H new ATOM 0 HB1 ALA A 35 -30.558 15.137 -1.466 1.00 2.11 H new ATOM 0 HB2 ALA A 35 -30.944 14.775 0.234 1.00 2.11 H new ATOM 0 HB3 ALA A 35 -29.253 14.742 -0.322 1.00 2.11 H new ATOM 559 N LEU A 36 -28.195 12.626 -1.727 1.00 1.76 N ATOM 560 CA LEU A 36 -27.133 12.240 -2.701 1.00 1.66 C ATOM 561 C LEU A 36 -26.756 10.753 -2.540 1.00 1.48 C ATOM 562 O LEU A 36 -26.718 9.999 -3.491 1.00 1.40 O ATOM 563 CB LEU A 36 -25.890 13.101 -2.460 1.00 1.73 C ATOM 564 CG LEU A 36 -25.867 14.260 -3.460 1.00 1.83 C ATOM 565 CD1 LEU A 36 -27.131 15.105 -3.295 1.00 2.23 C ATOM 566 CD2 LEU A 36 -24.635 15.131 -3.200 1.00 2.42 C ATOM 0 H LEU A 36 -27.850 12.841 -0.791 1.00 1.76 H new ATOM 0 HA LEU A 36 -27.513 12.398 -3.710 1.00 1.66 H new ATOM 0 HB2 LEU A 36 -25.894 13.487 -1.441 1.00 1.73 H new ATOM 0 HB3 LEU A 36 -24.990 12.496 -2.568 1.00 1.73 H new ATOM 0 HG LEU A 36 -25.827 13.863 -4.474 1.00 1.83 H new ATOM 0 HD11 LEU A 36 -27.113 15.930 -4.008 1.00 2.23 H new ATOM 0 HD12 LEU A 36 -28.009 14.486 -3.479 1.00 2.23 H new ATOM 0 HD13 LEU A 36 -27.173 15.503 -2.281 1.00 2.23 H new ATOM 0 HD21 LEU A 36 -24.617 15.957 -3.911 1.00 2.42 H new ATOM 0 HD22 LEU A 36 -24.677 15.527 -2.185 1.00 2.42 H new ATOM 0 HD23 LEU A 36 -23.733 14.530 -3.318 1.00 2.42 H new ATOM 578 N THR A 37 -26.424 10.356 -1.330 1.00 1.43 N ATOM 579 CA THR A 37 -25.983 8.946 -1.059 1.00 1.30 C ATOM 580 C THR A 37 -26.796 7.940 -1.874 1.00 1.23 C ATOM 581 O THR A 37 -26.272 6.931 -2.305 1.00 1.15 O ATOM 582 CB THR A 37 -26.110 8.637 0.436 1.00 1.36 C ATOM 583 OG1 THR A 37 -24.996 9.185 1.126 1.00 1.49 O ATOM 584 CG2 THR A 37 -26.146 7.123 0.664 1.00 1.33 C ATOM 0 H THR A 37 -26.440 10.959 -0.507 1.00 1.43 H new ATOM 0 HA THR A 37 -24.939 8.855 -1.360 1.00 1.30 H new ATOM 0 HB THR A 37 -27.035 9.077 0.810 1.00 1.36 H new ATOM 0 HG1 THR A 37 -24.897 8.739 1.993 1.00 1.49 H new ATOM 0 HG21 THR A 37 -26.236 6.918 1.731 1.00 1.33 H new ATOM 0 HG22 THR A 37 -27.000 6.696 0.139 1.00 1.33 H new ATOM 0 HG23 THR A 37 -25.227 6.676 0.285 1.00 1.33 H new ATOM 592 N GLY A 38 -28.057 8.187 -2.095 1.00 1.26 N ATOM 593 CA GLY A 38 -28.854 7.217 -2.904 1.00 1.21 C ATOM 594 C GLY A 38 -28.049 6.886 -4.165 1.00 1.17 C ATOM 595 O GLY A 38 -28.181 5.833 -4.757 1.00 1.12 O ATOM 0 H GLY A 38 -28.566 9.004 -1.758 1.00 1.26 H new ATOM 0 HA2 GLY A 38 -29.052 6.312 -2.329 1.00 1.21 H new ATOM 0 HA3 GLY A 38 -29.821 7.645 -3.169 1.00 1.21 H new ATOM 599 N ARG A 39 -27.198 7.797 -4.550 1.00 1.22 N ATOM 600 CA ARG A 39 -26.331 7.600 -5.747 1.00 1.23 C ATOM 601 C ARG A 39 -25.298 6.514 -5.443 1.00 1.13 C ATOM 602 O ARG A 39 -24.848 5.799 -6.317 1.00 1.10 O ATOM 603 CB ARG A 39 -25.611 8.918 -6.043 1.00 1.33 C ATOM 604 CG ARG A 39 -24.810 8.803 -7.341 1.00 1.36 C ATOM 605 CD ARG A 39 -23.439 9.457 -7.146 1.00 1.39 C ATOM 606 NE ARG A 39 -22.669 9.388 -8.420 1.00 1.58 N ATOM 607 CZ ARG A 39 -21.394 9.665 -8.428 1.00 2.13 C ATOM 608 NH1 ARG A 39 -20.795 10.013 -7.321 1.00 2.75 N ATOM 609 NH2 ARG A 39 -20.718 9.597 -9.541 1.00 2.58 N ATOM 0 H ARG A 39 -27.064 8.689 -4.074 1.00 1.22 H new ATOM 0 HA ARG A 39 -26.931 7.299 -6.606 1.00 1.23 H new ATOM 0 HB2 ARG A 39 -26.337 9.727 -6.126 1.00 1.33 H new ATOM 0 HB3 ARG A 39 -24.945 9.170 -5.218 1.00 1.33 H new ATOM 0 HG2 ARG A 39 -24.691 7.755 -7.617 1.00 1.36 H new ATOM 0 HG3 ARG A 39 -25.345 9.289 -8.157 1.00 1.36 H new ATOM 0 HD2 ARG A 39 -23.560 10.496 -6.838 1.00 1.39 H new ATOM 0 HD3 ARG A 39 -22.892 8.950 -6.351 1.00 1.39 H new ATOM 0 HE ARG A 39 -23.139 9.124 -9.286 1.00 1.58 H new ATOM 0 HH11 ARG A 39 -21.324 10.068 -6.451 1.00 2.75 H new ATOM 0 HH12 ARG A 39 -19.798 10.230 -7.327 1.00 2.75 H new ATOM 0 HH21 ARG A 39 -21.186 9.327 -10.406 1.00 2.58 H new ATOM 0 HH22 ARG A 39 -19.721 9.814 -9.546 1.00 2.58 H new ATOM 623 N TYR A 40 -24.935 6.378 -4.200 1.00 1.10 N ATOM 624 CA TYR A 40 -23.946 5.336 -3.822 1.00 1.01 C ATOM 625 C TYR A 40 -24.641 3.982 -3.808 1.00 0.91 C ATOM 626 O TYR A 40 -24.113 2.994 -4.278 1.00 0.85 O ATOM 627 CB TYR A 40 -23.369 5.651 -2.444 1.00 1.04 C ATOM 628 CG TYR A 40 -22.292 6.695 -2.594 1.00 1.24 C ATOM 629 CD1 TYR A 40 -22.629 7.994 -2.994 1.00 1.92 C ATOM 630 CD2 TYR A 40 -20.956 6.366 -2.344 1.00 1.74 C ATOM 631 CE1 TYR A 40 -21.631 8.963 -3.141 1.00 2.17 C ATOM 632 CE2 TYR A 40 -19.958 7.333 -2.492 1.00 2.01 C ATOM 633 CZ TYR A 40 -20.294 8.632 -2.891 1.00 1.89 C ATOM 634 OH TYR A 40 -19.309 9.587 -3.037 1.00 2.27 O ATOM 0 H TYR A 40 -25.283 6.946 -3.427 1.00 1.10 H new ATOM 0 HA TYR A 40 -23.129 5.316 -4.543 1.00 1.01 H new ATOM 0 HB2 TYR A 40 -24.154 6.012 -1.780 1.00 1.04 H new ATOM 0 HB3 TYR A 40 -22.959 4.748 -1.991 1.00 1.04 H new ATOM 0 HD1 TYR A 40 -23.660 8.248 -3.189 1.00 1.92 H new ATOM 0 HD2 TYR A 40 -20.695 5.364 -2.036 1.00 1.74 H new ATOM 0 HE1 TYR A 40 -21.892 9.965 -3.447 1.00 2.17 H new ATOM 0 HE2 TYR A 40 -18.927 7.078 -2.298 1.00 2.01 H new ATOM 0 HH TYR A 40 -18.473 9.155 -3.311 1.00 2.27 H new ATOM 644 N ILE A 41 -25.837 3.930 -3.289 1.00 0.89 N ATOM 645 CA ILE A 41 -26.578 2.643 -3.268 1.00 0.80 C ATOM 646 C ILE A 41 -26.850 2.210 -4.709 1.00 0.77 C ATOM 647 O ILE A 41 -26.471 1.138 -5.129 1.00 0.70 O ATOM 648 CB ILE A 41 -27.900 2.834 -2.521 1.00 0.82 C ATOM 649 CG1 ILE A 41 -27.636 2.817 -1.012 1.00 0.92 C ATOM 650 CG2 ILE A 41 -28.868 1.705 -2.879 1.00 0.77 C ATOM 651 CD1 ILE A 41 -28.863 3.354 -0.270 1.00 0.95 C ATOM 0 H ILE A 41 -26.330 4.723 -2.880 1.00 0.89 H new ATOM 0 HA ILE A 41 -25.991 1.877 -2.761 1.00 0.80 H new ATOM 0 HB ILE A 41 -28.341 3.789 -2.808 1.00 0.82 H new ATOM 0 HG12 ILE A 41 -27.415 1.802 -0.683 1.00 0.92 H new ATOM 0 HG13 ILE A 41 -26.762 3.425 -0.779 1.00 0.92 H new ATOM 0 HG21 ILE A 41 -29.807 1.847 -2.344 1.00 0.77 H new ATOM 0 HG22 ILE A 41 -29.057 1.715 -3.952 1.00 0.77 H new ATOM 0 HG23 ILE A 41 -28.431 0.747 -2.596 1.00 0.77 H new ATOM 0 HD11 ILE A 41 -28.674 3.341 0.803 1.00 0.95 H new ATOM 0 HD12 ILE A 41 -29.064 4.376 -0.591 1.00 0.95 H new ATOM 0 HD13 ILE A 41 -29.726 2.727 -0.493 1.00 0.95 H new ATOM 663 N LYS A 42 -27.493 3.051 -5.473 1.00 0.85 N ATOM 664 CA LYS A 42 -27.782 2.702 -6.892 1.00 0.86 C ATOM 665 C LYS A 42 -26.479 2.280 -7.570 1.00 0.85 C ATOM 666 O LYS A 42 -26.443 1.359 -8.362 1.00 0.82 O ATOM 667 CB LYS A 42 -28.363 3.931 -7.604 1.00 0.98 C ATOM 668 CG LYS A 42 -28.503 3.664 -9.108 1.00 1.09 C ATOM 669 CD LYS A 42 -29.302 2.380 -9.336 1.00 1.05 C ATOM 670 CE LYS A 42 -29.927 2.409 -10.731 1.00 1.07 C ATOM 671 NZ LYS A 42 -30.994 3.448 -10.775 1.00 1.81 N ATOM 0 H LYS A 42 -27.831 3.966 -5.174 1.00 0.85 H new ATOM 0 HA LYS A 42 -28.501 1.885 -6.940 1.00 0.86 H new ATOM 0 HB2 LYS A 42 -29.336 4.178 -7.180 1.00 0.98 H new ATOM 0 HB3 LYS A 42 -27.716 4.793 -7.440 1.00 0.98 H new ATOM 0 HG2 LYS A 42 -29.003 4.504 -9.590 1.00 1.09 H new ATOM 0 HG3 LYS A 42 -27.517 3.575 -9.564 1.00 1.09 H new ATOM 0 HD2 LYS A 42 -28.651 1.511 -9.236 1.00 1.05 H new ATOM 0 HD3 LYS A 42 -30.080 2.284 -8.579 1.00 1.05 H new ATOM 0 HE2 LYS A 42 -29.164 2.624 -11.479 1.00 1.07 H new ATOM 0 HE3 LYS A 42 -30.345 1.432 -10.974 1.00 1.07 H new ATOM 0 HZ1 LYS A 42 -31.709 3.181 -11.481 1.00 1.81 H new ATOM 0 HZ2 LYS A 42 -31.443 3.525 -9.840 1.00 1.81 H new ATOM 0 HZ3 LYS A 42 -30.576 4.364 -11.035 1.00 1.81 H new ATOM 685 N MET A 43 -25.409 2.946 -7.251 1.00 0.90 N ATOM 686 CA MET A 43 -24.093 2.596 -7.856 1.00 0.93 C ATOM 687 C MET A 43 -23.713 1.181 -7.429 1.00 0.80 C ATOM 688 O MET A 43 -23.346 0.350 -8.233 1.00 0.79 O ATOM 689 CB MET A 43 -23.031 3.594 -7.381 1.00 1.02 C ATOM 690 CG MET A 43 -21.635 3.029 -7.643 1.00 1.13 C ATOM 691 SD MET A 43 -20.413 4.362 -7.533 1.00 2.14 S ATOM 692 CE MET A 43 -20.535 4.930 -9.247 1.00 2.36 C ATOM 0 H MET A 43 -25.387 3.724 -6.592 1.00 0.90 H new ATOM 0 HA MET A 43 -24.157 2.641 -8.943 1.00 0.93 H new ATOM 0 HB2 MET A 43 -23.153 4.544 -7.902 1.00 1.02 H new ATOM 0 HB3 MET A 43 -23.158 3.795 -6.317 1.00 1.02 H new ATOM 0 HG2 MET A 43 -21.405 2.249 -6.917 1.00 1.13 H new ATOM 0 HG3 MET A 43 -21.597 2.567 -8.630 1.00 1.13 H new ATOM 0 HE1 MET A 43 -19.852 5.765 -9.403 1.00 2.36 H new ATOM 0 HE2 MET A 43 -20.271 4.114 -9.920 1.00 2.36 H new ATOM 0 HE3 MET A 43 -21.556 5.253 -9.451 1.00 2.36 H new ATOM 702 N LEU A 44 -23.807 0.904 -6.159 1.00 0.73 N ATOM 703 CA LEU A 44 -23.461 -0.451 -5.658 1.00 0.61 C ATOM 704 C LEU A 44 -24.461 -1.470 -6.223 1.00 0.57 C ATOM 705 O LEU A 44 -24.179 -2.649 -6.323 1.00 0.54 O ATOM 706 CB LEU A 44 -23.513 -0.435 -4.129 1.00 0.57 C ATOM 707 CG LEU A 44 -22.293 0.326 -3.588 1.00 0.69 C ATOM 708 CD1 LEU A 44 -22.611 0.942 -2.220 1.00 1.14 C ATOM 709 CD2 LEU A 44 -21.114 -0.640 -3.436 1.00 0.67 C ATOM 0 H LEU A 44 -24.111 1.564 -5.443 1.00 0.73 H new ATOM 0 HA LEU A 44 -22.458 -0.734 -5.979 1.00 0.61 H new ATOM 0 HB2 LEU A 44 -24.433 0.041 -3.790 1.00 0.57 H new ATOM 0 HB3 LEU A 44 -23.521 -1.454 -3.743 1.00 0.57 H new ATOM 0 HG LEU A 44 -22.039 1.121 -4.289 1.00 0.69 H new ATOM 0 HD11 LEU A 44 -21.737 1.478 -1.850 1.00 1.14 H new ATOM 0 HD12 LEU A 44 -23.446 1.635 -2.318 1.00 1.14 H new ATOM 0 HD13 LEU A 44 -22.876 0.152 -1.518 1.00 1.14 H new ATOM 0 HD21 LEU A 44 -20.248 -0.100 -3.052 1.00 0.67 H new ATOM 0 HD22 LEU A 44 -21.383 -1.436 -2.741 1.00 0.67 H new ATOM 0 HD23 LEU A 44 -20.871 -1.073 -4.406 1.00 0.67 H new ATOM 721 N MET A 45 -25.623 -1.017 -6.610 1.00 0.60 N ATOM 722 CA MET A 45 -26.640 -1.945 -7.191 1.00 0.58 C ATOM 723 C MET A 45 -26.308 -2.166 -8.659 1.00 0.62 C ATOM 724 O MET A 45 -26.209 -3.277 -9.142 1.00 0.59 O ATOM 725 CB MET A 45 -28.026 -1.300 -7.110 1.00 0.64 C ATOM 726 CG MET A 45 -28.355 -0.960 -5.665 1.00 1.07 C ATOM 727 SD MET A 45 -29.533 -2.176 -5.030 1.00 1.19 S ATOM 728 CE MET A 45 -31.043 -1.335 -5.569 1.00 1.04 C ATOM 0 H MET A 45 -25.914 -0.041 -6.549 1.00 0.60 H new ATOM 0 HA MET A 45 -26.633 -2.886 -6.642 1.00 0.58 H new ATOM 0 HB2 MET A 45 -28.053 -0.397 -7.720 1.00 0.64 H new ATOM 0 HB3 MET A 45 -28.777 -1.980 -7.513 1.00 0.64 H new ATOM 0 HG2 MET A 45 -27.448 -0.963 -5.061 1.00 1.07 H new ATOM 0 HG3 MET A 45 -28.777 0.043 -5.601 1.00 1.07 H new ATOM 0 HE1 MET A 45 -31.492 -0.815 -4.723 1.00 1.04 H new ATOM 0 HE2 MET A 45 -30.799 -0.614 -6.349 1.00 1.04 H new ATOM 0 HE3 MET A 45 -31.748 -2.068 -5.960 1.00 1.04 H new ATOM 738 N ASP A 46 -26.124 -1.089 -9.358 1.00 0.69 N ATOM 739 CA ASP A 46 -25.781 -1.172 -10.799 1.00 0.76 C ATOM 740 C ASP A 46 -24.490 -1.975 -10.959 1.00 0.75 C ATOM 741 O ASP A 46 -24.241 -2.575 -11.986 1.00 0.81 O ATOM 742 CB ASP A 46 -25.581 0.237 -11.352 1.00 0.85 C ATOM 743 CG ASP A 46 -26.181 0.328 -12.755 1.00 1.03 C ATOM 744 OD1 ASP A 46 -27.323 -0.070 -12.916 1.00 1.26 O ATOM 745 OD2 ASP A 46 -25.489 0.796 -13.644 1.00 1.71 O ATOM 0 H ASP A 46 -26.197 -0.141 -8.988 1.00 0.69 H new ATOM 0 HA ASP A 46 -26.587 -1.663 -11.345 1.00 0.76 H new ATOM 0 HB2 ASP A 46 -26.054 0.967 -10.695 1.00 0.85 H new ATOM 0 HB3 ASP A 46 -24.519 0.479 -11.384 1.00 0.85 H new ATOM 750 N LEU A 47 -23.660 -1.976 -9.949 1.00 0.69 N ATOM 751 CA LEU A 47 -22.373 -2.723 -10.033 1.00 0.70 C ATOM 752 C LEU A 47 -22.518 -4.113 -9.401 1.00 0.62 C ATOM 753 O LEU A 47 -21.602 -4.908 -9.434 1.00 0.63 O ATOM 754 CB LEU A 47 -21.283 -1.924 -9.314 1.00 0.72 C ATOM 755 CG LEU A 47 -20.592 -0.990 -10.316 1.00 0.84 C ATOM 756 CD1 LEU A 47 -21.636 -0.139 -11.040 1.00 0.89 C ATOM 757 CD2 LEU A 47 -19.618 -0.065 -9.579 1.00 0.89 C ATOM 0 H LEU A 47 -23.820 -1.489 -9.067 1.00 0.69 H new ATOM 0 HA LEU A 47 -22.098 -2.853 -11.080 1.00 0.70 H new ATOM 0 HB2 LEU A 47 -21.718 -1.344 -8.500 1.00 0.72 H new ATOM 0 HB3 LEU A 47 -20.554 -2.601 -8.869 1.00 0.72 H new ATOM 0 HG LEU A 47 -20.047 -1.595 -11.040 1.00 0.84 H new ATOM 0 HD11 LEU A 47 -21.138 0.522 -11.750 1.00 0.89 H new ATOM 0 HD12 LEU A 47 -22.329 -0.789 -11.574 1.00 0.89 H new ATOM 0 HD13 LEU A 47 -22.186 0.458 -10.313 1.00 0.89 H new ATOM 0 HD21 LEU A 47 -19.131 0.596 -10.296 1.00 0.89 H new ATOM 0 HD22 LEU A 47 -20.165 0.532 -8.849 1.00 0.89 H new ATOM 0 HD23 LEU A 47 -18.865 -0.664 -9.067 1.00 0.89 H new ATOM 769 N GLU A 48 -23.660 -4.413 -8.836 1.00 0.55 N ATOM 770 CA GLU A 48 -23.879 -5.757 -8.209 1.00 0.50 C ATOM 771 C GLU A 48 -23.110 -5.847 -6.888 1.00 0.44 C ATOM 772 O GLU A 48 -22.042 -6.420 -6.815 1.00 0.46 O ATOM 773 CB GLU A 48 -23.423 -6.877 -9.157 1.00 0.56 C ATOM 774 CG GLU A 48 -23.727 -6.492 -10.608 1.00 1.22 C ATOM 775 CD GLU A 48 -24.174 -7.733 -11.381 1.00 1.27 C ATOM 776 OE1 GLU A 48 -23.393 -8.667 -11.466 1.00 1.73 O ATOM 777 OE2 GLU A 48 -25.288 -7.729 -11.877 1.00 1.79 O ATOM 0 H GLU A 48 -24.458 -3.780 -8.781 1.00 0.55 H new ATOM 0 HA GLU A 48 -24.944 -5.880 -8.015 1.00 0.50 H new ATOM 0 HB2 GLU A 48 -22.354 -7.055 -9.036 1.00 0.56 H new ATOM 0 HB3 GLU A 48 -23.932 -7.808 -8.905 1.00 0.56 H new ATOM 0 HG2 GLU A 48 -24.507 -5.731 -10.638 1.00 1.22 H new ATOM 0 HG3 GLU A 48 -22.842 -6.059 -11.074 1.00 1.22 H new ATOM 784 N ILE A 49 -23.655 -5.286 -5.843 1.00 0.40 N ATOM 785 CA ILE A 49 -22.981 -5.327 -4.515 1.00 0.37 C ATOM 786 C ILE A 49 -24.065 -5.258 -3.448 1.00 0.37 C ATOM 787 O ILE A 49 -23.983 -5.906 -2.421 1.00 0.40 O ATOM 788 CB ILE A 49 -22.049 -4.117 -4.364 1.00 0.39 C ATOM 789 CG1 ILE A 49 -20.726 -4.339 -5.114 1.00 0.44 C ATOM 790 CG2 ILE A 49 -21.755 -3.876 -2.882 1.00 0.37 C ATOM 791 CD1 ILE A 49 -20.758 -3.563 -6.431 1.00 0.82 C ATOM 0 H ILE A 49 -24.549 -4.795 -5.854 1.00 0.40 H new ATOM 0 HA ILE A 49 -22.391 -6.239 -4.417 1.00 0.37 H new ATOM 0 HB ILE A 49 -22.549 -3.248 -4.792 1.00 0.39 H new ATOM 0 HG12 ILE A 49 -19.887 -4.006 -4.502 1.00 0.44 H new ATOM 0 HG13 ILE A 49 -20.578 -5.401 -5.308 1.00 0.44 H new ATOM 0 HG21 ILE A 49 -21.093 -3.016 -2.777 1.00 0.37 H new ATOM 0 HG22 ILE A 49 -22.688 -3.682 -2.353 1.00 0.37 H new ATOM 0 HG23 ILE A 49 -21.274 -4.758 -2.458 1.00 0.37 H new ATOM 0 HD11 ILE A 49 -19.821 -3.717 -6.967 1.00 0.82 H new ATOM 0 HD12 ILE A 49 -21.588 -3.917 -7.042 1.00 0.82 H new ATOM 0 HD13 ILE A 49 -20.887 -2.501 -6.224 1.00 0.82 H new ATOM 803 N ILE A 50 -25.097 -4.496 -3.702 1.00 0.43 N ATOM 804 CA ILE A 50 -26.209 -4.395 -2.729 1.00 0.48 C ATOM 805 C ILE A 50 -27.338 -5.270 -3.252 1.00 0.43 C ATOM 806 O ILE A 50 -27.284 -5.738 -4.371 1.00 0.49 O ATOM 807 CB ILE A 50 -26.644 -2.937 -2.606 1.00 0.56 C ATOM 808 CG1 ILE A 50 -25.669 -2.207 -1.675 1.00 0.62 C ATOM 809 CG2 ILE A 50 -28.048 -2.854 -2.012 1.00 0.67 C ATOM 810 CD1 ILE A 50 -25.943 -0.698 -1.692 1.00 0.74 C ATOM 0 H ILE A 50 -25.212 -3.939 -4.548 1.00 0.43 H new ATOM 0 HA ILE A 50 -25.911 -4.731 -1.736 1.00 0.48 H new ATOM 0 HB ILE A 50 -26.645 -2.478 -3.595 1.00 0.56 H new ATOM 0 HG12 ILE A 50 -25.770 -2.590 -0.660 1.00 0.62 H new ATOM 0 HG13 ILE A 50 -24.643 -2.400 -1.988 1.00 0.62 H new ATOM 0 HG21 ILE A 50 -28.347 -1.809 -1.929 1.00 0.67 H new ATOM 0 HG22 ILE A 50 -28.749 -3.382 -2.659 1.00 0.67 H new ATOM 0 HG23 ILE A 50 -28.052 -3.312 -1.023 1.00 0.67 H new ATOM 0 HD11 ILE A 50 -25.243 -0.194 -1.026 1.00 0.74 H new ATOM 0 HD12 ILE A 50 -25.819 -0.317 -2.706 1.00 0.74 H new ATOM 0 HD13 ILE A 50 -26.963 -0.510 -1.356 1.00 0.74 H new ATOM 822 N ARG A 51 -28.336 -5.535 -2.461 1.00 0.58 N ATOM 823 CA ARG A 51 -29.418 -6.432 -2.942 1.00 0.56 C ATOM 824 C ARG A 51 -30.751 -5.926 -2.410 1.00 0.53 C ATOM 825 O ARG A 51 -30.828 -5.351 -1.351 1.00 0.53 O ATOM 826 CB ARG A 51 -29.099 -7.854 -2.447 1.00 0.60 C ATOM 827 CG ARG A 51 -30.212 -8.849 -2.794 1.00 0.83 C ATOM 828 CD ARG A 51 -30.033 -9.338 -4.235 1.00 0.87 C ATOM 829 NE ARG A 51 -31.313 -9.926 -4.721 1.00 1.02 N ATOM 830 CZ ARG A 51 -31.406 -10.373 -5.943 1.00 1.06 C ATOM 831 NH1 ARG A 51 -30.375 -10.312 -6.740 1.00 1.47 N ATOM 832 NH2 ARG A 51 -32.529 -10.886 -6.365 1.00 1.39 N ATOM 0 H ARG A 51 -28.449 -5.174 -1.514 1.00 0.58 H new ATOM 0 HA ARG A 51 -29.483 -6.446 -4.030 1.00 0.56 H new ATOM 0 HB2 ARG A 51 -28.162 -8.190 -2.891 1.00 0.60 H new ATOM 0 HB3 ARG A 51 -28.952 -7.837 -1.367 1.00 0.60 H new ATOM 0 HG2 ARG A 51 -30.185 -9.694 -2.106 1.00 0.83 H new ATOM 0 HG3 ARG A 51 -31.187 -8.375 -2.679 1.00 0.83 H new ATOM 0 HD2 ARG A 51 -29.734 -8.510 -4.877 1.00 0.87 H new ATOM 0 HD3 ARG A 51 -29.237 -10.082 -4.282 1.00 0.87 H new ATOM 0 HE ARG A 51 -32.118 -9.979 -4.097 1.00 1.02 H new ATOM 0 HH11 ARG A 51 -29.496 -9.915 -6.408 1.00 1.47 H new ATOM 0 HH12 ARG A 51 -30.448 -10.662 -7.695 1.00 1.47 H new ATOM 0 HH21 ARG A 51 -33.333 -10.937 -5.740 1.00 1.39 H new ATOM 0 HH22 ARG A 51 -32.603 -11.236 -7.320 1.00 1.39 H new ATOM 846 N GLN A 52 -31.796 -6.118 -3.163 1.00 0.59 N ATOM 847 CA GLN A 52 -33.136 -5.619 -2.735 1.00 0.59 C ATOM 848 C GLN A 52 -33.936 -6.746 -2.099 1.00 0.56 C ATOM 849 O GLN A 52 -34.362 -7.672 -2.761 1.00 0.58 O ATOM 850 CB GLN A 52 -33.896 -5.097 -3.958 1.00 0.68 C ATOM 851 CG GLN A 52 -33.413 -3.688 -4.304 1.00 1.47 C ATOM 852 CD GLN A 52 -34.162 -2.666 -3.448 1.00 1.71 C ATOM 853 OE1 GLN A 52 -33.865 -2.497 -2.282 1.00 2.42 O ATOM 854 NE2 GLN A 52 -35.129 -1.971 -3.981 1.00 1.84 N ATOM 0 H GLN A 52 -31.782 -6.601 -4.061 1.00 0.59 H new ATOM 0 HA GLN A 52 -33.001 -4.819 -2.008 1.00 0.59 H new ATOM 0 HB2 GLN A 52 -33.740 -5.763 -4.806 1.00 0.68 H new ATOM 0 HB3 GLN A 52 -34.967 -5.085 -3.755 1.00 0.68 H new ATOM 0 HG2 GLN A 52 -32.340 -3.607 -4.130 1.00 1.47 H new ATOM 0 HG3 GLN A 52 -33.580 -3.484 -5.362 1.00 1.47 H new ATOM 0 HE21 GLN A 52 -35.379 -2.112 -4.960 1.00 1.84 H new ATOM 0 HE22 GLN A 52 -35.635 -1.286 -3.419 1.00 1.84 H new ATOM 863 N GLU A 53 -34.150 -6.658 -0.813 1.00 0.67 N ATOM 864 CA GLU A 53 -34.927 -7.696 -0.102 1.00 0.78 C ATOM 865 C GLU A 53 -36.175 -7.049 0.484 1.00 0.77 C ATOM 866 O GLU A 53 -36.129 -6.373 1.485 1.00 0.87 O ATOM 867 CB GLU A 53 -34.063 -8.259 1.019 1.00 1.04 C ATOM 868 CG GLU A 53 -34.393 -9.735 1.240 1.00 0.85 C ATOM 869 CD GLU A 53 -35.910 -9.919 1.294 1.00 1.59 C ATOM 870 OE1 GLU A 53 -36.472 -9.726 2.359 1.00 2.25 O ATOM 871 OE2 GLU A 53 -36.483 -10.251 0.270 1.00 2.30 O ATOM 0 H GLU A 53 -33.812 -5.898 -0.223 1.00 0.67 H new ATOM 0 HA GLU A 53 -35.217 -8.499 -0.780 1.00 0.78 H new ATOM 0 HB2 GLU A 53 -33.008 -8.147 0.768 1.00 1.04 H new ATOM 0 HB3 GLU A 53 -34.233 -7.698 1.938 1.00 1.04 H new ATOM 0 HG2 GLU A 53 -33.972 -10.337 0.434 1.00 0.85 H new ATOM 0 HG3 GLU A 53 -33.941 -10.084 2.168 1.00 0.85 H new ATOM 878 N GLY A 54 -37.291 -7.258 -0.141 1.00 0.73 N ATOM 879 CA GLY A 54 -38.556 -6.663 0.365 1.00 0.75 C ATOM 880 C GLY A 54 -38.466 -5.129 0.357 1.00 0.83 C ATOM 881 O GLY A 54 -39.059 -4.468 1.186 1.00 1.15 O ATOM 0 H GLY A 54 -37.386 -7.819 -0.987 1.00 0.73 H new ATOM 0 HA2 GLY A 54 -39.392 -6.988 -0.255 1.00 0.75 H new ATOM 0 HA3 GLY A 54 -38.753 -7.017 1.377 1.00 0.75 H new ATOM 885 N LYS A 55 -37.712 -4.572 -0.561 1.00 0.86 N ATOM 886 CA LYS A 55 -37.544 -3.082 -0.642 1.00 1.03 C ATOM 887 C LYS A 55 -36.409 -2.624 0.286 1.00 1.02 C ATOM 888 O LYS A 55 -36.071 -1.458 0.335 1.00 1.27 O ATOM 889 CB LYS A 55 -38.845 -2.363 -0.270 1.00 1.21 C ATOM 890 CG LYS A 55 -38.937 -1.050 -1.051 1.00 1.38 C ATOM 891 CD LYS A 55 -39.996 -0.145 -0.417 1.00 1.67 C ATOM 892 CE LYS A 55 -40.589 0.774 -1.486 1.00 1.89 C ATOM 893 NZ LYS A 55 -41.743 0.095 -2.142 1.00 2.27 N ATOM 0 H LYS A 55 -37.197 -5.094 -1.270 1.00 0.86 H new ATOM 0 HA LYS A 55 -37.291 -2.825 -1.671 1.00 1.03 H new ATOM 0 HB2 LYS A 55 -39.702 -2.996 -0.498 1.00 1.21 H new ATOM 0 HB3 LYS A 55 -38.871 -2.165 0.802 1.00 1.21 H new ATOM 0 HG2 LYS A 55 -37.969 -0.548 -1.052 1.00 1.38 H new ATOM 0 HG3 LYS A 55 -39.193 -1.252 -2.091 1.00 1.38 H new ATOM 0 HD2 LYS A 55 -40.783 -0.749 0.035 1.00 1.67 H new ATOM 0 HD3 LYS A 55 -39.551 0.449 0.382 1.00 1.67 H new ATOM 0 HE2 LYS A 55 -40.914 1.712 -1.035 1.00 1.89 H new ATOM 0 HE3 LYS A 55 -39.830 1.023 -2.228 1.00 1.89 H new ATOM 0 HZ1 LYS A 55 -42.146 0.720 -2.869 1.00 2.27 H new ATOM 0 HZ2 LYS A 55 -41.420 -0.788 -2.586 1.00 2.27 H new ATOM 0 HZ3 LYS A 55 -42.469 -0.121 -1.430 1.00 2.27 H new ATOM 907 N GLN A 56 -35.809 -3.537 1.002 1.00 0.87 N ATOM 908 CA GLN A 56 -34.681 -3.159 1.907 1.00 0.97 C ATOM 909 C GLN A 56 -33.388 -3.466 1.174 1.00 0.89 C ATOM 910 O GLN A 56 -33.403 -4.132 0.161 1.00 0.86 O ATOM 911 CB GLN A 56 -34.712 -3.967 3.208 1.00 1.04 C ATOM 912 CG GLN A 56 -36.153 -4.142 3.679 1.00 1.44 C ATOM 913 CD GLN A 56 -36.184 -4.172 5.207 1.00 1.38 C ATOM 914 OE1 GLN A 56 -37.048 -3.580 5.823 1.00 1.49 O ATOM 915 NE2 GLN A 56 -35.267 -4.844 5.851 1.00 2.04 N ATOM 0 H GLN A 56 -36.050 -4.528 1.000 1.00 0.87 H new ATOM 0 HA GLN A 56 -34.764 -2.103 2.164 1.00 0.97 H new ATOM 0 HB2 GLN A 56 -34.251 -4.942 3.051 1.00 1.04 H new ATOM 0 HB3 GLN A 56 -34.129 -3.458 3.976 1.00 1.04 H new ATOM 0 HG2 GLN A 56 -36.771 -3.325 3.307 1.00 1.44 H new ATOM 0 HG3 GLN A 56 -36.570 -5.065 3.277 1.00 1.44 H new ATOM 0 HE21 GLN A 56 -34.542 -5.341 5.334 1.00 2.04 H new ATOM 0 HE22 GLN A 56 -35.277 -4.872 6.871 1.00 2.04 H new ATOM 924 N TYR A 57 -32.275 -2.974 1.649 1.00 0.87 N ATOM 925 CA TYR A 57 -31.001 -3.233 0.932 1.00 0.80 C ATOM 926 C TYR A 57 -30.232 -4.344 1.635 1.00 0.79 C ATOM 927 O TYR A 57 -29.996 -4.312 2.826 1.00 0.95 O ATOM 928 CB TYR A 57 -30.187 -1.956 0.892 1.00 0.81 C ATOM 929 CG TYR A 57 -31.096 -0.826 0.435 1.00 0.85 C ATOM 930 CD1 TYR A 57 -32.037 -0.273 1.312 1.00 1.49 C ATOM 931 CD2 TYR A 57 -31.016 -0.354 -0.883 1.00 1.34 C ATOM 932 CE1 TYR A 57 -32.887 0.749 0.874 1.00 1.56 C ATOM 933 CE2 TYR A 57 -31.870 0.667 -1.319 1.00 1.35 C ATOM 934 CZ TYR A 57 -32.804 1.219 -0.439 1.00 0.98 C ATOM 935 OH TYR A 57 -33.647 2.224 -0.867 1.00 1.06 O ATOM 0 H TYR A 57 -32.196 -2.409 2.495 1.00 0.87 H new ATOM 0 HA TYR A 57 -31.206 -3.553 -0.090 1.00 0.80 H new ATOM 0 HB2 TYR A 57 -29.775 -1.737 1.877 1.00 0.81 H new ATOM 0 HB3 TYR A 57 -29.343 -2.064 0.210 1.00 0.81 H new ATOM 0 HD1 TYR A 57 -32.107 -0.635 2.327 1.00 1.49 H new ATOM 0 HD2 TYR A 57 -30.294 -0.779 -1.564 1.00 1.34 H new ATOM 0 HE1 TYR A 57 -33.610 1.176 1.554 1.00 1.56 H new ATOM 0 HE2 TYR A 57 -31.806 1.027 -2.335 1.00 1.35 H new ATOM 0 HH TYR A 57 -33.457 2.433 -1.805 1.00 1.06 H new ATOM 945 N MET A 58 -29.883 -5.347 0.882 1.00 0.66 N ATOM 946 CA MET A 58 -29.171 -6.531 1.425 1.00 0.67 C ATOM 947 C MET A 58 -27.845 -6.687 0.677 1.00 0.57 C ATOM 948 O MET A 58 -27.592 -5.987 -0.278 1.00 0.51 O ATOM 949 CB MET A 58 -30.080 -7.757 1.227 1.00 0.73 C ATOM 950 CG MET A 58 -29.287 -9.054 1.372 1.00 0.90 C ATOM 951 SD MET A 58 -30.437 -10.448 1.459 1.00 1.22 S ATOM 952 CE MET A 58 -29.442 -11.626 0.514 1.00 1.60 C ATOM 0 H MET A 58 -30.069 -5.394 -0.120 1.00 0.66 H new ATOM 0 HA MET A 58 -28.951 -6.422 2.487 1.00 0.67 H new ATOM 0 HB2 MET A 58 -30.888 -7.737 1.958 1.00 0.73 H new ATOM 0 HB3 MET A 58 -30.541 -7.717 0.240 1.00 0.73 H new ATOM 0 HG2 MET A 58 -28.611 -9.177 0.526 1.00 0.90 H new ATOM 0 HG3 MET A 58 -28.671 -9.019 2.270 1.00 0.90 H new ATOM 0 HE1 MET A 58 -29.973 -12.575 0.442 1.00 1.60 H new ATOM 0 HE2 MET A 58 -29.266 -11.233 -0.487 1.00 1.60 H new ATOM 0 HE3 MET A 58 -28.487 -11.781 1.016 1.00 1.60 H new ATOM 962 N LEU A 59 -26.992 -7.573 1.108 1.00 0.59 N ATOM 963 CA LEU A 59 -25.683 -7.732 0.408 1.00 0.52 C ATOM 964 C LEU A 59 -25.770 -8.925 -0.551 1.00 0.46 C ATOM 965 O LEU A 59 -26.317 -9.959 -0.223 1.00 0.53 O ATOM 966 CB LEU A 59 -24.546 -7.942 1.430 1.00 0.63 C ATOM 967 CG LEU A 59 -24.551 -9.363 2.023 1.00 0.71 C ATOM 968 CD1 LEU A 59 -23.380 -9.499 2.998 1.00 1.03 C ATOM 969 CD2 LEU A 59 -25.855 -9.617 2.780 1.00 1.16 C ATOM 0 H LEU A 59 -27.140 -8.190 1.907 1.00 0.59 H new ATOM 0 HA LEU A 59 -25.463 -6.827 -0.158 1.00 0.52 H new ATOM 0 HB2 LEU A 59 -23.587 -7.755 0.947 1.00 0.63 H new ATOM 0 HB3 LEU A 59 -24.645 -7.214 2.235 1.00 0.63 H new ATOM 0 HG LEU A 59 -24.460 -10.087 1.213 1.00 0.71 H new ATOM 0 HD11 LEU A 59 -23.375 -10.503 3.423 1.00 1.03 H new ATOM 0 HD12 LEU A 59 -22.443 -9.325 2.468 1.00 1.03 H new ATOM 0 HD13 LEU A 59 -23.486 -8.766 3.798 1.00 1.03 H new ATOM 0 HD21 LEU A 59 -25.845 -10.625 3.194 1.00 1.16 H new ATOM 0 HD22 LEU A 59 -25.953 -8.893 3.589 1.00 1.16 H new ATOM 0 HD23 LEU A 59 -26.698 -9.514 2.097 1.00 1.16 H new ATOM 981 N THR A 60 -25.261 -8.775 -1.747 1.00 0.39 N ATOM 982 CA THR A 60 -25.342 -9.887 -2.741 1.00 0.41 C ATOM 983 C THR A 60 -24.024 -10.661 -2.745 1.00 0.46 C ATOM 984 O THR A 60 -23.034 -10.200 -2.210 1.00 0.43 O ATOM 985 CB THR A 60 -25.575 -9.315 -4.141 1.00 0.40 C ATOM 986 OG1 THR A 60 -24.861 -10.092 -5.092 1.00 1.12 O ATOM 987 CG2 THR A 60 -25.085 -7.872 -4.190 1.00 1.04 C ATOM 0 H THR A 60 -24.793 -7.931 -2.078 1.00 0.39 H new ATOM 0 HA THR A 60 -26.166 -10.547 -2.469 1.00 0.41 H new ATOM 0 HB THR A 60 -26.640 -9.343 -4.374 1.00 0.40 H new ATOM 0 HG1 THR A 60 -25.010 -9.728 -5.990 1.00 1.12 H new ATOM 0 HG21 THR A 60 -25.251 -7.465 -5.187 1.00 1.04 H new ATOM 0 HG22 THR A 60 -25.633 -7.277 -3.459 1.00 1.04 H new ATOM 0 HG23 THR A 60 -24.020 -7.841 -3.958 1.00 1.04 H new ATOM 995 N LYS A 61 -24.004 -11.828 -3.344 1.00 0.54 N ATOM 996 CA LYS A 61 -22.744 -12.631 -3.392 1.00 0.61 C ATOM 997 C LYS A 61 -21.568 -11.691 -3.677 1.00 0.57 C ATOM 998 O LYS A 61 -20.544 -11.725 -3.026 1.00 0.56 O ATOM 999 CB LYS A 61 -22.832 -13.686 -4.505 1.00 0.70 C ATOM 1000 CG LYS A 61 -23.750 -13.202 -5.635 1.00 1.39 C ATOM 1001 CD LYS A 61 -25.180 -13.697 -5.395 1.00 0.99 C ATOM 1002 CE LYS A 61 -25.354 -15.080 -6.028 1.00 1.84 C ATOM 1003 NZ LYS A 61 -25.658 -14.927 -7.478 1.00 2.26 N ATOM 0 H LYS A 61 -24.808 -12.258 -3.802 1.00 0.54 H new ATOM 0 HA LYS A 61 -22.600 -13.135 -2.437 1.00 0.61 H new ATOM 0 HB2 LYS A 61 -21.837 -13.890 -4.900 1.00 0.70 H new ATOM 0 HB3 LYS A 61 -23.211 -14.623 -4.097 1.00 0.70 H new ATOM 0 HG2 LYS A 61 -23.737 -12.113 -5.685 1.00 1.39 H new ATOM 0 HG3 LYS A 61 -23.385 -13.569 -6.594 1.00 1.39 H new ATOM 0 HD2 LYS A 61 -25.384 -13.746 -4.325 1.00 0.99 H new ATOM 0 HD3 LYS A 61 -25.896 -12.996 -5.824 1.00 0.99 H new ATOM 0 HE2 LYS A 61 -24.446 -15.669 -5.896 1.00 1.84 H new ATOM 0 HE3 LYS A 61 -26.160 -15.620 -5.531 1.00 1.84 H new ATOM 0 HZ1 LYS A 61 -25.776 -15.866 -7.909 1.00 2.26 H new ATOM 0 HZ2 LYS A 61 -26.535 -14.380 -7.593 1.00 2.26 H new ATOM 0 HZ3 LYS A 61 -24.875 -14.428 -7.946 1.00 2.26 H new ATOM 1017 N LYS A 62 -21.720 -10.855 -4.660 1.00 0.57 N ATOM 1018 CA LYS A 62 -20.633 -9.898 -5.016 1.00 0.56 C ATOM 1019 C LYS A 62 -20.368 -8.946 -3.843 1.00 0.50 C ATOM 1020 O LYS A 62 -19.264 -8.472 -3.654 1.00 0.58 O ATOM 1021 CB LYS A 62 -21.052 -9.086 -6.244 1.00 0.59 C ATOM 1022 CG LYS A 62 -20.705 -9.862 -7.516 1.00 0.78 C ATOM 1023 CD LYS A 62 -21.458 -11.192 -7.525 1.00 1.25 C ATOM 1024 CE LYS A 62 -21.302 -11.859 -8.893 1.00 1.29 C ATOM 1025 NZ LYS A 62 -22.154 -11.154 -9.891 1.00 2.14 N ATOM 0 H LYS A 62 -22.557 -10.790 -5.240 1.00 0.57 H new ATOM 0 HA LYS A 62 -19.723 -10.457 -5.237 1.00 0.56 H new ATOM 0 HB2 LYS A 62 -22.122 -8.883 -6.210 1.00 0.59 H new ATOM 0 HB3 LYS A 62 -20.545 -8.121 -6.245 1.00 0.59 H new ATOM 0 HG2 LYS A 62 -20.971 -9.276 -8.396 1.00 0.78 H new ATOM 0 HG3 LYS A 62 -19.631 -10.040 -7.564 1.00 0.78 H new ATOM 0 HD2 LYS A 62 -21.071 -11.846 -6.744 1.00 1.25 H new ATOM 0 HD3 LYS A 62 -22.513 -11.026 -7.308 1.00 1.25 H new ATOM 0 HE2 LYS A 62 -20.258 -11.831 -9.206 1.00 1.29 H new ATOM 0 HE3 LYS A 62 -21.588 -12.909 -8.832 1.00 1.29 H new ATOM 0 HZ1 LYS A 62 -22.278 -11.757 -10.729 1.00 2.14 H new ATOM 0 HZ2 LYS A 62 -23.083 -10.949 -9.471 1.00 2.14 H new ATOM 0 HZ3 LYS A 62 -21.696 -10.263 -10.171 1.00 2.14 H new ATOM 1039 N GLY A 63 -21.375 -8.645 -3.068 1.00 0.43 N ATOM 1040 CA GLY A 63 -21.186 -7.702 -1.928 1.00 0.38 C ATOM 1041 C GLY A 63 -20.430 -8.372 -0.778 1.00 0.40 C ATOM 1042 O GLY A 63 -19.556 -7.777 -0.179 1.00 0.39 O ATOM 0 H GLY A 63 -22.321 -9.012 -3.175 1.00 0.43 H new ATOM 0 HA2 GLY A 63 -20.636 -6.824 -2.266 1.00 0.38 H new ATOM 0 HA3 GLY A 63 -22.157 -7.354 -1.575 1.00 0.38 H new ATOM 1046 N GLU A 64 -20.738 -9.599 -0.464 1.00 0.46 N ATOM 1047 CA GLU A 64 -20.001 -10.274 0.648 1.00 0.51 C ATOM 1048 C GLU A 64 -18.540 -10.461 0.238 1.00 0.51 C ATOM 1049 O GLU A 64 -17.627 -10.149 0.979 1.00 0.50 O ATOM 1050 CB GLU A 64 -20.626 -11.632 0.968 1.00 0.60 C ATOM 1051 CG GLU A 64 -21.832 -11.849 0.070 1.00 0.65 C ATOM 1052 CD GLU A 64 -22.481 -13.195 0.391 1.00 0.80 C ATOM 1053 OE1 GLU A 64 -21.763 -14.094 0.799 1.00 1.25 O ATOM 1054 OE2 GLU A 64 -23.684 -13.306 0.223 1.00 1.40 O ATOM 0 H GLU A 64 -21.457 -10.160 -0.920 1.00 0.46 H new ATOM 0 HA GLU A 64 -20.061 -9.652 1.541 1.00 0.51 H new ATOM 0 HB2 GLU A 64 -19.896 -12.427 0.816 1.00 0.60 H new ATOM 0 HB3 GLU A 64 -20.925 -11.671 2.015 1.00 0.60 H new ATOM 0 HG2 GLU A 64 -22.553 -11.044 0.213 1.00 0.65 H new ATOM 0 HG3 GLU A 64 -21.527 -11.822 -0.976 1.00 0.65 H new ATOM 1061 N GLU A 65 -18.315 -10.965 -0.946 1.00 0.55 N ATOM 1062 CA GLU A 65 -16.918 -11.171 -1.415 1.00 0.58 C ATOM 1063 C GLU A 65 -16.194 -9.826 -1.411 1.00 0.52 C ATOM 1064 O GLU A 65 -15.025 -9.738 -1.094 1.00 0.53 O ATOM 1065 CB GLU A 65 -16.934 -11.740 -2.836 1.00 0.64 C ATOM 1066 CG GLU A 65 -17.525 -13.152 -2.815 1.00 0.72 C ATOM 1067 CD GLU A 65 -17.517 -13.731 -4.231 1.00 1.15 C ATOM 1068 OE1 GLU A 65 -16.445 -13.829 -4.804 1.00 1.69 O ATOM 1069 OE2 GLU A 65 -18.584 -14.067 -4.719 1.00 1.82 O ATOM 0 H GLU A 65 -19.040 -11.242 -1.608 1.00 0.55 H new ATOM 0 HA GLU A 65 -16.404 -11.870 -0.755 1.00 0.58 H new ATOM 0 HB2 GLU A 65 -17.524 -11.097 -3.490 1.00 0.64 H new ATOM 0 HB3 GLU A 65 -15.922 -11.764 -3.241 1.00 0.64 H new ATOM 0 HG2 GLU A 65 -16.946 -13.790 -2.147 1.00 0.72 H new ATOM 0 HG3 GLU A 65 -18.543 -13.125 -2.428 1.00 0.72 H new ATOM 1076 N LEU A 66 -16.887 -8.774 -1.752 1.00 0.50 N ATOM 1077 CA LEU A 66 -16.246 -7.432 -1.757 1.00 0.48 C ATOM 1078 C LEU A 66 -15.942 -7.024 -0.313 1.00 0.44 C ATOM 1079 O LEU A 66 -14.913 -6.448 -0.025 1.00 0.45 O ATOM 1080 CB LEU A 66 -17.203 -6.419 -2.401 1.00 0.46 C ATOM 1081 CG LEU A 66 -16.650 -4.995 -2.267 1.00 0.62 C ATOM 1082 CD1 LEU A 66 -15.250 -4.925 -2.876 1.00 0.77 C ATOM 1083 CD2 LEU A 66 -17.574 -4.027 -3.009 1.00 1.54 C ATOM 0 H LEU A 66 -17.869 -8.788 -2.027 1.00 0.50 H new ATOM 0 HA LEU A 66 -15.318 -7.458 -2.328 1.00 0.48 H new ATOM 0 HB2 LEU A 66 -17.345 -6.663 -3.454 1.00 0.46 H new ATOM 0 HB3 LEU A 66 -18.182 -6.481 -1.925 1.00 0.46 H new ATOM 0 HG LEU A 66 -16.597 -4.723 -1.213 1.00 0.62 H new ATOM 0 HD11 LEU A 66 -14.861 -3.911 -2.779 1.00 0.77 H new ATOM 0 HD12 LEU A 66 -14.591 -5.618 -2.354 1.00 0.77 H new ATOM 0 HD13 LEU A 66 -15.298 -5.195 -3.931 1.00 0.77 H new ATOM 0 HD21 LEU A 66 -17.187 -3.012 -2.918 1.00 1.54 H new ATOM 0 HD22 LEU A 66 -17.621 -4.304 -4.062 1.00 1.54 H new ATOM 0 HD23 LEU A 66 -18.573 -4.074 -2.576 1.00 1.54 H new ATOM 1095 N LEU A 67 -16.826 -7.331 0.598 1.00 0.43 N ATOM 1096 CA LEU A 67 -16.585 -6.977 2.025 1.00 0.43 C ATOM 1097 C LEU A 67 -15.267 -7.600 2.487 1.00 0.46 C ATOM 1098 O LEU A 67 -14.489 -6.985 3.190 1.00 0.48 O ATOM 1099 CB LEU A 67 -17.735 -7.514 2.887 1.00 0.46 C ATOM 1100 CG LEU A 67 -17.995 -6.562 4.059 1.00 0.61 C ATOM 1101 CD1 LEU A 67 -18.961 -5.459 3.621 1.00 0.89 C ATOM 1102 CD2 LEU A 67 -18.615 -7.345 5.219 1.00 1.39 C ATOM 0 H LEU A 67 -17.706 -7.813 0.414 1.00 0.43 H new ATOM 0 HA LEU A 67 -16.531 -5.893 2.127 1.00 0.43 H new ATOM 0 HB2 LEU A 67 -18.637 -7.617 2.283 1.00 0.46 H new ATOM 0 HB3 LEU A 67 -17.487 -8.507 3.262 1.00 0.46 H new ATOM 0 HG LEU A 67 -17.054 -6.114 4.378 1.00 0.61 H new ATOM 0 HD11 LEU A 67 -19.144 -4.783 4.456 1.00 0.89 H new ATOM 0 HD12 LEU A 67 -18.525 -4.901 2.792 1.00 0.89 H new ATOM 0 HD13 LEU A 67 -19.903 -5.906 3.302 1.00 0.89 H new ATOM 0 HD21 LEU A 67 -18.801 -6.671 6.055 1.00 1.39 H new ATOM 0 HD22 LEU A 67 -19.556 -7.791 4.896 1.00 1.39 H new ATOM 0 HD23 LEU A 67 -17.930 -8.132 5.534 1.00 1.39 H new ATOM 1114 N GLU A 68 -15.006 -8.818 2.092 1.00 0.50 N ATOM 1115 CA GLU A 68 -13.736 -9.477 2.505 1.00 0.55 C ATOM 1116 C GLU A 68 -12.570 -8.803 1.785 1.00 0.52 C ATOM 1117 O GLU A 68 -11.570 -8.462 2.383 1.00 0.52 O ATOM 1118 CB GLU A 68 -13.783 -10.959 2.128 1.00 0.62 C ATOM 1119 CG GLU A 68 -12.395 -11.576 2.308 1.00 1.34 C ATOM 1120 CD GLU A 68 -12.526 -13.093 2.463 1.00 1.80 C ATOM 1121 OE1 GLU A 68 -12.864 -13.530 3.551 1.00 2.26 O ATOM 1122 OE2 GLU A 68 -12.287 -13.791 1.491 1.00 2.26 O ATOM 0 H GLU A 68 -15.617 -9.383 1.502 1.00 0.50 H new ATOM 0 HA GLU A 68 -13.606 -9.385 3.583 1.00 0.55 H new ATOM 0 HB2 GLU A 68 -14.508 -11.481 2.752 1.00 0.62 H new ATOM 0 HB3 GLU A 68 -14.112 -11.072 1.095 1.00 0.62 H new ATOM 0 HG2 GLU A 68 -11.767 -11.341 1.449 1.00 1.34 H new ATOM 0 HG3 GLU A 68 -11.908 -11.151 3.185 1.00 1.34 H new ATOM 1129 N ASP A 69 -12.693 -8.598 0.503 1.00 0.51 N ATOM 1130 CA ASP A 69 -11.594 -7.934 -0.246 1.00 0.51 C ATOM 1131 C ASP A 69 -11.293 -6.591 0.417 1.00 0.46 C ATOM 1132 O ASP A 69 -10.151 -6.240 0.644 1.00 0.48 O ATOM 1133 CB ASP A 69 -12.027 -7.704 -1.695 1.00 0.53 C ATOM 1134 CG ASP A 69 -12.653 -8.983 -2.251 1.00 0.62 C ATOM 1135 OD1 ASP A 69 -12.441 -10.029 -1.658 1.00 1.13 O ATOM 1136 OD2 ASP A 69 -13.335 -8.897 -3.259 1.00 1.34 O ATOM 0 H ASP A 69 -13.505 -8.861 -0.056 1.00 0.51 H new ATOM 0 HA ASP A 69 -10.704 -8.563 -0.236 1.00 0.51 H new ATOM 0 HB2 ASP A 69 -12.744 -6.884 -1.745 1.00 0.53 H new ATOM 0 HB3 ASP A 69 -11.168 -7.414 -2.300 1.00 0.53 H new ATOM 1141 N ILE A 70 -12.311 -5.839 0.736 1.00 0.43 N ATOM 1142 CA ILE A 70 -12.088 -4.521 1.391 1.00 0.43 C ATOM 1143 C ILE A 70 -11.318 -4.724 2.700 1.00 0.42 C ATOM 1144 O ILE A 70 -10.432 -3.964 3.036 1.00 0.43 O ATOM 1145 CB ILE A 70 -13.438 -3.863 1.690 1.00 0.48 C ATOM 1146 CG1 ILE A 70 -13.937 -3.138 0.439 1.00 0.89 C ATOM 1147 CG2 ILE A 70 -13.277 -2.856 2.830 1.00 0.78 C ATOM 1148 CD1 ILE A 70 -15.419 -2.797 0.602 1.00 1.29 C ATOM 0 H ILE A 70 -13.288 -6.082 0.571 1.00 0.43 H new ATOM 0 HA ILE A 70 -11.511 -3.879 0.726 1.00 0.43 H new ATOM 0 HB ILE A 70 -14.157 -4.628 1.982 1.00 0.48 H new ATOM 0 HG12 ILE A 70 -13.359 -2.228 0.279 1.00 0.89 H new ATOM 0 HG13 ILE A 70 -13.792 -3.766 -0.440 1.00 0.89 H new ATOM 0 HG21 ILE A 70 -14.239 -2.389 3.041 1.00 0.78 H new ATOM 0 HG22 ILE A 70 -12.920 -3.370 3.722 1.00 0.78 H new ATOM 0 HG23 ILE A 70 -12.558 -2.090 2.540 1.00 0.78 H new ATOM 0 HD11 ILE A 70 -15.774 -2.280 -0.290 1.00 1.29 H new ATOM 0 HD12 ILE A 70 -15.990 -3.715 0.741 1.00 1.29 H new ATOM 0 HD13 ILE A 70 -15.551 -2.152 1.471 1.00 1.29 H new ATOM 1160 N ARG A 71 -11.644 -5.746 3.439 1.00 0.43 N ATOM 1161 CA ARG A 71 -10.925 -5.996 4.718 1.00 0.47 C ATOM 1162 C ARG A 71 -9.427 -6.179 4.445 1.00 0.48 C ATOM 1163 O ARG A 71 -8.606 -5.400 4.883 1.00 0.51 O ATOM 1164 CB ARG A 71 -11.484 -7.258 5.383 1.00 0.51 C ATOM 1165 CG ARG A 71 -10.669 -7.583 6.636 1.00 0.81 C ATOM 1166 CD ARG A 71 -11.536 -8.369 7.623 1.00 1.02 C ATOM 1167 NE ARG A 71 -10.673 -9.277 8.430 1.00 1.58 N ATOM 1168 CZ ARG A 71 -11.202 -10.295 9.056 1.00 2.24 C ATOM 1169 NH1 ARG A 71 -12.485 -10.517 8.974 1.00 2.68 N ATOM 1170 NH2 ARG A 71 -10.446 -11.090 9.763 1.00 3.04 N ATOM 0 H ARG A 71 -12.377 -6.419 3.213 1.00 0.43 H new ATOM 0 HA ARG A 71 -11.067 -5.143 5.382 1.00 0.47 H new ATOM 0 HB2 ARG A 71 -12.531 -7.109 5.647 1.00 0.51 H new ATOM 0 HB3 ARG A 71 -11.447 -8.095 4.686 1.00 0.51 H new ATOM 0 HG2 ARG A 71 -9.787 -8.165 6.368 1.00 0.81 H new ATOM 0 HG3 ARG A 71 -10.315 -6.663 7.100 1.00 0.81 H new ATOM 0 HD2 ARG A 71 -12.073 -7.683 8.278 1.00 1.02 H new ATOM 0 HD3 ARG A 71 -12.286 -8.947 7.084 1.00 1.02 H new ATOM 0 HE ARG A 71 -9.670 -9.104 8.494 1.00 1.58 H new ATOM 0 HH11 ARG A 71 -13.076 -9.896 8.421 1.00 2.68 H new ATOM 0 HH12 ARG A 71 -12.897 -11.312 9.463 1.00 2.68 H new ATOM 0 HH21 ARG A 71 -9.443 -10.917 9.827 1.00 3.04 H new ATOM 0 HH22 ARG A 71 -10.858 -11.885 10.252 1.00 3.04 H new ATOM 1184 N LYS A 72 -9.072 -7.217 3.736 1.00 0.49 N ATOM 1185 CA LYS A 72 -7.632 -7.488 3.441 1.00 0.52 C ATOM 1186 C LYS A 72 -6.902 -6.210 3.008 1.00 0.49 C ATOM 1187 O LYS A 72 -6.005 -5.746 3.683 1.00 0.50 O ATOM 1188 CB LYS A 72 -7.536 -8.523 2.319 1.00 0.57 C ATOM 1189 CG LYS A 72 -8.493 -9.681 2.606 1.00 0.69 C ATOM 1190 CD LYS A 72 -7.764 -11.010 2.398 1.00 0.93 C ATOM 1191 CE LYS A 72 -8.719 -12.170 2.687 1.00 1.44 C ATOM 1192 NZ LYS A 72 -8.325 -13.353 1.872 1.00 1.87 N ATOM 0 H LYS A 72 -9.724 -7.896 3.344 1.00 0.49 H new ATOM 0 HA LYS A 72 -7.160 -7.863 4.349 1.00 0.52 H new ATOM 0 HB2 LYS A 72 -7.784 -8.062 1.363 1.00 0.57 H new ATOM 0 HB3 LYS A 72 -6.514 -8.894 2.239 1.00 0.57 H new ATOM 0 HG2 LYS A 72 -8.865 -9.614 3.628 1.00 0.69 H new ATOM 0 HG3 LYS A 72 -9.359 -9.622 1.947 1.00 0.69 H new ATOM 0 HD2 LYS A 72 -7.394 -11.077 1.375 1.00 0.93 H new ATOM 0 HD3 LYS A 72 -6.897 -11.067 3.056 1.00 0.93 H new ATOM 0 HE2 LYS A 72 -8.693 -12.421 3.747 1.00 1.44 H new ATOM 0 HE3 LYS A 72 -9.743 -11.879 2.453 1.00 1.44 H new ATOM 0 HZ1 LYS A 72 -8.974 -14.142 2.068 1.00 1.87 H new ATOM 0 HZ2 LYS A 72 -8.371 -13.110 0.862 1.00 1.87 H new ATOM 0 HZ3 LYS A 72 -7.354 -13.635 2.116 1.00 1.87 H new ATOM 1206 N PHE A 73 -7.260 -5.656 1.878 1.00 0.48 N ATOM 1207 CA PHE A 73 -6.572 -4.422 1.385 1.00 0.47 C ATOM 1208 C PHE A 73 -6.353 -3.447 2.541 1.00 0.46 C ATOM 1209 O PHE A 73 -5.247 -3.046 2.824 1.00 0.46 O ATOM 1210 CB PHE A 73 -7.436 -3.760 0.312 1.00 0.45 C ATOM 1211 CG PHE A 73 -7.648 -2.303 0.650 1.00 0.46 C ATOM 1212 CD1 PHE A 73 -6.619 -1.377 0.443 1.00 1.20 C ATOM 1213 CD2 PHE A 73 -8.876 -1.877 1.167 1.00 1.35 C ATOM 1214 CE1 PHE A 73 -6.820 -0.026 0.756 1.00 1.27 C ATOM 1215 CE2 PHE A 73 -9.077 -0.527 1.481 1.00 1.34 C ATOM 1216 CZ PHE A 73 -8.048 0.398 1.276 1.00 0.58 C ATOM 0 H PHE A 73 -8.002 -6.006 1.272 1.00 0.48 H new ATOM 0 HA PHE A 73 -5.604 -4.693 0.963 1.00 0.47 H new ATOM 0 HB2 PHE A 73 -6.955 -3.850 -0.662 1.00 0.45 H new ATOM 0 HB3 PHE A 73 -8.397 -4.269 0.241 1.00 0.45 H new ATOM 0 HD1 PHE A 73 -5.671 -1.704 0.042 1.00 1.20 H new ATOM 0 HD2 PHE A 73 -9.671 -2.591 1.324 1.00 1.35 H new ATOM 0 HE1 PHE A 73 -6.026 0.689 0.596 1.00 1.27 H new ATOM 0 HE2 PHE A 73 -10.026 -0.201 1.881 1.00 1.34 H new ATOM 0 HZ PHE A 73 -8.201 1.439 1.519 1.00 0.58 H new ATOM 1226 N ASN A 74 -7.398 -3.076 3.212 1.00 0.47 N ATOM 1227 CA ASN A 74 -7.237 -2.135 4.354 1.00 0.48 C ATOM 1228 C ASN A 74 -6.350 -2.795 5.407 1.00 0.50 C ATOM 1229 O ASN A 74 -5.600 -2.142 6.102 1.00 0.52 O ATOM 1230 CB ASN A 74 -8.604 -1.812 4.961 1.00 0.48 C ATOM 1231 CG ASN A 74 -8.425 -0.859 6.145 1.00 0.67 C ATOM 1232 OD1 ASN A 74 -8.329 -1.290 7.277 1.00 1.58 O ATOM 1233 ND2 ASN A 74 -8.375 0.426 5.930 1.00 1.06 N ATOM 0 H ASN A 74 -8.354 -3.379 3.024 1.00 0.47 H new ATOM 0 HA ASN A 74 -6.780 -1.208 4.007 1.00 0.48 H new ATOM 0 HB2 ASN A 74 -9.249 -1.358 4.209 1.00 0.48 H new ATOM 0 HB3 ASN A 74 -9.094 -2.729 5.289 1.00 0.48 H new ATOM 0 HD21 ASN A 74 -8.255 1.070 6.712 1.00 1.06 H new ATOM 0 HD22 ASN A 74 -8.456 0.788 4.980 1.00 1.06 H new ATOM 1240 N GLU A 75 -6.443 -4.087 5.535 1.00 0.51 N ATOM 1241 CA GLU A 75 -5.624 -4.797 6.547 1.00 0.55 C ATOM 1242 C GLU A 75 -4.163 -4.852 6.091 1.00 0.55 C ATOM 1243 O GLU A 75 -3.255 -4.854 6.900 1.00 0.65 O ATOM 1244 CB GLU A 75 -6.176 -6.212 6.710 1.00 0.59 C ATOM 1245 CG GLU A 75 -5.823 -6.758 8.095 1.00 0.87 C ATOM 1246 CD GLU A 75 -6.466 -8.135 8.274 1.00 1.22 C ATOM 1247 OE1 GLU A 75 -7.680 -8.215 8.195 1.00 1.77 O ATOM 1248 OE2 GLU A 75 -5.732 -9.086 8.488 1.00 1.79 O ATOM 0 H GLU A 75 -7.055 -4.683 4.978 1.00 0.51 H new ATOM 0 HA GLU A 75 -5.668 -4.270 7.500 1.00 0.55 H new ATOM 0 HB2 GLU A 75 -7.258 -6.206 6.578 1.00 0.59 H new ATOM 0 HB3 GLU A 75 -5.764 -6.862 5.938 1.00 0.59 H new ATOM 0 HG2 GLU A 75 -4.741 -6.832 8.205 1.00 0.87 H new ATOM 0 HG3 GLU A 75 -6.176 -6.076 8.868 1.00 0.87 H new ATOM 1255 N MET A 76 -3.919 -4.884 4.806 1.00 0.52 N ATOM 1256 CA MET A 76 -2.517 -4.925 4.309 1.00 0.51 C ATOM 1257 C MET A 76 -2.076 -3.504 3.965 1.00 0.51 C ATOM 1258 O MET A 76 -0.917 -3.156 4.068 1.00 0.52 O ATOM 1259 CB MET A 76 -2.457 -5.793 3.049 1.00 0.50 C ATOM 1260 CG MET A 76 -2.607 -7.267 3.434 1.00 0.52 C ATOM 1261 SD MET A 76 -1.027 -8.116 3.197 1.00 0.55 S ATOM 1262 CE MET A 76 -1.517 -9.704 3.914 1.00 0.65 C ATOM 0 H MET A 76 -4.635 -4.883 4.080 1.00 0.52 H new ATOM 0 HA MET A 76 -1.861 -5.343 5.072 1.00 0.51 H new ATOM 0 HB2 MET A 76 -3.249 -5.505 2.358 1.00 0.50 H new ATOM 0 HB3 MET A 76 -1.510 -5.636 2.532 1.00 0.50 H new ATOM 0 HG2 MET A 76 -2.925 -7.352 4.473 1.00 0.52 H new ATOM 0 HG3 MET A 76 -3.379 -7.736 2.825 1.00 0.52 H new ATOM 0 HE1 MET A 76 -0.677 -10.397 3.872 1.00 0.65 H new ATOM 0 HE2 MET A 76 -1.815 -9.558 4.952 1.00 0.65 H new ATOM 0 HE3 MET A 76 -2.355 -10.115 3.350 1.00 0.65 H new ATOM 1272 N ARG A 77 -3.000 -2.687 3.538 1.00 0.50 N ATOM 1273 CA ARG A 77 -2.652 -1.289 3.161 1.00 0.50 C ATOM 1274 C ARG A 77 -2.033 -0.542 4.346 1.00 0.51 C ATOM 1275 O ARG A 77 -1.017 0.110 4.209 1.00 0.52 O ATOM 1276 CB ARG A 77 -3.903 -0.543 2.695 1.00 0.49 C ATOM 1277 CG ARG A 77 -3.512 0.862 2.220 1.00 0.52 C ATOM 1278 CD ARG A 77 -4.218 1.909 3.084 1.00 0.54 C ATOM 1279 NE ARG A 77 -3.723 3.268 2.723 1.00 0.85 N ATOM 1280 CZ ARG A 77 -3.936 4.274 3.525 1.00 1.35 C ATOM 1281 NH1 ARG A 77 -4.588 4.092 4.642 1.00 1.85 N ATOM 1282 NH2 ARG A 77 -3.499 5.464 3.211 1.00 1.84 N ATOM 0 H ARG A 77 -3.985 -2.930 3.434 1.00 0.50 H new ATOM 0 HA ARG A 77 -1.925 -1.330 2.350 1.00 0.50 H new ATOM 0 HB2 ARG A 77 -4.386 -1.091 1.886 1.00 0.49 H new ATOM 0 HB3 ARG A 77 -4.624 -0.476 3.510 1.00 0.49 H new ATOM 0 HG2 ARG A 77 -2.432 0.991 2.284 1.00 0.52 H new ATOM 0 HG3 ARG A 77 -3.787 0.993 1.174 1.00 0.52 H new ATOM 0 HD2 ARG A 77 -5.296 1.852 2.935 1.00 0.54 H new ATOM 0 HD3 ARG A 77 -4.031 1.711 4.139 1.00 0.54 H new ATOM 0 HE ARG A 77 -3.218 3.411 1.849 1.00 0.85 H new ATOM 0 HH11 ARG A 77 -4.931 3.163 4.887 1.00 1.85 H new ATOM 0 HH12 ARG A 77 -4.755 4.879 5.269 1.00 1.85 H new ATOM 0 HH21 ARG A 77 -2.991 5.607 2.338 1.00 1.84 H new ATOM 0 HH22 ARG A 77 -3.666 6.251 3.839 1.00 1.84 H new ATOM 1296 N LYS A 78 -2.618 -0.633 5.511 1.00 0.51 N ATOM 1297 CA LYS A 78 -2.025 0.074 6.670 1.00 0.52 C ATOM 1298 C LYS A 78 -0.719 -0.617 7.027 1.00 0.53 C ATOM 1299 O LYS A 78 0.191 -0.014 7.555 1.00 0.55 O ATOM 1300 CB LYS A 78 -2.991 0.070 7.866 1.00 0.52 C ATOM 1301 CG LYS A 78 -3.345 -1.361 8.291 1.00 0.90 C ATOM 1302 CD LYS A 78 -3.209 -1.482 9.810 1.00 1.04 C ATOM 1303 CE LYS A 78 -4.115 -0.450 10.486 1.00 1.45 C ATOM 1304 NZ LYS A 78 -4.871 -1.097 11.595 1.00 2.15 N ATOM 0 H LYS A 78 -3.470 -1.160 5.704 1.00 0.51 H new ATOM 0 HA LYS A 78 -1.836 1.116 6.413 1.00 0.52 H new ATOM 0 HB2 LYS A 78 -2.538 0.599 8.704 1.00 0.52 H new ATOM 0 HB3 LYS A 78 -3.901 0.609 7.603 1.00 0.52 H new ATOM 0 HG2 LYS A 78 -4.363 -1.603 7.984 1.00 0.90 H new ATOM 0 HG3 LYS A 78 -2.685 -2.074 7.797 1.00 0.90 H new ATOM 0 HD2 LYS A 78 -3.481 -2.487 10.132 1.00 1.04 H new ATOM 0 HD3 LYS A 78 -2.173 -1.322 10.107 1.00 1.04 H new ATOM 0 HE2 LYS A 78 -3.517 0.375 10.873 1.00 1.45 H new ATOM 0 HE3 LYS A 78 -4.808 -0.028 9.758 1.00 1.45 H new ATOM 0 HZ1 LYS A 78 -5.486 -0.394 12.053 1.00 2.15 H new ATOM 0 HZ2 LYS A 78 -5.453 -1.870 11.214 1.00 2.15 H new ATOM 0 HZ3 LYS A 78 -4.203 -1.479 12.294 1.00 2.15 H new ATOM 1318 N ASN A 79 -0.603 -1.874 6.701 1.00 0.52 N ATOM 1319 CA ASN A 79 0.663 -2.595 6.991 1.00 0.53 C ATOM 1320 C ASN A 79 1.763 -1.990 6.129 1.00 0.54 C ATOM 1321 O ASN A 79 2.763 -1.511 6.623 1.00 0.54 O ATOM 1322 CB ASN A 79 0.507 -4.079 6.656 1.00 0.54 C ATOM 1323 CG ASN A 79 1.281 -4.915 7.676 1.00 0.60 C ATOM 1324 OD1 ASN A 79 2.476 -5.098 7.551 1.00 1.17 O ATOM 1325 ND2 ASN A 79 0.645 -5.437 8.689 1.00 1.14 N ATOM 0 H ASN A 79 -1.328 -2.430 6.248 1.00 0.52 H new ATOM 0 HA ASN A 79 0.913 -2.500 8.048 1.00 0.53 H new ATOM 0 HB2 ASN A 79 -0.547 -4.357 6.667 1.00 0.54 H new ATOM 0 HB3 ASN A 79 0.878 -4.277 5.651 1.00 0.54 H new ATOM 0 HD21 ASN A 79 1.151 -5.998 9.375 1.00 1.14 H new ATOM 0 HD22 ASN A 79 -0.358 -5.284 8.795 1.00 1.14 H new ATOM 1332 N MET A 80 1.580 -1.998 4.838 1.00 0.56 N ATOM 1333 CA MET A 80 2.611 -1.414 3.949 1.00 0.58 C ATOM 1334 C MET A 80 2.949 -0.011 4.458 1.00 0.57 C ATOM 1335 O MET A 80 4.097 0.304 4.679 1.00 0.56 O ATOM 1336 CB MET A 80 2.085 -1.366 2.505 1.00 0.60 C ATOM 1337 CG MET A 80 2.806 -0.270 1.712 1.00 0.64 C ATOM 1338 SD MET A 80 1.959 1.312 1.948 1.00 1.38 S ATOM 1339 CE MET A 80 3.188 2.354 1.122 1.00 1.16 C ATOM 0 H MET A 80 0.762 -2.383 4.365 1.00 0.56 H new ATOM 0 HA MET A 80 3.513 -2.025 3.956 1.00 0.58 H new ATOM 0 HB2 MET A 80 2.236 -2.332 2.023 1.00 0.60 H new ATOM 0 HB3 MET A 80 1.012 -1.176 2.508 1.00 0.60 H new ATOM 0 HG2 MET A 80 3.842 -0.191 2.041 1.00 0.64 H new ATOM 0 HG3 MET A 80 2.827 -0.528 0.653 1.00 0.64 H new ATOM 0 HE1 MET A 80 3.147 3.362 1.535 1.00 1.16 H new ATOM 0 HE2 MET A 80 4.183 1.937 1.279 1.00 1.16 H new ATOM 0 HE3 MET A 80 2.975 2.391 0.054 1.00 1.16 H new ATOM 1349 N ASP A 81 1.973 0.837 4.662 1.00 0.58 N ATOM 1350 CA ASP A 81 2.274 2.204 5.175 1.00 0.58 C ATOM 1351 C ASP A 81 3.010 2.113 6.515 1.00 0.56 C ATOM 1352 O ASP A 81 3.975 2.814 6.747 1.00 0.56 O ATOM 1353 CB ASP A 81 0.960 2.967 5.359 1.00 0.59 C ATOM 1354 CG ASP A 81 1.131 4.408 4.871 1.00 0.61 C ATOM 1355 OD1 ASP A 81 2.217 4.940 5.028 1.00 1.12 O ATOM 1356 OD2 ASP A 81 0.174 4.953 4.348 1.00 1.22 O ATOM 0 H ASP A 81 0.986 0.642 4.496 1.00 0.58 H new ATOM 0 HA ASP A 81 2.910 2.728 4.461 1.00 0.58 H new ATOM 0 HB2 ASP A 81 0.162 2.476 4.803 1.00 0.59 H new ATOM 0 HB3 ASP A 81 0.668 2.960 6.409 1.00 0.59 H new ATOM 1361 N GLN A 82 2.588 1.237 7.391 1.00 0.56 N ATOM 1362 CA GLN A 82 3.297 1.093 8.693 1.00 0.54 C ATOM 1363 C GLN A 82 4.734 0.690 8.380 1.00 0.53 C ATOM 1364 O GLN A 82 5.694 1.245 8.882 1.00 0.55 O ATOM 1365 CB GLN A 82 2.631 -0.019 9.511 1.00 0.55 C ATOM 1366 CG GLN A 82 1.239 0.418 9.955 1.00 1.12 C ATOM 1367 CD GLN A 82 1.273 0.809 11.433 1.00 0.77 C ATOM 1368 OE1 GLN A 82 1.609 1.927 11.769 1.00 1.13 O ATOM 1369 NE2 GLN A 82 0.940 -0.070 12.337 1.00 1.43 N ATOM 0 H GLN A 82 1.787 0.619 7.260 1.00 0.56 H new ATOM 0 HA GLN A 82 3.264 2.023 9.261 1.00 0.54 H new ATOM 0 HB2 GLN A 82 2.562 -0.928 8.914 1.00 0.55 H new ATOM 0 HB3 GLN A 82 3.242 -0.255 10.382 1.00 0.55 H new ATOM 0 HG2 GLN A 82 0.902 1.262 9.353 1.00 1.12 H new ATOM 0 HG3 GLN A 82 0.525 -0.391 9.798 1.00 1.12 H new ATOM 0 HE21 GLN A 82 0.658 -1.009 12.056 1.00 1.43 H new ATOM 0 HE22 GLN A 82 0.962 0.181 13.325 1.00 1.43 H new ATOM 1378 N LEU A 83 4.857 -0.272 7.521 1.00 0.51 N ATOM 1379 CA LEU A 83 6.197 -0.746 7.109 1.00 0.51 C ATOM 1380 C LEU A 83 6.902 0.404 6.389 1.00 0.52 C ATOM 1381 O LEU A 83 8.050 0.704 6.650 1.00 0.53 O ATOM 1382 CB LEU A 83 6.024 -1.951 6.188 1.00 0.49 C ATOM 1383 CG LEU A 83 5.398 -3.092 7.004 1.00 0.47 C ATOM 1384 CD1 LEU A 83 4.930 -4.201 6.068 1.00 0.52 C ATOM 1385 CD2 LEU A 83 6.416 -3.659 8.006 1.00 0.48 C ATOM 0 H LEU A 83 4.075 -0.757 7.081 1.00 0.51 H new ATOM 0 HA LEU A 83 6.798 -1.051 7.966 1.00 0.51 H new ATOM 0 HB2 LEU A 83 5.387 -1.694 5.342 1.00 0.49 H new ATOM 0 HB3 LEU A 83 6.987 -2.259 5.780 1.00 0.49 H new ATOM 0 HG LEU A 83 4.545 -2.697 7.555 1.00 0.47 H new ATOM 0 HD11 LEU A 83 4.487 -5.007 6.652 1.00 0.52 H new ATOM 0 HD12 LEU A 83 4.187 -3.804 5.376 1.00 0.52 H new ATOM 0 HD13 LEU A 83 5.781 -4.586 5.506 1.00 0.52 H new ATOM 0 HD21 LEU A 83 5.955 -4.466 8.575 1.00 0.48 H new ATOM 0 HD22 LEU A 83 7.282 -4.043 7.467 1.00 0.48 H new ATOM 0 HD23 LEU A 83 6.734 -2.870 8.687 1.00 0.48 H new ATOM 1397 N LYS A 84 6.210 1.069 5.503 1.00 0.53 N ATOM 1398 CA LYS A 84 6.821 2.221 4.786 1.00 0.56 C ATOM 1399 C LYS A 84 7.453 3.164 5.812 1.00 0.56 C ATOM 1400 O LYS A 84 8.576 3.600 5.665 1.00 0.57 O ATOM 1401 CB LYS A 84 5.741 2.975 4.007 1.00 0.57 C ATOM 1402 CG LYS A 84 6.402 3.992 3.073 1.00 0.58 C ATOM 1403 CD LYS A 84 5.743 5.362 3.256 1.00 0.75 C ATOM 1404 CE LYS A 84 6.388 6.371 2.301 1.00 0.77 C ATOM 1405 NZ LYS A 84 6.490 7.698 2.971 1.00 1.42 N ATOM 0 H LYS A 84 5.245 0.862 5.246 1.00 0.53 H new ATOM 0 HA LYS A 84 7.580 1.860 4.092 1.00 0.56 H new ATOM 0 HB2 LYS A 84 5.137 2.274 3.430 1.00 0.57 H new ATOM 0 HB3 LYS A 84 5.067 3.483 4.697 1.00 0.57 H new ATOM 0 HG2 LYS A 84 7.469 4.059 3.288 1.00 0.58 H new ATOM 0 HG3 LYS A 84 6.305 3.666 2.037 1.00 0.58 H new ATOM 0 HD2 LYS A 84 4.673 5.292 3.060 1.00 0.75 H new ATOM 0 HD3 LYS A 84 5.856 5.697 4.287 1.00 0.75 H new ATOM 0 HE2 LYS A 84 7.378 6.025 2.005 1.00 0.77 H new ATOM 0 HE3 LYS A 84 5.794 6.456 1.391 1.00 0.77 H new ATOM 0 HZ1 LYS A 84 6.928 8.382 2.322 1.00 1.42 H new ATOM 0 HZ2 LYS A 84 5.539 8.029 3.233 1.00 1.42 H new ATOM 0 HZ3 LYS A 84 7.074 7.611 3.827 1.00 1.42 H new ATOM 1419 N GLU A 85 6.730 3.484 6.853 1.00 0.55 N ATOM 1420 CA GLU A 85 7.277 4.400 7.892 1.00 0.55 C ATOM 1421 C GLU A 85 8.521 3.776 8.525 1.00 0.57 C ATOM 1422 O GLU A 85 9.470 4.459 8.854 1.00 0.57 O ATOM 1423 CB GLU A 85 6.223 4.627 8.980 1.00 0.55 C ATOM 1424 CG GLU A 85 6.920 5.015 10.287 1.00 0.56 C ATOM 1425 CD GLU A 85 5.921 5.712 11.212 1.00 0.56 C ATOM 1426 OE1 GLU A 85 5.228 6.601 10.742 1.00 1.12 O ATOM 1427 OE2 GLU A 85 5.865 5.347 12.374 1.00 1.18 O ATOM 0 H GLU A 85 5.783 3.149 7.027 1.00 0.55 H new ATOM 0 HA GLU A 85 7.540 5.351 7.428 1.00 0.55 H new ATOM 0 HB2 GLU A 85 5.533 5.414 8.675 1.00 0.55 H new ATOM 0 HB3 GLU A 85 5.632 3.723 9.124 1.00 0.55 H new ATOM 0 HG2 GLU A 85 7.324 4.127 10.774 1.00 0.56 H new ATOM 0 HG3 GLU A 85 7.762 5.676 10.080 1.00 0.56 H new ATOM 1434 N LYS A 86 8.534 2.485 8.680 1.00 0.58 N ATOM 1435 CA LYS A 86 9.729 1.823 9.273 1.00 0.61 C ATOM 1436 C LYS A 86 10.905 2.012 8.317 1.00 0.62 C ATOM 1437 O LYS A 86 12.024 2.255 8.722 1.00 0.63 O ATOM 1438 CB LYS A 86 9.447 0.327 9.453 1.00 0.62 C ATOM 1439 CG LYS A 86 9.223 -0.001 10.934 1.00 0.65 C ATOM 1440 CD LYS A 86 10.575 -0.158 11.634 1.00 0.83 C ATOM 1441 CE LYS A 86 10.351 -0.354 13.134 1.00 1.01 C ATOM 1442 NZ LYS A 86 9.582 -1.610 13.361 1.00 1.24 N ATOM 0 H LYS A 86 7.771 1.858 8.423 1.00 0.58 H new ATOM 0 HA LYS A 86 9.961 2.260 10.244 1.00 0.61 H new ATOM 0 HB2 LYS A 86 8.568 0.044 8.874 1.00 0.62 H new ATOM 0 HB3 LYS A 86 10.283 -0.256 9.067 1.00 0.62 H new ATOM 0 HG2 LYS A 86 8.646 0.792 11.409 1.00 0.65 H new ATOM 0 HG3 LYS A 86 8.643 -0.919 11.030 1.00 0.65 H new ATOM 0 HD2 LYS A 86 11.114 -1.011 11.221 1.00 0.83 H new ATOM 0 HD3 LYS A 86 11.192 0.724 11.459 1.00 0.83 H new ATOM 0 HE2 LYS A 86 11.309 -0.402 13.652 1.00 1.01 H new ATOM 0 HE3 LYS A 86 9.808 0.497 13.546 1.00 1.01 H new ATOM 0 HZ1 LYS A 86 9.646 -1.880 14.363 1.00 1.24 H new ATOM 0 HZ2 LYS A 86 8.585 -1.458 13.106 1.00 1.24 H new ATOM 0 HZ3 LYS A 86 9.978 -2.371 12.772 1.00 1.24 H new ATOM 1456 N ILE A 87 10.646 1.905 7.043 1.00 0.64 N ATOM 1457 CA ILE A 87 11.725 2.082 6.037 1.00 0.67 C ATOM 1458 C ILE A 87 12.274 3.502 6.134 1.00 0.65 C ATOM 1459 O ILE A 87 13.465 3.708 6.261 1.00 0.63 O ATOM 1460 CB ILE A 87 11.150 1.853 4.635 1.00 0.71 C ATOM 1461 CG1 ILE A 87 10.742 0.385 4.484 1.00 0.79 C ATOM 1462 CG2 ILE A 87 12.197 2.196 3.574 1.00 0.80 C ATOM 1463 CD1 ILE A 87 9.903 0.217 3.216 1.00 0.84 C ATOM 0 H ILE A 87 9.725 1.701 6.655 1.00 0.64 H new ATOM 0 HA ILE A 87 12.526 1.367 6.225 1.00 0.67 H new ATOM 0 HB ILE A 87 10.280 2.495 4.501 1.00 0.71 H new ATOM 0 HG12 ILE A 87 11.629 -0.247 4.432 1.00 0.79 H new ATOM 0 HG13 ILE A 87 10.172 0.063 5.356 1.00 0.79 H new ATOM 0 HG21 ILE A 87 11.778 2.030 2.582 1.00 0.80 H new ATOM 0 HG22 ILE A 87 12.488 3.242 3.674 1.00 0.80 H new ATOM 0 HG23 ILE A 87 13.073 1.561 3.709 1.00 0.80 H new ATOM 0 HD11 ILE A 87 9.612 -0.828 3.108 1.00 0.84 H new ATOM 0 HD12 ILE A 87 9.009 0.837 3.286 1.00 0.84 H new ATOM 0 HD13 ILE A 87 10.489 0.522 2.349 1.00 0.84 H new ATOM 1475 N ASN A 88 11.422 4.488 6.080 1.00 0.66 N ATOM 1476 CA ASN A 88 11.902 5.891 6.172 1.00 0.65 C ATOM 1477 C ASN A 88 12.641 6.113 7.489 1.00 0.62 C ATOM 1478 O ASN A 88 13.548 6.906 7.566 1.00 0.62 O ATOM 1479 CB ASN A 88 10.705 6.842 6.111 1.00 0.69 C ATOM 1480 CG ASN A 88 10.436 7.409 7.506 1.00 1.66 C ATOM 1481 OD1 ASN A 88 9.587 6.805 8.292 1.00 2.38 O flip ATOM 1482 ND2 ASN A 88 11.004 8.414 7.886 1.00 2.46 N flip ATOM 0 H ASN A 88 10.413 4.380 5.976 1.00 0.66 H new ATOM 0 HA ASN A 88 12.580 6.085 5.341 1.00 0.65 H new ATOM 0 HB2 ASN A 88 10.905 7.652 5.409 1.00 0.69 H new ATOM 0 HB3 ASN A 88 9.825 6.314 5.745 1.00 0.69 H new ATOM 0 HD21 ASN A 88 11.668 8.887 7.273 1.00 2.46 H new ATOM 0 HD22 ASN A 88 10.817 8.784 8.818 1.00 2.46 H new ATOM 1489 N SER A 89 12.245 5.443 8.535 1.00 0.61 N ATOM 1490 CA SER A 89 12.917 5.656 9.847 1.00 0.61 C ATOM 1491 C SER A 89 14.366 5.150 9.833 1.00 0.63 C ATOM 1492 O SER A 89 15.266 5.828 10.287 1.00 0.71 O ATOM 1493 CB SER A 89 12.139 4.915 10.935 1.00 0.62 C ATOM 1494 OG SER A 89 12.597 3.571 11.007 1.00 1.29 O ATOM 0 H SER A 89 11.488 4.760 8.539 1.00 0.61 H new ATOM 0 HA SER A 89 12.935 6.727 10.047 1.00 0.61 H new ATOM 0 HB2 SER A 89 12.275 5.410 11.897 1.00 0.62 H new ATOM 0 HB3 SER A 89 11.072 4.936 10.714 1.00 0.62 H new ATOM 0 HG SER A 89 12.169 3.041 10.302 1.00 1.29 H new ATOM 1500 N VAL A 90 14.606 3.962 9.345 1.00 0.58 N ATOM 1501 CA VAL A 90 15.995 3.413 9.337 1.00 0.60 C ATOM 1502 C VAL A 90 16.804 3.986 8.177 1.00 0.59 C ATOM 1503 O VAL A 90 17.944 4.379 8.329 1.00 0.63 O ATOM 1504 CB VAL A 90 15.918 1.897 9.186 1.00 0.61 C ATOM 1505 CG1 VAL A 90 17.264 1.270 9.560 1.00 0.52 C ATOM 1506 CG2 VAL A 90 14.828 1.348 10.109 1.00 0.81 C ATOM 0 H VAL A 90 13.897 3.345 8.950 1.00 0.58 H new ATOM 0 HA VAL A 90 16.487 3.687 10.270 1.00 0.60 H new ATOM 0 HB VAL A 90 15.681 1.650 8.151 1.00 0.61 H new ATOM 0 HG11 VAL A 90 17.204 0.187 9.451 1.00 0.52 H new ATOM 0 HG12 VAL A 90 18.042 1.659 8.902 1.00 0.52 H new ATOM 0 HG13 VAL A 90 17.506 1.517 10.594 1.00 0.52 H new ATOM 0 HG21 VAL A 90 14.772 0.265 10.002 1.00 0.81 H new ATOM 0 HG22 VAL A 90 15.066 1.599 11.143 1.00 0.81 H new ATOM 0 HG23 VAL A 90 13.868 1.789 9.841 1.00 0.81 H new ATOM 1516 N LEU A 91 16.213 4.039 7.020 1.00 0.57 N ATOM 1517 CA LEU A 91 16.923 4.585 5.838 1.00 0.61 C ATOM 1518 C LEU A 91 16.912 6.102 5.933 1.00 0.67 C ATOM 1519 O LEU A 91 17.655 6.779 5.254 1.00 0.70 O ATOM 1520 CB LEU A 91 16.182 4.138 4.569 1.00 0.62 C ATOM 1521 CG LEU A 91 16.766 4.823 3.327 1.00 0.72 C ATOM 1522 CD1 LEU A 91 18.271 4.568 3.248 1.00 0.91 C ATOM 1523 CD2 LEU A 91 16.094 4.250 2.076 1.00 0.97 C ATOM 0 H LEU A 91 15.259 3.724 6.842 1.00 0.57 H new ATOM 0 HA LEU A 91 17.951 4.225 5.803 1.00 0.61 H new ATOM 0 HB2 LEU A 91 16.256 3.056 4.462 1.00 0.62 H new ATOM 0 HB3 LEU A 91 15.122 4.378 4.658 1.00 0.62 H new ATOM 0 HG LEU A 91 16.587 5.896 3.391 1.00 0.72 H new ATOM 0 HD11 LEU A 91 18.677 5.058 2.363 1.00 0.91 H new ATOM 0 HD12 LEU A 91 18.755 4.968 4.139 1.00 0.91 H new ATOM 0 HD13 LEU A 91 18.456 3.496 3.186 1.00 0.91 H new ATOM 0 HD21 LEU A 91 16.504 4.733 1.189 1.00 0.97 H new ATOM 0 HD22 LEU A 91 16.278 3.177 2.023 1.00 0.97 H new ATOM 0 HD23 LEU A 91 15.020 4.432 2.124 1.00 0.97 H new ATOM 1535 N SER A 92 16.092 6.639 6.798 1.00 0.71 N ATOM 1536 CA SER A 92 16.024 8.130 6.965 1.00 0.81 C ATOM 1537 C SER A 92 15.654 8.805 5.628 1.00 0.88 C ATOM 1538 O SER A 92 15.127 9.898 5.607 1.00 1.04 O ATOM 1539 CB SER A 92 17.378 8.656 7.443 1.00 0.85 C ATOM 1540 OG SER A 92 17.302 8.947 8.832 1.00 0.94 O ATOM 0 H SER A 92 15.462 6.110 7.401 1.00 0.71 H new ATOM 0 HA SER A 92 15.257 8.364 7.703 1.00 0.81 H new ATOM 0 HB2 SER A 92 18.156 7.916 7.256 1.00 0.85 H new ATOM 0 HB3 SER A 92 17.651 9.552 6.886 1.00 0.85 H new ATOM 0 HG SER A 92 16.453 9.396 9.026 1.00 0.94 H new ATOM 1546 N ILE A 93 15.965 8.171 4.525 1.00 0.85 N ATOM 1547 CA ILE A 93 15.684 8.751 3.172 1.00 0.92 C ATOM 1548 C ILE A 93 16.573 9.976 2.934 1.00 1.05 C ATOM 1549 O ILE A 93 17.398 9.985 2.041 1.00 1.13 O ATOM 1550 CB ILE A 93 14.212 9.151 3.040 1.00 1.02 C ATOM 1551 CG1 ILE A 93 13.328 8.010 3.579 1.00 1.07 C ATOM 1552 CG2 ILE A 93 13.909 9.425 1.562 1.00 1.16 C ATOM 1553 CD1 ILE A 93 12.075 7.821 2.711 1.00 1.65 C ATOM 0 H ILE A 93 16.412 7.255 4.504 1.00 0.85 H new ATOM 0 HA ILE A 93 15.903 7.989 2.424 1.00 0.92 H new ATOM 0 HB ILE A 93 14.004 10.052 3.618 1.00 1.02 H new ATOM 0 HG12 ILE A 93 13.901 7.083 3.602 1.00 1.07 H new ATOM 0 HG13 ILE A 93 13.033 8.229 4.605 1.00 1.07 H new ATOM 0 HG21 ILE A 93 12.863 9.711 1.452 1.00 1.16 H new ATOM 0 HG22 ILE A 93 14.546 10.234 1.204 1.00 1.16 H new ATOM 0 HG23 ILE A 93 14.102 8.525 0.978 1.00 1.16 H new ATOM 0 HD11 ILE A 93 11.471 7.009 3.116 1.00 1.65 H new ATOM 0 HD12 ILE A 93 11.491 8.742 2.709 1.00 1.65 H new ATOM 0 HD13 ILE A 93 12.372 7.578 1.691 1.00 1.65 H new ATOM 1565 N ARG A 94 16.415 11.001 3.727 1.00 1.20 N ATOM 1566 CA ARG A 94 17.242 12.237 3.557 1.00 1.42 C ATOM 1567 C ARG A 94 17.629 12.790 4.933 1.00 1.49 C ATOM 1568 O ARG A 94 18.331 13.776 5.036 1.00 1.74 O ATOM 1569 CB ARG A 94 16.432 13.321 2.832 1.00 1.79 C ATOM 1570 CG ARG A 94 16.060 12.875 1.416 1.00 2.10 C ATOM 1571 CD ARG A 94 14.538 12.769 1.301 1.00 2.55 C ATOM 1572 NE ARG A 94 14.179 12.172 -0.014 1.00 3.16 N ATOM 1573 CZ ARG A 94 12.940 11.857 -0.271 1.00 3.74 C ATOM 1574 NH1 ARG A 94 12.015 12.061 0.627 1.00 3.85 N ATOM 1575 NH2 ARG A 94 12.626 11.337 -1.426 1.00 4.56 N ATOM 0 H ARG A 94 15.743 11.038 4.493 1.00 1.20 H new ATOM 0 HA ARG A 94 18.129 11.978 2.979 1.00 1.42 H new ATOM 0 HB2 ARG A 94 15.526 13.542 3.397 1.00 1.79 H new ATOM 0 HB3 ARG A 94 17.012 14.243 2.786 1.00 1.79 H new ATOM 0 HG2 ARG A 94 16.442 13.588 0.686 1.00 2.10 H new ATOM 0 HG3 ARG A 94 16.521 11.913 1.193 1.00 2.10 H new ATOM 0 HD2 ARG A 94 14.144 12.155 2.111 1.00 2.55 H new ATOM 0 HD3 ARG A 94 14.086 13.756 1.400 1.00 2.55 H new ATOM 0 HE ARG A 94 14.902 12.009 -0.715 1.00 3.16 H new ATOM 0 HH11 ARG A 94 12.261 12.467 1.530 1.00 3.85 H new ATOM 0 HH12 ARG A 94 11.046 11.815 0.426 1.00 3.85 H new ATOM 0 HH21 ARG A 94 13.350 11.177 -2.127 1.00 4.56 H new ATOM 0 HH22 ARG A 94 11.657 11.090 -1.628 1.00 4.56 H new ATOM 1589 N GLN A 95 17.181 12.171 5.992 1.00 1.46 N ATOM 1590 CA GLN A 95 17.531 12.677 7.350 1.00 1.61 C ATOM 1591 C GLN A 95 17.187 11.621 8.402 1.00 2.21 C ATOM 1592 O GLN A 95 16.188 10.943 8.226 1.00 2.75 O ATOM 1593 CB GLN A 95 16.745 13.959 7.638 1.00 1.83 C ATOM 1594 CG GLN A 95 15.247 13.686 7.497 1.00 2.35 C ATOM 1595 CD GLN A 95 14.579 13.776 8.871 1.00 2.88 C ATOM 1596 OE1 GLN A 95 14.193 12.773 9.439 1.00 3.43 O ATOM 1597 NE2 GLN A 95 14.428 14.943 9.434 1.00 3.20 N ATOM 1598 OXT GLN A 95 17.926 11.507 9.364 1.00 2.78 O ATOM 0 H GLN A 95 16.590 11.340 5.976 1.00 1.46 H new ATOM 0 HA GLN A 95 18.600 12.888 7.389 1.00 1.61 H new ATOM 0 HB2 GLN A 95 16.967 14.315 8.644 1.00 1.83 H new ATOM 0 HB3 GLN A 95 17.048 14.746 6.947 1.00 1.83 H new ATOM 0 HG2 GLN A 95 14.798 14.408 6.815 1.00 2.35 H new ATOM 0 HG3 GLN A 95 15.086 12.698 7.067 1.00 2.35 H new ATOM 0 HE21 GLN A 95 14.752 15.785 8.958 1.00 3.20 H new ATOM 0 HE22 GLN A 95 13.986 15.014 10.351 1.00 3.20 H new TER 1607 GLN A 95 ATOM 1608 N ALA B 1 17.048 -3.151 -18.344 1.00 5.31 N ATOM 1609 CA ALA B 1 17.111 -1.670 -18.193 1.00 4.73 C ATOM 1610 C ALA B 1 16.715 -1.286 -16.766 1.00 4.10 C ATOM 1611 O ALA B 1 15.837 -0.473 -16.552 1.00 3.94 O ATOM 1612 CB ALA B 1 16.144 -1.015 -19.182 1.00 4.76 C ATOM 0 H1 ALA B 1 17.317 -3.413 -19.314 1.00 5.31 H new ATOM 0 H2 ALA B 1 17.703 -3.597 -17.671 1.00 5.31 H new ATOM 0 H3 ALA B 1 16.080 -3.479 -18.153 1.00 5.31 H new ATOM 0 HA ALA B 1 18.126 -1.327 -18.394 1.00 4.73 H new ATOM 0 HB1 ALA B 1 16.190 0.068 -19.072 1.00 4.76 H new ATOM 0 HB2 ALA B 1 16.423 -1.289 -20.199 1.00 4.76 H new ATOM 0 HB3 ALA B 1 15.129 -1.358 -18.980 1.00 4.76 H new ATOM 1620 N LYS B 2 17.355 -1.865 -15.787 1.00 4.19 N ATOM 1621 CA LYS B 2 17.014 -1.533 -14.376 1.00 4.06 C ATOM 1622 C LYS B 2 17.724 -0.239 -13.970 1.00 3.61 C ATOM 1623 O LYS B 2 18.705 0.155 -14.568 1.00 4.29 O ATOM 1624 CB LYS B 2 17.467 -2.673 -13.461 1.00 4.79 C ATOM 1625 CG LYS B 2 17.290 -4.007 -14.189 1.00 5.69 C ATOM 1626 CD LYS B 2 17.479 -5.160 -13.200 1.00 6.62 C ATOM 1627 CE LYS B 2 17.172 -6.486 -13.895 1.00 7.56 C ATOM 1628 NZ LYS B 2 15.875 -7.022 -13.392 1.00 7.96 N ATOM 0 H LYS B 2 18.099 -2.553 -15.904 1.00 4.19 H new ATOM 0 HA LYS B 2 15.936 -1.399 -14.284 1.00 4.06 H new ATOM 0 HB2 LYS B 2 18.511 -2.535 -13.179 1.00 4.79 H new ATOM 0 HB3 LYS B 2 16.885 -2.668 -12.540 1.00 4.79 H new ATOM 0 HG2 LYS B 2 16.298 -4.059 -14.639 1.00 5.69 H new ATOM 0 HG3 LYS B 2 18.013 -4.089 -15.001 1.00 5.69 H new ATOM 0 HD2 LYS B 2 18.501 -5.164 -12.822 1.00 6.62 H new ATOM 0 HD3 LYS B 2 16.822 -5.027 -12.341 1.00 6.62 H new ATOM 0 HE2 LYS B 2 17.124 -6.341 -14.974 1.00 7.56 H new ATOM 0 HE3 LYS B 2 17.972 -7.202 -13.705 1.00 7.56 H new ATOM 0 HZ1 LYS B 2 15.666 -7.924 -13.865 1.00 7.96 H new ATOM 0 HZ2 LYS B 2 15.937 -7.175 -12.365 1.00 7.96 H new ATOM 0 HZ3 LYS B 2 15.116 -6.341 -13.595 1.00 7.96 H new ATOM 1642 N LYS B 3 17.238 0.418 -12.950 1.00 2.84 N ATOM 1643 CA LYS B 3 17.876 1.683 -12.488 1.00 2.84 C ATOM 1644 C LYS B 3 17.149 2.172 -11.235 1.00 2.25 C ATOM 1645 O LYS B 3 17.735 2.275 -10.177 1.00 2.75 O ATOM 1646 CB LYS B 3 17.794 2.758 -13.583 1.00 3.27 C ATOM 1647 CG LYS B 3 16.342 2.951 -14.037 1.00 3.74 C ATOM 1648 CD LYS B 3 16.325 3.428 -15.491 1.00 4.47 C ATOM 1649 CE LYS B 3 14.901 3.828 -15.879 1.00 5.15 C ATOM 1650 NZ LYS B 3 13.953 2.758 -15.459 1.00 5.62 N ATOM 0 H LYS B 3 16.420 0.129 -12.414 1.00 2.84 H new ATOM 0 HA LYS B 3 18.926 1.496 -12.265 1.00 2.84 H new ATOM 0 HB2 LYS B 3 18.192 3.700 -13.207 1.00 3.27 H new ATOM 0 HB3 LYS B 3 18.412 2.468 -14.433 1.00 3.27 H new ATOM 0 HG2 LYS B 3 15.792 2.015 -13.943 1.00 3.74 H new ATOM 0 HG3 LYS B 3 15.843 3.679 -13.398 1.00 3.74 H new ATOM 0 HD2 LYS B 3 16.999 4.276 -15.615 1.00 4.47 H new ATOM 0 HD3 LYS B 3 16.684 2.637 -16.149 1.00 4.47 H new ATOM 0 HE2 LYS B 3 14.635 4.772 -15.404 1.00 5.15 H new ATOM 0 HE3 LYS B 3 14.836 3.984 -16.956 1.00 5.15 H new ATOM 0 HZ1 LYS B 3 13.056 2.868 -15.973 1.00 5.62 H new ATOM 0 HZ2 LYS B 3 14.363 1.827 -15.673 1.00 5.62 H new ATOM 0 HZ3 LYS B 3 13.777 2.832 -14.437 1.00 5.62 H new ATOM 1664 N LYS B 4 15.876 2.460 -11.358 1.00 1.66 N ATOM 1665 CA LYS B 4 15.063 2.939 -10.194 1.00 1.45 C ATOM 1666 C LYS B 4 15.658 4.224 -9.610 1.00 1.21 C ATOM 1667 O LYS B 4 15.022 5.257 -9.624 1.00 1.74 O ATOM 1668 CB LYS B 4 14.995 1.852 -9.117 1.00 1.77 C ATOM 1669 CG LYS B 4 14.194 0.655 -9.653 1.00 2.27 C ATOM 1670 CD LYS B 4 12.719 1.031 -9.847 1.00 2.87 C ATOM 1671 CE LYS B 4 11.849 -0.213 -9.660 1.00 3.35 C ATOM 1672 NZ LYS B 4 10.423 0.136 -9.918 1.00 3.94 N ATOM 0 H LYS B 4 15.356 2.382 -12.232 1.00 1.66 H new ATOM 0 HA LYS B 4 14.054 3.156 -10.544 1.00 1.45 H new ATOM 0 HB2 LYS B 4 16.000 1.536 -8.839 1.00 1.77 H new ATOM 0 HB3 LYS B 4 14.524 2.245 -8.216 1.00 1.77 H new ATOM 0 HG2 LYS B 4 14.617 0.323 -10.601 1.00 2.27 H new ATOM 0 HG3 LYS B 4 14.273 -0.182 -8.959 1.00 2.27 H new ATOM 0 HD2 LYS B 4 12.431 1.801 -9.131 1.00 2.87 H new ATOM 0 HD3 LYS B 4 12.567 1.449 -10.842 1.00 2.87 H new ATOM 0 HE2 LYS B 4 12.171 -1.001 -10.341 1.00 3.35 H new ATOM 0 HE3 LYS B 4 11.962 -0.601 -8.648 1.00 3.35 H new ATOM 0 HZ1 LYS B 4 9.830 -0.709 -9.791 1.00 3.94 H new ATOM 0 HZ2 LYS B 4 10.120 0.874 -9.251 1.00 3.94 H new ATOM 0 HZ3 LYS B 4 10.322 0.487 -10.892 1.00 3.94 H new ATOM 1686 N SER B 5 16.862 4.161 -9.093 1.00 1.06 N ATOM 1687 CA SER B 5 17.511 5.373 -8.499 1.00 1.29 C ATOM 1688 C SER B 5 17.018 5.568 -7.069 1.00 1.14 C ATOM 1689 O SER B 5 17.102 6.647 -6.517 1.00 1.52 O ATOM 1690 CB SER B 5 17.174 6.608 -9.312 1.00 1.71 C ATOM 1691 OG SER B 5 18.260 7.523 -9.249 1.00 2.58 O ATOM 0 H SER B 5 17.428 3.313 -9.057 1.00 1.06 H new ATOM 0 HA SER B 5 18.591 5.226 -8.504 1.00 1.29 H new ATOM 0 HB2 SER B 5 16.975 6.332 -10.348 1.00 1.71 H new ATOM 0 HB3 SER B 5 16.267 7.075 -8.927 1.00 1.71 H new ATOM 0 HG SER B 5 18.568 7.602 -8.322 1.00 2.58 H new ATOM 1697 N LYS B 6 16.501 4.537 -6.467 1.00 1.03 N ATOM 1698 CA LYS B 6 15.996 4.658 -5.072 1.00 1.04 C ATOM 1699 C LYS B 6 15.355 3.335 -4.662 1.00 0.96 C ATOM 1700 O LYS B 6 15.310 2.986 -3.501 1.00 1.02 O ATOM 1701 CB LYS B 6 14.955 5.779 -4.997 1.00 1.37 C ATOM 1702 CG LYS B 6 14.006 5.526 -3.822 1.00 2.21 C ATOM 1703 CD LYS B 6 13.308 6.832 -3.440 1.00 2.52 C ATOM 1704 CE LYS B 6 11.943 6.521 -2.823 1.00 3.33 C ATOM 1705 NZ LYS B 6 11.340 7.776 -2.294 1.00 3.75 N ATOM 0 H LYS B 6 16.405 3.610 -6.882 1.00 1.03 H new ATOM 0 HA LYS B 6 16.821 4.893 -4.400 1.00 1.04 H new ATOM 0 HB2 LYS B 6 15.452 6.742 -4.875 1.00 1.37 H new ATOM 0 HB3 LYS B 6 14.391 5.827 -5.928 1.00 1.37 H new ATOM 0 HG2 LYS B 6 13.267 4.772 -4.093 1.00 2.21 H new ATOM 0 HG3 LYS B 6 14.562 5.135 -2.970 1.00 2.21 H new ATOM 0 HD2 LYS B 6 13.920 7.390 -2.732 1.00 2.52 H new ATOM 0 HD3 LYS B 6 13.185 7.462 -4.321 1.00 2.52 H new ATOM 0 HE2 LYS B 6 11.287 6.077 -3.571 1.00 3.33 H new ATOM 0 HE3 LYS B 6 12.052 5.791 -2.021 1.00 3.33 H new ATOM 0 HZ1 LYS B 6 10.412 7.565 -1.874 1.00 3.75 H new ATOM 0 HZ2 LYS B 6 11.964 8.182 -1.568 1.00 3.75 H new ATOM 0 HZ3 LYS B 6 11.222 8.458 -3.070 1.00 3.75 H new ATOM 1719 N LEU B 7 14.849 2.598 -5.612 1.00 0.91 N ATOM 1720 CA LEU B 7 14.206 1.295 -5.276 1.00 0.98 C ATOM 1721 C LEU B 7 15.195 0.141 -5.483 1.00 0.86 C ATOM 1722 O LEU B 7 15.578 -0.540 -4.550 1.00 0.86 O ATOM 1723 CB LEU B 7 12.990 1.082 -6.181 1.00 1.15 C ATOM 1724 CG LEU B 7 11.797 0.618 -5.342 1.00 1.40 C ATOM 1725 CD1 LEU B 7 11.247 1.793 -4.532 1.00 2.06 C ATOM 1726 CD2 LEU B 7 10.702 0.084 -6.268 1.00 1.70 C ATOM 0 H LEU B 7 14.852 2.840 -6.603 1.00 0.91 H new ATOM 0 HA LEU B 7 13.897 1.315 -4.231 1.00 0.98 H new ATOM 0 HB2 LEU B 7 12.744 2.009 -6.699 1.00 1.15 H new ATOM 0 HB3 LEU B 7 13.219 0.340 -6.946 1.00 1.15 H new ATOM 0 HG LEU B 7 12.120 -0.170 -4.662 1.00 1.40 H new ATOM 0 HD11 LEU B 7 10.398 1.458 -3.936 1.00 2.06 H new ATOM 0 HD12 LEU B 7 12.025 2.176 -3.872 1.00 2.06 H new ATOM 0 HD13 LEU B 7 10.925 2.583 -5.210 1.00 2.06 H new ATOM 0 HD21 LEU B 7 9.851 -0.247 -5.672 1.00 1.70 H new ATOM 0 HD22 LEU B 7 10.383 0.874 -6.948 1.00 1.70 H new ATOM 0 HD23 LEU B 7 11.090 -0.756 -6.844 1.00 1.70 H new ATOM 1738 N GLU B 8 15.587 -0.105 -6.706 1.00 0.85 N ATOM 1739 CA GLU B 8 16.516 -1.244 -6.968 1.00 0.91 C ATOM 1740 C GLU B 8 17.958 -0.873 -6.615 1.00 0.79 C ATOM 1741 O GLU B 8 18.509 -1.379 -5.669 1.00 0.74 O ATOM 1742 CB GLU B 8 16.450 -1.631 -8.451 1.00 1.08 C ATOM 1743 CG GLU B 8 17.619 -2.559 -8.806 1.00 1.20 C ATOM 1744 CD GLU B 8 17.804 -3.612 -7.712 1.00 1.47 C ATOM 1745 OE1 GLU B 8 16.859 -4.338 -7.451 1.00 2.06 O ATOM 1746 OE2 GLU B 8 18.887 -3.674 -7.154 1.00 1.97 O ATOM 0 H GLU B 8 15.307 0.429 -7.529 1.00 0.85 H new ATOM 0 HA GLU B 8 16.207 -2.083 -6.344 1.00 0.91 H new ATOM 0 HB2 GLU B 8 15.503 -2.128 -8.663 1.00 1.08 H new ATOM 0 HB3 GLU B 8 16.486 -0.735 -9.071 1.00 1.08 H new ATOM 0 HG2 GLU B 8 17.429 -3.046 -9.762 1.00 1.20 H new ATOM 0 HG3 GLU B 8 18.534 -1.977 -8.920 1.00 1.20 H new ATOM 1753 N ILE B 9 18.550 0.027 -7.353 1.00 0.80 N ATOM 1754 CA ILE B 9 19.963 0.432 -7.052 1.00 0.81 C ATOM 1755 C ILE B 9 20.141 0.372 -5.527 1.00 0.71 C ATOM 1756 O ILE B 9 21.117 -0.124 -5.004 1.00 0.82 O ATOM 1757 CB ILE B 9 20.207 1.853 -7.598 1.00 0.85 C ATOM 1758 CG1 ILE B 9 21.252 1.786 -8.714 1.00 1.52 C ATOM 1759 CG2 ILE B 9 20.706 2.804 -6.503 1.00 1.50 C ATOM 1760 CD1 ILE B 9 20.718 0.930 -9.865 1.00 1.88 C ATOM 0 H ILE B 9 18.123 0.500 -8.149 1.00 0.80 H new ATOM 0 HA ILE B 9 20.686 -0.232 -7.526 1.00 0.81 H new ATOM 0 HB ILE B 9 19.260 2.238 -7.976 1.00 0.85 H new ATOM 0 HG12 ILE B 9 21.483 2.790 -9.071 1.00 1.52 H new ATOM 0 HG13 ILE B 9 22.180 1.362 -8.332 1.00 1.52 H new ATOM 0 HG21 ILE B 9 20.866 3.795 -6.927 1.00 1.50 H new ATOM 0 HG22 ILE B 9 19.963 2.865 -5.708 1.00 1.50 H new ATOM 0 HG23 ILE B 9 21.644 2.428 -6.094 1.00 1.50 H new ATOM 0 HD11 ILE B 9 21.463 0.883 -10.659 1.00 1.88 H new ATOM 0 HD12 ILE B 9 20.509 -0.077 -9.503 1.00 1.88 H new ATOM 0 HD13 ILE B 9 19.801 1.373 -10.253 1.00 1.88 H new ATOM 1772 N ILE B 10 19.171 0.888 -4.842 1.00 0.59 N ATOM 1773 CA ILE B 10 19.196 0.906 -3.348 1.00 0.59 C ATOM 1774 C ILE B 10 19.285 -0.529 -2.823 1.00 0.51 C ATOM 1775 O ILE B 10 20.179 -0.874 -2.076 1.00 0.54 O ATOM 1776 CB ILE B 10 17.924 1.592 -2.815 1.00 0.67 C ATOM 1777 CG1 ILE B 10 18.222 3.071 -2.528 1.00 0.85 C ATOM 1778 CG2 ILE B 10 17.428 0.915 -1.527 1.00 0.74 C ATOM 1779 CD1 ILE B 10 18.934 3.223 -1.178 1.00 1.31 C ATOM 0 H ILE B 10 18.340 1.309 -5.257 1.00 0.59 H new ATOM 0 HA ILE B 10 20.066 1.465 -3.003 1.00 0.59 H new ATOM 0 HB ILE B 10 17.145 1.506 -3.573 1.00 0.67 H new ATOM 0 HG12 ILE B 10 18.844 3.484 -3.322 1.00 0.85 H new ATOM 0 HG13 ILE B 10 17.293 3.641 -2.522 1.00 0.85 H new ATOM 0 HG21 ILE B 10 16.529 1.420 -1.173 1.00 0.74 H new ATOM 0 HG22 ILE B 10 17.200 -0.131 -1.730 1.00 0.74 H new ATOM 0 HG23 ILE B 10 18.203 0.976 -0.763 1.00 0.74 H new ATOM 0 HD11 ILE B 10 19.138 4.277 -0.991 1.00 1.31 H new ATOM 0 HD12 ILE B 10 18.298 2.830 -0.385 1.00 1.31 H new ATOM 0 HD13 ILE B 10 19.873 2.670 -1.198 1.00 1.31 H new ATOM 1791 N GLN B 11 18.351 -1.357 -3.195 1.00 0.50 N ATOM 1792 CA GLN B 11 18.360 -2.763 -2.703 1.00 0.50 C ATOM 1793 C GLN B 11 19.638 -3.480 -3.154 1.00 0.52 C ATOM 1794 O GLN B 11 20.145 -4.341 -2.463 1.00 0.52 O ATOM 1795 CB GLN B 11 17.142 -3.502 -3.261 1.00 0.55 C ATOM 1796 CG GLN B 11 16.028 -3.514 -2.213 1.00 1.24 C ATOM 1797 CD GLN B 11 16.405 -4.468 -1.078 1.00 1.53 C ATOM 1798 OE1 GLN B 11 16.658 -4.043 0.031 1.00 2.22 O ATOM 1799 NE2 GLN B 11 16.454 -5.752 -1.312 1.00 1.91 N ATOM 0 H GLN B 11 17.580 -1.121 -3.820 1.00 0.50 H new ATOM 0 HA GLN B 11 18.325 -2.756 -1.614 1.00 0.50 H new ATOM 0 HB2 GLN B 11 16.794 -3.015 -4.172 1.00 0.55 H new ATOM 0 HB3 GLN B 11 17.414 -4.523 -3.529 1.00 0.55 H new ATOM 0 HG2 GLN B 11 15.872 -2.509 -1.821 1.00 1.24 H new ATOM 0 HG3 GLN B 11 15.089 -3.827 -2.669 1.00 1.24 H new ATOM 0 HE21 GLN B 11 16.241 -6.109 -2.244 1.00 1.91 H new ATOM 0 HE22 GLN B 11 16.705 -6.398 -0.563 1.00 1.91 H new ATOM 1808 N ALA B 12 20.173 -3.137 -4.295 1.00 0.57 N ATOM 1809 CA ALA B 12 21.421 -3.808 -4.764 1.00 0.62 C ATOM 1810 C ALA B 12 22.602 -3.424 -3.864 1.00 0.57 C ATOM 1811 O ALA B 12 23.443 -4.240 -3.544 1.00 0.57 O ATOM 1812 CB ALA B 12 21.720 -3.380 -6.202 1.00 0.71 C ATOM 0 H ALA B 12 19.801 -2.423 -4.922 1.00 0.57 H new ATOM 0 HA ALA B 12 21.278 -4.888 -4.721 1.00 0.62 H new ATOM 0 HB1 ALA B 12 22.631 -3.870 -6.545 1.00 0.71 H new ATOM 0 HB2 ALA B 12 20.889 -3.666 -6.847 1.00 0.71 H new ATOM 0 HB3 ALA B 12 21.853 -2.299 -6.240 1.00 0.71 H new ATOM 1818 N ILE B 13 22.668 -2.184 -3.457 1.00 0.55 N ATOM 1819 CA ILE B 13 23.794 -1.749 -2.582 1.00 0.51 C ATOM 1820 C ILE B 13 23.629 -2.376 -1.198 1.00 0.44 C ATOM 1821 O ILE B 13 24.589 -2.716 -0.536 1.00 0.45 O ATOM 1822 CB ILE B 13 23.791 -0.224 -2.460 1.00 0.52 C ATOM 1823 CG1 ILE B 13 23.960 0.400 -3.847 1.00 0.65 C ATOM 1824 CG2 ILE B 13 24.949 0.221 -1.564 1.00 0.52 C ATOM 1825 CD1 ILE B 13 23.390 1.819 -3.840 1.00 0.84 C ATOM 0 H ILE B 13 21.993 -1.456 -3.692 1.00 0.55 H new ATOM 0 HA ILE B 13 24.740 -2.071 -3.018 1.00 0.51 H new ATOM 0 HB ILE B 13 22.846 0.100 -2.024 1.00 0.52 H new ATOM 0 HG12 ILE B 13 25.015 0.422 -4.122 1.00 0.65 H new ATOM 0 HG13 ILE B 13 23.448 -0.205 -4.595 1.00 0.65 H new ATOM 0 HG21 ILE B 13 24.946 1.308 -1.478 1.00 0.52 H new ATOM 0 HG22 ILE B 13 24.834 -0.222 -0.575 1.00 0.52 H new ATOM 0 HG23 ILE B 13 25.893 -0.106 -2.000 1.00 0.52 H new ATOM 0 HD11 ILE B 13 23.510 2.264 -4.828 1.00 0.84 H new ATOM 0 HD12 ILE B 13 22.331 1.784 -3.584 1.00 0.84 H new ATOM 0 HD13 ILE B 13 23.922 2.421 -3.104 1.00 0.84 H new ATOM 1837 N LEU B 14 22.413 -2.522 -0.757 1.00 0.45 N ATOM 1838 CA LEU B 14 22.163 -3.116 0.584 1.00 0.41 C ATOM 1839 C LEU B 14 22.508 -4.607 0.567 1.00 0.42 C ATOM 1840 O LEU B 14 23.119 -5.127 1.479 1.00 0.41 O ATOM 1841 CB LEU B 14 20.683 -2.945 0.929 1.00 0.45 C ATOM 1842 CG LEU B 14 20.541 -2.056 2.165 1.00 0.57 C ATOM 1843 CD1 LEU B 14 19.060 -1.750 2.409 1.00 0.54 C ATOM 1844 CD2 LEU B 14 21.117 -2.784 3.382 1.00 1.01 C ATOM 0 H LEU B 14 21.575 -2.253 -1.272 1.00 0.45 H new ATOM 0 HA LEU B 14 22.784 -2.615 1.327 1.00 0.41 H new ATOM 0 HB2 LEU B 14 20.152 -2.501 0.087 1.00 0.45 H new ATOM 0 HB3 LEU B 14 20.228 -3.918 1.115 1.00 0.45 H new ATOM 0 HG LEU B 14 21.082 -1.123 2.006 1.00 0.57 H new ATOM 0 HD11 LEU B 14 18.960 -1.116 3.290 1.00 0.54 H new ATOM 0 HD12 LEU B 14 18.647 -1.234 1.542 1.00 0.54 H new ATOM 0 HD13 LEU B 14 18.517 -2.682 2.569 1.00 0.54 H new ATOM 0 HD21 LEU B 14 21.017 -2.152 4.265 1.00 1.01 H new ATOM 0 HD22 LEU B 14 20.574 -3.716 3.539 1.00 1.01 H new ATOM 0 HD23 LEU B 14 22.171 -3.003 3.210 1.00 1.01 H new ATOM 1856 N GLU B 15 22.119 -5.295 -0.468 1.00 0.47 N ATOM 1857 CA GLU B 15 22.416 -6.753 -0.561 1.00 0.52 C ATOM 1858 C GLU B 15 23.917 -6.976 -0.740 1.00 0.53 C ATOM 1859 O GLU B 15 24.476 -7.933 -0.245 1.00 0.60 O ATOM 1860 CB GLU B 15 21.676 -7.354 -1.760 1.00 0.59 C ATOM 1861 CG GLU B 15 20.172 -7.414 -1.481 1.00 0.80 C ATOM 1862 CD GLU B 15 19.616 -8.743 -1.995 1.00 0.73 C ATOM 1863 OE1 GLU B 15 20.123 -9.227 -2.994 1.00 1.29 O ATOM 1864 OE2 GLU B 15 18.693 -9.254 -1.382 1.00 1.28 O ATOM 0 H GLU B 15 21.605 -4.909 -1.260 1.00 0.47 H new ATOM 0 HA GLU B 15 22.086 -7.236 0.359 1.00 0.52 H new ATOM 0 HB2 GLU B 15 21.864 -6.754 -2.650 1.00 0.59 H new ATOM 0 HB3 GLU B 15 22.055 -8.355 -1.965 1.00 0.59 H new ATOM 0 HG2 GLU B 15 19.985 -7.317 -0.412 1.00 0.80 H new ATOM 0 HG3 GLU B 15 19.666 -6.581 -1.970 1.00 0.80 H new ATOM 1871 N ALA B 16 24.583 -6.112 -1.444 1.00 0.49 N ATOM 1872 CA ALA B 16 26.036 -6.303 -1.643 1.00 0.52 C ATOM 1873 C ALA B 16 26.743 -6.097 -0.315 1.00 0.50 C ATOM 1874 O ALA B 16 27.674 -6.797 0.023 1.00 0.54 O ATOM 1875 CB ALA B 16 26.548 -5.288 -2.660 1.00 0.53 C ATOM 0 H ALA B 16 24.184 -5.285 -1.888 1.00 0.49 H new ATOM 0 HA ALA B 16 26.232 -7.309 -2.013 1.00 0.52 H new ATOM 0 HB1 ALA B 16 27.619 -5.429 -2.807 1.00 0.53 H new ATOM 0 HB2 ALA B 16 26.030 -5.430 -3.608 1.00 0.53 H new ATOM 0 HB3 ALA B 16 26.362 -4.279 -2.292 1.00 0.53 H new ATOM 1881 N CYS B 17 26.318 -5.126 0.437 1.00 0.46 N ATOM 1882 CA CYS B 17 26.972 -4.858 1.729 1.00 0.46 C ATOM 1883 C CYS B 17 26.526 -5.888 2.774 1.00 0.47 C ATOM 1884 O CYS B 17 27.142 -6.040 3.804 1.00 0.49 O ATOM 1885 CB CYS B 17 26.597 -3.457 2.187 1.00 0.42 C ATOM 1886 SG CYS B 17 24.882 -3.439 2.762 1.00 0.42 S ATOM 0 H CYS B 17 25.541 -4.507 0.206 1.00 0.46 H new ATOM 0 HA CYS B 17 28.053 -4.932 1.613 1.00 0.46 H new ATOM 0 HB2 CYS B 17 27.262 -3.136 2.989 1.00 0.42 H new ATOM 0 HB3 CYS B 17 26.723 -2.750 1.367 1.00 0.42 H new ATOM 0 HG CYS B 17 24.241 -4.447 2.248 1.00 0.42 H new ATOM 1892 N LYS B 18 25.457 -6.589 2.529 1.00 0.49 N ATOM 1893 CA LYS B 18 24.984 -7.598 3.525 1.00 0.51 C ATOM 1894 C LYS B 18 26.136 -8.517 3.974 1.00 0.55 C ATOM 1895 O LYS B 18 25.949 -9.366 4.822 1.00 0.58 O ATOM 1896 CB LYS B 18 23.865 -8.444 2.914 1.00 0.56 C ATOM 1897 CG LYS B 18 24.460 -9.612 2.117 1.00 1.18 C ATOM 1898 CD LYS B 18 23.391 -10.203 1.193 1.00 1.89 C ATOM 1899 CE LYS B 18 22.323 -10.917 2.028 1.00 2.29 C ATOM 1900 NZ LYS B 18 21.461 -11.736 1.131 1.00 2.90 N ATOM 0 H LYS B 18 24.889 -6.510 1.686 1.00 0.49 H new ATOM 0 HA LYS B 18 24.609 -7.063 4.398 1.00 0.51 H new ATOM 0 HB2 LYS B 18 23.216 -8.825 3.702 1.00 0.56 H new ATOM 0 HB3 LYS B 18 23.247 -7.827 2.262 1.00 0.56 H new ATOM 0 HG2 LYS B 18 25.312 -9.268 1.530 1.00 1.18 H new ATOM 0 HG3 LYS B 18 24.830 -10.378 2.798 1.00 1.18 H new ATOM 0 HD2 LYS B 18 22.933 -9.412 0.599 1.00 1.89 H new ATOM 0 HD3 LYS B 18 23.848 -10.903 0.494 1.00 1.89 H new ATOM 0 HE2 LYS B 18 22.796 -11.553 2.777 1.00 2.29 H new ATOM 0 HE3 LYS B 18 21.718 -10.187 2.566 1.00 2.29 H new ATOM 0 HZ1 LYS B 18 20.735 -12.222 1.696 1.00 2.90 H new ATOM 0 HZ2 LYS B 18 21.000 -11.118 0.433 1.00 2.90 H new ATOM 0 HZ3 LYS B 18 22.045 -12.441 0.637 1.00 2.90 H new ATOM 1914 N SER B 19 27.319 -8.374 3.426 1.00 0.57 N ATOM 1915 CA SER B 19 28.433 -9.270 3.855 1.00 0.63 C ATOM 1916 C SER B 19 29.789 -8.614 3.576 1.00 0.66 C ATOM 1917 O SER B 19 30.771 -9.287 3.327 1.00 0.84 O ATOM 1918 CB SER B 19 28.346 -10.590 3.090 1.00 0.70 C ATOM 1919 OG SER B 19 27.117 -11.233 3.402 1.00 0.93 O ATOM 0 H SER B 19 27.557 -7.686 2.711 1.00 0.57 H new ATOM 0 HA SER B 19 28.343 -9.452 4.926 1.00 0.63 H new ATOM 0 HB2 SER B 19 28.412 -10.407 2.017 1.00 0.70 H new ATOM 0 HB3 SER B 19 29.184 -11.234 3.356 1.00 0.70 H new ATOM 0 HG SER B 19 26.741 -10.841 4.218 1.00 0.93 H new ATOM 1925 N GLY B 20 29.865 -7.313 3.634 1.00 0.65 N ATOM 1926 CA GLY B 20 31.169 -6.633 3.391 1.00 0.66 C ATOM 1927 C GLY B 20 31.649 -6.912 1.968 1.00 0.70 C ATOM 1928 O GLY B 20 32.112 -7.992 1.661 1.00 0.77 O ATOM 0 H GLY B 20 29.082 -6.692 3.839 1.00 0.65 H new ATOM 0 HA2 GLY B 20 31.062 -5.559 3.543 1.00 0.66 H new ATOM 0 HA3 GLY B 20 31.910 -6.984 4.109 1.00 0.66 H new ATOM 1932 N SER B 21 31.536 -5.951 1.092 1.00 0.67 N ATOM 1933 CA SER B 21 31.979 -6.172 -0.310 1.00 0.74 C ATOM 1934 C SER B 21 32.424 -4.826 -0.919 1.00 0.72 C ATOM 1935 O SER B 21 31.733 -3.837 -0.771 1.00 0.63 O ATOM 1936 CB SER B 21 30.802 -6.727 -1.108 1.00 0.74 C ATOM 1937 OG SER B 21 29.926 -7.413 -0.224 1.00 0.72 O ATOM 0 H SER B 21 31.157 -5.025 1.288 1.00 0.67 H new ATOM 0 HA SER B 21 32.812 -6.874 -0.337 1.00 0.74 H new ATOM 0 HB2 SER B 21 30.272 -5.917 -1.610 1.00 0.74 H new ATOM 0 HB3 SER B 21 31.159 -7.404 -1.884 1.00 0.74 H new ATOM 0 HG SER B 21 29.174 -6.830 0.009 1.00 0.72 H new ATOM 1943 N PRO B 22 33.560 -4.762 -1.599 1.00 0.82 N ATOM 1944 CA PRO B 22 34.026 -3.485 -2.215 1.00 0.83 C ATOM 1945 C PRO B 22 32.947 -2.859 -3.099 1.00 0.81 C ATOM 1946 O PRO B 22 31.997 -3.512 -3.480 1.00 0.80 O ATOM 1947 CB PRO B 22 35.225 -3.881 -3.079 1.00 0.93 C ATOM 1948 CG PRO B 22 35.679 -5.217 -2.593 1.00 1.08 C ATOM 1949 CD PRO B 22 34.510 -5.866 -1.851 1.00 0.95 C ATOM 0 HA PRO B 22 34.271 -2.747 -1.451 1.00 0.83 H new ATOM 0 HB2 PRO B 22 34.946 -3.926 -4.132 1.00 0.93 H new ATOM 0 HB3 PRO B 22 36.025 -3.145 -2.993 1.00 0.93 H new ATOM 0 HG2 PRO B 22 35.994 -5.841 -3.429 1.00 1.08 H new ATOM 0 HG3 PRO B 22 36.539 -5.111 -1.932 1.00 1.08 H new ATOM 0 HD2 PRO B 22 34.051 -6.654 -2.449 1.00 0.95 H new ATOM 0 HD3 PRO B 22 34.839 -6.324 -0.919 1.00 0.95 H new ATOM 1957 N LYS B 23 33.088 -1.608 -3.443 1.00 0.80 N ATOM 1958 CA LYS B 23 32.066 -0.968 -4.317 1.00 0.80 C ATOM 1959 C LYS B 23 32.014 -1.734 -5.644 1.00 0.79 C ATOM 1960 O LYS B 23 31.004 -1.763 -6.321 1.00 0.79 O ATOM 1961 CB LYS B 23 32.450 0.499 -4.577 1.00 0.82 C ATOM 1962 CG LYS B 23 31.267 1.263 -5.196 1.00 0.78 C ATOM 1963 CD LYS B 23 31.706 1.906 -6.514 1.00 1.42 C ATOM 1964 CE LYS B 23 32.781 2.959 -6.237 1.00 1.27 C ATOM 1965 NZ LYS B 23 32.281 4.301 -6.651 1.00 1.83 N ATOM 0 H LYS B 23 33.861 -1.006 -3.159 1.00 0.80 H new ATOM 0 HA LYS B 23 31.090 -0.994 -3.832 1.00 0.80 H new ATOM 0 HB2 LYS B 23 32.749 0.974 -3.643 1.00 0.82 H new ATOM 0 HB3 LYS B 23 33.309 0.543 -5.246 1.00 0.82 H new ATOM 0 HG2 LYS B 23 30.433 0.583 -5.371 1.00 0.78 H new ATOM 0 HG3 LYS B 23 30.914 2.029 -4.505 1.00 0.78 H new ATOM 0 HD2 LYS B 23 32.094 1.145 -7.191 1.00 1.42 H new ATOM 0 HD3 LYS B 23 30.851 2.366 -7.009 1.00 1.42 H new ATOM 0 HE2 LYS B 23 33.035 2.965 -5.177 1.00 1.27 H new ATOM 0 HE3 LYS B 23 33.693 2.715 -6.782 1.00 1.27 H new ATOM 0 HZ1 LYS B 23 33.012 5.017 -6.463 1.00 1.83 H new ATOM 0 HZ2 LYS B 23 32.060 4.291 -7.667 1.00 1.83 H new ATOM 0 HZ3 LYS B 23 31.422 4.533 -6.112 1.00 1.83 H new ATOM 1979 N THR B 24 33.102 -2.364 -6.017 1.00 0.79 N ATOM 1980 CA THR B 24 33.146 -3.144 -7.292 1.00 0.79 C ATOM 1981 C THR B 24 32.246 -4.388 -7.222 1.00 0.82 C ATOM 1982 O THR B 24 31.541 -4.703 -8.159 1.00 0.84 O ATOM 1983 CB THR B 24 34.589 -3.582 -7.559 1.00 0.78 C ATOM 1984 OG1 THR B 24 35.035 -4.411 -6.494 1.00 0.85 O ATOM 1985 CG2 THR B 24 35.488 -2.348 -7.657 1.00 0.82 C ATOM 0 H THR B 24 33.972 -2.370 -5.484 1.00 0.79 H new ATOM 0 HA THR B 24 32.782 -2.506 -8.097 1.00 0.79 H new ATOM 0 HB THR B 24 34.634 -4.137 -8.496 1.00 0.78 H new ATOM 0 HG1 THR B 24 35.958 -4.694 -6.664 1.00 0.85 H new ATOM 0 HG21 THR B 24 36.515 -2.660 -7.847 1.00 0.82 H new ATOM 0 HG22 THR B 24 35.145 -1.712 -8.473 1.00 0.82 H new ATOM 0 HG23 THR B 24 35.445 -1.791 -6.721 1.00 0.82 H new ATOM 1993 N ARG B 25 32.269 -5.106 -6.125 1.00 0.84 N ATOM 1994 CA ARG B 25 31.421 -6.335 -6.008 1.00 0.89 C ATOM 1995 C ARG B 25 29.955 -5.946 -6.166 1.00 0.90 C ATOM 1996 O ARG B 25 29.081 -6.775 -6.321 1.00 0.96 O ATOM 1997 CB ARG B 25 31.634 -6.951 -4.620 1.00 0.90 C ATOM 1998 CG ARG B 25 31.924 -8.452 -4.731 1.00 1.33 C ATOM 1999 CD ARG B 25 30.647 -9.188 -5.140 1.00 1.07 C ATOM 2000 NE ARG B 25 30.940 -10.640 -5.299 1.00 1.67 N ATOM 2001 CZ ARG B 25 31.590 -11.064 -6.347 1.00 2.00 C ATOM 2002 NH1 ARG B 25 31.985 -10.217 -7.257 1.00 2.14 N ATOM 2003 NH2 ARG B 25 31.847 -12.336 -6.485 1.00 2.74 N ATOM 0 H ARG B 25 32.838 -4.894 -5.305 1.00 0.84 H new ATOM 0 HA ARG B 25 31.694 -7.054 -6.780 1.00 0.89 H new ATOM 0 HB2 ARG B 25 32.463 -6.452 -4.119 1.00 0.90 H new ATOM 0 HB3 ARG B 25 30.748 -6.791 -4.006 1.00 0.90 H new ATOM 0 HG2 ARG B 25 32.710 -8.628 -5.466 1.00 1.33 H new ATOM 0 HG3 ARG B 25 32.288 -8.835 -3.777 1.00 1.33 H new ATOM 0 HD2 ARG B 25 29.873 -9.043 -4.386 1.00 1.07 H new ATOM 0 HD3 ARG B 25 30.262 -8.779 -6.074 1.00 1.07 H new ATOM 0 HE ARG B 25 30.632 -11.303 -4.588 1.00 1.67 H new ATOM 0 HH11 ARG B 25 31.786 -9.223 -7.149 1.00 2.14 H new ATOM 0 HH12 ARG B 25 32.493 -10.549 -8.077 1.00 2.14 H new ATOM 0 HH21 ARG B 25 31.539 -12.999 -5.773 1.00 2.74 H new ATOM 0 HH22 ARG B 25 32.355 -12.668 -7.305 1.00 2.74 H new ATOM 2017 N ILE B 26 29.703 -4.680 -6.133 1.00 0.86 N ATOM 2018 CA ILE B 26 28.317 -4.201 -6.287 1.00 0.89 C ATOM 2019 C ILE B 26 28.018 -4.081 -7.777 1.00 0.93 C ATOM 2020 O ILE B 26 26.877 -4.108 -8.196 1.00 0.96 O ATOM 2021 CB ILE B 26 28.172 -2.872 -5.551 1.00 0.86 C ATOM 2022 CG1 ILE B 26 28.832 -3.045 -4.175 1.00 0.92 C ATOM 2023 CG2 ILE B 26 26.686 -2.529 -5.399 1.00 0.90 C ATOM 2024 CD1 ILE B 26 28.278 -2.047 -3.153 1.00 0.62 C ATOM 0 H ILE B 26 30.404 -3.950 -6.005 1.00 0.86 H new ATOM 0 HA ILE B 26 27.597 -4.895 -5.853 1.00 0.89 H new ATOM 0 HB ILE B 26 28.648 -2.059 -6.100 1.00 0.86 H new ATOM 0 HG12 ILE B 26 28.668 -4.061 -3.817 1.00 0.92 H new ATOM 0 HG13 ILE B 26 29.910 -2.910 -4.268 1.00 0.92 H new ATOM 0 HG21 ILE B 26 26.584 -1.580 -4.873 1.00 0.90 H new ATOM 0 HG22 ILE B 26 26.228 -2.449 -6.385 1.00 0.90 H new ATOM 0 HG23 ILE B 26 26.188 -3.314 -4.830 1.00 0.90 H new ATOM 0 HD11 ILE B 26 28.769 -2.200 -2.192 1.00 0.62 H new ATOM 0 HD12 ILE B 26 28.466 -1.030 -3.498 1.00 0.62 H new ATOM 0 HD13 ILE B 26 27.205 -2.199 -3.041 1.00 0.62 H new ATOM 2036 N MET B 27 29.038 -3.975 -8.586 1.00 0.94 N ATOM 2037 CA MET B 27 28.810 -3.882 -10.053 1.00 0.99 C ATOM 2038 C MET B 27 28.058 -5.136 -10.496 1.00 1.06 C ATOM 2039 O MET B 27 27.102 -5.074 -11.243 1.00 1.10 O ATOM 2040 CB MET B 27 30.151 -3.787 -10.794 1.00 0.98 C ATOM 2041 CG MET B 27 30.761 -2.388 -10.626 1.00 1.55 C ATOM 2042 SD MET B 27 32.397 -2.356 -11.400 1.00 1.89 S ATOM 2043 CE MET B 27 31.905 -1.534 -12.937 1.00 1.25 C ATOM 0 H MET B 27 30.015 -3.949 -8.294 1.00 0.94 H new ATOM 0 HA MET B 27 28.229 -2.989 -10.285 1.00 0.99 H new ATOM 0 HB2 MET B 27 30.840 -4.539 -10.409 1.00 0.98 H new ATOM 0 HB3 MET B 27 30.004 -4.001 -11.853 1.00 0.98 H new ATOM 0 HG2 MET B 27 30.114 -1.639 -11.083 1.00 1.55 H new ATOM 0 HG3 MET B 27 30.841 -2.138 -9.568 1.00 1.55 H new ATOM 0 HE1 MET B 27 32.777 -1.409 -13.578 1.00 1.25 H new ATOM 0 HE2 MET B 27 31.160 -2.141 -13.452 1.00 1.25 H new ATOM 0 HE3 MET B 27 31.481 -0.556 -12.707 1.00 1.25 H new ATOM 2053 N TYR B 28 28.473 -6.274 -10.012 1.00 1.07 N ATOM 2054 CA TYR B 28 27.780 -7.543 -10.366 1.00 1.14 C ATOM 2055 C TYR B 28 26.342 -7.466 -9.849 1.00 1.09 C ATOM 2056 O TYR B 28 25.535 -8.348 -10.067 1.00 1.20 O ATOM 2057 CB TYR B 28 28.505 -8.710 -9.697 1.00 1.17 C ATOM 2058 CG TYR B 28 27.845 -10.012 -10.078 1.00 1.43 C ATOM 2059 CD1 TYR B 28 28.126 -10.605 -11.315 1.00 1.71 C ATOM 2060 CD2 TYR B 28 26.955 -10.630 -9.192 1.00 2.20 C ATOM 2061 CE1 TYR B 28 27.517 -11.815 -11.665 1.00 1.98 C ATOM 2062 CE2 TYR B 28 26.345 -11.840 -9.543 1.00 2.58 C ATOM 2063 CZ TYR B 28 26.627 -12.433 -10.780 1.00 2.21 C ATOM 2064 OH TYR B 28 26.027 -13.627 -11.125 1.00 2.65 O ATOM 0 H TYR B 28 29.268 -6.379 -9.382 1.00 1.07 H new ATOM 0 HA TYR B 28 27.780 -7.691 -11.446 1.00 1.14 H new ATOM 0 HB2 TYR B 28 29.552 -8.721 -10.000 1.00 1.17 H new ATOM 0 HB3 TYR B 28 28.488 -8.587 -8.614 1.00 1.17 H new ATOM 0 HD1 TYR B 28 28.813 -10.128 -11.999 1.00 1.71 H new ATOM 0 HD2 TYR B 28 26.739 -10.173 -8.237 1.00 2.20 H new ATOM 0 HE1 TYR B 28 27.734 -12.272 -12.619 1.00 1.98 H new ATOM 0 HE2 TYR B 28 25.657 -12.316 -8.860 1.00 2.58 H new ATOM 0 HH TYR B 28 25.439 -13.920 -10.398 1.00 2.65 H new ATOM 2074 N GLY B 29 26.030 -6.401 -9.164 1.00 1.05 N ATOM 2075 CA GLY B 29 24.653 -6.227 -8.618 1.00 1.02 C ATOM 2076 C GLY B 29 23.817 -5.384 -9.585 1.00 1.05 C ATOM 2077 O GLY B 29 22.608 -5.493 -9.632 1.00 1.10 O ATOM 0 H GLY B 29 26.674 -5.638 -8.957 1.00 1.05 H new ATOM 0 HA2 GLY B 29 24.184 -7.200 -8.470 1.00 1.02 H new ATOM 0 HA3 GLY B 29 24.697 -5.743 -7.642 1.00 1.02 H new ATOM 2081 N ALA B 30 24.450 -4.541 -10.359 1.00 1.06 N ATOM 2082 CA ALA B 30 23.689 -3.690 -11.320 1.00 1.10 C ATOM 2083 C ALA B 30 24.670 -2.940 -12.232 1.00 1.16 C ATOM 2084 O ALA B 30 25.870 -3.089 -12.122 1.00 1.24 O ATOM 2085 CB ALA B 30 22.832 -2.684 -10.543 1.00 1.13 C ATOM 0 H ALA B 30 25.461 -4.406 -10.367 1.00 1.06 H new ATOM 0 HA ALA B 30 23.042 -4.320 -11.930 1.00 1.10 H new ATOM 0 HB1 ALA B 30 22.276 -2.062 -11.244 1.00 1.13 H new ATOM 0 HB2 ALA B 30 22.134 -3.221 -9.901 1.00 1.13 H new ATOM 0 HB3 ALA B 30 23.477 -2.053 -9.931 1.00 1.13 H new ATOM 2091 N ASN B 31 24.168 -2.137 -13.137 1.00 1.19 N ATOM 2092 CA ASN B 31 25.071 -1.381 -14.060 1.00 1.26 C ATOM 2093 C ASN B 31 25.866 -0.335 -13.274 1.00 1.28 C ATOM 2094 O ASN B 31 26.557 0.487 -13.838 1.00 1.73 O ATOM 2095 CB ASN B 31 24.235 -0.685 -15.134 1.00 1.34 C ATOM 2096 CG ASN B 31 24.824 -0.987 -16.514 1.00 1.68 C ATOM 2097 OD1 ASN B 31 24.302 -1.804 -17.245 1.00 2.40 O ATOM 2098 ND2 ASN B 31 25.901 -0.358 -16.901 1.00 1.85 N ATOM 0 H ASN B 31 23.171 -1.972 -13.277 1.00 1.19 H new ATOM 0 HA ASN B 31 25.765 -2.077 -14.530 1.00 1.26 H new ATOM 0 HB2 ASN B 31 23.202 -1.028 -15.085 1.00 1.34 H new ATOM 0 HB3 ASN B 31 24.222 0.391 -14.960 1.00 1.34 H new ATOM 0 HD21 ASN B 31 26.304 -0.553 -17.818 1.00 1.85 H new ATOM 0 HD22 ASN B 31 26.339 0.328 -16.287 1.00 1.85 H new ATOM 2105 N LEU B 32 25.797 -0.398 -11.975 1.00 1.11 N ATOM 2106 CA LEU B 32 26.565 0.536 -11.098 1.00 1.05 C ATOM 2107 C LEU B 32 26.755 1.916 -11.697 1.00 1.03 C ATOM 2108 O LEU B 32 27.674 2.190 -12.444 1.00 1.08 O ATOM 2109 CB LEU B 32 27.925 -0.074 -10.772 1.00 1.08 C ATOM 2110 CG LEU B 32 28.109 -0.252 -9.246 1.00 1.11 C ATOM 2111 CD1 LEU B 32 28.227 1.111 -8.560 1.00 1.07 C ATOM 2112 CD2 LEU B 32 26.926 -1.014 -8.635 1.00 1.16 C ATOM 0 H LEU B 32 25.226 -1.075 -11.469 1.00 1.11 H new ATOM 0 HA LEU B 32 25.973 0.671 -10.193 1.00 1.05 H new ATOM 0 HB2 LEU B 32 28.021 -1.040 -11.267 1.00 1.08 H new ATOM 0 HB3 LEU B 32 28.716 0.565 -11.164 1.00 1.08 H new ATOM 0 HG LEU B 32 29.023 -0.824 -9.089 1.00 1.11 H new ATOM 0 HD11 LEU B 32 28.356 0.968 -7.487 1.00 1.07 H new ATOM 0 HD12 LEU B 32 29.087 1.647 -8.961 1.00 1.07 H new ATOM 0 HD13 LEU B 32 27.322 1.690 -8.743 1.00 1.07 H new ATOM 0 HD21 LEU B 32 27.080 -1.126 -7.562 1.00 1.16 H new ATOM 0 HD22 LEU B 32 26.005 -0.459 -8.813 1.00 1.16 H new ATOM 0 HD23 LEU B 32 26.851 -1.999 -9.095 1.00 1.16 H new ATOM 2124 N SER B 33 25.933 2.804 -11.262 1.00 0.99 N ATOM 2125 CA SER B 33 26.046 4.225 -11.638 1.00 1.01 C ATOM 2126 C SER B 33 27.323 4.749 -10.965 1.00 0.96 C ATOM 2127 O SER B 33 27.492 5.926 -10.798 1.00 0.96 O ATOM 2128 CB SER B 33 24.817 4.995 -11.150 1.00 0.99 C ATOM 2129 OG SER B 33 24.417 5.922 -12.153 1.00 1.33 O ATOM 0 H SER B 33 25.155 2.597 -10.636 1.00 0.99 H new ATOM 0 HA SER B 33 26.098 4.353 -12.719 1.00 1.01 H new ATOM 0 HB2 SER B 33 24.003 4.304 -10.931 1.00 0.99 H new ATOM 0 HB3 SER B 33 25.047 5.520 -10.223 1.00 0.99 H new ATOM 0 HG SER B 33 23.629 6.417 -11.846 1.00 1.33 H new ATOM 2135 N TYR B 34 28.148 3.836 -10.467 1.00 0.95 N ATOM 2136 CA TYR B 34 29.372 4.173 -9.658 1.00 0.94 C ATOM 2137 C TYR B 34 29.827 5.618 -9.838 1.00 0.96 C ATOM 2138 O TYR B 34 30.106 6.289 -8.864 1.00 0.89 O ATOM 2139 CB TYR B 34 30.518 3.262 -10.095 1.00 1.10 C ATOM 2140 CG TYR B 34 31.287 3.896 -11.229 1.00 1.01 C ATOM 2141 CD1 TYR B 34 32.335 4.786 -10.955 1.00 1.77 C ATOM 2142 CD2 TYR B 34 30.959 3.592 -12.555 1.00 1.81 C ATOM 2143 CE1 TYR B 34 33.050 5.372 -12.006 1.00 2.53 C ATOM 2144 CE2 TYR B 34 31.675 4.177 -13.606 1.00 2.56 C ATOM 2145 CZ TYR B 34 32.720 5.067 -13.331 1.00 2.75 C ATOM 2146 OH TYR B 34 33.427 5.643 -14.367 1.00 3.76 O ATOM 0 H TYR B 34 28.011 2.834 -10.598 1.00 0.95 H new ATOM 0 HA TYR B 34 29.110 4.032 -8.609 1.00 0.94 H new ATOM 0 HB2 TYR B 34 31.185 3.076 -9.253 1.00 1.10 H new ATOM 0 HB3 TYR B 34 30.124 2.295 -10.409 1.00 1.10 H new ATOM 0 HD1 TYR B 34 32.591 5.020 -9.932 1.00 1.77 H new ATOM 0 HD2 TYR B 34 30.153 2.906 -12.768 1.00 1.81 H new ATOM 0 HE1 TYR B 34 33.856 6.059 -11.794 1.00 2.53 H new ATOM 0 HE2 TYR B 34 31.421 3.942 -14.629 1.00 2.56 H new ATOM 0 HH TYR B 34 33.071 5.324 -15.223 1.00 3.76 H new ATOM 2156 N ALA B 35 29.884 6.138 -11.021 1.00 1.07 N ATOM 2157 CA ALA B 35 30.294 7.560 -11.127 1.00 1.15 C ATOM 2158 C ALA B 35 29.337 8.362 -10.242 1.00 1.05 C ATOM 2159 O ALA B 35 29.735 9.199 -9.456 1.00 1.03 O ATOM 2160 CB ALA B 35 30.178 8.031 -12.578 1.00 1.30 C ATOM 0 H ALA B 35 29.672 5.661 -11.897 1.00 1.07 H new ATOM 0 HA ALA B 35 31.329 7.694 -10.811 1.00 1.15 H new ATOM 0 HB1 ALA B 35 30.481 9.076 -12.647 1.00 1.30 H new ATOM 0 HB2 ALA B 35 30.825 7.423 -13.211 1.00 1.30 H new ATOM 0 HB3 ALA B 35 29.145 7.930 -12.912 1.00 1.30 H new ATOM 2166 N LEU B 36 28.071 8.074 -10.364 1.00 1.02 N ATOM 2167 CA LEU B 36 27.030 8.758 -9.542 1.00 0.96 C ATOM 2168 C LEU B 36 26.649 7.901 -8.320 1.00 0.83 C ATOM 2169 O LEU B 36 26.582 8.383 -7.207 1.00 0.79 O ATOM 2170 CB LEU B 36 25.783 8.990 -10.399 1.00 1.03 C ATOM 2171 CG LEU B 36 25.758 10.439 -10.888 1.00 1.16 C ATOM 2172 CD1 LEU B 36 27.027 10.729 -11.690 1.00 1.74 C ATOM 2173 CD2 LEU B 36 24.532 10.653 -11.779 1.00 1.99 C ATOM 0 H LEU B 36 27.705 7.378 -11.013 1.00 1.02 H new ATOM 0 HA LEU B 36 27.432 9.709 -9.192 1.00 0.96 H new ATOM 0 HB2 LEU B 36 25.782 8.309 -11.250 1.00 1.03 H new ATOM 0 HB3 LEU B 36 24.886 8.776 -9.818 1.00 1.03 H new ATOM 0 HG LEU B 36 25.709 11.111 -10.032 1.00 1.16 H new ATOM 0 HD11 LEU B 36 27.009 11.762 -12.038 1.00 1.74 H new ATOM 0 HD12 LEU B 36 27.901 10.575 -11.057 1.00 1.74 H new ATOM 0 HD13 LEU B 36 27.077 10.058 -12.547 1.00 1.74 H new ATOM 0 HD21 LEU B 36 24.512 11.685 -12.129 1.00 1.99 H new ATOM 0 HD22 LEU B 36 24.583 9.981 -12.635 1.00 1.99 H new ATOM 0 HD23 LEU B 36 23.627 10.446 -11.208 1.00 1.99 H new ATOM 2185 N THR B 37 26.352 6.640 -8.544 1.00 0.80 N ATOM 2186 CA THR B 37 25.915 5.736 -7.427 1.00 0.71 C ATOM 2187 C THR B 37 26.733 5.991 -6.165 1.00 0.66 C ATOM 2188 O THR B 37 26.227 5.868 -5.069 1.00 0.61 O ATOM 2189 CB THR B 37 26.051 4.270 -7.853 1.00 0.80 C ATOM 2190 OG1 THR B 37 24.890 3.878 -8.570 1.00 0.93 O ATOM 2191 CG2 THR B 37 26.212 3.375 -6.622 1.00 0.81 C ATOM 0 H THR B 37 26.394 6.195 -9.461 1.00 0.80 H new ATOM 0 HA THR B 37 24.869 5.950 -7.205 1.00 0.71 H new ATOM 0 HB THR B 37 26.931 4.165 -8.487 1.00 0.80 H new ATOM 0 HG1 THR B 37 24.819 2.901 -8.568 1.00 0.93 H new ATOM 0 HG21 THR B 37 26.308 2.336 -6.938 1.00 0.81 H new ATOM 0 HG22 THR B 37 27.105 3.671 -6.071 1.00 0.81 H new ATOM 0 HG23 THR B 37 25.338 3.480 -5.979 1.00 0.81 H new ATOM 2199 N GLY B 38 27.979 6.351 -6.290 1.00 0.69 N ATOM 2200 CA GLY B 38 28.779 6.627 -5.059 1.00 0.68 C ATOM 2201 C GLY B 38 27.946 7.553 -4.167 1.00 0.65 C ATOM 2202 O GLY B 38 28.065 7.563 -2.958 1.00 0.64 O ATOM 0 H GLY B 38 28.474 6.466 -7.174 1.00 0.69 H new ATOM 0 HA2 GLY B 38 29.012 5.699 -4.537 1.00 0.68 H new ATOM 0 HA3 GLY B 38 29.729 7.095 -5.316 1.00 0.68 H new ATOM 2206 N ARG B 39 27.087 8.313 -4.788 1.00 0.67 N ATOM 2207 CA ARG B 39 26.191 9.245 -4.043 1.00 0.69 C ATOM 2208 C ARG B 39 25.171 8.431 -3.245 1.00 0.64 C ATOM 2209 O ARG B 39 24.693 8.849 -2.209 1.00 0.64 O ATOM 2210 CB ARG B 39 25.455 10.127 -5.057 1.00 0.76 C ATOM 2211 CG ARG B 39 24.610 11.177 -4.333 1.00 0.80 C ATOM 2212 CD ARG B 39 23.207 11.214 -4.949 1.00 0.82 C ATOM 2213 NE ARG B 39 22.396 12.267 -4.274 1.00 1.17 N ATOM 2214 CZ ARG B 39 21.122 12.380 -4.539 1.00 1.79 C ATOM 2215 NH1 ARG B 39 20.559 11.571 -5.394 1.00 2.44 N ATOM 2216 NH2 ARG B 39 20.413 13.301 -3.947 1.00 2.34 N ATOM 0 H ARG B 39 26.965 8.328 -5.801 1.00 0.67 H new ATOM 0 HA ARG B 39 26.774 9.865 -3.361 1.00 0.69 H new ATOM 0 HB2 ARG B 39 26.175 10.618 -5.712 1.00 0.76 H new ATOM 0 HB3 ARG B 39 24.817 9.510 -5.690 1.00 0.76 H new ATOM 0 HG2 ARG B 39 24.547 10.940 -3.271 1.00 0.80 H new ATOM 0 HG3 ARG B 39 25.080 12.157 -4.413 1.00 0.80 H new ATOM 0 HD2 ARG B 39 23.273 11.419 -6.017 1.00 0.82 H new ATOM 0 HD3 ARG B 39 22.725 10.243 -4.840 1.00 0.82 H new ATOM 0 HE ARG B 39 22.836 12.899 -3.605 1.00 1.17 H new ATOM 0 HH11 ARG B 39 21.114 10.850 -5.856 1.00 2.44 H new ATOM 0 HH12 ARG B 39 19.564 11.659 -5.601 1.00 2.44 H new ATOM 0 HH21 ARG B 39 20.854 13.932 -3.278 1.00 2.34 H new ATOM 0 HH22 ARG B 39 19.418 13.390 -4.153 1.00 2.34 H new ATOM 2230 N TYR B 40 24.848 7.262 -3.719 1.00 0.60 N ATOM 2231 CA TYR B 40 23.872 6.406 -2.995 1.00 0.56 C ATOM 2232 C TYR B 40 24.571 5.747 -1.811 1.00 0.48 C ATOM 2233 O TYR B 40 24.047 5.696 -0.716 1.00 0.47 O ATOM 2234 CB TYR B 40 23.319 5.341 -3.939 1.00 0.58 C ATOM 2235 CG TYR B 40 22.220 5.951 -4.771 1.00 0.81 C ATOM 2236 CD1 TYR B 40 22.522 6.950 -5.704 1.00 1.61 C ATOM 2237 CD2 TYR B 40 20.900 5.527 -4.604 1.00 1.51 C ATOM 2238 CE1 TYR B 40 21.501 7.522 -6.472 1.00 1.88 C ATOM 2239 CE2 TYR B 40 19.879 6.097 -5.370 1.00 1.79 C ATOM 2240 CZ TYR B 40 20.178 7.095 -6.304 1.00 1.59 C ATOM 2241 OH TYR B 40 19.170 7.660 -7.060 1.00 2.01 O ATOM 0 H TYR B 40 25.220 6.861 -4.580 1.00 0.60 H new ATOM 0 HA TYR B 40 23.044 7.015 -2.633 1.00 0.56 H new ATOM 0 HB2 TYR B 40 24.112 4.959 -4.583 1.00 0.58 H new ATOM 0 HB3 TYR B 40 22.935 4.495 -3.369 1.00 0.58 H new ATOM 0 HD1 TYR B 40 23.543 7.279 -5.831 1.00 1.61 H new ATOM 0 HD2 TYR B 40 20.668 4.758 -3.882 1.00 1.51 H new ATOM 0 HE1 TYR B 40 21.733 8.292 -7.193 1.00 1.88 H new ATOM 0 HE2 TYR B 40 18.859 5.767 -5.241 1.00 1.79 H new ATOM 0 HH TYR B 40 18.323 7.602 -6.571 1.00 2.01 H new ATOM 2251 N ILE B 41 25.760 5.253 -2.019 1.00 0.44 N ATOM 2252 CA ILE B 41 26.499 4.611 -0.901 1.00 0.40 C ATOM 2253 C ILE B 41 26.710 5.645 0.203 1.00 0.41 C ATOM 2254 O ILE B 41 26.433 5.401 1.361 1.00 0.41 O ATOM 2255 CB ILE B 41 27.853 4.110 -1.405 1.00 0.41 C ATOM 2256 CG1 ILE B 41 27.673 2.745 -2.074 1.00 0.53 C ATOM 2257 CG2 ILE B 41 28.824 3.978 -0.231 1.00 0.47 C ATOM 2258 CD1 ILE B 41 28.899 2.429 -2.930 1.00 0.54 C ATOM 0 H ILE B 41 26.249 5.267 -2.914 1.00 0.44 H new ATOM 0 HA ILE B 41 25.930 3.766 -0.513 1.00 0.40 H new ATOM 0 HB ILE B 41 28.255 4.821 -2.127 1.00 0.41 H new ATOM 0 HG12 ILE B 41 27.536 1.973 -1.317 1.00 0.53 H new ATOM 0 HG13 ILE B 41 26.776 2.747 -2.693 1.00 0.53 H new ATOM 0 HG21 ILE B 41 29.788 3.621 -0.594 1.00 0.47 H new ATOM 0 HG22 ILE B 41 28.953 4.950 0.245 1.00 0.47 H new ATOM 0 HG23 ILE B 41 28.424 3.269 0.494 1.00 0.47 H new ATOM 0 HD11 ILE B 41 28.770 1.457 -3.406 1.00 0.54 H new ATOM 0 HD12 ILE B 41 29.015 3.196 -3.696 1.00 0.54 H new ATOM 0 HD13 ILE B 41 29.788 2.409 -2.299 1.00 0.54 H new ATOM 2270 N LYS B 42 27.188 6.807 -0.153 1.00 0.46 N ATOM 2271 CA LYS B 42 27.407 7.864 0.870 1.00 0.50 C ATOM 2272 C LYS B 42 26.090 8.118 1.606 1.00 0.51 C ATOM 2273 O LYS B 42 26.033 8.088 2.818 1.00 0.53 O ATOM 2274 CB LYS B 42 27.878 9.152 0.178 1.00 0.59 C ATOM 2275 CG LYS B 42 27.996 10.295 1.194 1.00 0.89 C ATOM 2276 CD LYS B 42 28.921 9.878 2.341 1.00 0.61 C ATOM 2277 CE LYS B 42 29.528 11.125 2.987 1.00 0.65 C ATOM 2278 NZ LYS B 42 30.597 11.671 2.104 1.00 1.61 N ATOM 0 H LYS B 42 27.435 7.068 -1.108 1.00 0.46 H new ATOM 0 HA LYS B 42 28.168 7.545 1.583 1.00 0.50 H new ATOM 0 HB2 LYS B 42 28.842 8.983 -0.301 1.00 0.59 H new ATOM 0 HB3 LYS B 42 27.175 9.427 -0.608 1.00 0.59 H new ATOM 0 HG2 LYS B 42 28.387 11.188 0.706 1.00 0.89 H new ATOM 0 HG3 LYS B 42 27.011 10.550 1.584 1.00 0.89 H new ATOM 0 HD2 LYS B 42 28.363 9.306 3.083 1.00 0.61 H new ATOM 0 HD3 LYS B 42 29.712 9.228 1.966 1.00 0.61 H new ATOM 0 HE2 LYS B 42 28.755 11.877 3.148 1.00 0.65 H new ATOM 0 HE3 LYS B 42 29.941 10.877 3.965 1.00 0.65 H new ATOM 0 HZ1 LYS B 42 31.247 12.257 2.667 1.00 1.61 H new ATOM 0 HZ2 LYS B 42 31.125 10.886 1.672 1.00 1.61 H new ATOM 0 HZ3 LYS B 42 30.167 12.252 1.356 1.00 1.61 H new ATOM 2292 N MET B 43 25.028 8.362 0.885 1.00 0.55 N ATOM 2293 CA MET B 43 23.718 8.613 1.552 1.00 0.60 C ATOM 2294 C MET B 43 23.410 7.465 2.512 1.00 0.50 C ATOM 2295 O MET B 43 23.094 7.682 3.655 1.00 0.52 O ATOM 2296 CB MET B 43 22.609 8.712 0.499 1.00 0.68 C ATOM 2297 CG MET B 43 21.271 9.028 1.177 1.00 0.78 C ATOM 2298 SD MET B 43 19.988 9.216 -0.085 1.00 1.39 S ATOM 2299 CE MET B 43 20.011 11.023 -0.160 1.00 2.16 C ATOM 0 H MET B 43 25.011 8.398 -0.134 1.00 0.55 H new ATOM 0 HA MET B 43 23.769 9.550 2.107 1.00 0.60 H new ATOM 0 HB2 MET B 43 22.852 9.489 -0.225 1.00 0.68 H new ATOM 0 HB3 MET B 43 22.535 7.775 -0.052 1.00 0.68 H new ATOM 0 HG2 MET B 43 21.003 8.229 1.868 1.00 0.78 H new ATOM 0 HG3 MET B 43 21.355 9.942 1.765 1.00 0.78 H new ATOM 0 HE1 MET B 43 19.280 11.366 -0.892 1.00 2.16 H new ATOM 0 HE2 MET B 43 19.763 11.431 0.820 1.00 2.16 H new ATOM 0 HE3 MET B 43 21.004 11.362 -0.453 1.00 2.16 H new ATOM 2309 N LEU B 44 23.506 6.248 2.062 1.00 0.43 N ATOM 2310 CA LEU B 44 23.211 5.098 2.964 1.00 0.35 C ATOM 2311 C LEU B 44 24.196 5.101 4.140 1.00 0.32 C ATOM 2312 O LEU B 44 23.825 4.900 5.282 1.00 0.35 O ATOM 2313 CB LEU B 44 23.343 3.797 2.171 1.00 0.33 C ATOM 2314 CG LEU B 44 22.145 3.668 1.219 1.00 0.49 C ATOM 2315 CD1 LEU B 44 22.541 2.897 -0.047 1.00 0.90 C ATOM 2316 CD2 LEU B 44 21.018 2.914 1.929 1.00 0.68 C ATOM 0 H LEU B 44 23.775 5.997 1.111 1.00 0.43 H new ATOM 0 HA LEU B 44 22.197 5.183 3.355 1.00 0.35 H new ATOM 0 HB2 LEU B 44 24.275 3.793 1.606 1.00 0.33 H new ATOM 0 HB3 LEU B 44 23.378 2.945 2.849 1.00 0.33 H new ATOM 0 HG LEU B 44 21.814 4.667 0.935 1.00 0.49 H new ATOM 0 HD11 LEU B 44 21.679 2.816 -0.709 1.00 0.90 H new ATOM 0 HD12 LEU B 44 23.343 3.427 -0.560 1.00 0.90 H new ATOM 0 HD13 LEU B 44 22.883 1.899 0.227 1.00 0.90 H new ATOM 0 HD21 LEU B 44 20.164 2.819 1.258 1.00 0.68 H new ATOM 0 HD22 LEU B 44 21.367 1.922 2.214 1.00 0.68 H new ATOM 0 HD23 LEU B 44 20.719 3.463 2.822 1.00 0.68 H new ATOM 2328 N MET B 45 25.445 5.343 3.876 1.00 0.40 N ATOM 2329 CA MET B 45 26.442 5.374 4.980 1.00 0.42 C ATOM 2330 C MET B 45 26.172 6.610 5.843 1.00 0.44 C ATOM 2331 O MET B 45 26.102 6.549 7.054 1.00 0.43 O ATOM 2332 CB MET B 45 27.842 5.471 4.369 1.00 0.52 C ATOM 2333 CG MET B 45 28.905 5.270 5.446 1.00 1.13 C ATOM 2334 SD MET B 45 29.964 3.875 4.993 1.00 0.80 S ATOM 2335 CE MET B 45 31.046 4.770 3.851 1.00 0.83 C ATOM 0 H MET B 45 25.821 5.521 2.945 1.00 0.40 H new ATOM 0 HA MET B 45 26.370 4.475 5.592 1.00 0.42 H new ATOM 0 HB2 MET B 45 27.959 4.719 3.589 1.00 0.52 H new ATOM 0 HB3 MET B 45 27.973 6.444 3.896 1.00 0.52 H new ATOM 0 HG2 MET B 45 29.503 6.175 5.555 1.00 1.13 H new ATOM 0 HG3 MET B 45 28.431 5.083 6.410 1.00 1.13 H new ATOM 0 HE1 MET B 45 31.661 4.059 3.300 1.00 0.83 H new ATOM 0 HE2 MET B 45 30.440 5.345 3.151 1.00 0.83 H new ATOM 0 HE3 MET B 45 31.690 5.446 4.414 1.00 0.83 H new ATOM 2345 N ASP B 46 26.010 7.726 5.199 1.00 0.48 N ATOM 2346 CA ASP B 46 25.728 8.996 5.927 1.00 0.53 C ATOM 2347 C ASP B 46 24.429 8.861 6.729 1.00 0.51 C ATOM 2348 O ASP B 46 24.217 9.563 7.699 1.00 0.55 O ATOM 2349 CB ASP B 46 25.582 10.141 4.926 1.00 0.59 C ATOM 2350 CG ASP B 46 25.836 11.475 5.633 1.00 0.71 C ATOM 2351 OD1 ASP B 46 26.899 11.622 6.212 1.00 1.26 O ATOM 2352 OD2 ASP B 46 24.962 12.325 5.582 1.00 1.30 O ATOM 0 H ASP B 46 26.061 7.817 4.184 1.00 0.48 H new ATOM 0 HA ASP B 46 26.554 9.205 6.607 1.00 0.53 H new ATOM 0 HB2 ASP B 46 26.288 10.012 4.105 1.00 0.59 H new ATOM 0 HB3 ASP B 46 24.582 10.133 4.491 1.00 0.59 H new ATOM 2357 N LEU B 47 23.558 7.970 6.327 1.00 0.48 N ATOM 2358 CA LEU B 47 22.269 7.800 7.065 1.00 0.50 C ATOM 2359 C LEU B 47 22.385 6.632 8.044 1.00 0.46 C ATOM 2360 O LEU B 47 21.454 6.318 8.754 1.00 0.50 O ATOM 2361 CB LEU B 47 21.129 7.551 6.073 1.00 0.51 C ATOM 2362 CG LEU B 47 20.455 8.889 5.705 1.00 0.59 C ATOM 2363 CD1 LEU B 47 21.502 9.944 5.329 1.00 0.59 C ATOM 2364 CD2 LEU B 47 19.504 8.688 4.518 1.00 0.62 C ATOM 0 H LEU B 47 23.683 7.355 5.523 1.00 0.48 H new ATOM 0 HA LEU B 47 22.052 8.710 7.625 1.00 0.50 H new ATOM 0 HB2 LEU B 47 21.515 7.069 5.175 1.00 0.51 H new ATOM 0 HB3 LEU B 47 20.396 6.872 6.510 1.00 0.51 H new ATOM 0 HG LEU B 47 19.897 9.235 6.575 1.00 0.59 H new ATOM 0 HD11 LEU B 47 21.002 10.878 5.074 1.00 0.59 H new ATOM 0 HD12 LEU B 47 22.171 10.110 6.173 1.00 0.59 H new ATOM 0 HD13 LEU B 47 22.079 9.595 4.472 1.00 0.59 H new ATOM 0 HD21 LEU B 47 19.032 9.638 4.265 1.00 0.62 H new ATOM 0 HD22 LEU B 47 20.066 8.322 3.659 1.00 0.62 H new ATOM 0 HD23 LEU B 47 18.737 7.962 4.786 1.00 0.62 H new ATOM 2376 N GLU B 48 23.526 5.992 8.076 1.00 0.42 N ATOM 2377 CA GLU B 48 23.746 4.840 9.004 1.00 0.42 C ATOM 2378 C GLU B 48 23.091 3.586 8.432 1.00 0.39 C ATOM 2379 O GLU B 48 22.115 3.086 8.950 1.00 0.47 O ATOM 2380 CB GLU B 48 23.179 5.134 10.402 1.00 0.47 C ATOM 2381 CG GLU B 48 23.424 6.603 10.770 1.00 1.16 C ATOM 2382 CD GLU B 48 23.878 6.693 12.227 1.00 1.19 C ATOM 2383 OE1 GLU B 48 23.116 6.290 13.091 1.00 1.72 O ATOM 2384 OE2 GLU B 48 24.980 7.163 12.455 1.00 1.69 O ATOM 0 H GLU B 48 24.328 6.222 7.489 1.00 0.42 H new ATOM 0 HA GLU B 48 24.820 4.681 9.101 1.00 0.42 H new ATOM 0 HB2 GLU B 48 22.111 4.919 10.423 1.00 0.47 H new ATOM 0 HB3 GLU B 48 23.650 4.483 11.139 1.00 0.47 H new ATOM 0 HG2 GLU B 48 24.182 7.032 10.114 1.00 1.16 H new ATOM 0 HG3 GLU B 48 22.512 7.182 10.625 1.00 1.16 H new ATOM 2391 N ILE B 49 23.637 3.069 7.370 1.00 0.32 N ATOM 2392 CA ILE B 49 23.078 1.839 6.754 1.00 0.30 C ATOM 2393 C ILE B 49 24.246 1.037 6.189 1.00 0.30 C ATOM 2394 O ILE B 49 24.284 -0.174 6.289 1.00 0.31 O ATOM 2395 CB ILE B 49 22.112 2.213 5.620 1.00 0.29 C ATOM 2396 CG1 ILE B 49 20.778 2.722 6.190 1.00 0.35 C ATOM 2397 CG2 ILE B 49 21.857 0.987 4.743 1.00 0.29 C ATOM 2398 CD1 ILE B 49 20.768 4.251 6.168 1.00 0.51 C ATOM 0 H ILE B 49 24.456 3.451 6.898 1.00 0.32 H new ATOM 0 HA ILE B 49 22.530 1.256 7.495 1.00 0.30 H new ATOM 0 HB ILE B 49 22.563 3.007 5.025 1.00 0.29 H new ATOM 0 HG12 ILE B 49 19.946 2.333 5.602 1.00 0.35 H new ATOM 0 HG13 ILE B 49 20.644 2.361 7.210 1.00 0.35 H new ATOM 0 HG21 ILE B 49 21.171 1.252 3.938 1.00 0.29 H new ATOM 0 HG22 ILE B 49 22.799 0.641 4.318 1.00 0.29 H new ATOM 0 HG23 ILE B 49 21.418 0.193 5.347 1.00 0.29 H new ATOM 0 HD11 ILE B 49 19.823 4.615 6.572 1.00 0.51 H new ATOM 0 HD12 ILE B 49 21.591 4.629 6.774 1.00 0.51 H new ATOM 0 HD13 ILE B 49 20.883 4.601 5.142 1.00 0.51 H new ATOM 2410 N ILE B 50 25.210 1.713 5.613 1.00 0.30 N ATOM 2411 CA ILE B 50 26.398 0.998 5.057 1.00 0.31 C ATOM 2412 C ILE B 50 27.607 1.255 5.954 1.00 0.36 C ATOM 2413 O ILE B 50 27.929 2.390 6.245 1.00 0.57 O ATOM 2414 CB ILE B 50 26.708 1.514 3.655 1.00 0.31 C ATOM 2415 CG1 ILE B 50 25.716 0.907 2.656 1.00 0.35 C ATOM 2416 CG2 ILE B 50 28.133 1.099 3.282 1.00 0.36 C ATOM 2417 CD1 ILE B 50 25.884 1.563 1.279 1.00 0.70 C ATOM 0 H ILE B 50 25.225 2.727 5.505 1.00 0.30 H new ATOM 0 HA ILE B 50 26.182 -0.069 5.013 1.00 0.31 H new ATOM 0 HB ILE B 50 26.621 2.600 3.630 1.00 0.31 H new ATOM 0 HG12 ILE B 50 25.879 -0.168 2.577 1.00 0.35 H new ATOM 0 HG13 ILE B 50 24.696 1.049 3.013 1.00 0.35 H new ATOM 0 HG21 ILE B 50 28.367 1.462 2.281 1.00 0.36 H new ATOM 0 HG22 ILE B 50 28.836 1.527 3.997 1.00 0.36 H new ATOM 0 HG23 ILE B 50 28.212 0.012 3.302 1.00 0.36 H new ATOM 0 HD11 ILE B 50 25.174 1.124 0.578 1.00 0.70 H new ATOM 0 HD12 ILE B 50 25.698 2.634 1.361 1.00 0.70 H new ATOM 0 HD13 ILE B 50 26.899 1.398 0.919 1.00 0.70 H new ATOM 2429 N ARG B 51 28.288 0.222 6.387 1.00 0.42 N ATOM 2430 CA ARG B 51 29.482 0.436 7.253 1.00 0.44 C ATOM 2431 C ARG B 51 30.759 0.251 6.436 1.00 0.44 C ATOM 2432 O ARG B 51 30.748 -0.309 5.358 1.00 0.54 O ATOM 2433 CB ARG B 51 29.481 -0.555 8.412 1.00 0.52 C ATOM 2434 CG ARG B 51 29.586 0.222 9.719 1.00 0.75 C ATOM 2435 CD ARG B 51 29.736 -0.748 10.886 1.00 0.89 C ATOM 2436 NE ARG B 51 31.057 -0.528 11.540 1.00 0.89 N ATOM 2437 CZ ARG B 51 31.270 0.559 12.231 1.00 0.95 C ATOM 2438 NH1 ARG B 51 30.322 1.447 12.360 1.00 1.50 N ATOM 2439 NH2 ARG B 51 32.430 0.757 12.795 1.00 1.24 N ATOM 0 H ARG B 51 28.069 -0.752 6.179 1.00 0.42 H new ATOM 0 HA ARG B 51 29.444 1.451 7.648 1.00 0.44 H new ATOM 0 HB2 ARG B 51 28.568 -1.151 8.399 1.00 0.52 H new ATOM 0 HB3 ARG B 51 30.316 -1.249 8.317 1.00 0.52 H new ATOM 0 HG2 ARG B 51 30.441 0.897 9.683 1.00 0.75 H new ATOM 0 HG3 ARG B 51 28.698 0.839 9.859 1.00 0.75 H new ATOM 0 HD2 ARG B 51 28.931 -0.597 11.605 1.00 0.89 H new ATOM 0 HD3 ARG B 51 29.659 -1.776 10.532 1.00 0.89 H new ATOM 0 HE ARG B 51 31.795 -1.227 11.448 1.00 0.89 H new ATOM 0 HH11 ARG B 51 29.415 1.292 11.921 1.00 1.50 H new ATOM 0 HH12 ARG B 51 30.489 2.296 12.900 1.00 1.50 H new ATOM 0 HH21 ARG B 51 33.170 0.062 12.696 1.00 1.24 H new ATOM 0 HH22 ARG B 51 32.596 1.606 13.335 1.00 1.24 H new ATOM 2453 N GLN B 52 31.860 0.720 6.953 1.00 0.44 N ATOM 2454 CA GLN B 52 33.161 0.585 6.235 1.00 0.48 C ATOM 2455 C GLN B 52 33.979 -0.538 6.867 1.00 0.53 C ATOM 2456 O GLN B 52 34.410 -0.430 7.998 1.00 0.65 O ATOM 2457 CB GLN B 52 33.937 1.899 6.347 1.00 0.61 C ATOM 2458 CG GLN B 52 33.454 2.870 5.268 1.00 1.46 C ATOM 2459 CD GLN B 52 34.210 2.601 3.965 1.00 1.70 C ATOM 2460 OE1 GLN B 52 33.931 1.642 3.274 1.00 2.42 O ATOM 2461 NE2 GLN B 52 35.163 3.413 3.600 1.00 1.80 N ATOM 0 H GLN B 52 31.916 1.197 7.853 1.00 0.44 H new ATOM 0 HA GLN B 52 32.976 0.354 5.186 1.00 0.48 H new ATOM 0 HB2 GLN B 52 33.793 2.336 7.335 1.00 0.61 H new ATOM 0 HB3 GLN B 52 35.005 1.714 6.233 1.00 0.61 H new ATOM 0 HG2 GLN B 52 32.382 2.751 5.110 1.00 1.46 H new ATOM 0 HG3 GLN B 52 33.617 3.899 5.590 1.00 1.46 H new ATOM 0 HE21 GLN B 52 35.397 4.218 4.181 1.00 1.80 H new ATOM 0 HE22 GLN B 52 35.674 3.243 2.734 1.00 1.80 H new ATOM 2470 N GLU B 53 34.213 -1.602 6.145 1.00 0.57 N ATOM 2471 CA GLU B 53 35.021 -2.720 6.697 1.00 0.74 C ATOM 2472 C GLU B 53 36.335 -2.794 5.930 1.00 0.75 C ATOM 2473 O GLU B 53 36.394 -3.277 4.823 1.00 0.76 O ATOM 2474 CB GLU B 53 34.243 -4.023 6.521 1.00 0.90 C ATOM 2475 CG GLU B 53 34.259 -4.815 7.828 1.00 1.02 C ATOM 2476 CD GLU B 53 35.704 -5.118 8.226 1.00 1.37 C ATOM 2477 OE1 GLU B 53 36.294 -5.996 7.618 1.00 1.95 O ATOM 2478 OE2 GLU B 53 36.198 -4.467 9.132 1.00 2.11 O ATOM 0 H GLU B 53 33.876 -1.742 5.193 1.00 0.57 H new ATOM 0 HA GLU B 53 35.225 -2.561 7.756 1.00 0.74 H new ATOM 0 HB2 GLU B 53 33.215 -3.807 6.228 1.00 0.90 H new ATOM 0 HB3 GLU B 53 34.685 -4.616 5.720 1.00 0.90 H new ATOM 0 HG2 GLU B 53 33.766 -4.246 8.616 1.00 1.02 H new ATOM 0 HG3 GLU B 53 33.701 -5.744 7.709 1.00 1.02 H new ATOM 2485 N GLY B 54 37.388 -2.307 6.507 1.00 0.80 N ATOM 2486 CA GLY B 54 38.694 -2.340 5.805 1.00 0.85 C ATOM 2487 C GLY B 54 38.569 -1.612 4.462 1.00 0.74 C ATOM 2488 O GLY B 54 39.151 -2.016 3.476 1.00 0.88 O ATOM 0 H GLY B 54 37.403 -1.886 7.436 1.00 0.80 H new ATOM 0 HA2 GLY B 54 39.461 -1.866 6.418 1.00 0.85 H new ATOM 0 HA3 GLY B 54 39.007 -3.372 5.644 1.00 0.85 H new ATOM 2492 N LYS B 55 37.783 -0.561 4.417 1.00 0.78 N ATOM 2493 CA LYS B 55 37.572 0.193 3.140 1.00 0.78 C ATOM 2494 C LYS B 55 36.527 -0.546 2.304 1.00 0.69 C ATOM 2495 O LYS B 55 36.275 -0.222 1.161 1.00 0.70 O ATOM 2496 CB LYS B 55 38.885 0.291 2.356 1.00 0.91 C ATOM 2497 CG LYS B 55 38.923 1.609 1.581 1.00 1.13 C ATOM 2498 CD LYS B 55 39.897 1.482 0.407 1.00 1.34 C ATOM 2499 CE LYS B 55 40.547 2.839 0.134 1.00 1.60 C ATOM 2500 NZ LYS B 55 41.707 3.027 1.052 1.00 2.11 N ATOM 0 H LYS B 55 37.274 -0.190 5.219 1.00 0.78 H new ATOM 0 HA LYS B 55 37.228 1.203 3.365 1.00 0.78 H new ATOM 0 HB2 LYS B 55 39.733 0.234 3.039 1.00 0.91 H new ATOM 0 HB3 LYS B 55 38.973 -0.550 1.668 1.00 0.91 H new ATOM 0 HG2 LYS B 55 37.927 1.857 1.216 1.00 1.13 H new ATOM 0 HG3 LYS B 55 39.233 2.421 2.239 1.00 1.13 H new ATOM 0 HD2 LYS B 55 40.662 0.740 0.634 1.00 1.34 H new ATOM 0 HD3 LYS B 55 39.369 1.134 -0.481 1.00 1.34 H new ATOM 0 HE2 LYS B 55 40.877 2.894 -0.903 1.00 1.60 H new ATOM 0 HE3 LYS B 55 39.821 3.638 0.280 1.00 1.60 H new ATOM 0 HZ1 LYS B 55 42.150 3.950 0.867 1.00 2.11 H new ATOM 0 HZ2 LYS B 55 41.379 2.992 2.038 1.00 2.11 H new ATOM 0 HZ3 LYS B 55 42.403 2.271 0.892 1.00 2.11 H new ATOM 2514 N GLN B 56 35.940 -1.554 2.880 1.00 0.70 N ATOM 2515 CA GLN B 56 34.927 -2.362 2.159 1.00 0.70 C ATOM 2516 C GLN B 56 33.537 -1.926 2.627 1.00 0.60 C ATOM 2517 O GLN B 56 33.407 -1.306 3.658 1.00 0.60 O ATOM 2518 CB GLN B 56 35.178 -3.827 2.510 1.00 0.85 C ATOM 2519 CG GLN B 56 34.671 -4.755 1.410 1.00 1.17 C ATOM 2520 CD GLN B 56 35.274 -6.147 1.618 1.00 1.15 C ATOM 2521 OE1 GLN B 56 34.566 -7.075 2.197 1.00 1.54 O flip ATOM 2522 NE2 GLN B 56 36.406 -6.391 1.249 1.00 1.66 N flip ATOM 0 H GLN B 56 36.124 -1.856 3.837 1.00 0.70 H new ATOM 0 HA GLN B 56 34.991 -2.225 1.080 1.00 0.70 H new ATOM 0 HB2 GLN B 56 36.245 -3.989 2.662 1.00 0.85 H new ATOM 0 HB3 GLN B 56 34.682 -4.068 3.450 1.00 0.85 H new ATOM 0 HG2 GLN B 56 33.583 -4.808 1.434 1.00 1.17 H new ATOM 0 HG3 GLN B 56 34.950 -4.366 0.431 1.00 1.17 H new ATOM 0 HE21 GLN B 56 36.962 -5.666 0.795 1.00 1.66 H new ATOM 0 HE22 GLN B 56 36.800 -7.321 1.393 1.00 1.66 H new ATOM 2531 N TYR B 57 32.502 -2.212 1.872 1.00 0.56 N ATOM 2532 CA TYR B 57 31.139 -1.764 2.285 1.00 0.48 C ATOM 2533 C TYR B 57 30.330 -2.925 2.858 1.00 0.47 C ATOM 2534 O TYR B 57 30.078 -3.910 2.192 1.00 0.53 O ATOM 2535 CB TYR B 57 30.417 -1.204 1.066 1.00 0.46 C ATOM 2536 CG TYR B 57 31.295 -0.164 0.406 1.00 0.49 C ATOM 2537 CD1 TYR B 57 32.288 -0.556 -0.499 1.00 1.18 C ATOM 2538 CD2 TYR B 57 31.121 1.193 0.705 1.00 1.27 C ATOM 2539 CE1 TYR B 57 33.104 0.407 -1.105 1.00 1.18 C ATOM 2540 CE2 TYR B 57 31.937 2.156 0.100 1.00 1.30 C ATOM 2541 CZ TYR B 57 32.929 1.762 -0.806 1.00 0.57 C ATOM 2542 OH TYR B 57 33.732 2.711 -1.404 1.00 0.63 O ATOM 0 H TYR B 57 32.544 -2.732 0.995 1.00 0.56 H new ATOM 0 HA TYR B 57 31.239 -1.001 3.057 1.00 0.48 H new ATOM 0 HB2 TYR B 57 30.189 -2.005 0.363 1.00 0.46 H new ATOM 0 HB3 TYR B 57 29.467 -0.760 1.363 1.00 0.46 H new ATOM 0 HD1 TYR B 57 32.425 -1.602 -0.730 1.00 1.18 H new ATOM 0 HD2 TYR B 57 30.356 1.497 1.404 1.00 1.27 H new ATOM 0 HE1 TYR B 57 33.869 0.103 -1.804 1.00 1.18 H new ATOM 0 HE2 TYR B 57 31.801 3.202 0.332 1.00 1.30 H new ATOM 0 HH TYR B 57 33.477 3.602 -1.087 1.00 0.63 H new ATOM 2552 N MET B 58 29.933 -2.799 4.099 1.00 0.44 N ATOM 2553 CA MET B 58 29.147 -3.872 4.766 1.00 0.45 C ATOM 2554 C MET B 58 27.891 -3.265 5.392 1.00 0.42 C ATOM 2555 O MET B 58 27.681 -2.069 5.343 1.00 0.40 O ATOM 2556 CB MET B 58 30.004 -4.615 5.806 1.00 0.50 C ATOM 2557 CG MET B 58 29.646 -4.185 7.232 1.00 1.04 C ATOM 2558 SD MET B 58 30.913 -4.789 8.375 1.00 1.10 S ATOM 2559 CE MET B 58 29.800 -5.201 9.743 1.00 1.52 C ATOM 0 H MET B 58 30.125 -1.985 4.683 1.00 0.44 H new ATOM 0 HA MET B 58 28.840 -4.611 4.025 1.00 0.45 H new ATOM 0 HB2 MET B 58 29.857 -5.690 5.700 1.00 0.50 H new ATOM 0 HB3 MET B 58 31.059 -4.418 5.619 1.00 0.50 H new ATOM 0 HG2 MET B 58 29.576 -3.099 7.290 1.00 1.04 H new ATOM 0 HG3 MET B 58 28.670 -4.583 7.510 1.00 1.04 H new ATOM 0 HE1 MET B 58 30.379 -5.600 10.576 1.00 1.52 H new ATOM 0 HE2 MET B 58 29.272 -4.304 10.066 1.00 1.52 H new ATOM 0 HE3 MET B 58 29.078 -5.948 9.412 1.00 1.52 H new ATOM 2569 N LEU B 59 27.028 -4.086 5.916 1.00 0.44 N ATOM 2570 CA LEU B 59 25.750 -3.561 6.472 1.00 0.43 C ATOM 2571 C LEU B 59 25.855 -3.353 7.988 1.00 0.41 C ATOM 2572 O LEU B 59 26.410 -4.158 8.709 1.00 0.47 O ATOM 2573 CB LEU B 59 24.610 -4.552 6.154 1.00 0.51 C ATOM 2574 CG LEU B 59 24.625 -5.782 7.088 1.00 0.77 C ATOM 2575 CD1 LEU B 59 23.455 -6.697 6.724 1.00 1.05 C ATOM 2576 CD2 LEU B 59 25.932 -6.567 6.926 1.00 1.25 C ATOM 0 H LEU B 59 27.150 -5.096 5.984 1.00 0.44 H new ATOM 0 HA LEU B 59 25.539 -2.596 6.012 1.00 0.43 H new ATOM 0 HB2 LEU B 59 23.651 -4.041 6.245 1.00 0.51 H new ATOM 0 HB3 LEU B 59 24.698 -4.883 5.119 1.00 0.51 H new ATOM 0 HG LEU B 59 24.541 -5.440 8.120 1.00 0.77 H new ATOM 0 HD11 LEU B 59 23.457 -7.569 7.379 1.00 1.05 H new ATOM 0 HD12 LEU B 59 22.517 -6.155 6.846 1.00 1.05 H new ATOM 0 HD13 LEU B 59 23.555 -7.021 5.688 1.00 1.05 H new ATOM 0 HD21 LEU B 59 25.923 -7.430 7.592 1.00 1.25 H new ATOM 0 HD22 LEU B 59 26.027 -6.906 5.894 1.00 1.25 H new ATOM 0 HD23 LEU B 59 26.776 -5.924 7.176 1.00 1.25 H new ATOM 2588 N THR B 60 25.334 -2.253 8.466 1.00 0.38 N ATOM 2589 CA THR B 60 25.403 -1.951 9.926 1.00 0.41 C ATOM 2590 C THR B 60 24.078 -2.345 10.581 1.00 0.44 C ATOM 2591 O THR B 60 23.100 -2.591 9.903 1.00 0.43 O ATOM 2592 CB THR B 60 25.625 -0.452 10.129 1.00 0.40 C ATOM 2593 OG1 THR B 60 24.866 -0.012 11.247 1.00 1.04 O ATOM 2594 CG2 THR B 60 25.178 0.304 8.881 1.00 1.01 C ATOM 0 H THR B 60 24.860 -1.546 7.903 1.00 0.38 H new ATOM 0 HA THR B 60 26.226 -2.509 10.373 1.00 0.41 H new ATOM 0 HB THR B 60 26.683 -0.261 10.307 1.00 0.40 H new ATOM 0 HG1 THR B 60 25.008 0.948 11.381 1.00 1.04 H new ATOM 0 HG21 THR B 60 25.337 1.373 9.027 1.00 1.01 H new ATOM 0 HG22 THR B 60 25.758 -0.035 8.023 1.00 1.01 H new ATOM 0 HG23 THR B 60 24.120 0.116 8.701 1.00 1.01 H new ATOM 2602 N LYS B 61 24.042 -2.408 11.890 1.00 0.51 N ATOM 2603 CA LYS B 61 22.776 -2.784 12.597 1.00 0.54 C ATOM 2604 C LYS B 61 21.587 -2.109 11.901 1.00 0.51 C ATOM 2605 O LYS B 61 20.567 -2.715 11.642 1.00 0.50 O ATOM 2606 CB LYS B 61 22.834 -2.321 14.061 1.00 0.61 C ATOM 2607 CG LYS B 61 23.680 -1.047 14.187 1.00 1.28 C ATOM 2608 CD LYS B 61 25.128 -1.410 14.535 1.00 1.04 C ATOM 2609 CE LYS B 61 25.278 -1.511 16.054 1.00 1.73 C ATOM 2610 NZ LYS B 61 25.524 -0.155 16.621 1.00 2.19 N ATOM 0 H LYS B 61 24.836 -2.215 12.501 1.00 0.51 H new ATOM 0 HA LYS B 61 22.658 -3.867 12.567 1.00 0.54 H new ATOM 0 HB2 LYS B 61 21.826 -2.133 14.430 1.00 0.61 H new ATOM 0 HB3 LYS B 61 23.259 -3.110 14.682 1.00 0.61 H new ATOM 0 HG2 LYS B 61 23.652 -0.488 13.252 1.00 1.28 H new ATOM 0 HG3 LYS B 61 23.264 -0.399 14.958 1.00 1.28 H new ATOM 0 HD2 LYS B 61 25.399 -2.357 14.068 1.00 1.04 H new ATOM 0 HD3 LYS B 61 25.808 -0.655 14.141 1.00 1.04 H new ATOM 0 HE2 LYS B 61 24.377 -1.941 16.491 1.00 1.73 H new ATOM 0 HE3 LYS B 61 26.104 -2.177 16.305 1.00 1.73 H new ATOM 0 HZ1 LYS B 61 25.626 -0.224 17.654 1.00 2.19 H new ATOM 0 HZ2 LYS B 61 26.395 0.239 16.213 1.00 2.19 H new ATOM 0 HZ3 LYS B 61 24.722 0.467 16.393 1.00 2.19 H new ATOM 2624 N LYS B 62 21.720 -0.852 11.608 1.00 0.51 N ATOM 2625 CA LYS B 62 20.616 -0.116 10.930 1.00 0.49 C ATOM 2626 C LYS B 62 20.380 -0.703 9.534 1.00 0.45 C ATOM 2627 O LYS B 62 19.272 -0.714 9.034 1.00 0.53 O ATOM 2628 CB LYS B 62 20.984 1.363 10.805 1.00 0.54 C ATOM 2629 CG LYS B 62 20.591 2.104 12.087 1.00 0.75 C ATOM 2630 CD LYS B 62 21.340 1.501 13.277 1.00 1.16 C ATOM 2631 CE LYS B 62 21.111 2.368 14.516 1.00 1.17 C ATOM 2632 NZ LYS B 62 21.908 3.622 14.399 1.00 2.08 N ATOM 0 H LYS B 62 22.551 -0.295 11.809 1.00 0.51 H new ATOM 0 HA LYS B 62 19.706 -0.215 11.521 1.00 0.49 H new ATOM 0 HB2 LYS B 62 22.054 1.467 10.627 1.00 0.54 H new ATOM 0 HB3 LYS B 62 20.474 1.803 9.948 1.00 0.54 H new ATOM 0 HG2 LYS B 62 20.828 3.164 11.994 1.00 0.75 H new ATOM 0 HG3 LYS B 62 19.515 2.031 12.246 1.00 0.75 H new ATOM 0 HD2 LYS B 62 20.992 0.485 13.462 1.00 1.16 H new ATOM 0 HD3 LYS B 62 22.405 1.438 13.056 1.00 1.16 H new ATOM 0 HE2 LYS B 62 20.052 2.606 14.616 1.00 1.17 H new ATOM 0 HE3 LYS B 62 21.401 1.822 15.414 1.00 1.17 H new ATOM 0 HZ1 LYS B 62 21.988 4.071 15.334 1.00 2.08 H new ATOM 0 HZ2 LYS B 62 22.858 3.397 14.040 1.00 2.08 H new ATOM 0 HZ3 LYS B 62 21.435 4.274 13.742 1.00 2.08 H new ATOM 2646 N GLY B 63 21.416 -1.174 8.891 1.00 0.41 N ATOM 2647 CA GLY B 63 21.252 -1.737 7.519 1.00 0.39 C ATOM 2648 C GLY B 63 20.503 -3.072 7.556 1.00 0.38 C ATOM 2649 O GLY B 63 19.634 -3.322 6.743 1.00 0.39 O ATOM 0 H GLY B 63 22.368 -1.193 9.257 1.00 0.41 H new ATOM 0 HA2 GLY B 63 20.708 -1.028 6.895 1.00 0.39 H new ATOM 0 HA3 GLY B 63 22.231 -1.879 7.061 1.00 0.39 H new ATOM 2653 N GLU B 64 20.816 -3.933 8.485 1.00 0.40 N ATOM 2654 CA GLU B 64 20.095 -5.241 8.548 1.00 0.43 C ATOM 2655 C GLU B 64 18.626 -4.995 8.899 1.00 0.43 C ATOM 2656 O GLU B 64 17.725 -5.515 8.268 1.00 0.42 O ATOM 2657 CB GLU B 64 20.728 -6.157 9.595 1.00 0.52 C ATOM 2658 CG GLU B 64 21.909 -5.444 10.233 1.00 0.63 C ATOM 2659 CD GLU B 64 22.562 -6.355 11.273 1.00 0.88 C ATOM 2660 OE1 GLU B 64 21.856 -7.166 11.849 1.00 1.51 O ATOM 2661 OE2 GLU B 64 23.758 -6.225 11.478 1.00 1.45 O ATOM 0 H GLU B 64 21.532 -3.792 9.198 1.00 0.40 H new ATOM 0 HA GLU B 64 20.166 -5.728 7.575 1.00 0.43 H new ATOM 0 HB2 GLU B 64 19.994 -6.422 10.356 1.00 0.52 H new ATOM 0 HB3 GLU B 64 21.056 -7.087 9.131 1.00 0.52 H new ATOM 0 HG2 GLU B 64 22.636 -5.169 9.469 1.00 0.63 H new ATOM 0 HG3 GLU B 64 21.576 -4.519 10.704 1.00 0.63 H new ATOM 2668 N GLU B 65 18.383 -4.203 9.908 1.00 0.46 N ATOM 2669 CA GLU B 65 16.980 -3.916 10.312 1.00 0.49 C ATOM 2670 C GLU B 65 16.235 -3.299 9.129 1.00 0.45 C ATOM 2671 O GLU B 65 15.061 -3.538 8.927 1.00 0.48 O ATOM 2672 CB GLU B 65 16.974 -2.936 11.486 1.00 0.54 C ATOM 2673 CG GLU B 65 17.547 -3.621 12.727 1.00 0.62 C ATOM 2674 CD GLU B 65 17.488 -2.660 13.915 1.00 1.07 C ATOM 2675 OE1 GLU B 65 16.394 -2.242 14.261 1.00 1.66 O ATOM 2676 OE2 GLU B 65 18.536 -2.357 14.461 1.00 1.68 O ATOM 0 H GLU B 65 19.098 -3.742 10.470 1.00 0.46 H new ATOM 0 HA GLU B 65 16.489 -4.841 10.614 1.00 0.49 H new ATOM 0 HB2 GLU B 65 17.565 -2.054 11.240 1.00 0.54 H new ATOM 0 HB3 GLU B 65 15.958 -2.595 11.683 1.00 0.54 H new ATOM 0 HG2 GLU B 65 16.981 -4.526 12.949 1.00 0.62 H new ATOM 0 HG3 GLU B 65 18.577 -3.926 12.544 1.00 0.62 H new ATOM 2683 N LEU B 66 16.912 -2.511 8.339 1.00 0.44 N ATOM 2684 CA LEU B 66 16.247 -1.887 7.164 1.00 0.45 C ATOM 2685 C LEU B 66 15.980 -2.973 6.117 1.00 0.43 C ATOM 2686 O LEU B 66 14.947 -2.996 5.478 1.00 0.45 O ATOM 2687 CB LEU B 66 17.170 -0.796 6.588 1.00 0.46 C ATOM 2688 CG LEU B 66 16.750 -0.396 5.164 1.00 0.64 C ATOM 2689 CD1 LEU B 66 15.313 0.126 5.165 1.00 0.72 C ATOM 2690 CD2 LEU B 66 17.679 0.710 4.669 1.00 1.57 C ATOM 0 H LEU B 66 17.897 -2.273 8.458 1.00 0.44 H new ATOM 0 HA LEU B 66 15.301 -1.431 7.454 1.00 0.45 H new ATOM 0 HB2 LEU B 66 17.146 0.081 7.235 1.00 0.46 H new ATOM 0 HB3 LEU B 66 18.199 -1.157 6.577 1.00 0.46 H new ATOM 0 HG LEU B 66 16.813 -1.267 4.512 1.00 0.64 H new ATOM 0 HD11 LEU B 66 15.027 0.406 4.151 1.00 0.72 H new ATOM 0 HD12 LEU B 66 14.643 -0.653 5.529 1.00 0.72 H new ATOM 0 HD13 LEU B 66 15.243 0.998 5.816 1.00 0.72 H new ATOM 0 HD21 LEU B 66 17.391 1.002 3.659 1.00 1.57 H new ATOM 0 HD22 LEU B 66 17.604 1.572 5.332 1.00 1.57 H new ATOM 0 HD23 LEU B 66 18.706 0.346 4.662 1.00 1.57 H new ATOM 2702 N LEU B 67 16.901 -3.883 5.946 1.00 0.42 N ATOM 2703 CA LEU B 67 16.701 -4.975 4.953 1.00 0.43 C ATOM 2704 C LEU B 67 15.400 -5.714 5.266 1.00 0.45 C ATOM 2705 O LEU B 67 14.630 -6.038 4.383 1.00 0.48 O ATOM 2706 CB LEU B 67 17.879 -5.954 5.024 1.00 0.45 C ATOM 2707 CG LEU B 67 18.180 -6.509 3.627 1.00 0.51 C ATOM 2708 CD1 LEU B 67 19.124 -5.559 2.887 1.00 0.90 C ATOM 2709 CD2 LEU B 67 18.846 -7.880 3.758 1.00 1.26 C ATOM 0 H LEU B 67 17.785 -3.916 6.453 1.00 0.42 H new ATOM 0 HA LEU B 67 16.645 -4.550 3.951 1.00 0.43 H new ATOM 0 HB2 LEU B 67 18.759 -5.449 5.422 1.00 0.45 H new ATOM 0 HB3 LEU B 67 17.644 -6.771 5.707 1.00 0.45 H new ATOM 0 HG LEU B 67 17.249 -6.603 3.069 1.00 0.51 H new ATOM 0 HD11 LEU B 67 19.336 -5.957 1.894 1.00 0.90 H new ATOM 0 HD12 LEU B 67 18.655 -4.580 2.793 1.00 0.90 H new ATOM 0 HD13 LEU B 67 20.055 -5.463 3.446 1.00 0.90 H new ATOM 0 HD21 LEU B 67 19.061 -8.276 2.766 1.00 1.26 H new ATOM 0 HD22 LEU B 67 19.776 -7.781 4.318 1.00 1.26 H new ATOM 0 HD23 LEU B 67 18.177 -8.561 4.284 1.00 1.26 H new ATOM 2721 N GLU B 68 15.146 -5.980 6.519 1.00 0.44 N ATOM 2722 CA GLU B 68 13.892 -6.694 6.889 1.00 0.48 C ATOM 2723 C GLU B 68 12.700 -5.777 6.626 1.00 0.46 C ATOM 2724 O GLU B 68 11.705 -6.181 6.057 1.00 0.47 O ATOM 2725 CB GLU B 68 13.933 -7.064 8.372 1.00 0.52 C ATOM 2726 CG GLU B 68 12.550 -7.541 8.818 1.00 1.26 C ATOM 2727 CD GLU B 68 12.687 -8.411 10.068 1.00 1.77 C ATOM 2728 OE1 GLU B 68 13.057 -9.564 9.926 1.00 2.25 O ATOM 2729 OE2 GLU B 68 12.419 -7.909 11.148 1.00 2.23 O ATOM 0 H GLU B 68 15.753 -5.734 7.301 1.00 0.44 H new ATOM 0 HA GLU B 68 13.797 -7.602 6.294 1.00 0.48 H new ATOM 0 HB2 GLU B 68 14.672 -7.847 8.542 1.00 0.52 H new ATOM 0 HB3 GLU B 68 14.240 -6.202 8.964 1.00 0.52 H new ATOM 0 HG2 GLU B 68 11.909 -6.685 9.027 1.00 1.26 H new ATOM 0 HG3 GLU B 68 12.074 -8.108 8.018 1.00 1.26 H new ATOM 2736 N ASP B 69 12.797 -4.540 7.027 1.00 0.44 N ATOM 2737 CA ASP B 69 11.675 -3.594 6.788 1.00 0.45 C ATOM 2738 C ASP B 69 11.371 -3.560 5.291 1.00 0.45 C ATOM 2739 O ASP B 69 10.232 -3.646 4.874 1.00 0.46 O ATOM 2740 CB ASP B 69 12.072 -2.194 7.263 1.00 0.46 C ATOM 2741 CG ASP B 69 12.666 -2.280 8.670 1.00 0.51 C ATOM 2742 OD1 ASP B 69 12.478 -3.301 9.310 1.00 1.12 O ATOM 2743 OD2 ASP B 69 13.298 -1.323 9.084 1.00 1.25 O ATOM 0 H ASP B 69 13.604 -4.145 7.509 1.00 0.44 H new ATOM 0 HA ASP B 69 10.793 -3.920 7.339 1.00 0.45 H new ATOM 0 HB2 ASP B 69 12.798 -1.758 6.577 1.00 0.46 H new ATOM 0 HB3 ASP B 69 11.201 -1.539 7.264 1.00 0.46 H new ATOM 2748 N ILE B 70 12.385 -3.440 4.477 1.00 0.45 N ATOM 2749 CA ILE B 70 12.162 -3.404 3.005 1.00 0.49 C ATOM 2750 C ILE B 70 11.463 -4.690 2.556 1.00 0.48 C ATOM 2751 O ILE B 70 10.572 -4.673 1.731 1.00 0.50 O ATOM 2752 CB ILE B 70 13.510 -3.283 2.291 1.00 0.56 C ATOM 2753 CG1 ILE B 70 13.965 -1.821 2.308 1.00 0.90 C ATOM 2754 CG2 ILE B 70 13.366 -3.756 0.844 1.00 0.85 C ATOM 2755 CD1 ILE B 70 15.449 -1.743 1.944 1.00 1.29 C ATOM 0 H ILE B 70 13.359 -3.365 4.769 1.00 0.45 H new ATOM 0 HA ILE B 70 11.536 -2.547 2.756 1.00 0.49 H new ATOM 0 HB ILE B 70 14.249 -3.900 2.802 1.00 0.56 H new ATOM 0 HG12 ILE B 70 13.375 -1.237 1.601 1.00 0.90 H new ATOM 0 HG13 ILE B 70 13.799 -1.389 3.295 1.00 0.90 H new ATOM 0 HG21 ILE B 70 14.326 -3.670 0.336 1.00 0.85 H new ATOM 0 HG22 ILE B 70 13.041 -4.796 0.832 1.00 0.85 H new ATOM 0 HG23 ILE B 70 12.628 -3.140 0.331 1.00 0.85 H new ATOM 0 HD11 ILE B 70 15.772 -0.702 1.956 1.00 1.29 H new ATOM 0 HD12 ILE B 70 16.032 -2.313 2.668 1.00 1.29 H new ATOM 0 HD13 ILE B 70 15.602 -2.159 0.948 1.00 1.29 H new ATOM 2767 N ARG B 71 11.856 -5.806 3.099 1.00 0.47 N ATOM 2768 CA ARG B 71 11.212 -7.091 2.711 1.00 0.50 C ATOM 2769 C ARG B 71 9.714 -7.038 3.021 1.00 0.50 C ATOM 2770 O ARG B 71 8.882 -7.323 2.182 1.00 0.54 O ATOM 2771 CB ARG B 71 11.850 -8.236 3.497 1.00 0.52 C ATOM 2772 CG ARG B 71 11.020 -9.504 3.302 1.00 0.82 C ATOM 2773 CD ARG B 71 11.913 -10.731 3.484 1.00 1.02 C ATOM 2774 NE ARG B 71 11.073 -11.904 3.857 1.00 1.57 N ATOM 2775 CZ ARG B 71 11.618 -12.938 4.437 1.00 2.17 C ATOM 2776 NH1 ARG B 71 12.898 -12.947 4.688 1.00 2.58 N ATOM 2777 NH2 ARG B 71 10.880 -13.964 4.765 1.00 2.98 N ATOM 0 H ARG B 71 12.597 -5.885 3.796 1.00 0.47 H new ATOM 0 HA ARG B 71 11.353 -7.253 1.642 1.00 0.50 H new ATOM 0 HB2 ARG B 71 12.873 -8.401 3.157 1.00 0.52 H new ATOM 0 HB3 ARG B 71 11.903 -7.981 4.555 1.00 0.52 H new ATOM 0 HG2 ARG B 71 10.200 -9.528 4.019 1.00 0.82 H new ATOM 0 HG3 ARG B 71 10.574 -9.510 2.307 1.00 0.82 H new ATOM 0 HD2 ARG B 71 12.457 -10.938 2.563 1.00 1.02 H new ATOM 0 HD3 ARG B 71 12.657 -10.542 4.258 1.00 1.02 H new ATOM 0 HE ARG B 71 10.072 -11.899 3.659 1.00 1.57 H new ATOM 0 HH11 ARG B 71 13.474 -12.145 4.431 1.00 2.58 H new ATOM 0 HH12 ARG B 71 13.323 -13.756 5.141 1.00 2.58 H new ATOM 0 HH21 ARG B 71 9.879 -13.956 4.568 1.00 2.98 H new ATOM 0 HH22 ARG B 71 11.304 -14.773 5.218 1.00 2.98 H new ATOM 2791 N LYS B 72 9.370 -6.690 4.231 1.00 0.48 N ATOM 2792 CA LYS B 72 7.933 -6.634 4.621 1.00 0.49 C ATOM 2793 C LYS B 72 7.150 -5.711 3.679 1.00 0.48 C ATOM 2794 O LYS B 72 6.269 -6.144 2.964 1.00 0.51 O ATOM 2795 CB LYS B 72 7.823 -6.104 6.051 1.00 0.49 C ATOM 2796 CG LYS B 72 8.761 -6.897 6.964 1.00 0.65 C ATOM 2797 CD LYS B 72 7.971 -7.437 8.158 1.00 0.91 C ATOM 2798 CE LYS B 72 8.901 -8.246 9.064 1.00 1.46 C ATOM 2799 NZ LYS B 72 8.461 -8.101 10.481 1.00 1.81 N ATOM 0 H LYS B 72 10.027 -6.441 4.970 1.00 0.48 H new ATOM 0 HA LYS B 72 7.512 -7.637 4.556 1.00 0.49 H new ATOM 0 HB2 LYS B 72 8.081 -5.045 6.078 1.00 0.49 H new ATOM 0 HB3 LYS B 72 6.795 -6.191 6.404 1.00 0.49 H new ATOM 0 HG2 LYS B 72 9.214 -7.720 6.412 1.00 0.65 H new ATOM 0 HG3 LYS B 72 9.574 -6.259 7.310 1.00 0.65 H new ATOM 0 HD2 LYS B 72 7.528 -6.613 8.717 1.00 0.91 H new ATOM 0 HD3 LYS B 72 7.150 -8.064 7.810 1.00 0.91 H new ATOM 0 HE2 LYS B 72 8.887 -9.296 8.773 1.00 1.46 H new ATOM 0 HE3 LYS B 72 9.928 -7.898 8.953 1.00 1.46 H new ATOM 0 HZ1 LYS B 72 9.092 -8.650 11.098 1.00 1.81 H new ATOM 0 HZ2 LYS B 72 8.496 -7.098 10.754 1.00 1.81 H new ATOM 0 HZ3 LYS B 72 7.487 -8.453 10.580 1.00 1.81 H new ATOM 2813 N PHE B 73 7.452 -4.439 3.696 1.00 0.47 N ATOM 2814 CA PHE B 73 6.720 -3.464 2.828 1.00 0.48 C ATOM 2815 C PHE B 73 6.498 -4.052 1.433 1.00 0.51 C ATOM 2816 O PHE B 73 5.390 -4.102 0.938 1.00 0.52 O ATOM 2817 CB PHE B 73 7.545 -2.179 2.726 1.00 0.48 C ATOM 2818 CG PHE B 73 7.738 -1.793 1.277 1.00 0.52 C ATOM 2819 CD1 PHE B 73 6.712 -1.148 0.583 1.00 1.25 C ATOM 2820 CD2 PHE B 73 8.947 -2.077 0.632 1.00 1.37 C ATOM 2821 CE1 PHE B 73 6.889 -0.788 -0.758 1.00 1.29 C ATOM 2822 CE2 PHE B 73 9.126 -1.716 -0.709 1.00 1.40 C ATOM 2823 CZ PHE B 73 8.097 -1.072 -1.405 1.00 0.67 C ATOM 0 H PHE B 73 8.181 -4.028 4.279 1.00 0.47 H new ATOM 0 HA PHE B 73 5.746 -3.248 3.267 1.00 0.48 H new ATOM 0 HB2 PHE B 73 7.042 -1.373 3.260 1.00 0.48 H new ATOM 0 HB3 PHE B 73 8.514 -2.322 3.203 1.00 0.48 H new ATOM 0 HD1 PHE B 73 5.780 -0.927 1.082 1.00 1.25 H new ATOM 0 HD2 PHE B 73 9.742 -2.574 1.168 1.00 1.37 H new ATOM 0 HE1 PHE B 73 6.093 -0.291 -1.293 1.00 1.29 H new ATOM 0 HE2 PHE B 73 10.059 -1.935 -1.207 1.00 1.40 H new ATOM 0 HZ PHE B 73 8.235 -0.795 -2.440 1.00 0.67 H new ATOM 2833 N ASN B 74 7.540 -4.497 0.799 1.00 0.52 N ATOM 2834 CA ASN B 74 7.380 -5.081 -0.562 1.00 0.55 C ATOM 2835 C ASN B 74 6.464 -6.302 -0.477 1.00 0.57 C ATOM 2836 O ASN B 74 5.703 -6.583 -1.382 1.00 0.60 O ATOM 2837 CB ASN B 74 8.747 -5.492 -1.113 1.00 0.57 C ATOM 2838 CG ASN B 74 8.595 -5.966 -2.560 1.00 0.79 C ATOM 2839 OD1 ASN B 74 8.502 -7.150 -2.816 1.00 1.73 O ATOM 2840 ND2 ASN B 74 8.564 -5.085 -3.523 1.00 0.99 N ATOM 0 H ASN B 74 8.494 -4.484 1.160 1.00 0.52 H new ATOM 0 HA ASN B 74 6.940 -4.341 -1.230 1.00 0.55 H new ATOM 0 HB2 ASN B 74 9.438 -4.650 -1.066 1.00 0.57 H new ATOM 0 HB3 ASN B 74 9.173 -6.288 -0.502 1.00 0.57 H new ATOM 0 HD21 ASN B 74 8.462 -5.391 -4.491 1.00 0.99 H new ATOM 0 HD22 ASN B 74 8.642 -4.091 -3.308 1.00 0.99 H new ATOM 2847 N GLU B 75 6.532 -7.033 0.598 1.00 0.55 N ATOM 2848 CA GLU B 75 5.669 -8.235 0.734 1.00 0.59 C ATOM 2849 C GLU B 75 4.221 -7.818 0.990 1.00 0.57 C ATOM 2850 O GLU B 75 3.300 -8.508 0.601 1.00 0.68 O ATOM 2851 CB GLU B 75 6.159 -9.078 1.907 1.00 0.62 C ATOM 2852 CG GLU B 75 7.136 -10.134 1.402 1.00 1.10 C ATOM 2853 CD GLU B 75 7.642 -10.965 2.582 1.00 1.46 C ATOM 2854 OE1 GLU B 75 6.818 -11.550 3.265 1.00 1.88 O ATOM 2855 OE2 GLU B 75 8.844 -11.003 2.782 1.00 2.12 O ATOM 0 H GLU B 75 7.149 -6.849 1.389 1.00 0.55 H new ATOM 0 HA GLU B 75 5.719 -8.813 -0.189 1.00 0.59 H new ATOM 0 HB2 GLU B 75 6.645 -8.442 2.647 1.00 0.62 H new ATOM 0 HB3 GLU B 75 5.314 -9.556 2.403 1.00 0.62 H new ATOM 0 HG2 GLU B 75 6.646 -10.779 0.673 1.00 1.10 H new ATOM 0 HG3 GLU B 75 7.974 -9.657 0.894 1.00 1.10 H new ATOM 2862 N MET B 76 3.997 -6.703 1.639 1.00 0.53 N ATOM 2863 CA MET B 76 2.602 -6.269 1.909 1.00 0.51 C ATOM 2864 C MET B 76 2.168 -5.295 0.818 1.00 0.52 C ATOM 2865 O MET B 76 1.034 -5.296 0.383 1.00 0.53 O ATOM 2866 CB MET B 76 2.549 -5.577 3.270 1.00 0.48 C ATOM 2867 CG MET B 76 2.731 -6.624 4.372 1.00 0.48 C ATOM 2868 SD MET B 76 1.151 -6.904 5.209 1.00 0.51 S ATOM 2869 CE MET B 76 1.682 -8.303 6.228 1.00 0.60 C ATOM 0 H MET B 76 4.722 -6.078 1.991 1.00 0.53 H new ATOM 0 HA MET B 76 1.934 -7.130 1.915 1.00 0.51 H new ATOM 0 HB2 MET B 76 3.331 -4.820 3.338 1.00 0.48 H new ATOM 0 HB3 MET B 76 1.596 -5.063 3.394 1.00 0.48 H new ATOM 0 HG2 MET B 76 3.098 -7.557 3.944 1.00 0.48 H new ATOM 0 HG3 MET B 76 3.479 -6.286 5.089 1.00 0.48 H new ATOM 0 HE1 MET B 76 0.847 -8.645 6.840 1.00 0.60 H new ATOM 0 HE2 MET B 76 2.017 -9.116 5.584 1.00 0.60 H new ATOM 0 HE3 MET B 76 2.502 -7.991 6.875 1.00 0.60 H new ATOM 2879 N ARG B 77 3.069 -4.464 0.362 1.00 0.52 N ATOM 2880 CA ARG B 77 2.715 -3.495 -0.709 1.00 0.54 C ATOM 2881 C ARG B 77 2.193 -4.242 -1.938 1.00 0.57 C ATOM 2882 O ARG B 77 1.180 -3.886 -2.505 1.00 0.57 O ATOM 2883 CB ARG B 77 3.953 -2.690 -1.103 1.00 0.54 C ATOM 2884 CG ARG B 77 3.565 -1.634 -2.140 1.00 0.57 C ATOM 2885 CD ARG B 77 4.305 -1.903 -3.451 1.00 0.62 C ATOM 2886 NE ARG B 77 3.814 -0.965 -4.500 1.00 0.86 N ATOM 2887 CZ ARG B 77 4.068 -1.199 -5.760 1.00 1.32 C ATOM 2888 NH1 ARG B 77 4.754 -2.255 -6.102 1.00 1.81 N ATOM 2889 NH2 ARG B 77 3.636 -0.377 -6.676 1.00 1.80 N ATOM 0 H ARG B 77 4.035 -4.417 0.687 1.00 0.52 H new ATOM 0 HA ARG B 77 1.941 -2.824 -0.336 1.00 0.54 H new ATOM 0 HB2 ARG B 77 4.384 -2.211 -0.224 1.00 0.54 H new ATOM 0 HB3 ARG B 77 4.716 -3.353 -1.511 1.00 0.54 H new ATOM 0 HG2 ARG B 77 2.488 -1.654 -2.308 1.00 0.57 H new ATOM 0 HG3 ARG B 77 3.811 -0.639 -1.770 1.00 0.57 H new ATOM 0 HD2 ARG B 77 5.378 -1.776 -3.308 1.00 0.62 H new ATOM 0 HD3 ARG B 77 4.145 -2.934 -3.766 1.00 0.62 H new ATOM 0 HE ARG B 77 3.279 -0.139 -4.234 1.00 0.86 H new ATOM 0 HH11 ARG B 77 5.092 -2.898 -5.386 1.00 1.81 H new ATOM 0 HH12 ARG B 77 4.952 -2.438 -7.086 1.00 1.81 H new ATOM 0 HH21 ARG B 77 3.100 0.449 -6.409 1.00 1.80 H new ATOM 0 HH22 ARG B 77 3.834 -0.560 -7.660 1.00 1.80 H new ATOM 2903 N LYS B 78 2.868 -5.283 -2.348 1.00 0.58 N ATOM 2904 CA LYS B 78 2.387 -6.046 -3.531 1.00 0.61 C ATOM 2905 C LYS B 78 1.040 -6.667 -3.177 1.00 0.60 C ATOM 2906 O LYS B 78 0.162 -6.797 -4.007 1.00 0.62 O ATOM 2907 CB LYS B 78 3.406 -7.135 -3.914 1.00 0.63 C ATOM 2908 CG LYS B 78 3.030 -8.481 -3.279 1.00 1.17 C ATOM 2909 CD LYS B 78 4.198 -9.461 -3.415 1.00 1.22 C ATOM 2910 CE LYS B 78 4.664 -9.513 -4.871 1.00 1.57 C ATOM 2911 NZ LYS B 78 5.442 -10.764 -5.097 1.00 2.26 N ATOM 0 H LYS B 78 3.724 -5.634 -1.918 1.00 0.58 H new ATOM 0 HA LYS B 78 2.275 -5.383 -4.389 1.00 0.61 H new ATOM 0 HB2 LYS B 78 3.445 -7.238 -4.998 1.00 0.63 H new ATOM 0 HB3 LYS B 78 4.402 -6.839 -3.586 1.00 0.63 H new ATOM 0 HG2 LYS B 78 2.781 -8.341 -2.227 1.00 1.17 H new ATOM 0 HG3 LYS B 78 2.143 -8.888 -3.765 1.00 1.17 H new ATOM 0 HD2 LYS B 78 5.021 -9.152 -2.771 1.00 1.22 H new ATOM 0 HD3 LYS B 78 3.892 -10.454 -3.086 1.00 1.22 H new ATOM 0 HE2 LYS B 78 3.805 -9.480 -5.541 1.00 1.57 H new ATOM 0 HE3 LYS B 78 5.279 -8.643 -5.099 1.00 1.57 H new ATOM 0 HZ1 LYS B 78 5.760 -10.801 -6.087 1.00 2.26 H new ATOM 0 HZ2 LYS B 78 6.269 -10.777 -4.467 1.00 2.26 H new ATOM 0 HZ3 LYS B 78 4.840 -11.588 -4.895 1.00 2.26 H new ATOM 2925 N ASN B 79 0.866 -7.029 -1.936 1.00 0.58 N ATOM 2926 CA ASN B 79 -0.435 -7.619 -1.512 1.00 0.58 C ATOM 2927 C ASN B 79 -1.515 -6.551 -1.663 1.00 0.57 C ATOM 2928 O ASN B 79 -2.562 -6.780 -2.235 1.00 0.57 O ATOM 2929 CB ASN B 79 -0.362 -8.063 -0.051 1.00 0.57 C ATOM 2930 CG ASN B 79 -0.996 -9.448 0.094 1.00 0.62 C ATOM 2931 OD1 ASN B 79 -2.200 -9.567 0.212 1.00 1.18 O ATOM 2932 ND2 ASN B 79 -0.234 -10.507 0.090 1.00 1.16 N ATOM 0 H ASN B 79 1.566 -6.942 -1.199 1.00 0.58 H new ATOM 0 HA ASN B 79 -0.665 -8.487 -2.129 1.00 0.58 H new ATOM 0 HB2 ASN B 79 0.676 -8.090 0.280 1.00 0.57 H new ATOM 0 HB3 ASN B 79 -0.881 -7.345 0.585 1.00 0.57 H new ATOM 0 HD21 ASN B 79 -0.649 -11.434 0.186 1.00 1.16 H new ATOM 0 HD22 ASN B 79 0.776 -10.408 -0.009 1.00 1.16 H new ATOM 2939 N MET B 80 -1.257 -5.379 -1.151 1.00 0.57 N ATOM 2940 CA MET B 80 -2.249 -4.276 -1.255 1.00 0.57 C ATOM 2941 C MET B 80 -2.653 -4.095 -2.721 1.00 0.58 C ATOM 2942 O MET B 80 -3.812 -4.215 -3.067 1.00 0.57 O ATOM 2943 CB MET B 80 -1.617 -2.988 -0.713 1.00 0.60 C ATOM 2944 CG MET B 80 -2.590 -1.809 -0.841 1.00 0.69 C ATOM 2945 SD MET B 80 -1.806 -0.495 -1.812 1.00 1.27 S ATOM 2946 CE MET B 80 -3.225 -0.080 -2.856 1.00 1.05 C ATOM 0 H MET B 80 -0.395 -5.138 -0.662 1.00 0.57 H new ATOM 0 HA MET B 80 -3.139 -4.512 -0.672 1.00 0.57 H new ATOM 0 HB2 MET B 80 -1.340 -3.125 0.332 1.00 0.60 H new ATOM 0 HB3 MET B 80 -0.700 -2.770 -1.260 1.00 0.60 H new ATOM 0 HG2 MET B 80 -3.512 -2.133 -1.323 1.00 0.69 H new ATOM 0 HG3 MET B 80 -2.861 -1.436 0.147 1.00 0.69 H new ATOM 0 HE1 MET B 80 -3.098 0.924 -3.260 1.00 1.05 H new ATOM 0 HE2 MET B 80 -3.295 -0.795 -3.676 1.00 1.05 H new ATOM 0 HE3 MET B 80 -4.138 -0.119 -2.262 1.00 1.05 H new ATOM 2956 N ASP B 81 -1.720 -3.817 -3.593 1.00 0.60 N ATOM 2957 CA ASP B 81 -2.071 -3.641 -5.032 1.00 0.62 C ATOM 2958 C ASP B 81 -2.771 -4.896 -5.552 1.00 0.63 C ATOM 2959 O ASP B 81 -3.735 -4.823 -6.287 1.00 0.64 O ATOM 2960 CB ASP B 81 -0.792 -3.408 -5.835 1.00 0.65 C ATOM 2961 CG ASP B 81 -0.922 -2.117 -6.644 1.00 0.67 C ATOM 2962 OD1 ASP B 81 -1.987 -1.893 -7.198 1.00 1.19 O ATOM 2963 OD2 ASP B 81 0.043 -1.374 -6.699 1.00 1.23 O ATOM 0 H ASP B 81 -0.731 -3.704 -3.371 1.00 0.60 H new ATOM 0 HA ASP B 81 -2.739 -2.786 -5.140 1.00 0.62 H new ATOM 0 HB2 ASP B 81 0.064 -3.344 -5.164 1.00 0.65 H new ATOM 0 HB3 ASP B 81 -0.611 -4.251 -6.502 1.00 0.65 H new ATOM 2968 N GLN B 82 -2.303 -6.046 -5.158 1.00 0.64 N ATOM 2969 CA GLN B 82 -2.939 -7.310 -5.595 1.00 0.66 C ATOM 2970 C GLN B 82 -4.373 -7.316 -5.061 1.00 0.63 C ATOM 2971 O GLN B 82 -5.333 -7.527 -5.779 1.00 0.65 O ATOM 2972 CB GLN B 82 -2.119 -8.444 -4.987 1.00 0.68 C ATOM 2973 CG GLN B 82 -2.629 -9.795 -5.459 1.00 1.09 C ATOM 2974 CD GLN B 82 -1.790 -10.272 -6.646 1.00 0.83 C ATOM 2975 OE1 GLN B 82 -1.994 -9.839 -7.763 1.00 1.28 O ATOM 2976 NE2 GLN B 82 -0.843 -11.149 -6.450 1.00 1.41 N ATOM 0 H GLN B 82 -1.497 -6.161 -4.544 1.00 0.64 H new ATOM 0 HA GLN B 82 -2.970 -7.421 -6.679 1.00 0.66 H new ATOM 0 HB2 GLN B 82 -1.071 -8.329 -5.264 1.00 0.68 H new ATOM 0 HB3 GLN B 82 -2.169 -8.392 -3.899 1.00 0.68 H new ATOM 0 HG2 GLN B 82 -2.574 -10.520 -4.647 1.00 1.09 H new ATOM 0 HG3 GLN B 82 -3.677 -9.719 -5.748 1.00 1.09 H new ATOM 0 HE21 GLN B 82 -0.671 -11.513 -5.513 1.00 1.41 H new ATOM 0 HE22 GLN B 82 -0.275 -11.470 -7.234 1.00 1.41 H new ATOM 2985 N LEU B 83 -4.503 -7.047 -3.796 1.00 0.59 N ATOM 2986 CA LEU B 83 -5.854 -6.992 -3.178 1.00 0.56 C ATOM 2987 C LEU B 83 -6.624 -5.854 -3.850 1.00 0.55 C ATOM 2988 O LEU B 83 -7.772 -5.998 -4.222 1.00 0.56 O ATOM 2989 CB LEU B 83 -5.724 -6.729 -1.677 1.00 0.53 C ATOM 2990 CG LEU B 83 -5.140 -7.973 -0.994 1.00 0.53 C ATOM 2991 CD1 LEU B 83 -4.810 -7.652 0.463 1.00 0.55 C ATOM 2992 CD2 LEU B 83 -6.147 -9.132 -1.044 1.00 0.56 C ATOM 0 H LEU B 83 -3.728 -6.862 -3.159 1.00 0.59 H new ATOM 0 HA LEU B 83 -6.381 -7.936 -3.314 1.00 0.56 H new ATOM 0 HB2 LEU B 83 -5.080 -5.867 -1.501 1.00 0.53 H new ATOM 0 HB3 LEU B 83 -6.699 -6.490 -1.252 1.00 0.53 H new ATOM 0 HG LEU B 83 -4.232 -8.268 -1.521 1.00 0.53 H new ATOM 0 HD11 LEU B 83 -4.395 -8.537 0.946 1.00 0.55 H new ATOM 0 HD12 LEU B 83 -4.081 -6.843 0.501 1.00 0.55 H new ATOM 0 HD13 LEU B 83 -5.718 -7.347 0.983 1.00 0.55 H new ATOM 0 HD21 LEU B 83 -5.719 -10.007 -0.556 1.00 0.56 H new ATOM 0 HD22 LEU B 83 -7.063 -8.841 -0.529 1.00 0.56 H new ATOM 0 HD23 LEU B 83 -6.375 -9.371 -2.083 1.00 0.56 H new ATOM 3004 N LYS B 84 -5.986 -4.728 -4.025 1.00 0.55 N ATOM 3005 CA LYS B 84 -6.658 -3.578 -4.693 1.00 0.55 C ATOM 3006 C LYS B 84 -7.266 -4.042 -6.019 1.00 0.58 C ATOM 3007 O LYS B 84 -8.398 -3.736 -6.336 1.00 0.58 O ATOM 3008 CB LYS B 84 -5.628 -2.486 -4.974 1.00 0.56 C ATOM 3009 CG LYS B 84 -6.343 -1.209 -5.420 1.00 0.57 C ATOM 3010 CD LYS B 84 -5.690 -0.682 -6.701 1.00 0.80 C ATOM 3011 CE LYS B 84 -6.385 0.608 -7.138 1.00 0.80 C ATOM 3012 NZ LYS B 84 -6.439 0.662 -8.626 1.00 1.40 N ATOM 0 H LYS B 84 -5.024 -4.555 -3.732 1.00 0.55 H new ATOM 0 HA LYS B 84 -7.443 -3.190 -4.044 1.00 0.55 H new ATOM 0 HB2 LYS B 84 -5.037 -2.290 -4.079 1.00 0.56 H new ATOM 0 HB3 LYS B 84 -4.935 -2.816 -5.748 1.00 0.56 H new ATOM 0 HG2 LYS B 84 -7.400 -1.412 -5.594 1.00 0.57 H new ATOM 0 HG3 LYS B 84 -6.289 -0.455 -4.634 1.00 0.57 H new ATOM 0 HD2 LYS B 84 -4.630 -0.496 -6.531 1.00 0.80 H new ATOM 0 HD3 LYS B 84 -5.759 -1.430 -7.491 1.00 0.80 H new ATOM 0 HE2 LYS B 84 -7.393 0.649 -6.725 1.00 0.80 H new ATOM 0 HE3 LYS B 84 -5.847 1.473 -6.751 1.00 0.80 H new ATOM 0 HZ1 LYS B 84 -6.912 1.539 -8.925 1.00 1.40 H new ATOM 0 HZ2 LYS B 84 -5.472 0.642 -9.009 1.00 1.40 H new ATOM 0 HZ3 LYS B 84 -6.971 -0.157 -8.984 1.00 1.40 H new ATOM 3026 N GLU B 85 -6.516 -4.775 -6.799 1.00 0.60 N ATOM 3027 CA GLU B 85 -7.040 -5.256 -8.107 1.00 0.63 C ATOM 3028 C GLU B 85 -8.240 -6.170 -7.871 1.00 0.63 C ATOM 3029 O GLU B 85 -9.188 -6.178 -8.631 1.00 0.64 O ATOM 3030 CB GLU B 85 -5.948 -6.043 -8.837 1.00 0.66 C ATOM 3031 CG GLU B 85 -6.597 -7.036 -9.805 1.00 0.69 C ATOM 3032 CD GLU B 85 -5.573 -7.461 -10.860 1.00 0.73 C ATOM 3033 OE1 GLU B 85 -4.908 -6.591 -11.397 1.00 1.28 O ATOM 3034 OE2 GLU B 85 -5.472 -8.651 -11.112 1.00 1.21 O ATOM 0 H GLU B 85 -5.561 -5.061 -6.584 1.00 0.60 H new ATOM 0 HA GLU B 85 -7.343 -4.400 -8.710 1.00 0.63 H new ATOM 0 HB2 GLU B 85 -5.295 -5.361 -9.382 1.00 0.66 H new ATOM 0 HB3 GLU B 85 -5.325 -6.574 -8.118 1.00 0.66 H new ATOM 0 HG2 GLU B 85 -6.958 -7.909 -9.260 1.00 0.69 H new ATOM 0 HG3 GLU B 85 -7.462 -6.580 -10.285 1.00 0.69 H new ATOM 3041 N LYS B 86 -8.214 -6.930 -6.817 1.00 0.63 N ATOM 3042 CA LYS B 86 -9.363 -7.830 -6.525 1.00 0.63 C ATOM 3043 C LYS B 86 -10.596 -6.968 -6.260 1.00 0.61 C ATOM 3044 O LYS B 86 -11.693 -7.275 -6.687 1.00 0.62 O ATOM 3045 CB LYS B 86 -9.047 -8.674 -5.283 1.00 0.64 C ATOM 3046 CG LYS B 86 -8.798 -10.136 -5.676 1.00 0.70 C ATOM 3047 CD LYS B 86 -10.136 -10.852 -5.885 1.00 0.89 C ATOM 3048 CE LYS B 86 -9.885 -12.232 -6.494 1.00 1.09 C ATOM 3049 NZ LYS B 86 -9.106 -13.064 -5.533 1.00 0.99 N ATOM 0 H LYS B 86 -7.448 -6.969 -6.144 1.00 0.63 H new ATOM 0 HA LYS B 86 -9.546 -8.494 -7.369 1.00 0.63 H new ATOM 0 HB2 LYS B 86 -8.169 -8.273 -4.777 1.00 0.64 H new ATOM 0 HB3 LYS B 86 -9.875 -8.617 -4.577 1.00 0.64 H new ATOM 0 HG2 LYS B 86 -8.205 -10.181 -6.589 1.00 0.70 H new ATOM 0 HG3 LYS B 86 -8.224 -10.639 -4.898 1.00 0.70 H new ATOM 0 HD2 LYS B 86 -10.660 -10.952 -4.934 1.00 0.89 H new ATOM 0 HD3 LYS B 86 -10.777 -10.264 -6.542 1.00 0.89 H new ATOM 0 HE2 LYS B 86 -10.833 -12.717 -6.726 1.00 1.09 H new ATOM 0 HE3 LYS B 86 -9.339 -12.134 -7.432 1.00 1.09 H new ATOM 0 HZ1 LYS B 86 -9.122 -14.057 -5.841 1.00 0.99 H new ATOM 0 HZ2 LYS B 86 -8.122 -12.728 -5.501 1.00 0.99 H new ATOM 0 HZ3 LYS B 86 -9.529 -12.988 -4.586 1.00 0.99 H new ATOM 3063 N ILE B 87 -10.414 -5.883 -5.561 1.00 0.59 N ATOM 3064 CA ILE B 87 -11.560 -4.983 -5.261 1.00 0.57 C ATOM 3065 C ILE B 87 -12.079 -4.369 -6.559 1.00 0.57 C ATOM 3066 O ILE B 87 -13.264 -4.380 -6.822 1.00 0.55 O ATOM 3067 CB ILE B 87 -11.098 -3.874 -4.310 1.00 0.59 C ATOM 3068 CG1 ILE B 87 -10.584 -4.504 -3.012 1.00 0.65 C ATOM 3069 CG2 ILE B 87 -12.266 -2.937 -3.991 1.00 0.68 C ATOM 3070 CD1 ILE B 87 -9.827 -3.456 -2.191 1.00 0.70 C ATOM 0 H ILE B 87 -9.516 -5.580 -5.183 1.00 0.59 H new ATOM 0 HA ILE B 87 -12.361 -5.553 -4.789 1.00 0.57 H new ATOM 0 HB ILE B 87 -10.301 -3.302 -4.786 1.00 0.59 H new ATOM 0 HG12 ILE B 87 -11.419 -4.899 -2.433 1.00 0.65 H new ATOM 0 HG13 ILE B 87 -9.928 -5.344 -3.240 1.00 0.65 H new ATOM 0 HG21 ILE B 87 -11.928 -2.152 -3.314 1.00 0.68 H new ATOM 0 HG22 ILE B 87 -12.634 -2.488 -4.913 1.00 0.68 H new ATOM 0 HG23 ILE B 87 -13.068 -3.503 -3.518 1.00 0.68 H new ATOM 0 HD11 ILE B 87 -9.464 -3.909 -1.269 1.00 0.70 H new ATOM 0 HD12 ILE B 87 -8.982 -3.082 -2.769 1.00 0.70 H new ATOM 0 HD13 ILE B 87 -10.496 -2.630 -1.950 1.00 0.70 H new ATOM 3082 N ASN B 88 -11.215 -3.836 -7.380 1.00 0.60 N ATOM 3083 CA ASN B 88 -11.684 -3.233 -8.654 1.00 0.63 C ATOM 3084 C ASN B 88 -12.400 -4.282 -9.504 1.00 0.63 C ATOM 3085 O ASN B 88 -13.320 -3.977 -10.230 1.00 0.64 O ATOM 3086 CB ASN B 88 -10.479 -2.702 -9.436 1.00 0.70 C ATOM 3087 CG ASN B 88 -10.184 -3.633 -10.614 1.00 1.78 C ATOM 3088 OD1 ASN B 88 -9.327 -4.606 -10.463 1.00 2.47 O flip ATOM 3089 ND2 ASN B 88 -10.739 -3.475 -11.683 1.00 2.62 N flip ATOM 0 H ASN B 88 -10.208 -3.793 -7.222 1.00 0.60 H new ATOM 0 HA ASN B 88 -12.375 -2.421 -8.426 1.00 0.63 H new ATOM 0 HB2 ASN B 88 -10.682 -1.694 -9.798 1.00 0.70 H new ATOM 0 HB3 ASN B 88 -9.608 -2.637 -8.783 1.00 0.70 H new ATOM 0 HD21 ASN B 88 -11.409 -2.715 -11.802 1.00 2.62 H new ATOM 0 HD22 ASN B 88 -10.535 -4.102 -12.461 1.00 2.62 H new ATOM 3096 N SER B 89 -11.973 -5.511 -9.439 1.00 0.64 N ATOM 3097 CA SER B 89 -12.616 -6.567 -10.269 1.00 0.68 C ATOM 3098 C SER B 89 -14.054 -6.844 -9.813 1.00 0.67 C ATOM 3099 O SER B 89 -14.955 -6.946 -10.622 1.00 0.74 O ATOM 3100 CB SER B 89 -11.799 -7.855 -10.163 1.00 0.70 C ATOM 3101 OG SER B 89 -12.222 -8.587 -9.020 1.00 1.23 O ATOM 0 H SER B 89 -11.206 -5.831 -8.847 1.00 0.64 H new ATOM 0 HA SER B 89 -12.648 -6.217 -11.301 1.00 0.68 H new ATOM 0 HB2 SER B 89 -11.929 -8.457 -11.063 1.00 0.70 H new ATOM 0 HB3 SER B 89 -10.737 -7.621 -10.086 1.00 0.70 H new ATOM 0 HG SER B 89 -11.940 -8.117 -8.208 1.00 1.23 H new ATOM 3107 N VAL B 90 -14.284 -6.988 -8.535 1.00 0.63 N ATOM 3108 CA VAL B 90 -15.664 -7.283 -8.045 1.00 0.64 C ATOM 3109 C VAL B 90 -16.503 -6.010 -7.988 1.00 0.57 C ATOM 3110 O VAL B 90 -17.650 -5.983 -8.390 1.00 0.59 O ATOM 3111 CB VAL B 90 -15.576 -7.878 -6.645 1.00 0.66 C ATOM 3112 CG1 VAL B 90 -16.917 -8.516 -6.274 1.00 0.66 C ATOM 3113 CG2 VAL B 90 -14.478 -8.945 -6.615 1.00 0.89 C ATOM 0 H VAL B 90 -13.574 -6.914 -7.806 1.00 0.63 H new ATOM 0 HA VAL B 90 -16.136 -7.985 -8.732 1.00 0.64 H new ATOM 0 HB VAL B 90 -15.340 -7.090 -5.930 1.00 0.66 H new ATOM 0 HG11 VAL B 90 -16.853 -8.941 -5.272 1.00 0.66 H new ATOM 0 HG12 VAL B 90 -17.699 -7.757 -6.297 1.00 0.66 H new ATOM 0 HG13 VAL B 90 -17.155 -9.304 -6.988 1.00 0.66 H new ATOM 0 HG21 VAL B 90 -14.413 -9.372 -5.614 1.00 0.89 H new ATOM 0 HG22 VAL B 90 -14.716 -9.732 -7.331 1.00 0.89 H new ATOM 0 HG23 VAL B 90 -13.523 -8.491 -6.879 1.00 0.89 H new ATOM 3123 N LEU B 91 -15.934 -4.957 -7.481 1.00 0.51 N ATOM 3124 CA LEU B 91 -16.675 -3.678 -7.380 1.00 0.49 C ATOM 3125 C LEU B 91 -16.694 -3.020 -8.752 1.00 0.57 C ATOM 3126 O LEU B 91 -17.456 -2.109 -9.003 1.00 0.61 O ATOM 3127 CB LEU B 91 -15.956 -2.773 -6.368 1.00 0.47 C ATOM 3128 CG LEU B 91 -16.578 -1.372 -6.352 1.00 0.59 C ATOM 3129 CD1 LEU B 91 -18.079 -1.473 -6.089 1.00 0.91 C ATOM 3130 CD2 LEU B 91 -15.927 -0.546 -5.242 1.00 0.84 C ATOM 0 H LEU B 91 -14.977 -4.929 -7.129 1.00 0.51 H new ATOM 0 HA LEU B 91 -17.699 -3.848 -7.047 1.00 0.49 H new ATOM 0 HB2 LEU B 91 -16.016 -3.214 -5.373 1.00 0.47 H new ATOM 0 HB3 LEU B 91 -14.898 -2.703 -6.623 1.00 0.47 H new ATOM 0 HG LEU B 91 -16.413 -0.894 -7.317 1.00 0.59 H new ATOM 0 HD11 LEU B 91 -18.515 -0.474 -6.079 1.00 0.91 H new ATOM 0 HD12 LEU B 91 -18.547 -2.065 -6.875 1.00 0.91 H new ATOM 0 HD13 LEU B 91 -18.248 -1.952 -5.125 1.00 0.91 H new ATOM 0 HD21 LEU B 91 -16.366 0.452 -5.226 1.00 0.84 H new ATOM 0 HD22 LEU B 91 -16.095 -1.032 -4.281 1.00 0.84 H new ATOM 0 HD23 LEU B 91 -14.856 -0.468 -5.427 1.00 0.84 H new ATOM 3142 N SER B 92 -15.880 -3.504 -9.652 1.00 0.63 N ATOM 3143 CA SER B 92 -15.840 -2.929 -11.038 1.00 0.76 C ATOM 3144 C SER B 92 -15.483 -1.431 -10.988 1.00 0.83 C ATOM 3145 O SER B 92 -14.984 -0.875 -11.944 1.00 1.11 O ATOM 3146 CB SER B 92 -17.208 -3.102 -11.709 1.00 0.72 C ATOM 3147 OG SER B 92 -17.132 -4.155 -12.660 1.00 0.89 O ATOM 0 H SER B 92 -15.235 -4.278 -9.490 1.00 0.63 H new ATOM 0 HA SER B 92 -15.079 -3.457 -11.612 1.00 0.76 H new ATOM 0 HB2 SER B 92 -17.968 -3.326 -10.960 1.00 0.72 H new ATOM 0 HB3 SER B 92 -17.506 -2.175 -12.198 1.00 0.72 H new ATOM 0 HG SER B 92 -16.251 -4.145 -13.090 1.00 0.89 H new ATOM 3153 N ILE B 93 -15.777 -0.778 -9.893 1.00 0.74 N ATOM 3154 CA ILE B 93 -15.510 0.689 -9.757 1.00 0.82 C ATOM 3155 C ILE B 93 -16.398 1.471 -10.728 1.00 1.03 C ATOM 3156 O ILE B 93 -17.244 2.238 -10.314 1.00 1.11 O ATOM 3157 CB ILE B 93 -14.041 1.012 -10.036 1.00 0.92 C ATOM 3158 CG1 ILE B 93 -13.154 0.004 -9.284 1.00 0.87 C ATOM 3159 CG2 ILE B 93 -13.762 2.447 -9.573 1.00 1.13 C ATOM 3160 CD1 ILE B 93 -11.934 0.696 -8.657 1.00 1.43 C ATOM 0 H ILE B 93 -16.200 -1.207 -9.070 1.00 0.74 H new ATOM 0 HA ILE B 93 -15.738 0.980 -8.732 1.00 0.82 H new ATOM 0 HB ILE B 93 -13.820 0.936 -11.101 1.00 0.92 H new ATOM 0 HG12 ILE B 93 -13.737 -0.487 -8.505 1.00 0.87 H new ATOM 0 HG13 ILE B 93 -12.821 -0.774 -9.971 1.00 0.87 H new ATOM 0 HG21 ILE B 93 -12.718 2.695 -9.765 1.00 1.13 H new ATOM 0 HG22 ILE B 93 -14.405 3.137 -10.120 1.00 1.13 H new ATOM 0 HG23 ILE B 93 -13.965 2.531 -8.505 1.00 1.13 H new ATOM 0 HD11 ILE B 93 -11.327 -0.042 -8.133 1.00 1.43 H new ATOM 0 HD12 ILE B 93 -11.339 1.165 -9.441 1.00 1.43 H new ATOM 0 HD13 ILE B 93 -12.270 1.457 -7.952 1.00 1.43 H new ATOM 3172 N ARG B 94 -16.223 1.274 -12.010 1.00 1.25 N ATOM 3173 CA ARG B 94 -17.061 2.004 -13.014 1.00 1.52 C ATOM 3174 C ARG B 94 -17.439 1.052 -14.151 1.00 1.60 C ATOM 3175 O ARG B 94 -18.144 1.420 -15.070 1.00 1.76 O ATOM 3176 CB ARG B 94 -16.268 3.170 -13.616 1.00 1.97 C ATOM 3177 CG ARG B 94 -15.955 4.221 -12.547 1.00 2.23 C ATOM 3178 CD ARG B 94 -14.439 4.347 -12.383 1.00 2.52 C ATOM 3179 NE ARG B 94 -14.138 5.223 -11.216 1.00 3.12 N ATOM 3180 CZ ARG B 94 -12.913 5.332 -10.781 1.00 3.73 C ATOM 3181 NH1 ARG B 94 -11.952 4.670 -11.366 1.00 3.88 N ATOM 3182 NH2 ARG B 94 -12.649 6.100 -9.760 1.00 4.55 N ATOM 0 H ARG B 94 -15.533 0.637 -12.408 1.00 1.25 H new ATOM 0 HA ARG B 94 -17.954 2.379 -12.514 1.00 1.52 H new ATOM 0 HB2 ARG B 94 -15.340 2.799 -14.051 1.00 1.97 H new ATOM 0 HB3 ARG B 94 -16.839 3.626 -14.425 1.00 1.97 H new ATOM 0 HG2 ARG B 94 -16.382 5.183 -12.832 1.00 2.23 H new ATOM 0 HG3 ARG B 94 -16.412 3.938 -11.599 1.00 2.23 H new ATOM 0 HD2 ARG B 94 -13.995 3.362 -12.237 1.00 2.52 H new ATOM 0 HD3 ARG B 94 -13.998 4.764 -13.288 1.00 2.52 H new ATOM 0 HE ARG B 94 -14.890 5.737 -10.757 1.00 3.12 H new ATOM 0 HH11 ARG B 94 -12.159 4.068 -12.163 1.00 3.88 H new ATOM 0 HH12 ARG B 94 -10.994 4.755 -11.026 1.00 3.88 H new ATOM 0 HH21 ARG B 94 -13.401 6.615 -9.302 1.00 4.55 H new ATOM 0 HH22 ARG B 94 -11.691 6.185 -9.420 1.00 4.55 H new ATOM 3196 N GLN B 95 -16.980 -0.168 -14.101 1.00 1.55 N ATOM 3197 CA GLN B 95 -17.321 -1.134 -15.183 1.00 1.73 C ATOM 3198 C GLN B 95 -16.978 -2.555 -14.731 1.00 2.40 C ATOM 3199 O GLN B 95 -17.758 -3.449 -15.011 1.00 2.92 O ATOM 3200 CB GLN B 95 -16.530 -0.791 -16.450 1.00 1.94 C ATOM 3201 CG GLN B 95 -15.034 -0.731 -16.128 1.00 2.44 C ATOM 3202 CD GLN B 95 -14.308 -1.853 -16.872 1.00 2.98 C ATOM 3203 OE1 GLN B 95 -13.885 -2.822 -16.271 1.00 3.53 O ATOM 3204 NE2 GLN B 95 -14.145 -1.765 -18.164 1.00 3.31 N ATOM 3205 OXT GLN B 95 -15.940 -2.725 -14.115 1.00 3.00 O ATOM 0 H GLN B 95 -16.385 -0.537 -13.359 1.00 1.55 H new ATOM 0 HA GLN B 95 -18.388 -1.072 -15.397 1.00 1.73 H new ATOM 0 HB2 GLN B 95 -16.716 -1.540 -17.220 1.00 1.94 H new ATOM 0 HB3 GLN B 95 -16.864 0.166 -16.850 1.00 1.94 H new ATOM 0 HG2 GLN B 95 -14.627 0.237 -16.420 1.00 2.44 H new ATOM 0 HG3 GLN B 95 -14.878 -0.832 -15.054 1.00 2.44 H new ATOM 0 HE21 GLN B 95 -14.500 -0.953 -18.669 1.00 3.31 H new ATOM 0 HE22 GLN B 95 -13.663 -2.509 -18.669 1.00 3.31 H new TER 3214 GLN B 95