USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 738 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 NoAdj-H: A 30 HIS HD1 : A 30 HIS ND1 : A 201 ZNZN :(H bumps) USER MOD NoAdj-H: A 91 HIS HD1 : A 91 HIS ND1 : A 601 ZNZN :(H bumps) USER MOD Single : A 1 GLY N :NH3+ -118:sc= 0.0524 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.0946 USER MOD Single : A 5 SER OG : rot 38:sc= 0.377 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00569) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 HIS : no HE2:sc= -1.54 K(o=-1.5,f=-0.67) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 32 THR OG1 : rot -33:sc= 0.343 USER MOD Single : A 38 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0438) USER MOD Single : A 41 HIS : no HD1:sc= -2.78 K(o=-2.8,f=-1.4) USER MOD Single : A 45 ASN : amide:sc= -0.364 X(o=-0.36,f=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.134 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc=-0.000409 X(o=-0.00041,f=-0.15) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 ASN : amide:sc= -0.88 K(o=-0.88,f=-7.9!) USER MOD Single : A 59 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.114) USER MOD Single : A 61 THR OG1 : rot -30:sc= -0.867 USER MOD Single : A 62 THR OG1 : rot 92:sc= 1.27 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 170:sc=-0.00292 (180deg=-0.118) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0435) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 ASN : amide:sc= -4.38! C(o=-4.4!,f=-7.6!) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.0175 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -5.005 31.587 -10.910 1.00 0.00 N ATOM 2 CA GLY A 1 -4.369 30.364 -10.455 1.00 0.00 C ATOM 3 C GLY A 1 -4.457 29.250 -11.478 1.00 0.00 C ATOM 4 O GLY A 1 -4.706 29.499 -12.658 1.00 0.00 O ATOM 0 H1 GLY A 1 -4.296 32.345 -10.970 1.00 0.00 H new ATOM 0 H2 GLY A 1 -5.426 31.431 -11.848 1.00 0.00 H new ATOM 0 H3 GLY A 1 -5.749 31.862 -10.238 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -3.321 30.565 -10.230 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -4.838 30.038 -9.526 1.00 0.00 H new ATOM 8 N SER A 2 -4.250 28.017 -11.027 1.00 0.00 N ATOM 9 CA SER A 2 -4.302 26.860 -11.913 1.00 0.00 C ATOM 10 C SER A 2 -3.252 26.972 -13.015 1.00 0.00 C ATOM 11 O SER A 2 -3.532 26.707 -14.184 1.00 0.00 O ATOM 12 CB SER A 2 -5.694 26.726 -12.532 1.00 0.00 C ATOM 13 OG SER A 2 -6.608 26.153 -11.613 1.00 0.00 O ATOM 0 H SER A 2 -4.045 27.793 -10.053 1.00 0.00 H new ATOM 0 HA SER A 2 -4.089 25.970 -11.320 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.053 27.707 -12.843 1.00 0.00 H new ATOM 0 HB3 SER A 2 -5.639 26.108 -13.428 1.00 0.00 H new ATOM 0 HG SER A 2 -7.491 26.080 -12.032 1.00 0.00 H new ATOM 19 N SER A 3 -2.042 27.369 -12.633 1.00 0.00 N ATOM 20 CA SER A 3 -0.951 27.521 -13.587 1.00 0.00 C ATOM 21 C SER A 3 -0.652 26.198 -14.286 1.00 0.00 C ATOM 22 O SER A 3 -0.445 26.156 -15.498 1.00 0.00 O ATOM 23 CB SER A 3 0.306 28.032 -12.880 1.00 0.00 C ATOM 24 OG SER A 3 0.890 27.018 -12.081 1.00 0.00 O ATOM 0 H SER A 3 -1.793 27.591 -11.669 1.00 0.00 H new ATOM 0 HA SER A 3 -1.258 28.248 -14.339 1.00 0.00 H new ATOM 0 HB2 SER A 3 1.028 28.377 -13.620 1.00 0.00 H new ATOM 0 HB3 SER A 3 0.053 28.890 -12.257 1.00 0.00 H new ATOM 0 HG SER A 3 1.692 27.369 -11.641 1.00 0.00 H new ATOM 30 N GLY A 4 -0.631 25.117 -13.511 1.00 0.00 N ATOM 31 CA GLY A 4 -0.357 23.807 -14.072 1.00 0.00 C ATOM 32 C GLY A 4 -1.505 23.285 -14.913 1.00 0.00 C ATOM 33 O GLY A 4 -1.289 22.605 -15.916 1.00 0.00 O ATOM 0 H GLY A 4 -0.799 25.126 -12.505 1.00 0.00 H new ATOM 0 HA2 GLY A 4 0.544 23.858 -14.684 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -0.154 23.104 -13.264 1.00 0.00 H new ATOM 37 N SER A 5 -2.729 23.602 -14.503 1.00 0.00 N ATOM 38 CA SER A 5 -3.915 23.155 -15.223 1.00 0.00 C ATOM 39 C SER A 5 -3.957 21.632 -15.311 1.00 0.00 C ATOM 40 O SER A 5 -4.225 21.068 -16.371 1.00 0.00 O ATOM 41 CB SER A 5 -3.943 23.759 -16.629 1.00 0.00 C ATOM 42 OG SER A 5 -4.409 25.097 -16.600 1.00 0.00 O ATOM 0 H SER A 5 -2.925 24.166 -13.676 1.00 0.00 H new ATOM 0 HA SER A 5 -4.792 23.494 -14.672 1.00 0.00 H new ATOM 0 HB2 SER A 5 -2.943 23.728 -17.061 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.587 23.160 -17.273 1.00 0.00 H new ATOM 0 HG SER A 5 -4.069 25.545 -15.797 1.00 0.00 H new ATOM 48 N SER A 6 -3.688 20.974 -14.188 1.00 0.00 N ATOM 49 CA SER A 6 -3.690 19.516 -14.137 1.00 0.00 C ATOM 50 C SER A 6 -4.368 19.018 -12.864 1.00 0.00 C ATOM 51 O SER A 6 -4.749 19.807 -12.001 1.00 0.00 O ATOM 52 CB SER A 6 -2.259 18.980 -14.210 1.00 0.00 C ATOM 53 OG SER A 6 -1.572 19.512 -15.330 1.00 0.00 O ATOM 0 H SER A 6 -3.466 21.427 -13.301 1.00 0.00 H new ATOM 0 HA SER A 6 -4.252 19.148 -14.995 1.00 0.00 H new ATOM 0 HB2 SER A 6 -1.724 19.237 -13.296 1.00 0.00 H new ATOM 0 HB3 SER A 6 -2.278 17.892 -14.274 1.00 0.00 H new ATOM 0 HG SER A 6 -0.659 19.156 -15.354 1.00 0.00 H new ATOM 59 N GLY A 7 -4.514 17.701 -12.756 1.00 0.00 N ATOM 60 CA GLY A 7 -5.145 17.119 -11.586 1.00 0.00 C ATOM 61 C GLY A 7 -4.939 15.619 -11.502 1.00 0.00 C ATOM 62 O GLY A 7 -4.525 14.986 -12.474 1.00 0.00 O ATOM 0 H GLY A 7 -4.207 17.027 -13.457 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.743 17.589 -10.688 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.213 17.335 -11.608 1.00 0.00 H new ATOM 66 N CYS A 8 -5.226 15.049 -10.337 1.00 0.00 N ATOM 67 CA CYS A 8 -5.068 13.614 -10.128 1.00 0.00 C ATOM 68 C CYS A 8 -6.339 12.865 -10.516 1.00 0.00 C ATOM 69 O CYS A 8 -7.444 13.396 -10.407 1.00 0.00 O ATOM 70 CB CYS A 8 -4.719 13.327 -8.666 1.00 0.00 C ATOM 71 SG CYS A 8 -4.289 11.588 -8.333 1.00 0.00 S ATOM 0 H CYS A 8 -5.569 15.558 -9.523 1.00 0.00 H new ATOM 0 HA CYS A 8 -4.254 13.266 -10.764 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -3.882 13.960 -8.372 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -5.566 13.607 -8.039 1.00 0.00 H new ATOM 76 N VAL A 9 -6.173 11.626 -10.969 1.00 0.00 N ATOM 77 CA VAL A 9 -7.307 10.802 -11.372 1.00 0.00 C ATOM 78 C VAL A 9 -7.738 9.871 -10.245 1.00 0.00 C ATOM 79 O VAL A 9 -8.881 9.416 -10.205 1.00 0.00 O ATOM 80 CB VAL A 9 -6.973 9.961 -12.619 1.00 0.00 C ATOM 81 CG1 VAL A 9 -6.502 10.854 -13.756 1.00 0.00 C ATOM 82 CG2 VAL A 9 -5.926 8.909 -12.287 1.00 0.00 C ATOM 0 H VAL A 9 -5.265 11.171 -11.066 1.00 0.00 H new ATOM 0 HA VAL A 9 -8.125 11.482 -11.609 1.00 0.00 H new ATOM 0 HB VAL A 9 -7.879 9.449 -12.944 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -6.271 10.242 -14.628 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -7.288 11.565 -14.010 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -5.609 11.396 -13.446 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -5.702 8.324 -13.179 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -5.017 9.398 -11.936 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -6.307 8.250 -11.507 1.00 0.00 H new ATOM 92 N GLU A 10 -6.815 9.592 -9.329 1.00 0.00 N ATOM 93 CA GLU A 10 -7.101 8.714 -8.200 1.00 0.00 C ATOM 94 C GLU A 10 -7.864 9.461 -7.110 1.00 0.00 C ATOM 95 O GLU A 10 -8.949 9.047 -6.701 1.00 0.00 O ATOM 96 CB GLU A 10 -5.802 8.143 -7.629 1.00 0.00 C ATOM 97 CG GLU A 10 -5.965 6.767 -7.004 1.00 0.00 C ATOM 98 CD GLU A 10 -7.049 6.732 -5.945 1.00 0.00 C ATOM 99 OE1 GLU A 10 -7.269 7.772 -5.288 1.00 0.00 O ATOM 100 OE2 GLU A 10 -7.677 5.667 -5.772 1.00 0.00 O ATOM 0 H GLU A 10 -5.864 9.961 -9.347 1.00 0.00 H new ATOM 0 HA GLU A 10 -7.724 7.894 -8.558 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -5.059 8.086 -8.425 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -5.412 8.830 -6.878 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -6.201 6.043 -7.784 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -5.018 6.459 -6.560 1.00 0.00 H new ATOM 107 N CYS A 11 -7.288 10.564 -6.643 1.00 0.00 N ATOM 108 CA CYS A 11 -7.911 11.369 -5.599 1.00 0.00 C ATOM 109 C CYS A 11 -8.708 12.521 -6.205 1.00 0.00 C ATOM 110 O CYS A 11 -9.171 13.411 -5.491 1.00 0.00 O ATOM 111 CB CYS A 11 -6.848 11.916 -4.645 1.00 0.00 C ATOM 112 SG CYS A 11 -5.543 12.888 -5.463 1.00 0.00 S ATOM 0 H CYS A 11 -6.391 10.921 -6.971 1.00 0.00 H new ATOM 0 HA CYS A 11 -8.595 10.730 -5.041 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -7.335 12.540 -3.895 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -6.387 11.082 -4.115 1.00 0.00 H new ATOM 117 N ARG A 12 -8.864 12.497 -7.524 1.00 0.00 N ATOM 118 CA ARG A 12 -9.604 13.539 -8.226 1.00 0.00 C ATOM 119 C ARG A 12 -9.343 14.906 -7.600 1.00 0.00 C ATOM 120 O ARG A 12 -10.218 15.771 -7.584 1.00 0.00 O ATOM 121 CB ARG A 12 -11.102 13.233 -8.203 1.00 0.00 C ATOM 122 CG ARG A 12 -11.478 11.970 -8.960 1.00 0.00 C ATOM 123 CD ARG A 12 -12.877 12.068 -9.549 1.00 0.00 C ATOM 124 NE ARG A 12 -13.891 11.541 -8.640 1.00 0.00 N ATOM 125 CZ ARG A 12 -14.472 12.263 -7.688 1.00 0.00 C ATOM 126 NH1 ARG A 12 -14.140 13.536 -7.521 1.00 0.00 N ATOM 127 NH2 ARG A 12 -15.387 11.712 -6.901 1.00 0.00 N ATOM 0 H ARG A 12 -8.488 11.767 -8.129 1.00 0.00 H new ATOM 0 HA ARG A 12 -9.261 13.561 -9.260 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -11.428 13.136 -7.168 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -11.643 14.077 -8.630 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -10.757 11.795 -9.759 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -11.424 11.113 -8.289 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -13.102 13.110 -9.778 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -12.913 11.519 -10.490 1.00 0.00 H new ATOM 0 HE ARG A 12 -14.169 10.565 -8.742 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -13.437 13.963 -8.124 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -14.588 14.088 -6.789 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -15.645 10.733 -7.027 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -15.832 12.267 -6.170 1.00 0.00 H new ATOM 141 N LYS A 13 -8.133 15.093 -7.084 1.00 0.00 N ATOM 142 CA LYS A 13 -7.755 16.354 -6.457 1.00 0.00 C ATOM 143 C LYS A 13 -6.703 17.081 -7.289 1.00 0.00 C ATOM 144 O LYS A 13 -5.997 16.484 -8.102 1.00 0.00 O ATOM 145 CB LYS A 13 -7.221 16.106 -5.045 1.00 0.00 C ATOM 146 CG LYS A 13 -8.313 15.941 -4.002 1.00 0.00 C ATOM 147 CD LYS A 13 -7.871 16.460 -2.644 1.00 0.00 C ATOM 148 CE LYS A 13 -8.521 15.682 -1.511 1.00 0.00 C ATOM 149 NZ LYS A 13 -10.002 15.847 -1.503 1.00 0.00 N ATOM 0 H LYS A 13 -7.397 14.387 -7.088 1.00 0.00 H new ATOM 0 HA LYS A 13 -8.644 16.982 -6.397 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -6.599 15.211 -5.053 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -6.578 16.938 -4.757 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -9.207 16.475 -4.323 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -8.583 14.888 -3.920 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -6.787 16.388 -2.561 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -8.128 17.516 -2.556 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -8.274 14.625 -1.608 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -8.113 16.019 -0.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -10.405 15.329 -0.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -10.238 16.856 -1.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -10.398 15.471 -2.388 1.00 0.00 H new ATOM 163 N PRO A 14 -6.592 18.402 -7.081 1.00 0.00 N ATOM 164 CA PRO A 14 -5.627 19.238 -7.801 1.00 0.00 C ATOM 165 C PRO A 14 -4.189 18.953 -7.384 1.00 0.00 C ATOM 166 O PRO A 14 -3.899 18.777 -6.200 1.00 0.00 O ATOM 167 CB PRO A 14 -6.027 20.662 -7.405 1.00 0.00 C ATOM 168 CG PRO A 14 -6.704 20.512 -6.087 1.00 0.00 C ATOM 169 CD PRO A 14 -7.401 19.180 -6.128 1.00 0.00 C ATOM 0 HA PRO A 14 -5.652 19.057 -8.876 1.00 0.00 H new ATOM 0 HB2 PRO A 14 -5.155 21.312 -7.331 1.00 0.00 H new ATOM 0 HB3 PRO A 14 -6.694 21.106 -8.144 1.00 0.00 H new ATOM 0 HG2 PRO A 14 -5.982 20.550 -5.271 1.00 0.00 H new ATOM 0 HG3 PRO A 14 -7.416 21.320 -5.920 1.00 0.00 H new ATOM 0 HD2 PRO A 14 -7.427 18.710 -5.145 1.00 0.00 H new ATOM 0 HD3 PRO A 14 -8.434 19.277 -6.463 1.00 0.00 H new ATOM 177 N ILE A 15 -3.291 18.911 -8.363 1.00 0.00 N ATOM 178 CA ILE A 15 -1.882 18.649 -8.096 1.00 0.00 C ATOM 179 C ILE A 15 -1.061 19.932 -8.167 1.00 0.00 C ATOM 180 O ILE A 15 -1.394 20.853 -8.911 1.00 0.00 O ATOM 181 CB ILE A 15 -1.302 17.626 -9.090 1.00 0.00 C ATOM 182 CG1 ILE A 15 -2.146 16.349 -9.094 1.00 0.00 C ATOM 183 CG2 ILE A 15 0.145 17.309 -8.741 1.00 0.00 C ATOM 184 CD1 ILE A 15 -1.755 15.370 -10.178 1.00 0.00 C ATOM 0 H ILE A 15 -3.514 19.055 -9.348 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.823 18.238 -7.088 1.00 0.00 H new ATOM 0 HB ILE A 15 -1.328 18.059 -10.090 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -2.055 15.860 -8.124 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -3.195 16.617 -9.219 1.00 0.00 H new ATOM 0 HG21 ILE A 15 0.541 16.584 -9.453 1.00 0.00 H new ATOM 0 HG22 ILE A 15 0.738 18.222 -8.785 1.00 0.00 H new ATOM 0 HG23 ILE A 15 0.194 16.893 -7.735 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -2.395 14.489 -10.121 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -1.873 15.841 -11.154 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -0.715 15.073 -10.042 1.00 0.00 H new ATOM 196 N GLY A 16 0.015 19.984 -7.388 1.00 0.00 N ATOM 197 CA GLY A 16 0.868 21.157 -7.378 1.00 0.00 C ATOM 198 C GLY A 16 2.213 20.902 -8.030 1.00 0.00 C ATOM 199 O GLY A 16 2.710 19.776 -8.023 1.00 0.00 O ATOM 0 H GLY A 16 0.311 19.234 -6.763 1.00 0.00 H new ATOM 0 HA2 GLY A 16 0.365 21.973 -7.897 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.022 21.481 -6.349 1.00 0.00 H new ATOM 203 N ALA A 17 2.802 21.950 -8.597 1.00 0.00 N ATOM 204 CA ALA A 17 4.097 21.834 -9.256 1.00 0.00 C ATOM 205 C ALA A 17 5.169 21.360 -8.280 1.00 0.00 C ATOM 206 O ALA A 17 5.974 20.486 -8.603 1.00 0.00 O ATOM 207 CB ALA A 17 4.496 23.165 -9.874 1.00 0.00 C ATOM 0 H ALA A 17 2.403 22.889 -8.613 1.00 0.00 H new ATOM 0 HA ALA A 17 4.008 21.090 -10.048 1.00 0.00 H new ATOM 0 HB1 ALA A 17 5.465 23.063 -10.363 1.00 0.00 H new ATOM 0 HB2 ALA A 17 3.749 23.464 -10.609 1.00 0.00 H new ATOM 0 HB3 ALA A 17 4.561 23.924 -9.094 1.00 0.00 H new ATOM 213 N ASP A 18 5.174 21.941 -7.086 1.00 0.00 N ATOM 214 CA ASP A 18 6.147 21.578 -6.062 1.00 0.00 C ATOM 215 C ASP A 18 6.089 20.083 -5.763 1.00 0.00 C ATOM 216 O ASP A 18 7.108 19.459 -5.467 1.00 0.00 O ATOM 217 CB ASP A 18 5.896 22.377 -4.782 1.00 0.00 C ATOM 218 CG ASP A 18 5.770 23.865 -5.044 1.00 0.00 C ATOM 219 OD1 ASP A 18 6.657 24.426 -5.721 1.00 0.00 O ATOM 220 OD2 ASP A 18 4.784 24.468 -4.572 1.00 0.00 O ATOM 0 H ASP A 18 4.515 22.666 -6.803 1.00 0.00 H new ATOM 0 HA ASP A 18 7.141 21.817 -6.440 1.00 0.00 H new ATOM 0 HB2 ASP A 18 4.985 22.017 -4.305 1.00 0.00 H new ATOM 0 HB3 ASP A 18 6.713 22.202 -4.082 1.00 0.00 H new ATOM 225 N SER A 19 4.890 19.515 -5.842 1.00 0.00 N ATOM 226 CA SER A 19 4.698 18.095 -5.575 1.00 0.00 C ATOM 227 C SER A 19 5.056 17.259 -6.800 1.00 0.00 C ATOM 228 O SER A 19 4.476 17.428 -7.873 1.00 0.00 O ATOM 229 CB SER A 19 3.250 17.823 -5.164 1.00 0.00 C ATOM 230 OG SER A 19 3.033 18.166 -3.806 1.00 0.00 O ATOM 0 H SER A 19 4.037 20.017 -6.089 1.00 0.00 H new ATOM 0 HA SER A 19 5.360 17.812 -4.757 1.00 0.00 H new ATOM 0 HB2 SER A 19 2.574 18.396 -5.800 1.00 0.00 H new ATOM 0 HB3 SER A 19 3.016 16.770 -5.318 1.00 0.00 H new ATOM 0 HG SER A 19 2.100 17.985 -3.568 1.00 0.00 H new ATOM 236 N LYS A 20 6.016 16.355 -6.632 1.00 0.00 N ATOM 237 CA LYS A 20 6.453 15.491 -7.722 1.00 0.00 C ATOM 238 C LYS A 20 5.321 14.575 -8.177 1.00 0.00 C ATOM 239 O LYS A 20 4.992 13.599 -7.505 1.00 0.00 O ATOM 240 CB LYS A 20 7.656 14.652 -7.285 1.00 0.00 C ATOM 241 CG LYS A 20 8.960 15.431 -7.251 1.00 0.00 C ATOM 242 CD LYS A 20 9.745 15.260 -8.541 1.00 0.00 C ATOM 243 CE LYS A 20 9.459 16.387 -9.521 1.00 0.00 C ATOM 244 NZ LYS A 20 10.274 17.598 -9.227 1.00 0.00 N ATOM 0 H LYS A 20 6.506 16.202 -5.751 1.00 0.00 H new ATOM 0 HA LYS A 20 6.744 16.125 -8.560 1.00 0.00 H new ATOM 0 HB2 LYS A 20 7.462 14.242 -6.294 1.00 0.00 H new ATOM 0 HB3 LYS A 20 7.765 13.807 -7.964 1.00 0.00 H new ATOM 0 HG2 LYS A 20 8.749 16.488 -7.090 1.00 0.00 H new ATOM 0 HG3 LYS A 20 9.564 15.094 -6.409 1.00 0.00 H new ATOM 0 HD2 LYS A 20 10.812 15.232 -8.318 1.00 0.00 H new ATOM 0 HD3 LYS A 20 9.490 14.304 -8.999 1.00 0.00 H new ATOM 0 HE2 LYS A 20 9.666 16.047 -10.536 1.00 0.00 H new ATOM 0 HE3 LYS A 20 8.400 16.643 -9.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 10.050 18.343 -9.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 10.058 17.938 -8.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 11.284 17.360 -9.290 1.00 0.00 H new ATOM 258 N GLU A 21 4.730 14.897 -9.324 1.00 0.00 N ATOM 259 CA GLU A 21 3.635 14.102 -9.868 1.00 0.00 C ATOM 260 C GLU A 21 4.139 13.148 -10.946 1.00 0.00 C ATOM 261 O GLU A 21 5.309 13.186 -11.327 1.00 0.00 O ATOM 262 CB GLU A 21 2.550 15.014 -10.445 1.00 0.00 C ATOM 263 CG GLU A 21 3.018 15.841 -11.631 1.00 0.00 C ATOM 264 CD GLU A 21 3.455 14.985 -12.803 1.00 0.00 C ATOM 265 OE1 GLU A 21 2.618 14.220 -13.325 1.00 0.00 O ATOM 266 OE2 GLU A 21 4.636 15.080 -13.199 1.00 0.00 O ATOM 0 H GLU A 21 4.991 15.702 -9.894 1.00 0.00 H new ATOM 0 HA GLU A 21 3.210 13.513 -9.056 1.00 0.00 H new ATOM 0 HB2 GLU A 21 1.700 14.405 -10.751 1.00 0.00 H new ATOM 0 HB3 GLU A 21 2.197 15.685 -9.662 1.00 0.00 H new ATOM 0 HG2 GLU A 21 2.212 16.502 -11.949 1.00 0.00 H new ATOM 0 HG3 GLU A 21 3.847 16.477 -11.321 1.00 0.00 H new ATOM 273 N VAL A 22 3.248 12.292 -11.435 1.00 0.00 N ATOM 274 CA VAL A 22 3.601 11.327 -12.470 1.00 0.00 C ATOM 275 C VAL A 22 2.597 11.360 -13.617 1.00 0.00 C ATOM 276 O VAL A 22 1.470 10.883 -13.483 1.00 0.00 O ATOM 277 CB VAL A 22 3.670 9.897 -11.903 1.00 0.00 C ATOM 278 CG1 VAL A 22 4.085 8.913 -12.987 1.00 0.00 C ATOM 279 CG2 VAL A 22 4.628 9.837 -10.723 1.00 0.00 C ATOM 0 H VAL A 22 2.275 12.247 -11.131 1.00 0.00 H new ATOM 0 HA VAL A 22 4.585 11.609 -12.844 1.00 0.00 H new ATOM 0 HB VAL A 22 2.678 9.616 -11.550 1.00 0.00 H new ATOM 0 HG11 VAL A 22 4.129 7.908 -12.568 1.00 0.00 H new ATOM 0 HG12 VAL A 22 3.357 8.937 -13.798 1.00 0.00 H new ATOM 0 HG13 VAL A 22 5.067 9.189 -13.372 1.00 0.00 H new ATOM 0 HG21 VAL A 22 4.664 8.819 -10.335 1.00 0.00 H new ATOM 0 HG22 VAL A 22 5.624 10.137 -11.048 1.00 0.00 H new ATOM 0 HG23 VAL A 22 4.283 10.512 -9.940 1.00 0.00 H new ATOM 289 N HIS A 23 3.015 11.925 -14.745 1.00 0.00 N ATOM 290 CA HIS A 23 2.152 12.019 -15.918 1.00 0.00 C ATOM 291 C HIS A 23 2.387 10.843 -16.860 1.00 0.00 C ATOM 292 O HIS A 23 3.504 10.625 -17.331 1.00 0.00 O ATOM 293 CB HIS A 23 2.400 13.336 -16.655 1.00 0.00 C ATOM 294 CG HIS A 23 1.803 13.375 -18.028 1.00 0.00 C ATOM 295 ND1 HIS A 23 2.300 14.166 -19.042 1.00 0.00 N ATOM 296 CD2 HIS A 23 0.745 12.714 -18.552 1.00 0.00 C ATOM 297 CE1 HIS A 23 1.572 13.991 -20.131 1.00 0.00 C ATOM 298 NE2 HIS A 23 0.622 13.114 -19.860 1.00 0.00 N ATOM 0 H HIS A 23 3.945 12.324 -14.872 1.00 0.00 H new ATOM 0 HA HIS A 23 1.116 11.990 -15.580 1.00 0.00 H new ATOM 0 HB2 HIS A 23 1.989 14.156 -16.066 1.00 0.00 H new ATOM 0 HB3 HIS A 23 3.474 13.504 -16.730 1.00 0.00 H new ATOM 0 HD1 HIS A 23 3.104 14.789 -18.964 1.00 0.00 H new ATOM 0 HD2 HIS A 23 0.115 12.004 -18.037 1.00 0.00 H new ATOM 0 HE1 HIS A 23 1.727 14.481 -21.081 1.00 0.00 H new ATOM 307 N TYR A 24 1.328 10.088 -17.131 1.00 0.00 N ATOM 308 CA TYR A 24 1.419 8.932 -18.015 1.00 0.00 C ATOM 309 C TYR A 24 0.080 8.655 -18.690 1.00 0.00 C ATOM 310 O TYR A 24 -0.968 8.662 -18.044 1.00 0.00 O ATOM 311 CB TYR A 24 1.873 7.699 -17.231 1.00 0.00 C ATOM 312 CG TYR A 24 2.444 6.603 -18.103 1.00 0.00 C ATOM 313 CD1 TYR A 24 3.691 6.742 -18.699 1.00 0.00 C ATOM 314 CD2 TYR A 24 1.735 5.430 -18.331 1.00 0.00 C ATOM 315 CE1 TYR A 24 4.216 5.744 -19.497 1.00 0.00 C ATOM 316 CE2 TYR A 24 2.254 4.426 -19.126 1.00 0.00 C ATOM 317 CZ TYR A 24 3.494 4.588 -19.707 1.00 0.00 C ATOM 318 OH TYR A 24 4.013 3.591 -20.501 1.00 0.00 O ATOM 0 H TYR A 24 0.396 10.256 -16.751 1.00 0.00 H new ATOM 0 HA TYR A 24 2.155 9.155 -18.788 1.00 0.00 H new ATOM 0 HB2 TYR A 24 2.625 7.999 -16.501 1.00 0.00 H new ATOM 0 HB3 TYR A 24 1.026 7.302 -16.672 1.00 0.00 H new ATOM 0 HD1 TYR A 24 4.260 7.646 -18.536 1.00 0.00 H new ATOM 0 HD2 TYR A 24 0.762 5.301 -17.880 1.00 0.00 H new ATOM 0 HE1 TYR A 24 5.187 5.868 -19.954 1.00 0.00 H new ATOM 0 HE2 TYR A 24 1.691 3.519 -19.291 1.00 0.00 H new ATOM 0 HH TYR A 24 3.379 2.845 -20.545 1.00 0.00 H new ATOM 328 N LYS A 25 0.122 8.409 -19.995 1.00 0.00 N ATOM 329 CA LYS A 25 -1.087 8.127 -20.760 1.00 0.00 C ATOM 330 C LYS A 25 -2.145 9.200 -20.521 1.00 0.00 C ATOM 331 O LYS A 25 -3.313 8.892 -20.291 1.00 0.00 O ATOM 332 CB LYS A 25 -1.645 6.753 -20.384 1.00 0.00 C ATOM 333 CG LYS A 25 -0.641 5.624 -20.545 1.00 0.00 C ATOM 334 CD LYS A 25 -0.452 5.251 -22.006 1.00 0.00 C ATOM 335 CE LYS A 25 0.916 4.633 -22.251 1.00 0.00 C ATOM 336 NZ LYS A 25 1.213 4.500 -23.704 1.00 0.00 N ATOM 0 H LYS A 25 0.981 8.399 -20.545 1.00 0.00 H new ATOM 0 HA LYS A 25 -0.826 8.129 -21.818 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -1.986 6.780 -19.349 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -2.518 6.543 -21.002 1.00 0.00 H new ATOM 0 HG2 LYS A 25 0.316 5.923 -20.118 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -0.980 4.752 -19.987 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -1.229 4.548 -22.307 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -0.568 6.139 -22.627 1.00 0.00 H new ATOM 0 HE2 LYS A 25 1.682 5.248 -21.779 1.00 0.00 H new ATOM 0 HE3 LYS A 25 0.960 3.651 -21.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 2.154 4.075 -23.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 0.497 3.892 -24.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 1.196 5.440 -24.149 1.00 0.00 H new ATOM 350 N ASN A 26 -1.727 10.460 -20.579 1.00 0.00 N ATOM 351 CA ASN A 26 -2.640 11.578 -20.370 1.00 0.00 C ATOM 352 C ASN A 26 -3.267 11.516 -18.981 1.00 0.00 C ATOM 353 O ASN A 26 -4.444 11.831 -18.806 1.00 0.00 O ATOM 354 CB ASN A 26 -3.736 11.576 -21.438 1.00 0.00 C ATOM 355 CG ASN A 26 -3.194 11.870 -22.823 1.00 0.00 C ATOM 356 OD1 ASN A 26 -2.045 12.283 -22.978 1.00 0.00 O ATOM 357 ND2 ASN A 26 -4.022 11.657 -23.840 1.00 0.00 N ATOM 0 H ASN A 26 -0.763 10.733 -20.769 1.00 0.00 H new ATOM 0 HA ASN A 26 -2.067 12.502 -20.449 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -4.232 10.606 -21.444 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -4.491 12.319 -21.181 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -3.713 11.837 -24.795 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -4.967 11.314 -23.665 1.00 0.00 H new ATOM 364 N ARG A 27 -2.473 11.108 -17.997 1.00 0.00 N ATOM 365 CA ARG A 27 -2.950 11.003 -16.623 1.00 0.00 C ATOM 366 C ARG A 27 -1.984 11.684 -15.658 1.00 0.00 C ATOM 367 O ARG A 27 -0.974 12.254 -16.073 1.00 0.00 O ATOM 368 CB ARG A 27 -3.127 9.535 -16.233 1.00 0.00 C ATOM 369 CG ARG A 27 -4.027 8.757 -17.180 1.00 0.00 C ATOM 370 CD ARG A 27 -5.491 8.886 -16.789 1.00 0.00 C ATOM 371 NE ARG A 27 -5.843 7.996 -15.686 1.00 0.00 N ATOM 372 CZ ARG A 27 -7.067 7.518 -15.489 1.00 0.00 C ATOM 373 NH1 ARG A 27 -8.050 7.842 -16.318 1.00 0.00 N ATOM 374 NH2 ARG A 27 -7.309 6.713 -14.463 1.00 0.00 N ATOM 0 H ARG A 27 -1.496 10.845 -18.125 1.00 0.00 H new ATOM 0 HA ARG A 27 -3.914 11.507 -16.560 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -2.148 9.056 -16.200 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -3.542 9.483 -15.226 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -3.888 9.121 -18.198 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -3.739 7.706 -17.176 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -5.701 9.917 -16.504 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -6.118 8.660 -17.652 1.00 0.00 H new ATOM 0 HE ARG A 27 -5.109 7.727 -15.031 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -7.867 8.459 -17.109 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -8.989 7.474 -16.165 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -6.555 6.460 -13.824 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -8.249 6.347 -14.313 1.00 0.00 H new ATOM 388 N PHE A 28 -2.300 11.621 -14.369 1.00 0.00 N ATOM 389 CA PHE A 28 -1.461 12.232 -13.345 1.00 0.00 C ATOM 390 C PHE A 28 -1.766 11.645 -11.970 1.00 0.00 C ATOM 391 O PHE A 28 -2.902 11.698 -11.500 1.00 0.00 O ATOM 392 CB PHE A 28 -1.670 13.748 -13.323 1.00 0.00 C ATOM 393 CG PHE A 28 -1.675 14.373 -14.689 1.00 0.00 C ATOM 394 CD1 PHE A 28 -2.824 14.369 -15.463 1.00 0.00 C ATOM 395 CD2 PHE A 28 -0.530 14.964 -15.199 1.00 0.00 C ATOM 396 CE1 PHE A 28 -2.831 14.942 -16.720 1.00 0.00 C ATOM 397 CE2 PHE A 28 -0.531 15.539 -16.456 1.00 0.00 C ATOM 398 CZ PHE A 28 -1.683 15.529 -17.217 1.00 0.00 C ATOM 0 H PHE A 28 -3.131 11.153 -14.009 1.00 0.00 H new ATOM 0 HA PHE A 28 -0.420 12.019 -13.588 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -2.615 13.969 -12.828 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -0.882 14.207 -12.725 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -3.725 13.913 -15.079 1.00 0.00 H new ATOM 0 HD2 PHE A 28 0.374 14.975 -14.608 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -3.733 14.931 -17.314 1.00 0.00 H new ATOM 0 HE2 PHE A 28 0.368 15.996 -16.842 1.00 0.00 H new ATOM 0 HZ PHE A 28 -1.687 15.979 -18.199 1.00 0.00 H new ATOM 408 N TRP A 29 -0.744 11.087 -11.333 1.00 0.00 N ATOM 409 CA TRP A 29 -0.902 10.489 -10.012 1.00 0.00 C ATOM 410 C TRP A 29 0.088 11.090 -9.020 1.00 0.00 C ATOM 411 O TRP A 29 1.252 11.321 -9.352 1.00 0.00 O ATOM 412 CB TRP A 29 -0.709 8.974 -10.089 1.00 0.00 C ATOM 413 CG TRP A 29 -1.764 8.281 -10.896 1.00 0.00 C ATOM 414 CD1 TRP A 29 -2.964 7.809 -10.445 1.00 0.00 C ATOM 415 CD2 TRP A 29 -1.713 7.980 -12.295 1.00 0.00 C ATOM 416 NE1 TRP A 29 -3.661 7.233 -11.480 1.00 0.00 N ATOM 417 CE2 TRP A 29 -2.916 7.326 -12.625 1.00 0.00 C ATOM 418 CE3 TRP A 29 -0.769 8.201 -13.302 1.00 0.00 C ATOM 419 CZ2 TRP A 29 -3.197 6.892 -13.918 1.00 0.00 C ATOM 420 CZ3 TRP A 29 -1.049 7.769 -14.584 1.00 0.00 C ATOM 421 CH2 TRP A 29 -2.255 7.122 -14.883 1.00 0.00 C ATOM 0 H TRP A 29 0.203 11.036 -11.709 1.00 0.00 H new ATOM 0 HA TRP A 29 -1.912 10.702 -9.663 1.00 0.00 H new ATOM 0 HB2 TRP A 29 0.268 8.761 -10.522 1.00 0.00 H new ATOM 0 HB3 TRP A 29 -0.706 8.564 -9.079 1.00 0.00 H new ATOM 0 HD1 TRP A 29 -3.313 7.878 -9.425 1.00 0.00 H new ATOM 0 HE1 TRP A 29 -4.584 6.805 -11.407 1.00 0.00 H new ATOM 0 HE3 TRP A 29 0.163 8.701 -13.082 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 -4.125 6.392 -14.151 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 -0.326 7.933 -15.369 1.00 0.00 H new ATOM 0 HH2 TRP A 29 -2.445 6.798 -15.896 1.00 0.00 H new ATOM 432 N HIS A 30 -0.380 11.342 -7.802 1.00 0.00 N ATOM 433 CA HIS A 30 0.466 11.916 -6.761 1.00 0.00 C ATOM 434 C HIS A 30 1.582 10.951 -6.375 1.00 0.00 C ATOM 435 O HIS A 30 1.483 9.746 -6.608 1.00 0.00 O ATOM 436 CB HIS A 30 -0.371 12.266 -5.530 1.00 0.00 C ATOM 437 CG HIS A 30 -1.089 13.575 -5.646 1.00 0.00 C ATOM 438 ND1 HIS A 30 -2.459 13.693 -5.544 1.00 0.00 N ATOM 439 CD2 HIS A 30 -0.620 14.827 -5.856 1.00 0.00 C ATOM 440 CE1 HIS A 30 -2.802 14.961 -5.687 1.00 0.00 C ATOM 441 NE2 HIS A 30 -1.704 15.670 -5.878 1.00 0.00 N ATOM 0 H HIS A 30 -1.340 11.158 -7.511 1.00 0.00 H new ATOM 0 HA HIS A 30 0.918 12.827 -7.155 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -1.101 11.475 -5.360 1.00 0.00 H new ATOM 0 HB3 HIS A 30 0.279 12.294 -4.655 1.00 0.00 H new ATOM 0 HD2 HIS A 30 0.414 15.110 -5.983 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -3.808 15.351 -5.653 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -1.667 16.680 -6.019 1.00 0.00 H new ATOM 449 N ASP A 31 2.644 11.488 -5.784 1.00 0.00 N ATOM 450 CA ASP A 31 3.779 10.675 -5.364 1.00 0.00 C ATOM 451 C ASP A 31 3.332 9.563 -4.421 1.00 0.00 C ATOM 452 O ASP A 31 4.037 8.571 -4.233 1.00 0.00 O ATOM 453 CB ASP A 31 4.834 11.546 -4.682 1.00 0.00 C ATOM 454 CG ASP A 31 5.599 10.796 -3.609 1.00 0.00 C ATOM 455 OD1 ASP A 31 6.439 9.943 -3.965 1.00 0.00 O ATOM 456 OD2 ASP A 31 5.359 11.063 -2.413 1.00 0.00 O ATOM 0 H ASP A 31 2.742 12.484 -5.585 1.00 0.00 H new ATOM 0 HA ASP A 31 4.216 10.219 -6.253 1.00 0.00 H new ATOM 0 HB2 ASP A 31 5.534 11.917 -5.431 1.00 0.00 H new ATOM 0 HB3 ASP A 31 4.351 12.416 -4.238 1.00 0.00 H new ATOM 461 N THR A 32 2.155 9.735 -3.827 1.00 0.00 N ATOM 462 CA THR A 32 1.614 8.748 -2.901 1.00 0.00 C ATOM 463 C THR A 32 0.477 7.959 -3.540 1.00 0.00 C ATOM 464 O THR A 32 0.054 6.927 -3.019 1.00 0.00 O ATOM 465 CB THR A 32 1.100 9.412 -1.609 1.00 0.00 C ATOM 466 OG1 THR A 32 0.594 8.415 -0.714 1.00 0.00 O ATOM 467 CG2 THR A 32 0.008 10.424 -1.919 1.00 0.00 C ATOM 0 H THR A 32 1.558 10.549 -3.971 1.00 0.00 H new ATOM 0 HA THR A 32 2.429 8.068 -2.652 1.00 0.00 H new ATOM 0 HB THR A 32 1.933 9.933 -1.138 1.00 0.00 H new ATOM 0 HG1 THR A 32 0.201 7.681 -1.231 1.00 0.00 H new ATOM 0 HG21 THR A 32 -0.339 10.880 -0.992 1.00 0.00 H new ATOM 0 HG22 THR A 32 0.405 11.197 -2.577 1.00 0.00 H new ATOM 0 HG23 THR A 32 -0.825 9.921 -2.411 1.00 0.00 H new ATOM 475 N CYS A 33 -0.014 8.451 -4.673 1.00 0.00 N ATOM 476 CA CYS A 33 -1.103 7.792 -5.385 1.00 0.00 C ATOM 477 C CYS A 33 -0.561 6.788 -6.398 1.00 0.00 C ATOM 478 O CYS A 33 -1.042 5.658 -6.487 1.00 0.00 O ATOM 479 CB CYS A 33 -1.977 8.828 -6.094 1.00 0.00 C ATOM 480 SG CYS A 33 -3.061 9.775 -4.978 1.00 0.00 S ATOM 0 H CYS A 33 0.325 9.304 -5.118 1.00 0.00 H new ATOM 0 HA CYS A 33 -1.709 7.254 -4.655 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -1.333 9.523 -6.634 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -2.592 8.321 -6.837 1.00 0.00 H new ATOM 485 N PHE A 34 0.444 7.208 -7.160 1.00 0.00 N ATOM 486 CA PHE A 34 1.051 6.346 -8.168 1.00 0.00 C ATOM 487 C PHE A 34 1.678 5.114 -7.523 1.00 0.00 C ATOM 488 O PHE A 34 2.744 5.194 -6.913 1.00 0.00 O ATOM 489 CB PHE A 34 2.111 7.118 -8.957 1.00 0.00 C ATOM 490 CG PHE A 34 2.625 6.373 -10.156 1.00 0.00 C ATOM 491 CD1 PHE A 34 1.753 5.915 -11.130 1.00 0.00 C ATOM 492 CD2 PHE A 34 3.981 6.131 -10.308 1.00 0.00 C ATOM 493 CE1 PHE A 34 2.224 5.230 -12.234 1.00 0.00 C ATOM 494 CE2 PHE A 34 4.457 5.447 -11.410 1.00 0.00 C ATOM 495 CZ PHE A 34 3.577 4.995 -12.374 1.00 0.00 C ATOM 0 H PHE A 34 0.855 8.139 -7.099 1.00 0.00 H new ATOM 0 HA PHE A 34 0.267 6.018 -8.850 1.00 0.00 H new ATOM 0 HB2 PHE A 34 1.689 8.069 -9.283 1.00 0.00 H new ATOM 0 HB3 PHE A 34 2.947 7.350 -8.297 1.00 0.00 H new ATOM 0 HD1 PHE A 34 0.693 6.095 -11.025 1.00 0.00 H new ATOM 0 HD2 PHE A 34 4.673 6.481 -9.557 1.00 0.00 H new ATOM 0 HE1 PHE A 34 1.534 4.879 -12.987 1.00 0.00 H new ATOM 0 HE2 PHE A 34 5.516 5.266 -11.518 1.00 0.00 H new ATOM 0 HZ PHE A 34 3.947 4.459 -13.235 1.00 0.00 H new ATOM 505 N ARG A 35 1.008 3.975 -7.663 1.00 0.00 N ATOM 506 CA ARG A 35 1.497 2.725 -7.093 1.00 0.00 C ATOM 507 C ARG A 35 0.855 1.525 -7.782 1.00 0.00 C ATOM 508 O ARG A 35 -0.053 1.677 -8.600 1.00 0.00 O ATOM 509 CB ARG A 35 1.211 2.678 -5.591 1.00 0.00 C ATOM 510 CG ARG A 35 -0.254 2.448 -5.257 1.00 0.00 C ATOM 511 CD ARG A 35 -0.453 2.195 -3.771 1.00 0.00 C ATOM 512 NE ARG A 35 -1.843 2.385 -3.365 1.00 0.00 N ATOM 513 CZ ARG A 35 -2.357 3.565 -3.033 1.00 0.00 C ATOM 514 NH1 ARG A 35 -1.599 4.652 -3.060 1.00 0.00 N ATOM 515 NH2 ARG A 35 -3.631 3.658 -2.674 1.00 0.00 N ATOM 0 H ARG A 35 0.125 3.892 -8.166 1.00 0.00 H new ATOM 0 HA ARG A 35 2.574 2.680 -7.252 1.00 0.00 H new ATOM 0 HB2 ARG A 35 1.807 1.884 -5.141 1.00 0.00 H new ATOM 0 HB3 ARG A 35 1.535 3.615 -5.138 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -0.838 3.317 -5.561 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -0.629 1.597 -5.826 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -0.141 1.178 -3.531 1.00 0.00 H new ATOM 0 HD3 ARG A 35 0.187 2.868 -3.200 1.00 0.00 H new ATOM 0 HE ARG A 35 -2.453 1.568 -3.335 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -0.619 4.584 -3.336 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -1.995 5.557 -2.805 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -4.217 2.823 -2.653 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -4.024 4.564 -2.419 1.00 0.00 H new ATOM 529 N CYS A 36 1.332 0.331 -7.446 1.00 0.00 N ATOM 530 CA CYS A 36 0.806 -0.896 -8.032 1.00 0.00 C ATOM 531 C CYS A 36 -0.629 -1.145 -7.576 1.00 0.00 C ATOM 532 O CYS A 36 -1.116 -0.502 -6.646 1.00 0.00 O ATOM 533 CB CYS A 36 1.688 -2.087 -7.652 1.00 0.00 C ATOM 534 SG CYS A 36 1.417 -3.569 -8.676 1.00 0.00 S ATOM 0 H CYS A 36 2.083 0.187 -6.770 1.00 0.00 H new ATOM 0 HA CYS A 36 0.809 -0.782 -9.116 1.00 0.00 H new ATOM 0 HB2 CYS A 36 2.734 -1.791 -7.730 1.00 0.00 H new ATOM 0 HB3 CYS A 36 1.506 -2.342 -6.608 1.00 0.00 H new ATOM 539 N ALA A 37 -1.299 -2.084 -8.236 1.00 0.00 N ATOM 540 CA ALA A 37 -2.677 -2.420 -7.897 1.00 0.00 C ATOM 541 C ALA A 37 -2.760 -3.793 -7.239 1.00 0.00 C ATOM 542 O ALA A 37 -3.751 -4.121 -6.585 1.00 0.00 O ATOM 543 CB ALA A 37 -3.552 -2.374 -9.140 1.00 0.00 C ATOM 0 H ALA A 37 -0.910 -2.625 -9.008 1.00 0.00 H new ATOM 0 HA ALA A 37 -3.041 -1.681 -7.183 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -4.578 -2.627 -8.872 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -3.525 -1.372 -9.567 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -3.181 -3.091 -9.873 1.00 0.00 H new ATOM 549 N LYS A 38 -1.715 -4.594 -7.416 1.00 0.00 N ATOM 550 CA LYS A 38 -1.669 -5.932 -6.839 1.00 0.00 C ATOM 551 C LYS A 38 -0.893 -5.932 -5.526 1.00 0.00 C ATOM 552 O LYS A 38 -1.322 -6.533 -4.540 1.00 0.00 O ATOM 553 CB LYS A 38 -1.026 -6.912 -7.823 1.00 0.00 C ATOM 554 CG LYS A 38 -2.028 -7.618 -8.721 1.00 0.00 C ATOM 555 CD LYS A 38 -1.358 -8.680 -9.577 1.00 0.00 C ATOM 556 CE LYS A 38 -0.999 -9.910 -8.758 1.00 0.00 C ATOM 557 NZ LYS A 38 -2.199 -10.731 -8.435 1.00 0.00 N ATOM 0 H LYS A 38 -0.887 -4.339 -7.955 1.00 0.00 H new ATOM 0 HA LYS A 38 -2.692 -6.248 -6.636 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -0.311 -6.373 -8.444 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -0.463 -7.659 -7.263 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -2.804 -8.078 -8.110 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -2.519 -6.888 -9.364 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -2.023 -8.965 -10.392 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -0.457 -8.268 -10.031 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -0.281 -10.517 -9.310 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -0.511 -9.601 -7.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -1.899 -11.639 -8.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -2.793 -10.223 -7.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -2.744 -10.905 -9.303 1.00 0.00 H new ATOM 571 N CYS A 39 0.249 -5.254 -5.519 1.00 0.00 N ATOM 572 CA CYS A 39 1.085 -5.174 -4.327 1.00 0.00 C ATOM 573 C CYS A 39 0.927 -3.820 -3.641 1.00 0.00 C ATOM 574 O CYS A 39 1.220 -3.675 -2.454 1.00 0.00 O ATOM 575 CB CYS A 39 2.553 -5.406 -4.690 1.00 0.00 C ATOM 576 SG CYS A 39 3.255 -4.136 -5.792 1.00 0.00 S ATOM 0 H CYS A 39 0.617 -4.751 -6.326 1.00 0.00 H new ATOM 0 HA CYS A 39 0.762 -5.952 -3.635 1.00 0.00 H new ATOM 0 HB2 CYS A 39 3.142 -5.442 -3.773 1.00 0.00 H new ATOM 0 HB3 CYS A 39 2.648 -6.381 -5.169 1.00 0.00 H new ATOM 581 N LEU A 40 0.461 -2.832 -4.397 1.00 0.00 N ATOM 582 CA LEU A 40 0.263 -1.488 -3.863 1.00 0.00 C ATOM 583 C LEU A 40 1.598 -0.840 -3.511 1.00 0.00 C ATOM 584 O LEU A 40 1.806 -0.395 -2.382 1.00 0.00 O ATOM 585 CB LEU A 40 -0.635 -1.537 -2.625 1.00 0.00 C ATOM 586 CG LEU A 40 -1.802 -2.523 -2.681 1.00 0.00 C ATOM 587 CD1 LEU A 40 -2.255 -2.894 -1.278 1.00 0.00 C ATOM 588 CD2 LEU A 40 -2.958 -1.936 -3.479 1.00 0.00 C ATOM 0 H LEU A 40 0.213 -2.936 -5.381 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.221 -0.886 -4.632 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.017 -1.785 -1.762 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.037 -0.539 -2.453 1.00 0.00 H new ATOM 0 HG LEU A 40 -1.463 -3.429 -3.183 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -3.086 -3.596 -1.338 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.428 -3.356 -0.739 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.576 -1.996 -0.750 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.780 -2.651 -3.509 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -3.296 -1.014 -3.005 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -2.627 -1.722 -4.495 1.00 0.00 H new ATOM 600 N HIS A 41 2.500 -0.787 -4.487 1.00 0.00 N ATOM 601 CA HIS A 41 3.814 -0.190 -4.282 1.00 0.00 C ATOM 602 C HIS A 41 4.017 1.009 -5.204 1.00 0.00 C ATOM 603 O HIS A 41 3.652 0.986 -6.380 1.00 0.00 O ATOM 604 CB HIS A 41 4.912 -1.226 -4.524 1.00 0.00 C ATOM 605 CG HIS A 41 6.297 -0.670 -4.406 1.00 0.00 C ATOM 606 ND1 HIS A 41 7.149 -0.984 -3.368 1.00 0.00 N ATOM 607 CD2 HIS A 41 6.979 0.184 -5.205 1.00 0.00 C ATOM 608 CE1 HIS A 41 8.294 -0.346 -3.533 1.00 0.00 C ATOM 609 NE2 HIS A 41 8.217 0.369 -4.640 1.00 0.00 N ATOM 0 H HIS A 41 2.344 -1.150 -5.427 1.00 0.00 H new ATOM 0 HA HIS A 41 3.871 0.155 -3.250 1.00 0.00 H new ATOM 0 HB2 HIS A 41 4.795 -2.041 -3.810 1.00 0.00 H new ATOM 0 HB3 HIS A 41 4.784 -1.653 -5.519 1.00 0.00 H new ATOM 0 HD2 HIS A 41 6.617 0.636 -6.117 1.00 0.00 H new ATOM 0 HE1 HIS A 41 9.148 -0.400 -2.874 1.00 0.00 H new ATOM 0 HE2 HIS A 41 8.957 0.963 -5.015 1.00 0.00 H new ATOM 618 N PRO A 42 4.611 2.081 -4.660 1.00 0.00 N ATOM 619 CA PRO A 42 4.875 3.309 -5.417 1.00 0.00 C ATOM 620 C PRO A 42 5.961 3.118 -6.470 1.00 0.00 C ATOM 621 O PRO A 42 7.138 2.958 -6.141 1.00 0.00 O ATOM 622 CB PRO A 42 5.338 4.295 -4.342 1.00 0.00 C ATOM 623 CG PRO A 42 5.890 3.439 -3.255 1.00 0.00 C ATOM 624 CD PRO A 42 5.071 2.178 -3.265 1.00 0.00 C ATOM 0 HA PRO A 42 3.998 3.643 -5.972 1.00 0.00 H new ATOM 0 HB2 PRO A 42 6.094 4.978 -4.730 1.00 0.00 H new ATOM 0 HB3 PRO A 42 4.510 4.906 -3.983 1.00 0.00 H new ATOM 0 HG2 PRO A 42 6.944 3.221 -3.427 1.00 0.00 H new ATOM 0 HG3 PRO A 42 5.822 3.941 -2.290 1.00 0.00 H new ATOM 0 HD2 PRO A 42 5.665 1.311 -2.977 1.00 0.00 H new ATOM 0 HD3 PRO A 42 4.234 2.237 -2.569 1.00 0.00 H new ATOM 632 N LEU A 43 5.561 3.137 -7.736 1.00 0.00 N ATOM 633 CA LEU A 43 6.502 2.967 -8.838 1.00 0.00 C ATOM 634 C LEU A 43 7.157 4.295 -9.205 1.00 0.00 C ATOM 635 O LEU A 43 7.567 4.502 -10.346 1.00 0.00 O ATOM 636 CB LEU A 43 5.787 2.384 -10.059 1.00 0.00 C ATOM 637 CG LEU A 43 5.388 0.911 -9.963 1.00 0.00 C ATOM 638 CD1 LEU A 43 6.403 0.136 -9.138 1.00 0.00 C ATOM 639 CD2 LEU A 43 3.995 0.775 -9.365 1.00 0.00 C ATOM 0 H LEU A 43 4.592 3.268 -8.025 1.00 0.00 H new ATOM 0 HA LEU A 43 7.281 2.276 -8.515 1.00 0.00 H new ATOM 0 HB2 LEU A 43 4.888 2.972 -10.244 1.00 0.00 H new ATOM 0 HB3 LEU A 43 6.434 2.509 -10.928 1.00 0.00 H new ATOM 0 HG LEU A 43 5.373 0.491 -10.969 1.00 0.00 H new ATOM 0 HD11 LEU A 43 6.103 -0.910 -9.081 1.00 0.00 H new ATOM 0 HD12 LEU A 43 7.384 0.207 -9.608 1.00 0.00 H new ATOM 0 HD13 LEU A 43 6.451 0.555 -8.133 1.00 0.00 H new ATOM 0 HD21 LEU A 43 3.727 -0.280 -9.304 1.00 0.00 H new ATOM 0 HD22 LEU A 43 3.984 1.211 -8.366 1.00 0.00 H new ATOM 0 HD23 LEU A 43 3.276 1.296 -9.996 1.00 0.00 H new ATOM 651 N ALA A 44 7.254 5.191 -8.227 1.00 0.00 N ATOM 652 CA ALA A 44 7.863 6.497 -8.446 1.00 0.00 C ATOM 653 C ALA A 44 9.324 6.358 -8.862 1.00 0.00 C ATOM 654 O ALA A 44 9.708 6.767 -9.956 1.00 0.00 O ATOM 655 CB ALA A 44 7.749 7.349 -7.191 1.00 0.00 C ATOM 0 H ALA A 44 6.919 5.036 -7.276 1.00 0.00 H new ATOM 0 HA ALA A 44 7.326 6.990 -9.257 1.00 0.00 H new ATOM 0 HB1 ALA A 44 8.208 8.322 -7.369 1.00 0.00 H new ATOM 0 HB2 ALA A 44 6.698 7.485 -6.938 1.00 0.00 H new ATOM 0 HB3 ALA A 44 8.260 6.852 -6.366 1.00 0.00 H new ATOM 661 N ASN A 45 10.133 5.779 -7.981 1.00 0.00 N ATOM 662 CA ASN A 45 11.552 5.588 -8.257 1.00 0.00 C ATOM 663 C ASN A 45 11.779 4.333 -9.095 1.00 0.00 C ATOM 664 O ASN A 45 12.817 4.185 -9.739 1.00 0.00 O ATOM 665 CB ASN A 45 12.339 5.491 -6.948 1.00 0.00 C ATOM 666 CG ASN A 45 12.219 6.746 -6.107 1.00 0.00 C ATOM 667 OD1 ASN A 45 13.128 7.576 -6.077 1.00 0.00 O ATOM 668 ND2 ASN A 45 11.094 6.891 -5.417 1.00 0.00 N ATOM 0 H ASN A 45 9.830 5.434 -7.070 1.00 0.00 H new ATOM 0 HA ASN A 45 11.906 6.450 -8.823 1.00 0.00 H new ATOM 0 HB2 ASN A 45 11.980 4.637 -6.374 1.00 0.00 H new ATOM 0 HB3 ASN A 45 13.390 5.306 -7.172 1.00 0.00 H new ATOM 0 HD21 ASN A 45 10.957 7.716 -4.832 1.00 0.00 H new ATOM 0 HD22 ASN A 45 10.367 6.178 -5.472 1.00 0.00 H new ATOM 675 N GLU A 46 10.801 3.434 -9.081 1.00 0.00 N ATOM 676 CA GLU A 46 10.895 2.192 -9.839 1.00 0.00 C ATOM 677 C GLU A 46 10.088 2.281 -11.131 1.00 0.00 C ATOM 678 O GLU A 46 9.392 3.267 -11.376 1.00 0.00 O ATOM 679 CB GLU A 46 10.400 1.015 -8.996 1.00 0.00 C ATOM 680 CG GLU A 46 11.495 0.346 -8.183 1.00 0.00 C ATOM 681 CD GLU A 46 12.744 0.073 -8.998 1.00 0.00 C ATOM 682 OE1 GLU A 46 12.616 -0.156 -10.219 1.00 0.00 O ATOM 683 OE2 GLU A 46 13.848 0.089 -8.416 1.00 0.00 O ATOM 0 H GLU A 46 9.935 3.542 -8.553 1.00 0.00 H new ATOM 0 HA GLU A 46 11.942 2.031 -10.095 1.00 0.00 H new ATOM 0 HB2 GLU A 46 9.620 1.366 -8.320 1.00 0.00 H new ATOM 0 HB3 GLU A 46 9.943 0.275 -9.653 1.00 0.00 H new ATOM 0 HG2 GLU A 46 11.751 0.980 -7.334 1.00 0.00 H new ATOM 0 HG3 GLU A 46 11.118 -0.593 -7.777 1.00 0.00 H new ATOM 690 N THR A 47 10.187 1.244 -11.957 1.00 0.00 N ATOM 691 CA THR A 47 9.468 1.205 -13.224 1.00 0.00 C ATOM 692 C THR A 47 8.072 0.620 -13.047 1.00 0.00 C ATOM 693 O THR A 47 7.777 -0.013 -12.033 1.00 0.00 O ATOM 694 CB THR A 47 10.230 0.376 -14.276 1.00 0.00 C ATOM 695 OG1 THR A 47 9.588 0.492 -15.550 1.00 0.00 O ATOM 696 CG2 THR A 47 10.296 -1.088 -13.867 1.00 0.00 C ATOM 0 H THR A 47 10.758 0.420 -11.771 1.00 0.00 H new ATOM 0 HA THR A 47 9.385 2.235 -13.572 1.00 0.00 H new ATOM 0 HB THR A 47 11.246 0.764 -14.345 1.00 0.00 H new ATOM 0 HG1 THR A 47 10.079 -0.036 -16.213 1.00 0.00 H new ATOM 0 HG21 THR A 47 10.838 -1.653 -14.625 1.00 0.00 H new ATOM 0 HG22 THR A 47 10.811 -1.176 -12.911 1.00 0.00 H new ATOM 0 HG23 THR A 47 9.285 -1.485 -13.772 1.00 0.00 H new ATOM 704 N PHE A 48 7.215 0.835 -14.040 1.00 0.00 N ATOM 705 CA PHE A 48 5.848 0.329 -13.994 1.00 0.00 C ATOM 706 C PHE A 48 5.446 -0.275 -15.336 1.00 0.00 C ATOM 707 O PHE A 48 6.116 -0.069 -16.348 1.00 0.00 O ATOM 708 CB PHE A 48 4.879 1.451 -13.615 1.00 0.00 C ATOM 709 CG PHE A 48 4.949 2.638 -14.533 1.00 0.00 C ATOM 710 CD1 PHE A 48 6.031 3.502 -14.489 1.00 0.00 C ATOM 711 CD2 PHE A 48 3.932 2.890 -15.439 1.00 0.00 C ATOM 712 CE1 PHE A 48 6.098 4.595 -15.332 1.00 0.00 C ATOM 713 CE2 PHE A 48 3.993 3.981 -16.285 1.00 0.00 C ATOM 714 CZ PHE A 48 5.078 4.835 -16.231 1.00 0.00 C ATOM 0 H PHE A 48 7.443 1.356 -14.886 1.00 0.00 H new ATOM 0 HA PHE A 48 5.802 -0.453 -13.236 1.00 0.00 H new ATOM 0 HB2 PHE A 48 3.862 1.059 -13.618 1.00 0.00 H new ATOM 0 HB3 PHE A 48 5.092 1.776 -12.597 1.00 0.00 H new ATOM 0 HD1 PHE A 48 6.832 3.319 -13.788 1.00 0.00 H new ATOM 0 HD2 PHE A 48 3.081 2.226 -15.485 1.00 0.00 H new ATOM 0 HE1 PHE A 48 6.947 5.261 -15.288 1.00 0.00 H new ATOM 0 HE2 PHE A 48 3.194 4.166 -16.987 1.00 0.00 H new ATOM 0 HZ PHE A 48 5.128 5.689 -16.891 1.00 0.00 H new ATOM 724 N VAL A 49 4.347 -1.022 -15.336 1.00 0.00 N ATOM 725 CA VAL A 49 3.853 -1.656 -16.553 1.00 0.00 C ATOM 726 C VAL A 49 2.341 -1.512 -16.674 1.00 0.00 C ATOM 727 O VAL A 49 1.594 -1.927 -15.788 1.00 0.00 O ATOM 728 CB VAL A 49 4.220 -3.152 -16.595 1.00 0.00 C ATOM 729 CG1 VAL A 49 3.650 -3.807 -17.844 1.00 0.00 C ATOM 730 CG2 VAL A 49 5.729 -3.332 -16.530 1.00 0.00 C ATOM 0 H VAL A 49 3.781 -1.203 -14.507 1.00 0.00 H new ATOM 0 HA VAL A 49 4.331 -1.148 -17.390 1.00 0.00 H new ATOM 0 HB VAL A 49 3.781 -3.641 -15.725 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.919 -4.863 -17.856 1.00 0.00 H new ATOM 0 HG12 VAL A 49 2.564 -3.709 -17.843 1.00 0.00 H new ATOM 0 HG13 VAL A 49 4.057 -3.318 -18.729 1.00 0.00 H new ATOM 0 HG21 VAL A 49 5.970 -4.395 -16.561 1.00 0.00 H new ATOM 0 HG22 VAL A 49 6.192 -2.830 -17.379 1.00 0.00 H new ATOM 0 HG23 VAL A 49 6.107 -2.901 -15.603 1.00 0.00 H new ATOM 740 N ALA A 50 1.894 -0.919 -17.777 1.00 0.00 N ATOM 741 CA ALA A 50 0.470 -0.722 -18.015 1.00 0.00 C ATOM 742 C ALA A 50 -0.095 -1.821 -18.908 1.00 0.00 C ATOM 743 O ALA A 50 0.231 -1.902 -20.092 1.00 0.00 O ATOM 744 CB ALA A 50 0.224 0.645 -18.637 1.00 0.00 C ATOM 0 H ALA A 50 2.498 -0.567 -18.519 1.00 0.00 H new ATOM 0 HA ALA A 50 -0.044 -0.771 -17.055 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -0.844 0.779 -18.810 1.00 0.00 H new ATOM 0 HB2 ALA A 50 0.583 1.422 -17.962 1.00 0.00 H new ATOM 0 HB3 ALA A 50 0.756 0.714 -19.586 1.00 0.00 H new ATOM 750 N LYS A 51 -0.943 -2.667 -18.332 1.00 0.00 N ATOM 751 CA LYS A 51 -1.555 -3.762 -19.075 1.00 0.00 C ATOM 752 C LYS A 51 -3.017 -3.939 -18.679 1.00 0.00 C ATOM 753 O LYS A 51 -3.374 -3.797 -17.509 1.00 0.00 O ATOM 754 CB LYS A 51 -0.788 -5.063 -18.830 1.00 0.00 C ATOM 755 CG LYS A 51 -0.690 -5.444 -17.362 1.00 0.00 C ATOM 756 CD LYS A 51 0.478 -6.381 -17.106 1.00 0.00 C ATOM 757 CE LYS A 51 0.192 -7.782 -17.625 1.00 0.00 C ATOM 758 NZ LYS A 51 1.308 -8.723 -17.326 1.00 0.00 N ATOM 0 H LYS A 51 -1.222 -2.615 -17.352 1.00 0.00 H new ATOM 0 HA LYS A 51 -1.512 -3.516 -20.136 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -1.276 -5.871 -19.375 1.00 0.00 H new ATOM 0 HB3 LYS A 51 0.217 -4.965 -19.239 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -0.574 -4.544 -16.758 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -1.617 -5.922 -17.047 1.00 0.00 H new ATOM 0 HD2 LYS A 51 1.373 -5.989 -17.588 1.00 0.00 H new ATOM 0 HD3 LYS A 51 0.685 -6.423 -16.037 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -0.728 -8.155 -17.175 1.00 0.00 H new ATOM 0 HE3 LYS A 51 0.028 -7.744 -18.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 1.075 -9.667 -17.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 2.181 -8.381 -17.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 1.448 -8.779 -16.297 1.00 0.00 H new ATOM 772 N ASP A 52 -3.857 -4.250 -19.659 1.00 0.00 N ATOM 773 CA ASP A 52 -5.281 -4.449 -19.412 1.00 0.00 C ATOM 774 C ASP A 52 -5.869 -3.270 -18.644 1.00 0.00 C ATOM 775 O ASP A 52 -6.699 -3.448 -17.753 1.00 0.00 O ATOM 776 CB ASP A 52 -5.508 -5.746 -18.633 1.00 0.00 C ATOM 777 CG ASP A 52 -5.614 -6.956 -19.540 1.00 0.00 C ATOM 778 OD1 ASP A 52 -6.183 -6.822 -20.644 1.00 0.00 O ATOM 779 OD2 ASP A 52 -5.126 -8.036 -19.147 1.00 0.00 O ATOM 0 H ASP A 52 -3.577 -4.370 -20.633 1.00 0.00 H new ATOM 0 HA ASP A 52 -5.786 -4.520 -20.375 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -4.687 -5.893 -17.931 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -6.420 -5.657 -18.043 1.00 0.00 H new ATOM 784 N ASN A 53 -5.432 -2.065 -18.994 1.00 0.00 N ATOM 785 CA ASN A 53 -5.914 -0.856 -18.337 1.00 0.00 C ATOM 786 C ASN A 53 -5.743 -0.954 -16.824 1.00 0.00 C ATOM 787 O ASN A 53 -6.627 -0.565 -16.061 1.00 0.00 O ATOM 788 CB ASN A 53 -7.385 -0.615 -18.680 1.00 0.00 C ATOM 789 CG ASN A 53 -7.769 0.849 -18.587 1.00 0.00 C ATOM 790 OD1 ASN A 53 -7.123 1.711 -19.183 1.00 0.00 O ATOM 791 ND2 ASN A 53 -8.825 1.137 -17.835 1.00 0.00 N ATOM 0 H ASN A 53 -4.745 -1.900 -19.729 1.00 0.00 H new ATOM 0 HA ASN A 53 -5.321 -0.016 -18.699 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -7.584 -0.976 -19.689 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -8.013 -1.196 -18.004 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -9.130 2.105 -17.734 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -9.331 0.390 -17.359 1.00 0.00 H new ATOM 798 N LYS A 54 -4.599 -1.477 -16.396 1.00 0.00 N ATOM 799 CA LYS A 54 -4.309 -1.626 -14.975 1.00 0.00 C ATOM 800 C LYS A 54 -2.821 -1.436 -14.700 1.00 0.00 C ATOM 801 O LYS A 54 -1.976 -2.041 -15.361 1.00 0.00 O ATOM 802 CB LYS A 54 -4.757 -3.005 -14.484 1.00 0.00 C ATOM 803 CG LYS A 54 -6.264 -3.192 -14.489 1.00 0.00 C ATOM 804 CD LYS A 54 -6.681 -4.381 -13.640 1.00 0.00 C ATOM 805 CE LYS A 54 -8.105 -4.816 -13.951 1.00 0.00 C ATOM 806 NZ LYS A 54 -8.659 -5.701 -12.889 1.00 0.00 N ATOM 0 H LYS A 54 -3.857 -1.805 -17.014 1.00 0.00 H new ATOM 0 HA LYS A 54 -4.861 -0.857 -14.435 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -4.302 -3.771 -15.113 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -4.383 -3.160 -13.472 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -6.745 -2.289 -14.113 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -6.610 -3.335 -15.513 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -5.999 -5.213 -13.816 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -6.601 -4.122 -12.584 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -8.739 -3.936 -14.057 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -8.124 -5.340 -14.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -9.631 -5.976 -13.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -8.069 -6.553 -12.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -8.665 -5.193 -11.982 1.00 0.00 H new ATOM 820 N ILE A 55 -2.508 -0.593 -13.721 1.00 0.00 N ATOM 821 CA ILE A 55 -1.121 -0.326 -13.358 1.00 0.00 C ATOM 822 C ILE A 55 -0.545 -1.460 -12.517 1.00 0.00 C ATOM 823 O ILE A 55 -1.139 -1.872 -11.520 1.00 0.00 O ATOM 824 CB ILE A 55 -0.988 0.995 -12.579 1.00 0.00 C ATOM 825 CG1 ILE A 55 -1.530 2.160 -13.410 1.00 0.00 C ATOM 826 CG2 ILE A 55 0.464 1.241 -12.197 1.00 0.00 C ATOM 827 CD1 ILE A 55 -0.787 2.372 -14.710 1.00 0.00 C ATOM 0 H ILE A 55 -3.195 -0.084 -13.166 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.560 -0.247 -14.289 1.00 0.00 H new ATOM 0 HB ILE A 55 -1.577 0.921 -11.665 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -2.583 1.981 -13.628 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -1.477 3.074 -12.818 1.00 0.00 H new ATOM 0 HG21 ILE A 55 0.542 2.179 -11.647 1.00 0.00 H new ATOM 0 HG22 ILE A 55 0.819 0.422 -11.571 1.00 0.00 H new ATOM 0 HG23 ILE A 55 1.073 1.298 -13.099 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -1.225 3.214 -15.247 1.00 0.00 H new ATOM 0 HD12 ILE A 55 0.262 2.582 -14.500 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -0.861 1.473 -15.322 1.00 0.00 H new ATOM 839 N LEU A 56 0.616 -1.960 -12.925 1.00 0.00 N ATOM 840 CA LEU A 56 1.276 -3.046 -12.208 1.00 0.00 C ATOM 841 C LEU A 56 2.793 -2.906 -12.283 1.00 0.00 C ATOM 842 O LEU A 56 3.323 -2.256 -13.184 1.00 0.00 O ATOM 843 CB LEU A 56 0.847 -4.397 -12.783 1.00 0.00 C ATOM 844 CG LEU A 56 -0.636 -4.743 -12.651 1.00 0.00 C ATOM 845 CD1 LEU A 56 -0.990 -5.924 -13.541 1.00 0.00 C ATOM 846 CD2 LEU A 56 -0.987 -5.042 -11.200 1.00 0.00 C ATOM 0 H LEU A 56 1.120 -1.631 -13.748 1.00 0.00 H new ATOM 0 HA LEU A 56 0.977 -2.992 -11.161 1.00 0.00 H new ATOM 0 HB2 LEU A 56 1.112 -4.420 -13.840 1.00 0.00 H new ATOM 0 HB3 LEU A 56 1.427 -5.179 -12.292 1.00 0.00 H new ATOM 0 HG LEU A 56 -1.220 -3.882 -12.975 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -2.050 -6.156 -13.434 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.777 -5.673 -14.580 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.398 -6.791 -13.248 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.047 -5.286 -11.125 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -0.394 -5.887 -10.849 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -0.772 -4.167 -10.586 1.00 0.00 H new ATOM 858 N CYS A 57 3.486 -3.522 -11.331 1.00 0.00 N ATOM 859 CA CYS A 57 4.942 -3.468 -11.289 1.00 0.00 C ATOM 860 C CYS A 57 5.550 -4.743 -11.867 1.00 0.00 C ATOM 861 O CYS A 57 4.880 -5.769 -11.975 1.00 0.00 O ATOM 862 CB CYS A 57 5.425 -3.267 -9.851 1.00 0.00 C ATOM 863 SG CYS A 57 5.247 -4.739 -8.793 1.00 0.00 S ATOM 0 H CYS A 57 3.062 -4.064 -10.578 1.00 0.00 H new ATOM 0 HA CYS A 57 5.267 -2.623 -11.896 1.00 0.00 H new ATOM 0 HB2 CYS A 57 6.474 -2.971 -9.870 1.00 0.00 H new ATOM 0 HB3 CYS A 57 4.869 -2.443 -9.404 1.00 0.00 H new ATOM 868 N ASN A 58 6.825 -4.669 -12.237 1.00 0.00 N ATOM 869 CA ASN A 58 7.524 -5.817 -12.804 1.00 0.00 C ATOM 870 C ASN A 58 7.337 -7.054 -11.931 1.00 0.00 C ATOM 871 O ASN A 58 7.122 -8.156 -12.434 1.00 0.00 O ATOM 872 CB ASN A 58 9.014 -5.507 -12.958 1.00 0.00 C ATOM 873 CG ASN A 58 9.534 -4.604 -11.857 1.00 0.00 C ATOM 874 OD1 ASN A 58 9.174 -4.759 -10.690 1.00 0.00 O ATOM 875 ND2 ASN A 58 10.385 -3.653 -12.224 1.00 0.00 N ATOM 0 H ASN A 58 7.395 -3.827 -12.154 1.00 0.00 H new ATOM 0 HA ASN A 58 7.099 -6.021 -13.787 1.00 0.00 H new ATOM 0 HB2 ASN A 58 9.578 -6.440 -12.956 1.00 0.00 H new ATOM 0 HB3 ASN A 58 9.186 -5.033 -13.924 1.00 0.00 H new ATOM 0 HD21 ASN A 58 10.768 -3.014 -11.527 1.00 0.00 H new ATOM 0 HD22 ASN A 58 10.656 -3.561 -13.203 1.00 0.00 H new ATOM 882 N LYS A 59 7.420 -6.862 -10.618 1.00 0.00 N ATOM 883 CA LYS A 59 7.259 -7.961 -9.673 1.00 0.00 C ATOM 884 C LYS A 59 5.952 -8.706 -9.923 1.00 0.00 C ATOM 885 O LYS A 59 5.943 -9.926 -10.092 1.00 0.00 O ATOM 886 CB LYS A 59 7.291 -7.433 -8.237 1.00 0.00 C ATOM 887 CG LYS A 59 7.742 -8.467 -7.219 1.00 0.00 C ATOM 888 CD LYS A 59 6.581 -9.322 -6.740 1.00 0.00 C ATOM 889 CE LYS A 59 7.051 -10.426 -5.805 1.00 0.00 C ATOM 890 NZ LYS A 59 7.847 -11.459 -6.523 1.00 0.00 N ATOM 0 H LYS A 59 7.598 -5.956 -10.185 1.00 0.00 H new ATOM 0 HA LYS A 59 8.086 -8.656 -9.817 1.00 0.00 H new ATOM 0 HB2 LYS A 59 7.959 -6.573 -8.190 1.00 0.00 H new ATOM 0 HB3 LYS A 59 6.296 -7.079 -7.967 1.00 0.00 H new ATOM 0 HG2 LYS A 59 8.507 -9.105 -7.662 1.00 0.00 H new ATOM 0 HG3 LYS A 59 8.200 -7.964 -6.367 1.00 0.00 H new ATOM 0 HD2 LYS A 59 5.853 -8.694 -6.226 1.00 0.00 H new ATOM 0 HD3 LYS A 59 6.073 -9.762 -7.598 1.00 0.00 H new ATOM 0 HE2 LYS A 59 7.654 -9.993 -5.006 1.00 0.00 H new ATOM 0 HE3 LYS A 59 6.187 -10.895 -5.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 7.976 -12.288 -5.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 7.345 -11.744 -7.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 8.777 -11.067 -6.775 1.00 0.00 H new ATOM 904 N CYS A 60 4.849 -7.966 -9.947 1.00 0.00 N ATOM 905 CA CYS A 60 3.536 -8.556 -10.178 1.00 0.00 C ATOM 906 C CYS A 60 3.431 -9.112 -11.595 1.00 0.00 C ATOM 907 O CYS A 60 3.157 -10.297 -11.791 1.00 0.00 O ATOM 908 CB CYS A 60 2.438 -7.516 -9.944 1.00 0.00 C ATOM 909 SG CYS A 60 2.141 -7.131 -8.188 1.00 0.00 S ATOM 0 H CYS A 60 4.838 -6.955 -9.809 1.00 0.00 H new ATOM 0 HA CYS A 60 3.406 -9.377 -9.474 1.00 0.00 H new ATOM 0 HB2 CYS A 60 2.705 -6.597 -10.466 1.00 0.00 H new ATOM 0 HB3 CYS A 60 1.510 -7.877 -10.388 1.00 0.00 H new ATOM 914 N THR A 61 3.650 -8.249 -12.582 1.00 0.00 N ATOM 915 CA THR A 61 3.580 -8.652 -13.980 1.00 0.00 C ATOM 916 C THR A 61 4.209 -10.025 -14.189 1.00 0.00 C ATOM 917 O THR A 61 3.607 -10.910 -14.798 1.00 0.00 O ATOM 918 CB THR A 61 4.285 -7.633 -14.895 1.00 0.00 C ATOM 919 OG1 THR A 61 5.675 -7.556 -14.563 1.00 0.00 O ATOM 920 CG2 THR A 61 3.649 -6.257 -14.763 1.00 0.00 C ATOM 0 H THR A 61 3.878 -7.265 -12.438 1.00 0.00 H new ATOM 0 HA THR A 61 2.523 -8.695 -14.243 1.00 0.00 H new ATOM 0 HB THR A 61 4.177 -7.968 -15.927 1.00 0.00 H new ATOM 0 HG1 THR A 61 5.794 -7.745 -13.609 1.00 0.00 H new ATOM 0 HG21 THR A 61 4.163 -5.554 -15.418 1.00 0.00 H new ATOM 0 HG22 THR A 61 2.598 -6.314 -15.045 1.00 0.00 H new ATOM 0 HG23 THR A 61 3.730 -5.916 -13.731 1.00 0.00 H new ATOM 928 N THR A 62 5.425 -10.198 -13.679 1.00 0.00 N ATOM 929 CA THR A 62 6.136 -11.463 -13.810 1.00 0.00 C ATOM 930 C THR A 62 5.235 -12.640 -13.450 1.00 0.00 C ATOM 931 O THR A 62 4.880 -12.829 -12.287 1.00 0.00 O ATOM 932 CB THR A 62 7.389 -11.499 -12.915 1.00 0.00 C ATOM 933 OG1 THR A 62 8.265 -10.418 -13.256 1.00 0.00 O ATOM 934 CG2 THR A 62 8.124 -12.822 -13.066 1.00 0.00 C ATOM 0 H THR A 62 5.938 -9.477 -13.171 1.00 0.00 H new ATOM 0 HA THR A 62 6.441 -11.547 -14.853 1.00 0.00 H new ATOM 0 HB THR A 62 7.071 -11.395 -11.878 1.00 0.00 H new ATOM 0 HG1 THR A 62 8.058 -9.640 -12.697 1.00 0.00 H new ATOM 0 HG21 THR A 62 9.005 -12.824 -12.424 1.00 0.00 H new ATOM 0 HG22 THR A 62 7.464 -13.640 -12.778 1.00 0.00 H new ATOM 0 HG23 THR A 62 8.431 -12.951 -14.104 1.00 0.00 H new ATOM 942 N ARG A 63 4.869 -13.428 -14.456 1.00 0.00 N ATOM 943 CA ARG A 63 4.010 -14.586 -14.245 1.00 0.00 C ATOM 944 C ARG A 63 4.313 -15.252 -12.906 1.00 0.00 C ATOM 945 O ARG A 63 5.466 -15.553 -12.600 1.00 0.00 O ATOM 946 CB ARG A 63 4.189 -15.595 -15.381 1.00 0.00 C ATOM 947 CG ARG A 63 5.574 -16.219 -15.427 1.00 0.00 C ATOM 948 CD ARG A 63 5.671 -17.280 -16.513 1.00 0.00 C ATOM 949 NE ARG A 63 6.013 -16.706 -17.811 1.00 0.00 N ATOM 950 CZ ARG A 63 7.260 -16.470 -18.204 1.00 0.00 C ATOM 951 NH1 ARG A 63 8.277 -16.759 -17.405 1.00 0.00 N ATOM 952 NH2 ARG A 63 7.491 -15.945 -19.401 1.00 0.00 N ATOM 0 H ARG A 63 5.154 -13.285 -15.425 1.00 0.00 H new ATOM 0 HA ARG A 63 2.976 -14.242 -14.234 1.00 0.00 H new ATOM 0 HB2 ARG A 63 3.447 -16.386 -15.274 1.00 0.00 H new ATOM 0 HB3 ARG A 63 3.991 -15.099 -16.331 1.00 0.00 H new ATOM 0 HG2 ARG A 63 6.318 -15.443 -15.607 1.00 0.00 H new ATOM 0 HG3 ARG A 63 5.806 -16.665 -14.460 1.00 0.00 H new ATOM 0 HD2 ARG A 63 6.424 -18.017 -16.233 1.00 0.00 H new ATOM 0 HD3 ARG A 63 4.721 -17.808 -16.589 1.00 0.00 H new ATOM 0 HE ARG A 63 5.253 -16.474 -18.451 1.00 0.00 H new ATOM 0 HH11 ARG A 63 8.104 -17.164 -16.485 1.00 0.00 H new ATOM 0 HH12 ARG A 63 9.233 -16.576 -17.710 1.00 0.00 H new ATOM 0 HH21 ARG A 63 6.711 -15.723 -20.019 1.00 0.00 H new ATOM 0 HH22 ARG A 63 8.449 -15.764 -19.702 1.00 0.00 H new ATOM 966 N GLU A 64 3.270 -15.478 -12.113 1.00 0.00 N ATOM 967 CA GLU A 64 3.426 -16.106 -10.807 1.00 0.00 C ATOM 968 C GLU A 64 2.084 -16.603 -10.278 1.00 0.00 C ATOM 969 O GLU A 64 1.028 -16.236 -10.793 1.00 0.00 O ATOM 970 CB GLU A 64 4.046 -15.122 -9.813 1.00 0.00 C ATOM 971 CG GLU A 64 4.866 -15.792 -8.723 1.00 0.00 C ATOM 972 CD GLU A 64 4.028 -16.192 -7.525 1.00 0.00 C ATOM 973 OE1 GLU A 64 3.435 -15.296 -6.889 1.00 0.00 O ATOM 974 OE2 GLU A 64 3.964 -17.403 -7.224 1.00 0.00 O ATOM 0 H GLU A 64 2.309 -15.235 -12.353 1.00 0.00 H new ATOM 0 HA GLU A 64 4.091 -16.962 -10.922 1.00 0.00 H new ATOM 0 HB2 GLU A 64 4.682 -14.423 -10.356 1.00 0.00 H new ATOM 0 HB3 GLU A 64 3.251 -14.537 -9.350 1.00 0.00 H new ATOM 0 HG2 GLU A 64 5.353 -16.677 -9.132 1.00 0.00 H new ATOM 0 HG3 GLU A 64 5.656 -15.114 -8.399 1.00 0.00 H new ATOM 981 N ASP A 65 2.134 -17.439 -9.247 1.00 0.00 N ATOM 982 CA ASP A 65 0.922 -17.986 -8.646 1.00 0.00 C ATOM 983 C ASP A 65 0.132 -18.802 -9.665 1.00 0.00 C ATOM 984 O ASP A 65 -1.096 -18.732 -9.713 1.00 0.00 O ATOM 985 CB ASP A 65 0.050 -16.859 -8.090 1.00 0.00 C ATOM 986 CG ASP A 65 0.587 -16.303 -6.785 1.00 0.00 C ATOM 987 OD1 ASP A 65 0.895 -17.106 -5.880 1.00 0.00 O ATOM 988 OD2 ASP A 65 0.697 -15.064 -6.669 1.00 0.00 O ATOM 0 H ASP A 65 3.000 -17.753 -8.810 1.00 0.00 H new ATOM 0 HA ASP A 65 1.216 -18.644 -7.829 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -0.014 -16.056 -8.825 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -0.963 -17.230 -7.934 1.00 0.00 H new ATOM 993 N SER A 66 0.845 -19.574 -10.478 1.00 0.00 N ATOM 994 CA SER A 66 0.211 -20.400 -11.499 1.00 0.00 C ATOM 995 C SER A 66 -1.143 -20.913 -11.019 1.00 0.00 C ATOM 996 O SER A 66 -1.346 -21.193 -9.837 1.00 0.00 O ATOM 997 CB SER A 66 1.115 -21.579 -11.865 1.00 0.00 C ATOM 998 OG SER A 66 2.150 -21.174 -12.744 1.00 0.00 O ATOM 0 H SER A 66 1.862 -19.645 -10.450 1.00 0.00 H new ATOM 0 HA SER A 66 0.054 -19.783 -12.384 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.548 -22.004 -10.960 1.00 0.00 H new ATOM 0 HB3 SER A 66 0.522 -22.364 -12.334 1.00 0.00 H new ATOM 0 HG SER A 66 2.715 -21.945 -12.961 1.00 0.00 H new ATOM 1004 N PRO A 67 -2.094 -21.039 -11.957 1.00 0.00 N ATOM 1005 CA PRO A 67 -3.445 -21.519 -11.655 1.00 0.00 C ATOM 1006 C PRO A 67 -3.468 -23.000 -11.293 1.00 0.00 C ATOM 1007 O PRO A 67 -2.428 -23.659 -11.267 1.00 0.00 O ATOM 1008 CB PRO A 67 -4.208 -21.275 -12.959 1.00 0.00 C ATOM 1009 CG PRO A 67 -3.161 -21.291 -14.019 1.00 0.00 C ATOM 1010 CD PRO A 67 -1.922 -20.723 -13.385 1.00 0.00 C ATOM 0 HA PRO A 67 -3.874 -21.010 -10.792 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -4.957 -22.048 -13.130 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -4.735 -20.321 -12.937 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -2.986 -22.305 -14.379 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -3.467 -20.696 -14.879 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -1.018 -21.177 -13.791 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -1.841 -19.649 -13.552 1.00 0.00 H new ATOM 1018 N LYS A 68 -4.659 -23.519 -11.016 1.00 0.00 N ATOM 1019 CA LYS A 68 -4.818 -24.924 -10.658 1.00 0.00 C ATOM 1020 C LYS A 68 -6.088 -25.502 -11.275 1.00 0.00 C ATOM 1021 O LYS A 68 -7.020 -24.768 -11.603 1.00 0.00 O ATOM 1022 CB LYS A 68 -4.859 -25.082 -9.137 1.00 0.00 C ATOM 1023 CG LYS A 68 -6.036 -24.379 -8.484 1.00 0.00 C ATOM 1024 CD LYS A 68 -5.889 -24.333 -6.972 1.00 0.00 C ATOM 1025 CE LYS A 68 -7.043 -23.584 -6.322 1.00 0.00 C ATOM 1026 NZ LYS A 68 -8.346 -24.266 -6.552 1.00 0.00 N ATOM 0 H LYS A 68 -5.529 -22.987 -11.032 1.00 0.00 H new ATOM 0 HA LYS A 68 -3.962 -25.473 -11.051 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -4.899 -26.143 -8.891 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -3.933 -24.691 -8.714 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -6.117 -23.364 -8.874 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -6.960 -24.895 -8.745 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -5.845 -25.349 -6.579 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -4.947 -23.850 -6.711 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -6.862 -23.498 -5.251 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -7.088 -22.570 -6.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -9.078 -23.826 -5.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -8.612 -24.177 -7.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -8.259 -25.272 -6.305 1.00 0.00 H new ATOM 1040 N CYS A 69 -6.118 -26.821 -11.427 1.00 0.00 N ATOM 1041 CA CYS A 69 -7.273 -27.499 -12.003 1.00 0.00 C ATOM 1042 C CYS A 69 -8.203 -28.014 -10.908 1.00 0.00 C ATOM 1043 O CYS A 69 -7.809 -28.130 -9.747 1.00 0.00 O ATOM 1044 CB CYS A 69 -6.820 -28.660 -12.891 1.00 0.00 C ATOM 1045 SG CYS A 69 -8.186 -29.557 -13.696 1.00 0.00 S ATOM 0 H CYS A 69 -5.355 -27.443 -11.159 1.00 0.00 H new ATOM 0 HA CYS A 69 -7.820 -26.778 -12.611 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -6.149 -28.275 -13.659 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -6.244 -29.362 -12.288 1.00 0.00 H new ATOM 1050 N LYS A 70 -9.439 -28.323 -11.286 1.00 0.00 N ATOM 1051 CA LYS A 70 -10.425 -28.828 -10.338 1.00 0.00 C ATOM 1052 C LYS A 70 -10.825 -30.260 -10.680 1.00 0.00 C ATOM 1053 O LYS A 70 -11.207 -31.034 -9.804 1.00 0.00 O ATOM 1054 CB LYS A 70 -11.664 -27.929 -10.332 1.00 0.00 C ATOM 1055 CG LYS A 70 -12.537 -28.105 -9.102 1.00 0.00 C ATOM 1056 CD LYS A 70 -12.134 -27.153 -7.990 1.00 0.00 C ATOM 1057 CE LYS A 70 -12.751 -27.556 -6.659 1.00 0.00 C ATOM 1058 NZ LYS A 70 -12.558 -26.509 -5.618 1.00 0.00 N ATOM 0 H LYS A 70 -9.782 -28.232 -12.242 1.00 0.00 H new ATOM 0 HA LYS A 70 -9.974 -28.822 -9.346 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -11.348 -26.888 -10.397 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -12.258 -28.137 -11.222 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -13.580 -27.934 -9.368 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -12.463 -29.133 -8.747 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -11.048 -27.138 -7.899 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -12.447 -26.141 -8.245 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -13.817 -27.742 -6.794 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -12.305 -28.491 -6.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -12.993 -26.822 -4.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -11.541 -26.350 -5.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -13.006 -25.623 -5.929 1.00 0.00 H new ATOM 1072 N GLY A 71 -10.734 -30.605 -11.961 1.00 0.00 N ATOM 1073 CA GLY A 71 -11.088 -31.944 -12.395 1.00 0.00 C ATOM 1074 C GLY A 71 -10.162 -33.002 -11.829 1.00 0.00 C ATOM 1075 O GLY A 71 -10.596 -34.106 -11.499 1.00 0.00 O ATOM 0 H GLY A 71 -10.422 -29.982 -12.705 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -12.112 -32.162 -12.091 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -11.062 -31.988 -13.484 1.00 0.00 H new ATOM 1079 N CYS A 72 -8.881 -32.665 -11.716 1.00 0.00 N ATOM 1080 CA CYS A 72 -7.890 -33.595 -11.188 1.00 0.00 C ATOM 1081 C CYS A 72 -7.143 -32.980 -10.008 1.00 0.00 C ATOM 1082 O CYS A 72 -6.573 -33.693 -9.181 1.00 0.00 O ATOM 1083 CB CYS A 72 -6.897 -33.991 -12.283 1.00 0.00 C ATOM 1084 SG CYS A 72 -6.101 -32.577 -13.112 1.00 0.00 S ATOM 0 H CYS A 72 -8.505 -31.755 -11.983 1.00 0.00 H new ATOM 0 HA CYS A 72 -8.413 -34.486 -10.841 1.00 0.00 H new ATOM 0 HB2 CYS A 72 -6.125 -34.624 -11.846 1.00 0.00 H new ATOM 0 HB3 CYS A 72 -7.417 -34.591 -13.030 1.00 0.00 H new ATOM 1089 N PHE A 73 -7.151 -31.653 -9.935 1.00 0.00 N ATOM 1090 CA PHE A 73 -6.474 -30.942 -8.857 1.00 0.00 C ATOM 1091 C PHE A 73 -4.961 -30.977 -9.049 1.00 0.00 C ATOM 1092 O PHE A 73 -4.216 -31.342 -8.139 1.00 0.00 O ATOM 1093 CB PHE A 73 -6.843 -31.555 -7.504 1.00 0.00 C ATOM 1094 CG PHE A 73 -6.607 -30.630 -6.344 1.00 0.00 C ATOM 1095 CD1 PHE A 73 -7.248 -29.404 -6.277 1.00 0.00 C ATOM 1096 CD2 PHE A 73 -5.746 -30.989 -5.319 1.00 0.00 C ATOM 1097 CE1 PHE A 73 -7.032 -28.551 -5.211 1.00 0.00 C ATOM 1098 CE2 PHE A 73 -5.527 -30.140 -4.250 1.00 0.00 C ATOM 1099 CZ PHE A 73 -6.171 -28.920 -4.196 1.00 0.00 C ATOM 0 H PHE A 73 -7.619 -31.048 -10.610 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.801 -29.902 -8.878 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -7.894 -31.845 -7.520 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -6.263 -32.466 -7.356 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -7.924 -29.111 -7.067 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -5.240 -31.943 -5.356 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -7.536 -27.597 -5.172 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -4.853 -30.431 -3.458 1.00 0.00 H new ATOM 0 HZ PHE A 73 -6.002 -28.255 -3.362 1.00 0.00 H new ATOM 1109 N LYS A 74 -4.513 -30.594 -10.239 1.00 0.00 N ATOM 1110 CA LYS A 74 -3.089 -30.579 -10.553 1.00 0.00 C ATOM 1111 C LYS A 74 -2.646 -29.193 -11.010 1.00 0.00 C ATOM 1112 O LYS A 74 -3.382 -28.495 -11.707 1.00 0.00 O ATOM 1113 CB LYS A 74 -2.774 -31.611 -11.639 1.00 0.00 C ATOM 1114 CG LYS A 74 -3.129 -33.035 -11.247 1.00 0.00 C ATOM 1115 CD LYS A 74 -3.055 -33.976 -12.437 1.00 0.00 C ATOM 1116 CE LYS A 74 -1.661 -34.562 -12.598 1.00 0.00 C ATOM 1117 NZ LYS A 74 -1.384 -35.620 -11.587 1.00 0.00 N ATOM 0 H LYS A 74 -5.116 -30.289 -11.003 1.00 0.00 H new ATOM 0 HA LYS A 74 -2.541 -30.835 -9.647 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -3.316 -31.347 -12.547 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -1.711 -31.563 -11.877 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -2.449 -33.379 -10.467 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -4.134 -33.058 -10.826 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -3.777 -34.782 -12.310 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -3.332 -33.439 -13.344 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -1.556 -34.980 -13.599 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -0.920 -33.768 -12.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -0.509 -36.121 -11.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -1.275 -35.184 -10.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -2.175 -36.295 -11.565 1.00 0.00 H new ATOM 1131 N ALA A 75 -1.440 -28.801 -10.615 1.00 0.00 N ATOM 1132 CA ALA A 75 -0.898 -27.500 -10.987 1.00 0.00 C ATOM 1133 C ALA A 75 -0.990 -27.278 -12.493 1.00 0.00 C ATOM 1134 O ALA A 75 -0.409 -28.029 -13.277 1.00 0.00 O ATOM 1135 CB ALA A 75 0.544 -27.375 -10.520 1.00 0.00 C ATOM 0 H ALA A 75 -0.819 -29.366 -10.037 1.00 0.00 H new ATOM 0 HA ALA A 75 -1.494 -26.731 -10.495 1.00 0.00 H new ATOM 0 HB1 ALA A 75 0.935 -26.398 -10.805 1.00 0.00 H new ATOM 0 HB2 ALA A 75 0.586 -27.481 -9.436 1.00 0.00 H new ATOM 0 HB3 ALA A 75 1.146 -28.156 -10.984 1.00 0.00 H new ATOM 1141 N ILE A 76 -1.724 -26.244 -12.890 1.00 0.00 N ATOM 1142 CA ILE A 76 -1.890 -25.924 -14.302 1.00 0.00 C ATOM 1143 C ILE A 76 -0.715 -25.104 -14.823 1.00 0.00 C ATOM 1144 O ILE A 76 -0.082 -24.360 -14.073 1.00 0.00 O ATOM 1145 CB ILE A 76 -3.195 -25.145 -14.553 1.00 0.00 C ATOM 1146 CG1 ILE A 76 -4.405 -25.993 -14.155 1.00 0.00 C ATOM 1147 CG2 ILE A 76 -3.291 -24.727 -16.012 1.00 0.00 C ATOM 1148 CD1 ILE A 76 -5.717 -25.242 -14.219 1.00 0.00 C ATOM 0 H ILE A 76 -2.213 -25.614 -12.254 1.00 0.00 H new ATOM 0 HA ILE A 76 -1.933 -26.873 -14.837 1.00 0.00 H new ATOM 0 HB ILE A 76 -3.187 -24.245 -13.938 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -4.461 -26.862 -14.811 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -4.259 -26.367 -13.142 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -4.219 -24.178 -16.173 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -2.443 -24.090 -16.264 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -3.280 -25.614 -16.646 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -6.530 -25.905 -13.924 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -5.681 -24.388 -13.542 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -5.886 -24.891 -15.237 1.00 0.00 H new ATOM 1160 N VAL A 77 -0.428 -25.244 -16.113 1.00 0.00 N ATOM 1161 CA VAL A 77 0.670 -24.515 -16.736 1.00 0.00 C ATOM 1162 C VAL A 77 0.150 -23.384 -17.616 1.00 0.00 C ATOM 1163 O VAL A 77 -0.867 -23.530 -18.294 1.00 0.00 O ATOM 1164 CB VAL A 77 1.554 -25.448 -17.586 1.00 0.00 C ATOM 1165 CG1 VAL A 77 2.758 -24.694 -18.129 1.00 0.00 C ATOM 1166 CG2 VAL A 77 1.993 -26.654 -16.770 1.00 0.00 C ATOM 0 H VAL A 77 -0.941 -25.856 -16.747 1.00 0.00 H new ATOM 0 HA VAL A 77 1.270 -24.096 -15.928 1.00 0.00 H new ATOM 0 HB VAL A 77 0.967 -25.805 -18.433 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.371 -25.369 -18.727 1.00 0.00 H new ATOM 0 HG12 VAL A 77 2.418 -23.866 -18.751 1.00 0.00 H new ATOM 0 HG13 VAL A 77 3.349 -24.306 -17.299 1.00 0.00 H new ATOM 0 HG21 VAL A 77 2.616 -27.302 -17.386 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.563 -26.319 -15.903 1.00 0.00 H new ATOM 0 HG23 VAL A 77 1.115 -27.206 -16.435 1.00 0.00 H new ATOM 1176 N ALA A 78 0.854 -22.258 -17.602 1.00 0.00 N ATOM 1177 CA ALA A 78 0.465 -21.103 -18.401 1.00 0.00 C ATOM 1178 C ALA A 78 0.169 -21.506 -19.841 1.00 0.00 C ATOM 1179 O ALA A 78 -0.911 -21.232 -20.364 1.00 0.00 O ATOM 1180 CB ALA A 78 1.555 -20.042 -18.361 1.00 0.00 C ATOM 0 H ALA A 78 1.698 -22.121 -17.046 1.00 0.00 H new ATOM 0 HA ALA A 78 -0.447 -20.687 -17.973 1.00 0.00 H new ATOM 0 HB1 ALA A 78 1.251 -19.185 -18.962 1.00 0.00 H new ATOM 0 HB2 ALA A 78 1.716 -19.724 -17.331 1.00 0.00 H new ATOM 0 HB3 ALA A 78 2.480 -20.456 -18.761 1.00 0.00 H new ATOM 1186 N GLY A 79 1.136 -22.159 -20.479 1.00 0.00 N ATOM 1187 CA GLY A 79 0.959 -22.589 -21.854 1.00 0.00 C ATOM 1188 C GLY A 79 -0.211 -23.539 -22.018 1.00 0.00 C ATOM 1189 O GLY A 79 -0.917 -23.496 -23.026 1.00 0.00 O ATOM 0 H GLY A 79 2.039 -22.398 -20.068 1.00 0.00 H new ATOM 0 HA2 GLY A 79 0.805 -21.716 -22.488 1.00 0.00 H new ATOM 0 HA3 GLY A 79 1.871 -23.077 -22.199 1.00 0.00 H new ATOM 1193 N ASP A 80 -0.416 -24.399 -21.027 1.00 0.00 N ATOM 1194 CA ASP A 80 -1.509 -25.365 -21.066 1.00 0.00 C ATOM 1195 C ASP A 80 -2.852 -24.659 -21.228 1.00 0.00 C ATOM 1196 O ASP A 80 -3.089 -23.612 -20.628 1.00 0.00 O ATOM 1197 CB ASP A 80 -1.514 -26.213 -19.794 1.00 0.00 C ATOM 1198 CG ASP A 80 -0.671 -27.466 -19.929 1.00 0.00 C ATOM 1199 OD1 ASP A 80 0.302 -27.444 -20.711 1.00 0.00 O ATOM 1200 OD2 ASP A 80 -0.985 -28.467 -19.252 1.00 0.00 O ATOM 0 H ASP A 80 0.160 -24.448 -20.187 1.00 0.00 H new ATOM 0 HA ASP A 80 -1.355 -26.017 -21.926 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -1.141 -25.616 -18.962 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -2.539 -26.493 -19.552 1.00 0.00 H new ATOM 1205 N GLN A 81 -3.725 -25.241 -22.044 1.00 0.00 N ATOM 1206 CA GLN A 81 -5.043 -24.666 -22.286 1.00 0.00 C ATOM 1207 C GLN A 81 -5.984 -24.951 -21.120 1.00 0.00 C ATOM 1208 O GLN A 81 -6.334 -26.101 -20.860 1.00 0.00 O ATOM 1209 CB GLN A 81 -5.635 -25.223 -23.582 1.00 0.00 C ATOM 1210 CG GLN A 81 -5.179 -24.480 -24.828 1.00 0.00 C ATOM 1211 CD GLN A 81 -5.778 -25.050 -26.099 1.00 0.00 C ATOM 1212 OE1 GLN A 81 -5.574 -26.219 -26.425 1.00 0.00 O ATOM 1213 NE2 GLN A 81 -6.522 -24.224 -26.825 1.00 0.00 N ATOM 0 H GLN A 81 -3.544 -26.109 -22.548 1.00 0.00 H new ATOM 0 HA GLN A 81 -4.929 -23.586 -22.381 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -5.361 -26.274 -23.675 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -6.723 -25.182 -23.522 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -5.454 -23.429 -24.741 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -4.092 -24.521 -24.893 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -6.665 -23.262 -26.517 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -6.951 -24.551 -27.691 1.00 0.00 H new ATOM 1222 N ASN A 82 -6.388 -23.896 -20.421 1.00 0.00 N ATOM 1223 CA ASN A 82 -7.288 -24.033 -19.281 1.00 0.00 C ATOM 1224 C ASN A 82 -8.664 -23.457 -19.602 1.00 0.00 C ATOM 1225 O ASN A 82 -8.804 -22.612 -20.485 1.00 0.00 O ATOM 1226 CB ASN A 82 -6.702 -23.330 -18.055 1.00 0.00 C ATOM 1227 CG ASN A 82 -5.186 -23.281 -18.086 1.00 0.00 C ATOM 1228 OD1 ASN A 82 -4.535 -24.192 -18.598 1.00 0.00 O ATOM 1229 ND2 ASN A 82 -4.618 -22.215 -17.536 1.00 0.00 N ATOM 0 H ASN A 82 -6.107 -22.937 -20.623 1.00 0.00 H new ATOM 0 HA ASN A 82 -7.400 -25.095 -19.064 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -7.095 -22.315 -18.000 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -7.028 -23.847 -17.153 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -3.602 -22.127 -17.526 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -5.198 -21.484 -17.123 1.00 0.00 H new ATOM 1236 N VAL A 83 -9.677 -23.921 -18.877 1.00 0.00 N ATOM 1237 CA VAL A 83 -11.042 -23.452 -19.082 1.00 0.00 C ATOM 1238 C VAL A 83 -11.611 -22.841 -17.806 1.00 0.00 C ATOM 1239 O VAL A 83 -11.843 -23.542 -16.822 1.00 0.00 O ATOM 1240 CB VAL A 83 -11.964 -24.594 -19.547 1.00 0.00 C ATOM 1241 CG1 VAL A 83 -13.360 -24.066 -19.844 1.00 0.00 C ATOM 1242 CG2 VAL A 83 -11.377 -25.289 -20.766 1.00 0.00 C ATOM 0 H VAL A 83 -9.578 -24.622 -18.142 1.00 0.00 H new ATOM 0 HA VAL A 83 -11.001 -22.689 -19.859 1.00 0.00 H new ATOM 0 HB VAL A 83 -12.042 -25.326 -18.743 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -13.998 -24.887 -20.171 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -13.779 -23.618 -18.943 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -13.305 -23.314 -20.631 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -12.041 -26.093 -21.081 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -11.268 -24.570 -21.578 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -10.401 -25.703 -20.514 1.00 0.00 H new ATOM 1252 N GLU A 84 -11.832 -21.530 -17.831 1.00 0.00 N ATOM 1253 CA GLU A 84 -12.374 -20.825 -16.676 1.00 0.00 C ATOM 1254 C GLU A 84 -13.888 -20.671 -16.793 1.00 0.00 C ATOM 1255 O GLU A 84 -14.383 -19.928 -17.642 1.00 0.00 O ATOM 1256 CB GLU A 84 -11.719 -19.450 -16.536 1.00 0.00 C ATOM 1257 CG GLU A 84 -11.620 -18.965 -15.100 1.00 0.00 C ATOM 1258 CD GLU A 84 -11.686 -17.455 -14.987 1.00 0.00 C ATOM 1259 OE1 GLU A 84 -10.622 -16.807 -15.076 1.00 0.00 O ATOM 1260 OE2 GLU A 84 -12.800 -16.921 -14.811 1.00 0.00 O ATOM 0 H GLU A 84 -11.644 -20.935 -18.638 1.00 0.00 H new ATOM 0 HA GLU A 84 -12.155 -21.416 -15.787 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -10.719 -19.488 -16.967 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -12.289 -18.725 -17.117 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -12.428 -19.405 -14.516 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -10.684 -19.317 -14.665 1.00 0.00 H new ATOM 1267 N TYR A 85 -14.617 -21.377 -15.936 1.00 0.00 N ATOM 1268 CA TYR A 85 -16.074 -21.321 -15.945 1.00 0.00 C ATOM 1269 C TYR A 85 -16.588 -20.357 -14.880 1.00 0.00 C ATOM 1270 O TYR A 85 -17.075 -19.270 -15.193 1.00 0.00 O ATOM 1271 CB TYR A 85 -16.660 -22.715 -15.713 1.00 0.00 C ATOM 1272 CG TYR A 85 -18.130 -22.702 -15.359 1.00 0.00 C ATOM 1273 CD1 TYR A 85 -19.071 -22.178 -16.237 1.00 0.00 C ATOM 1274 CD2 TYR A 85 -18.578 -23.214 -14.148 1.00 0.00 C ATOM 1275 CE1 TYR A 85 -20.415 -22.163 -15.918 1.00 0.00 C ATOM 1276 CE2 TYR A 85 -19.920 -23.205 -13.822 1.00 0.00 C ATOM 1277 CZ TYR A 85 -20.835 -22.679 -14.710 1.00 0.00 C ATOM 1278 OH TYR A 85 -22.172 -22.667 -14.388 1.00 0.00 O ATOM 0 H TYR A 85 -14.223 -21.995 -15.226 1.00 0.00 H new ATOM 0 HA TYR A 85 -16.393 -20.958 -16.922 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -16.517 -23.315 -16.612 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -16.106 -23.204 -14.912 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -18.746 -21.776 -17.185 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -17.865 -23.626 -13.450 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -21.133 -21.749 -16.611 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -20.251 -23.608 -12.876 1.00 0.00 H new ATOM 0 HH TYR A 85 -22.299 -23.068 -13.503 1.00 0.00 H new ATOM 1288 N LYS A 86 -16.476 -20.763 -13.620 1.00 0.00 N ATOM 1289 CA LYS A 86 -16.927 -19.936 -12.507 1.00 0.00 C ATOM 1290 C LYS A 86 -15.813 -19.748 -11.482 1.00 0.00 C ATOM 1291 O LYS A 86 -15.927 -20.191 -10.340 1.00 0.00 O ATOM 1292 CB LYS A 86 -18.149 -20.569 -11.837 1.00 0.00 C ATOM 1293 CG LYS A 86 -19.460 -20.242 -12.530 1.00 0.00 C ATOM 1294 CD LYS A 86 -20.641 -20.377 -11.583 1.00 0.00 C ATOM 1295 CE LYS A 86 -21.880 -19.690 -12.136 1.00 0.00 C ATOM 1296 NZ LYS A 86 -21.944 -18.256 -11.737 1.00 0.00 N ATOM 0 H LYS A 86 -16.077 -21.660 -13.344 1.00 0.00 H new ATOM 0 HA LYS A 86 -17.202 -18.958 -12.902 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -18.020 -21.651 -11.813 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -18.201 -20.232 -10.802 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -19.421 -19.226 -12.922 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -19.598 -20.908 -13.382 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -20.854 -21.432 -11.413 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -20.385 -19.944 -10.616 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -21.882 -19.765 -13.223 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -22.771 -20.206 -11.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -22.803 -17.823 -12.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -21.968 -18.185 -10.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -21.106 -17.757 -12.099 1.00 0.00 H new ATOM 1310 N GLY A 87 -14.737 -19.088 -11.899 1.00 0.00 N ATOM 1311 CA GLY A 87 -13.619 -18.853 -11.004 1.00 0.00 C ATOM 1312 C GLY A 87 -12.640 -20.010 -10.982 1.00 0.00 C ATOM 1313 O GLY A 87 -11.438 -19.814 -10.802 1.00 0.00 O ATOM 0 H GLY A 87 -14.620 -18.712 -12.840 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -13.098 -17.946 -11.310 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -13.995 -18.680 -9.996 1.00 0.00 H new ATOM 1317 N THR A 88 -13.155 -21.222 -11.164 1.00 0.00 N ATOM 1318 CA THR A 88 -12.320 -22.416 -11.161 1.00 0.00 C ATOM 1319 C THR A 88 -11.949 -22.832 -12.580 1.00 0.00 C ATOM 1320 O THR A 88 -12.819 -23.007 -13.433 1.00 0.00 O ATOM 1321 CB THR A 88 -13.024 -23.594 -10.461 1.00 0.00 C ATOM 1322 OG1 THR A 88 -14.439 -23.512 -10.670 1.00 0.00 O ATOM 1323 CG2 THR A 88 -12.726 -23.594 -8.969 1.00 0.00 C ATOM 0 H THR A 88 -14.147 -21.402 -11.315 1.00 0.00 H new ATOM 0 HA THR A 88 -11.414 -22.165 -10.610 1.00 0.00 H new ATOM 0 HB THR A 88 -12.646 -24.522 -10.890 1.00 0.00 H new ATOM 0 HG1 THR A 88 -14.880 -24.265 -10.224 1.00 0.00 H new ATOM 0 HG21 THR A 88 -13.234 -24.435 -8.497 1.00 0.00 H new ATOM 0 HG22 THR A 88 -11.651 -23.685 -8.813 1.00 0.00 H new ATOM 0 HG23 THR A 88 -13.079 -22.662 -8.527 1.00 0.00 H new ATOM 1331 N VAL A 89 -10.652 -22.989 -12.826 1.00 0.00 N ATOM 1332 CA VAL A 89 -10.167 -23.385 -14.143 1.00 0.00 C ATOM 1333 C VAL A 89 -10.030 -24.900 -14.244 1.00 0.00 C ATOM 1334 O VAL A 89 -9.602 -25.560 -13.297 1.00 0.00 O ATOM 1335 CB VAL A 89 -8.806 -22.736 -14.458 1.00 0.00 C ATOM 1336 CG1 VAL A 89 -8.691 -22.434 -15.944 1.00 0.00 C ATOM 1337 CG2 VAL A 89 -8.615 -21.473 -13.632 1.00 0.00 C ATOM 0 H VAL A 89 -9.919 -22.848 -12.131 1.00 0.00 H new ATOM 0 HA VAL A 89 -10.903 -23.040 -14.869 1.00 0.00 H new ATOM 0 HB VAL A 89 -8.016 -23.439 -14.192 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -7.723 -21.976 -16.148 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -8.781 -23.360 -16.512 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -9.486 -21.749 -16.239 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -7.648 -21.027 -13.867 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -9.408 -20.763 -13.865 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -8.651 -21.723 -12.572 1.00 0.00 H new ATOM 1347 N TRP A 90 -10.397 -25.446 -15.398 1.00 0.00 N ATOM 1348 CA TRP A 90 -10.315 -26.884 -15.624 1.00 0.00 C ATOM 1349 C TRP A 90 -9.548 -27.191 -16.906 1.00 0.00 C ATOM 1350 O TRP A 90 -9.721 -26.515 -17.921 1.00 0.00 O ATOM 1351 CB TRP A 90 -11.717 -27.491 -15.696 1.00 0.00 C ATOM 1352 CG TRP A 90 -12.601 -27.081 -14.557 1.00 0.00 C ATOM 1353 CD1 TRP A 90 -13.063 -25.824 -14.290 1.00 0.00 C ATOM 1354 CD2 TRP A 90 -13.127 -27.931 -13.532 1.00 0.00 C ATOM 1355 NE1 TRP A 90 -13.845 -25.841 -13.159 1.00 0.00 N ATOM 1356 CE2 TRP A 90 -13.900 -27.122 -12.676 1.00 0.00 C ATOM 1357 CE3 TRP A 90 -13.022 -29.296 -13.254 1.00 0.00 C ATOM 1358 CZ2 TRP A 90 -14.562 -27.635 -11.564 1.00 0.00 C ATOM 1359 CZ3 TRP A 90 -13.678 -29.804 -12.150 1.00 0.00 C ATOM 1360 CH2 TRP A 90 -14.441 -28.975 -11.316 1.00 0.00 C ATOM 0 H TRP A 90 -10.754 -24.914 -16.192 1.00 0.00 H new ATOM 0 HA TRP A 90 -9.777 -27.328 -14.786 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -12.185 -27.195 -16.635 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -11.634 -28.578 -15.709 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -12.846 -24.946 -14.880 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -14.309 -25.031 -12.747 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -12.438 -29.943 -13.892 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -15.150 -26.998 -10.920 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -13.602 -30.858 -11.925 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -14.943 -29.403 -10.461 1.00 0.00 H new ATOM 1371 N HIS A 91 -8.701 -28.214 -16.853 1.00 0.00 N ATOM 1372 CA HIS A 91 -7.909 -28.611 -18.011 1.00 0.00 C ATOM 1373 C HIS A 91 -8.801 -28.845 -19.226 1.00 0.00 C ATOM 1374 O HIS A 91 -9.771 -29.601 -19.161 1.00 0.00 O ATOM 1375 CB HIS A 91 -7.109 -29.877 -17.700 1.00 0.00 C ATOM 1376 CG HIS A 91 -5.938 -29.638 -16.798 1.00 0.00 C ATOM 1377 ND1 HIS A 91 -5.622 -30.464 -15.739 1.00 0.00 N ATOM 1378 CD2 HIS A 91 -5.001 -28.661 -16.803 1.00 0.00 C ATOM 1379 CE1 HIS A 91 -4.544 -30.003 -15.131 1.00 0.00 C ATOM 1380 NE2 HIS A 91 -4.147 -28.910 -15.757 1.00 0.00 N ATOM 0 H HIS A 91 -8.546 -28.783 -16.021 1.00 0.00 H new ATOM 0 HA HIS A 91 -7.217 -27.801 -18.241 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -7.770 -30.610 -17.238 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -6.755 -30.312 -18.635 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -4.937 -27.839 -17.500 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -4.068 -30.445 -14.268 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -3.338 -28.343 -15.505 1.00 0.00 H new ATOM 1388 N LYS A 92 -8.468 -28.191 -20.334 1.00 0.00 N ATOM 1389 CA LYS A 92 -9.238 -28.328 -21.564 1.00 0.00 C ATOM 1390 C LYS A 92 -9.744 -29.757 -21.734 1.00 0.00 C ATOM 1391 O LYS A 92 -10.791 -29.987 -22.339 1.00 0.00 O ATOM 1392 CB LYS A 92 -8.385 -27.931 -22.771 1.00 0.00 C ATOM 1393 CG LYS A 92 -9.199 -27.601 -24.010 1.00 0.00 C ATOM 1394 CD LYS A 92 -9.887 -26.252 -23.882 1.00 0.00 C ATOM 1395 CE LYS A 92 -10.886 -26.027 -25.006 1.00 0.00 C ATOM 1396 NZ LYS A 92 -11.684 -24.786 -24.799 1.00 0.00 N ATOM 0 H LYS A 92 -7.669 -27.561 -20.405 1.00 0.00 H new ATOM 0 HA LYS A 92 -10.099 -27.662 -21.500 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -7.776 -27.067 -22.506 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -7.699 -28.745 -23.004 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -8.548 -27.597 -24.884 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -9.946 -28.378 -24.173 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -10.399 -26.193 -22.922 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -9.140 -25.459 -23.894 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -10.355 -25.963 -25.956 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -11.557 -26.883 -25.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -12.353 -24.668 -25.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -12.210 -24.857 -23.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -11.046 -23.965 -24.761 1.00 0.00 H new ATOM 1410 N ASP A 93 -8.995 -30.712 -21.196 1.00 0.00 N ATOM 1411 CA ASP A 93 -9.369 -32.119 -21.286 1.00 0.00 C ATOM 1412 C ASP A 93 -10.400 -32.476 -20.219 1.00 0.00 C ATOM 1413 O ASP A 93 -11.466 -33.009 -20.525 1.00 0.00 O ATOM 1414 CB ASP A 93 -8.133 -33.008 -21.137 1.00 0.00 C ATOM 1415 CG ASP A 93 -7.135 -32.806 -22.260 1.00 0.00 C ATOM 1416 OD1 ASP A 93 -7.457 -33.167 -23.411 1.00 0.00 O ATOM 1417 OD2 ASP A 93 -6.032 -32.287 -21.987 1.00 0.00 O ATOM 0 H ASP A 93 -8.125 -30.538 -20.693 1.00 0.00 H new ATOM 0 HA ASP A 93 -9.813 -32.290 -22.267 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -7.650 -32.796 -20.183 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -8.442 -34.053 -21.113 1.00 0.00 H new ATOM 1422 N CYS A 94 -10.073 -32.180 -18.965 1.00 0.00 N ATOM 1423 CA CYS A 94 -10.969 -32.471 -17.852 1.00 0.00 C ATOM 1424 C CYS A 94 -12.352 -31.876 -18.098 1.00 0.00 C ATOM 1425 O CYS A 94 -13.364 -32.428 -17.664 1.00 0.00 O ATOM 1426 CB CYS A 94 -10.389 -31.921 -16.547 1.00 0.00 C ATOM 1427 SG CYS A 94 -8.875 -32.767 -15.992 1.00 0.00 S ATOM 0 H CYS A 94 -9.194 -31.739 -18.694 1.00 0.00 H new ATOM 0 HA CYS A 94 -11.068 -33.553 -17.770 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -10.173 -30.860 -16.676 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -11.144 -32.000 -15.765 1.00 0.00 H new ATOM 1432 N PHE A 95 -12.389 -30.746 -18.796 1.00 0.00 N ATOM 1433 CA PHE A 95 -13.648 -30.075 -19.099 1.00 0.00 C ATOM 1434 C PHE A 95 -14.122 -30.418 -20.509 1.00 0.00 C ATOM 1435 O PHE A 95 -13.488 -30.045 -21.496 1.00 0.00 O ATOM 1436 CB PHE A 95 -13.490 -28.560 -18.957 1.00 0.00 C ATOM 1437 CG PHE A 95 -14.780 -27.846 -18.671 1.00 0.00 C ATOM 1438 CD1 PHE A 95 -15.803 -27.836 -19.605 1.00 0.00 C ATOM 1439 CD2 PHE A 95 -14.969 -27.186 -17.468 1.00 0.00 C ATOM 1440 CE1 PHE A 95 -16.992 -27.181 -19.344 1.00 0.00 C ATOM 1441 CE2 PHE A 95 -16.156 -26.530 -17.201 1.00 0.00 C ATOM 1442 CZ PHE A 95 -17.168 -26.526 -18.141 1.00 0.00 C ATOM 0 H PHE A 95 -11.562 -30.275 -19.163 1.00 0.00 H new ATOM 0 HA PHE A 95 -14.397 -30.424 -18.388 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -12.783 -28.350 -18.155 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -13.059 -28.160 -19.875 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -15.670 -28.346 -20.548 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -14.180 -27.184 -16.730 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -17.782 -27.181 -20.080 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -16.292 -26.021 -16.258 1.00 0.00 H new ATOM 0 HZ PHE A 95 -18.095 -26.012 -17.936 1.00 0.00 H new ATOM 1452 N SER A 96 -15.240 -31.132 -20.593 1.00 0.00 N ATOM 1453 CA SER A 96 -15.797 -31.531 -21.880 1.00 0.00 C ATOM 1454 C SER A 96 -17.232 -31.035 -22.028 1.00 0.00 C ATOM 1455 O SER A 96 -17.546 -30.267 -22.936 1.00 0.00 O ATOM 1456 CB SER A 96 -15.753 -33.052 -22.030 1.00 0.00 C ATOM 1457 OG SER A 96 -16.106 -33.446 -23.345 1.00 0.00 O ATOM 0 H SER A 96 -15.778 -31.446 -19.785 1.00 0.00 H new ATOM 0 HA SER A 96 -15.192 -31.079 -22.666 1.00 0.00 H new ATOM 0 HB2 SER A 96 -14.752 -33.415 -21.795 1.00 0.00 H new ATOM 0 HB3 SER A 96 -16.435 -33.511 -21.314 1.00 0.00 H new ATOM 0 HG SER A 96 -16.068 -34.423 -23.415 1.00 0.00 H new ATOM 1463 N GLY A 97 -18.101 -31.481 -21.125 1.00 0.00 N ATOM 1464 CA GLY A 97 -19.493 -31.074 -21.171 1.00 0.00 C ATOM 1465 C GLY A 97 -20.445 -32.251 -21.087 1.00 0.00 C ATOM 1466 O GLY A 97 -20.749 -32.754 -20.005 1.00 0.00 O ATOM 0 H GLY A 97 -17.865 -32.117 -20.363 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -19.695 -30.388 -20.348 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -19.678 -30.527 -22.095 1.00 0.00 H new ATOM 1470 N PRO A 98 -20.934 -32.706 -22.250 1.00 0.00 N ATOM 1471 CA PRO A 98 -21.865 -33.836 -22.329 1.00 0.00 C ATOM 1472 C PRO A 98 -21.199 -35.161 -21.977 1.00 0.00 C ATOM 1473 O PRO A 98 -20.001 -35.211 -21.698 1.00 0.00 O ATOM 1474 CB PRO A 98 -22.305 -33.831 -23.795 1.00 0.00 C ATOM 1475 CG PRO A 98 -21.184 -33.173 -24.524 1.00 0.00 C ATOM 1476 CD PRO A 98 -20.615 -32.154 -23.577 1.00 0.00 C ATOM 0 HA PRO A 98 -22.689 -33.736 -21.622 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -22.475 -34.844 -24.161 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -23.238 -33.284 -23.926 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -20.427 -33.901 -24.814 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -21.539 -32.700 -25.440 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -19.540 -32.034 -23.714 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -21.067 -31.173 -23.723 1.00 0.00 H new ATOM 1484 N SER A 99 -21.983 -36.235 -21.993 1.00 0.00 N ATOM 1485 CA SER A 99 -21.470 -37.561 -21.672 1.00 0.00 C ATOM 1486 C SER A 99 -21.477 -38.460 -22.905 1.00 0.00 C ATOM 1487 O SER A 99 -20.481 -39.112 -23.217 1.00 0.00 O ATOM 1488 CB SER A 99 -22.303 -38.198 -20.558 1.00 0.00 C ATOM 1489 OG SER A 99 -21.765 -39.451 -20.172 1.00 0.00 O ATOM 0 H SER A 99 -22.976 -36.212 -22.225 1.00 0.00 H new ATOM 0 HA SER A 99 -20.441 -37.452 -21.329 1.00 0.00 H new ATOM 0 HB2 SER A 99 -22.334 -37.531 -19.696 1.00 0.00 H new ATOM 0 HB3 SER A 99 -23.331 -38.329 -20.897 1.00 0.00 H new ATOM 0 HG SER A 99 -22.314 -39.837 -19.458 1.00 0.00 H new ATOM 1495 N SER A 100 -22.608 -38.487 -23.602 1.00 0.00 N ATOM 1496 CA SER A 100 -22.748 -39.308 -24.800 1.00 0.00 C ATOM 1497 C SER A 100 -21.439 -39.354 -25.582 1.00 0.00 C ATOM 1498 O SER A 100 -20.693 -38.377 -25.625 1.00 0.00 O ATOM 1499 CB SER A 100 -23.868 -38.764 -25.688 1.00 0.00 C ATOM 1500 OG SER A 100 -24.442 -39.794 -26.474 1.00 0.00 O ATOM 0 H SER A 100 -23.441 -37.950 -23.359 1.00 0.00 H new ATOM 0 HA SER A 100 -23.001 -40.322 -24.489 1.00 0.00 H new ATOM 0 HB2 SER A 100 -24.637 -38.304 -25.068 1.00 0.00 H new ATOM 0 HB3 SER A 100 -23.474 -37.983 -26.338 1.00 0.00 H new ATOM 0 HG SER A 100 -25.156 -39.421 -27.031 1.00 0.00 H new ATOM 1506 N GLY A 101 -21.168 -40.499 -26.201 1.00 0.00 N ATOM 1507 CA GLY A 101 -19.949 -40.654 -26.974 1.00 0.00 C ATOM 1508 C GLY A 101 -19.950 -41.918 -27.811 1.00 0.00 C ATOM 1509 O GLY A 101 -21.016 -42.487 -28.035 1.00 0.00 O ATOM 0 H GLY A 101 -21.770 -41.322 -26.181 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -19.824 -39.790 -27.627 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -19.094 -40.670 -26.299 1.00 0.00 H new TER 1513 GLY A 101 HETATM 1514 ZN ZN A 201 -3.624 11.744 -6.059 1.00 0.00 ZN HETATM 1515 ZN ZN A 401 3.091 -5.018 -7.942 1.00 0.00 ZN HETATM 1516 ZN ZN A 601 -7.423 -31.509 -14.700 1.00 0.00 ZN