USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=20 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 Set 1.1: A 47 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 58 ASN : amide:sc= -1.58 K(o=-1.6,f=-1) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 39:sc= 0.694 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 158:sc= 0 (180deg=-0.207) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ -157:sc= -0.0742 (180deg=-0.414) USER MOD Single : A 23 HIS : no HE2:sc= -1.22 K(o=-1.2,f=-0.37) 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 X(o=0,f=0) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 HIS : no HD1:sc= -2.75 X(o=-2.8,f=-3.2!) USER MOD Single : A 45 ASN : amide:sc= -0.153 K(o=-0.15,f=-2.3!) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 THR OG1 : rot -28:sc= -0.366 USER MOD Single : A 62 THR OG1 : rot -76:sc= 1.22 USER MOD Single : A 66 SER OG : rot 43:sc= 0.13 USER MOD Single : A 68 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00664) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 ASN : amide:sc= -6.69! C(o=-6.7!,f=-13!) 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= 0.173 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 -8:sc= 0.32 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -7.614 32.034 -11.938 1.00 0.00 N ATOM 2 CA GLY A 1 -8.170 32.249 -13.261 1.00 0.00 C ATOM 3 C GLY A 1 -8.260 30.968 -14.067 1.00 0.00 C ATOM 4 O GLY A 1 -8.653 29.925 -13.545 1.00 0.00 O ATOM 0 H1 GLY A 1 -7.573 32.939 -11.427 1.00 0.00 H new ATOM 0 H2 GLY A 1 -8.215 31.367 -11.413 1.00 0.00 H new ATOM 0 H3 GLY A 1 -6.655 31.642 -12.024 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -9.164 32.686 -13.167 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -7.554 32.970 -13.798 1.00 0.00 H new ATOM 8 N SER A 2 -7.896 31.047 -15.343 1.00 0.00 N ATOM 9 CA SER A 2 -7.943 29.886 -16.224 1.00 0.00 C ATOM 10 C SER A 2 -6.536 29.456 -16.631 1.00 0.00 C ATOM 11 O SER A 2 -5.946 30.018 -17.553 1.00 0.00 O ATOM 12 CB SER A 2 -8.773 30.198 -17.470 1.00 0.00 C ATOM 13 OG SER A 2 -8.255 31.322 -18.160 1.00 0.00 O ATOM 0 H SER A 2 -7.565 31.902 -15.790 1.00 0.00 H new ATOM 0 HA SER A 2 -8.412 29.066 -15.680 1.00 0.00 H new ATOM 0 HB2 SER A 2 -8.780 29.332 -18.132 1.00 0.00 H new ATOM 0 HB3 SER A 2 -9.807 30.388 -17.183 1.00 0.00 H new ATOM 0 HG SER A 2 -7.276 31.299 -18.135 1.00 0.00 H new ATOM 19 N SER A 3 -6.007 28.454 -15.936 1.00 0.00 N ATOM 20 CA SER A 3 -4.668 27.950 -16.221 1.00 0.00 C ATOM 21 C SER A 3 -4.718 26.482 -16.634 1.00 0.00 C ATOM 22 O SER A 3 -5.592 25.732 -16.201 1.00 0.00 O ATOM 23 CB SER A 3 -3.766 28.117 -14.998 1.00 0.00 C ATOM 24 OG SER A 3 -3.791 29.452 -14.524 1.00 0.00 O ATOM 0 H SER A 3 -6.484 27.975 -15.172 1.00 0.00 H new ATOM 0 HA SER A 3 -4.257 28.529 -17.048 1.00 0.00 H new ATOM 0 HB2 SER A 3 -4.091 27.441 -14.207 1.00 0.00 H new ATOM 0 HB3 SER A 3 -2.744 27.838 -15.255 1.00 0.00 H new ATOM 0 HG SER A 3 -3.208 29.532 -13.741 1.00 0.00 H new ATOM 30 N GLY A 4 -3.771 26.078 -17.476 1.00 0.00 N ATOM 31 CA GLY A 4 -3.723 24.702 -17.934 1.00 0.00 C ATOM 32 C GLY A 4 -3.147 23.763 -16.893 1.00 0.00 C ATOM 33 O GLY A 4 -2.233 22.991 -17.181 1.00 0.00 O ATOM 0 H GLY A 4 -3.036 26.679 -17.849 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -4.729 24.375 -18.197 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -3.122 24.645 -18.842 1.00 0.00 H new ATOM 37 N SER A 5 -3.681 23.831 -15.677 1.00 0.00 N ATOM 38 CA SER A 5 -3.209 22.984 -14.587 1.00 0.00 C ATOM 39 C SER A 5 -3.634 21.535 -14.803 1.00 0.00 C ATOM 40 O SER A 5 -4.314 21.214 -15.777 1.00 0.00 O ATOM 41 CB SER A 5 -3.749 23.492 -13.249 1.00 0.00 C ATOM 42 OG SER A 5 -3.389 24.846 -13.035 1.00 0.00 O ATOM 0 H SER A 5 -4.440 24.463 -15.422 1.00 0.00 H new ATOM 0 HA SER A 5 -2.120 23.026 -14.571 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.834 23.394 -13.230 1.00 0.00 H new ATOM 0 HB3 SER A 5 -3.359 22.876 -12.438 1.00 0.00 H new ATOM 0 HG SER A 5 -3.747 25.148 -12.174 1.00 0.00 H new ATOM 48 N SER A 6 -3.228 20.663 -13.885 1.00 0.00 N ATOM 49 CA SER A 6 -3.563 19.247 -13.975 1.00 0.00 C ATOM 50 C SER A 6 -3.843 18.666 -12.592 1.00 0.00 C ATOM 51 O SER A 6 -3.177 19.008 -11.616 1.00 0.00 O ATOM 52 CB SER A 6 -2.425 18.474 -14.644 1.00 0.00 C ATOM 53 OG SER A 6 -2.030 19.094 -15.856 1.00 0.00 O ATOM 0 H SER A 6 -2.667 20.913 -13.071 1.00 0.00 H new ATOM 0 HA SER A 6 -4.464 19.150 -14.580 1.00 0.00 H new ATOM 0 HB2 SER A 6 -1.573 18.417 -13.967 1.00 0.00 H new ATOM 0 HB3 SER A 6 -2.744 17.451 -14.842 1.00 0.00 H new ATOM 0 HG SER A 6 -1.301 18.582 -16.263 1.00 0.00 H new ATOM 59 N GLY A 7 -4.836 17.784 -12.518 1.00 0.00 N ATOM 60 CA GLY A 7 -5.188 17.169 -11.252 1.00 0.00 C ATOM 61 C GLY A 7 -4.898 15.681 -11.229 1.00 0.00 C ATOM 62 O GLY A 7 -4.367 15.130 -12.193 1.00 0.00 O ATOM 0 H GLY A 7 -5.402 17.485 -13.312 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.635 17.656 -10.449 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.247 17.333 -11.054 1.00 0.00 H new ATOM 66 N CYS A 8 -5.246 15.029 -10.125 1.00 0.00 N ATOM 67 CA CYS A 8 -5.018 13.596 -9.978 1.00 0.00 C ATOM 68 C CYS A 8 -6.209 12.800 -10.504 1.00 0.00 C ATOM 69 O CYS A 8 -7.342 13.282 -10.501 1.00 0.00 O ATOM 70 CB CYS A 8 -4.764 13.247 -8.511 1.00 0.00 C ATOM 71 SG CYS A 8 -4.076 11.580 -8.252 1.00 0.00 S ATOM 0 H CYS A 8 -5.687 15.470 -9.318 1.00 0.00 H new ATOM 0 HA CYS A 8 -4.138 13.330 -10.564 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -4.079 13.981 -8.087 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -5.701 13.331 -7.961 1.00 0.00 H new ATOM 76 N VAL A 9 -5.944 11.577 -10.954 1.00 0.00 N ATOM 77 CA VAL A 9 -6.993 10.713 -11.481 1.00 0.00 C ATOM 78 C VAL A 9 -7.490 9.740 -10.417 1.00 0.00 C ATOM 79 O VAL A 9 -8.479 9.036 -10.620 1.00 0.00 O ATOM 80 CB VAL A 9 -6.501 9.914 -12.702 1.00 0.00 C ATOM 81 CG1 VAL A 9 -5.049 9.502 -12.520 1.00 0.00 C ATOM 82 CG2 VAL A 9 -7.384 8.697 -12.933 1.00 0.00 C ATOM 0 H VAL A 9 -5.012 11.163 -10.964 1.00 0.00 H new ATOM 0 HA VAL A 9 -7.813 11.362 -11.787 1.00 0.00 H new ATOM 0 HB VAL A 9 -6.565 10.553 -13.583 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -4.719 8.938 -13.393 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -4.430 10.392 -12.407 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -4.956 8.880 -11.630 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -7.022 8.144 -13.800 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -7.354 8.054 -12.054 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -8.410 9.020 -13.111 1.00 0.00 H new ATOM 92 N GLU A 10 -6.797 9.707 -9.283 1.00 0.00 N ATOM 93 CA GLU A 10 -7.168 8.820 -8.187 1.00 0.00 C ATOM 94 C GLU A 10 -8.070 9.538 -7.187 1.00 0.00 C ATOM 95 O GLU A 10 -9.191 9.104 -6.921 1.00 0.00 O ATOM 96 CB GLU A 10 -5.917 8.297 -7.479 1.00 0.00 C ATOM 97 CG GLU A 10 -5.435 6.956 -8.006 1.00 0.00 C ATOM 98 CD GLU A 10 -6.373 5.819 -7.653 1.00 0.00 C ATOM 99 OE1 GLU A 10 -6.984 5.871 -6.565 1.00 0.00 O ATOM 100 OE2 GLU A 10 -6.497 4.877 -8.463 1.00 0.00 O ATOM 0 H GLU A 10 -5.976 10.284 -9.100 1.00 0.00 H new ATOM 0 HA GLU A 10 -7.718 7.977 -8.606 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -5.116 9.029 -7.586 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -6.125 8.205 -6.413 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -5.330 7.012 -9.089 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -4.446 6.745 -7.600 1.00 0.00 H new ATOM 107 N CYS A 11 -7.572 10.639 -6.636 1.00 0.00 N ATOM 108 CA CYS A 11 -8.330 11.419 -5.664 1.00 0.00 C ATOM 109 C CYS A 11 -8.873 12.697 -6.297 1.00 0.00 C ATOM 110 O CYS A 11 -9.194 13.659 -5.599 1.00 0.00 O ATOM 111 CB CYS A 11 -7.452 11.765 -4.460 1.00 0.00 C ATOM 112 SG CYS A 11 -5.877 12.569 -4.896 1.00 0.00 S ATOM 0 H CYS A 11 -6.646 11.012 -6.846 1.00 0.00 H new ATOM 0 HA CYS A 11 -9.173 10.815 -5.328 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -8.011 12.422 -3.793 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -7.240 10.852 -3.904 1.00 0.00 H new ATOM 117 N ARG A 12 -8.972 12.699 -7.622 1.00 0.00 N ATOM 118 CA ARG A 12 -9.475 13.858 -8.349 1.00 0.00 C ATOM 119 C ARG A 12 -9.132 15.151 -7.614 1.00 0.00 C ATOM 120 O ARG A 12 -9.930 16.088 -7.578 1.00 0.00 O ATOM 121 CB ARG A 12 -10.990 13.752 -8.536 1.00 0.00 C ATOM 122 CG ARG A 12 -11.400 12.801 -9.649 1.00 0.00 C ATOM 123 CD ARG A 12 -11.073 13.373 -11.020 1.00 0.00 C ATOM 124 NE ARG A 12 -11.193 12.370 -12.074 1.00 0.00 N ATOM 125 CZ ARG A 12 -12.352 11.992 -12.601 1.00 0.00 C ATOM 126 NH1 ARG A 12 -13.486 12.531 -12.173 1.00 0.00 N ATOM 127 NH2 ARG A 12 -12.380 11.073 -13.558 1.00 0.00 N ATOM 0 H ARG A 12 -8.710 11.911 -8.214 1.00 0.00 H new ATOM 0 HA ARG A 12 -8.996 13.878 -9.328 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -11.441 13.420 -7.601 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -11.392 14.743 -8.749 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -10.889 11.847 -9.520 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -12.469 12.601 -9.583 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -11.743 14.206 -11.234 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -10.059 13.773 -11.014 1.00 0.00 H new ATOM 0 HE ARG A 12 -10.340 11.936 -12.425 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -13.469 13.238 -11.438 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -14.375 12.239 -12.579 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -11.510 10.656 -13.890 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -13.271 10.784 -13.962 1.00 0.00 H new ATOM 141 N LYS A 13 -7.941 15.194 -7.028 1.00 0.00 N ATOM 142 CA LYS A 13 -7.491 16.371 -6.295 1.00 0.00 C ATOM 143 C LYS A 13 -6.449 17.146 -7.095 1.00 0.00 C ATOM 144 O LYS A 13 -5.794 16.610 -7.989 1.00 0.00 O ATOM 145 CB LYS A 13 -6.907 15.961 -4.940 1.00 0.00 C ATOM 146 CG LYS A 13 -7.962 15.691 -3.881 1.00 0.00 C ATOM 147 CD LYS A 13 -7.448 16.013 -2.488 1.00 0.00 C ATOM 148 CE LYS A 13 -8.333 15.402 -1.412 1.00 0.00 C ATOM 149 NZ LYS A 13 -8.016 13.965 -1.185 1.00 0.00 N ATOM 0 H LYS A 13 -7.269 14.427 -7.046 1.00 0.00 H new ATOM 0 HA LYS A 13 -8.353 17.018 -6.132 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -6.299 15.066 -5.072 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -6.242 16.749 -4.586 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -8.850 16.288 -4.090 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -8.264 14.645 -3.926 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -6.430 15.639 -2.379 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -7.406 17.094 -2.355 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -8.206 15.954 -0.481 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -9.379 15.502 -1.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -8.343 13.683 -0.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -8.495 13.386 -1.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -6.988 13.821 -1.253 1.00 0.00 H new ATOM 163 N PRO A 14 -6.289 18.437 -6.767 1.00 0.00 N ATOM 164 CA PRO A 14 -5.326 19.312 -7.443 1.00 0.00 C ATOM 165 C PRO A 14 -3.882 18.948 -7.114 1.00 0.00 C ATOM 166 O PRO A 14 -3.544 18.697 -5.957 1.00 0.00 O ATOM 167 CB PRO A 14 -5.666 20.701 -6.897 1.00 0.00 C ATOM 168 CG PRO A 14 -6.297 20.444 -5.572 1.00 0.00 C ATOM 169 CD PRO A 14 -7.036 19.141 -5.712 1.00 0.00 C ATOM 0 HA PRO A 14 -5.397 19.236 -8.528 1.00 0.00 H new ATOM 0 HB2 PRO A 14 -4.772 21.317 -6.797 1.00 0.00 H new ATOM 0 HB3 PRO A 14 -6.346 21.232 -7.563 1.00 0.00 H new ATOM 0 HG2 PRO A 14 -5.544 20.383 -4.786 1.00 0.00 H new ATOM 0 HG3 PRO A 14 -6.977 21.251 -5.300 1.00 0.00 H new ATOM 0 HD2 PRO A 14 -7.039 18.579 -4.778 1.00 0.00 H new ATOM 0 HD3 PRO A 14 -8.077 19.298 -5.993 1.00 0.00 H new ATOM 177 N ILE A 15 -3.036 18.922 -8.137 1.00 0.00 N ATOM 178 CA ILE A 15 -1.628 18.591 -7.955 1.00 0.00 C ATOM 179 C ILE A 15 -0.759 19.843 -7.993 1.00 0.00 C ATOM 180 O ILE A 15 -0.927 20.702 -8.858 1.00 0.00 O ATOM 181 CB ILE A 15 -1.137 17.606 -9.033 1.00 0.00 C ATOM 182 CG1 ILE A 15 -1.934 16.302 -8.965 1.00 0.00 C ATOM 183 CG2 ILE A 15 0.350 17.334 -8.865 1.00 0.00 C ATOM 184 CD1 ILE A 15 -1.788 15.439 -10.198 1.00 0.00 C ATOM 0 H ILE A 15 -3.300 19.126 -9.101 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.539 18.120 -6.976 1.00 0.00 H new ATOM 0 HB ILE A 15 -1.295 18.055 -10.013 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -1.611 15.733 -8.093 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -2.988 16.537 -8.819 1.00 0.00 H new ATOM 0 HG21 ILE A 15 0.681 16.636 -9.634 1.00 0.00 H new ATOM 0 HG22 ILE A 15 0.904 18.268 -8.959 1.00 0.00 H new ATOM 0 HG23 ILE A 15 0.532 16.902 -7.881 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -2.380 14.532 -10.079 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.139 15.989 -11.071 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -0.740 15.173 -10.334 1.00 0.00 H new ATOM 196 N GLY A 16 0.173 19.940 -7.050 1.00 0.00 N ATOM 197 CA GLY A 16 1.056 21.090 -6.994 1.00 0.00 C ATOM 198 C GLY A 16 2.329 20.883 -7.792 1.00 0.00 C ATOM 199 O GLY A 16 2.910 19.798 -7.775 1.00 0.00 O ATOM 0 H GLY A 16 0.332 19.242 -6.323 1.00 0.00 H new ATOM 0 HA2 GLY A 16 0.531 21.966 -7.374 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.312 21.298 -5.955 1.00 0.00 H new ATOM 203 N ALA A 17 2.762 21.925 -8.493 1.00 0.00 N ATOM 204 CA ALA A 17 3.974 21.852 -9.300 1.00 0.00 C ATOM 205 C ALA A 17 5.147 21.325 -8.482 1.00 0.00 C ATOM 206 O ALA A 17 5.877 20.438 -8.926 1.00 0.00 O ATOM 207 CB ALA A 17 4.304 23.220 -9.880 1.00 0.00 C ATOM 0 H ALA A 17 2.292 22.830 -8.519 1.00 0.00 H new ATOM 0 HA ALA A 17 3.795 21.156 -10.119 1.00 0.00 H new ATOM 0 HB1 ALA A 17 5.211 23.151 -10.480 1.00 0.00 H new ATOM 0 HB2 ALA A 17 3.479 23.558 -10.507 1.00 0.00 H new ATOM 0 HB3 ALA A 17 4.459 23.931 -9.069 1.00 0.00 H new ATOM 213 N ASP A 18 5.324 21.876 -7.286 1.00 0.00 N ATOM 214 CA ASP A 18 6.410 21.460 -6.406 1.00 0.00 C ATOM 215 C ASP A 18 6.320 19.968 -6.100 1.00 0.00 C ATOM 216 O ASP A 18 7.338 19.293 -5.948 1.00 0.00 O ATOM 217 CB ASP A 18 6.375 22.263 -5.105 1.00 0.00 C ATOM 218 CG ASP A 18 6.196 23.749 -5.346 1.00 0.00 C ATOM 219 OD1 ASP A 18 6.853 24.285 -6.263 1.00 0.00 O ATOM 220 OD2 ASP A 18 5.398 24.376 -4.618 1.00 0.00 O ATOM 0 H ASP A 18 4.730 22.612 -6.904 1.00 0.00 H new ATOM 0 HA ASP A 18 7.353 21.651 -6.917 1.00 0.00 H new ATOM 0 HB2 ASP A 18 5.561 21.899 -4.479 1.00 0.00 H new ATOM 0 HB3 ASP A 18 7.300 22.096 -4.554 1.00 0.00 H new ATOM 225 N SER A 19 5.095 19.460 -6.009 1.00 0.00 N ATOM 226 CA SER A 19 4.873 18.049 -5.717 1.00 0.00 C ATOM 227 C SER A 19 5.181 17.186 -6.936 1.00 0.00 C ATOM 228 O SER A 19 4.663 17.423 -8.027 1.00 0.00 O ATOM 229 CB SER A 19 3.427 17.821 -5.269 1.00 0.00 C ATOM 230 OG SER A 19 3.268 18.114 -3.892 1.00 0.00 O ATOM 0 H SER A 19 4.241 20.004 -6.133 1.00 0.00 H new ATOM 0 HA SER A 19 5.547 17.760 -4.910 1.00 0.00 H new ATOM 0 HB2 SER A 19 2.757 18.448 -5.857 1.00 0.00 H new ATOM 0 HB3 SER A 19 3.143 16.786 -5.459 1.00 0.00 H new ATOM 0 HG SER A 19 2.336 17.962 -3.631 1.00 0.00 H new ATOM 236 N LYS A 20 6.031 16.182 -6.743 1.00 0.00 N ATOM 237 CA LYS A 20 6.410 15.281 -7.824 1.00 0.00 C ATOM 238 C LYS A 20 5.195 14.527 -8.355 1.00 0.00 C ATOM 239 O LYS A 20 4.702 13.599 -7.716 1.00 0.00 O ATOM 240 CB LYS A 20 7.468 14.288 -7.341 1.00 0.00 C ATOM 241 CG LYS A 20 8.888 14.822 -7.427 1.00 0.00 C ATOM 242 CD LYS A 20 9.392 14.836 -8.861 1.00 0.00 C ATOM 243 CE LYS A 20 10.041 13.513 -9.236 1.00 0.00 C ATOM 244 NZ LYS A 20 11.307 13.284 -8.486 1.00 0.00 N ATOM 0 H LYS A 20 6.470 15.972 -5.847 1.00 0.00 H new ATOM 0 HA LYS A 20 6.826 15.881 -8.634 1.00 0.00 H new ATOM 0 HB2 LYS A 20 7.253 14.015 -6.308 1.00 0.00 H new ATOM 0 HB3 LYS A 20 7.395 13.376 -7.933 1.00 0.00 H new ATOM 0 HG2 LYS A 20 8.924 15.832 -7.018 1.00 0.00 H new ATOM 0 HG3 LYS A 20 9.547 14.207 -6.815 1.00 0.00 H new ATOM 0 HD2 LYS A 20 8.562 15.040 -9.538 1.00 0.00 H new ATOM 0 HD3 LYS A 20 10.112 15.644 -8.987 1.00 0.00 H new ATOM 0 HE2 LYS A 20 9.347 12.698 -9.034 1.00 0.00 H new ATOM 0 HE3 LYS A 20 10.246 13.499 -10.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 11.906 12.616 -9.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 11.812 14.186 -8.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 11.089 12.890 -7.549 1.00 0.00 H new ATOM 258 N GLU A 21 4.719 14.932 -9.529 1.00 0.00 N ATOM 259 CA GLU A 21 3.562 14.293 -10.144 1.00 0.00 C ATOM 260 C GLU A 21 3.995 13.323 -11.240 1.00 0.00 C ATOM 261 O GLU A 21 5.047 13.495 -11.856 1.00 0.00 O ATOM 262 CB GLU A 21 2.617 15.347 -10.725 1.00 0.00 C ATOM 263 CG GLU A 21 3.144 16.005 -11.990 1.00 0.00 C ATOM 264 CD GLU A 21 4.083 17.160 -11.699 1.00 0.00 C ATOM 265 OE1 GLU A 21 3.977 17.748 -10.603 1.00 0.00 O ATOM 266 OE2 GLU A 21 4.923 17.474 -12.568 1.00 0.00 O ATOM 0 H GLU A 21 5.116 15.699 -10.072 1.00 0.00 H new ATOM 0 HA GLU A 21 3.037 13.731 -9.372 1.00 0.00 H new ATOM 0 HB2 GLU A 21 1.655 14.881 -10.941 1.00 0.00 H new ATOM 0 HB3 GLU A 21 2.437 16.116 -9.973 1.00 0.00 H new ATOM 0 HG2 GLU A 21 3.665 15.261 -12.592 1.00 0.00 H new ATOM 0 HG3 GLU A 21 2.304 16.365 -12.585 1.00 0.00 H new ATOM 273 N VAL A 22 3.176 12.304 -11.478 1.00 0.00 N ATOM 274 CA VAL A 22 3.473 11.307 -12.499 1.00 0.00 C ATOM 275 C VAL A 22 2.455 11.361 -13.633 1.00 0.00 C ATOM 276 O VAL A 22 1.328 10.886 -13.494 1.00 0.00 O ATOM 277 CB VAL A 22 3.489 9.885 -11.907 1.00 0.00 C ATOM 278 CG1 VAL A 22 3.823 8.862 -12.983 1.00 0.00 C ATOM 279 CG2 VAL A 22 4.477 9.799 -10.754 1.00 0.00 C ATOM 0 H VAL A 22 2.301 12.147 -10.977 1.00 0.00 H new ATOM 0 HA VAL A 22 4.463 11.541 -12.891 1.00 0.00 H new ATOM 0 HB VAL A 22 2.495 9.660 -11.521 1.00 0.00 H new ATOM 0 HG11 VAL A 22 3.830 7.863 -12.546 1.00 0.00 H new ATOM 0 HG12 VAL A 22 3.074 8.907 -13.773 1.00 0.00 H new ATOM 0 HG13 VAL A 22 4.805 9.082 -13.401 1.00 0.00 H new ATOM 0 HG21 VAL A 22 4.475 8.787 -10.348 1.00 0.00 H new ATOM 0 HG22 VAL A 22 5.477 10.044 -11.112 1.00 0.00 H new ATOM 0 HG23 VAL A 22 4.188 10.504 -9.974 1.00 0.00 H new ATOM 289 N HIS A 23 2.860 11.945 -14.757 1.00 0.00 N ATOM 290 CA HIS A 23 1.984 12.061 -15.917 1.00 0.00 C ATOM 291 C HIS A 23 2.137 10.853 -16.837 1.00 0.00 C ATOM 292 O HIS A 23 3.208 10.617 -17.395 1.00 0.00 O ATOM 293 CB HIS A 23 2.291 13.346 -16.688 1.00 0.00 C ATOM 294 CG HIS A 23 1.654 13.398 -18.043 1.00 0.00 C ATOM 295 ND1 HIS A 23 2.166 14.140 -19.086 1.00 0.00 N ATOM 296 CD2 HIS A 23 0.543 12.792 -18.523 1.00 0.00 C ATOM 297 CE1 HIS A 23 1.395 13.991 -20.149 1.00 0.00 C ATOM 298 NE2 HIS A 23 0.404 13.177 -19.834 1.00 0.00 N ATOM 0 H HIS A 23 3.789 12.345 -14.889 1.00 0.00 H new ATOM 0 HA HIS A 23 0.954 12.096 -15.561 1.00 0.00 H new ATOM 0 HB2 HIS A 23 1.952 14.201 -16.103 1.00 0.00 H new ATOM 0 HB3 HIS A 23 3.371 13.444 -16.799 1.00 0.00 H new ATOM 0 HD1 HIS A 23 3.008 14.714 -19.044 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -0.112 12.129 -17.977 1.00 0.00 H new ATOM 0 HE1 HIS A 23 1.549 14.456 -21.112 1.00 0.00 H new ATOM 307 N TYR A 24 1.059 10.092 -16.989 1.00 0.00 N ATOM 308 CA TYR A 24 1.074 8.907 -17.839 1.00 0.00 C ATOM 309 C TYR A 24 -0.318 8.612 -18.388 1.00 0.00 C ATOM 310 O TYR A 24 -1.314 8.696 -17.668 1.00 0.00 O ATOM 311 CB TYR A 24 1.592 7.699 -17.055 1.00 0.00 C ATOM 312 CG TYR A 24 2.003 6.539 -17.934 1.00 0.00 C ATOM 313 CD1 TYR A 24 2.985 6.692 -18.905 1.00 0.00 C ATOM 314 CD2 TYR A 24 1.410 5.291 -17.793 1.00 0.00 C ATOM 315 CE1 TYR A 24 3.364 5.636 -19.710 1.00 0.00 C ATOM 316 CE2 TYR A 24 1.784 4.228 -18.592 1.00 0.00 C ATOM 317 CZ TYR A 24 2.761 4.406 -19.550 1.00 0.00 C ATOM 318 OH TYR A 24 3.135 3.350 -20.349 1.00 0.00 O ATOM 0 H TYR A 24 0.164 10.274 -16.535 1.00 0.00 H new ATOM 0 HA TYR A 24 1.741 9.101 -18.679 1.00 0.00 H new ATOM 0 HB2 TYR A 24 2.446 8.007 -16.451 1.00 0.00 H new ATOM 0 HB3 TYR A 24 0.817 7.365 -16.365 1.00 0.00 H new ATOM 0 HD1 TYR A 24 3.460 7.653 -19.032 1.00 0.00 H new ATOM 0 HD2 TYR A 24 0.643 5.149 -17.046 1.00 0.00 H new ATOM 0 HE1 TYR A 24 4.128 5.773 -20.461 1.00 0.00 H new ATOM 0 HE2 TYR A 24 1.315 3.263 -18.468 1.00 0.00 H new ATOM 0 HH TYR A 24 2.615 2.556 -20.106 1.00 0.00 H new ATOM 328 N LYS A 25 -0.380 8.266 -19.669 1.00 0.00 N ATOM 329 CA LYS A 25 -1.649 7.956 -20.318 1.00 0.00 C ATOM 330 C LYS A 25 -2.635 9.109 -20.162 1.00 0.00 C ATOM 331 O LYS A 25 -3.804 8.899 -19.843 1.00 0.00 O ATOM 332 CB LYS A 25 -2.247 6.676 -19.729 1.00 0.00 C ATOM 333 CG LYS A 25 -1.340 5.465 -19.858 1.00 0.00 C ATOM 334 CD LYS A 25 -1.176 5.044 -21.309 1.00 0.00 C ATOM 335 CE LYS A 25 -0.458 3.708 -21.423 1.00 0.00 C ATOM 336 NZ LYS A 25 -0.761 3.024 -22.712 1.00 0.00 N ATOM 0 H LYS A 25 0.434 8.193 -20.279 1.00 0.00 H new ATOM 0 HA LYS A 25 -1.458 7.805 -21.381 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -2.471 6.841 -18.675 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -3.194 6.465 -20.226 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -0.363 5.694 -19.432 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -1.753 4.637 -19.282 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -2.156 4.973 -21.782 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -0.616 5.807 -21.849 1.00 0.00 H new ATOM 0 HE2 LYS A 25 0.617 3.865 -21.339 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -0.752 3.066 -20.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -0.253 2.117 -22.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -1.784 2.851 -22.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -0.457 3.626 -23.504 1.00 0.00 H new ATOM 350 N ASN A 26 -2.156 10.327 -20.393 1.00 0.00 N ATOM 351 CA ASN A 26 -2.996 11.513 -20.280 1.00 0.00 C ATOM 352 C ASN A 26 -3.596 11.623 -18.881 1.00 0.00 C ATOM 353 O ASN A 26 -4.667 12.204 -18.698 1.00 0.00 O ATOM 354 CB ASN A 26 -4.113 11.474 -21.325 1.00 0.00 C ATOM 355 CG ASN A 26 -3.583 11.272 -22.731 1.00 0.00 C ATOM 356 OD1 ASN A 26 -2.698 11.999 -23.183 1.00 0.00 O ATOM 357 ND2 ASN A 26 -4.123 10.280 -23.429 1.00 0.00 N ATOM 0 H ASN A 26 -1.190 10.518 -20.660 1.00 0.00 H new ATOM 0 HA ASN A 26 -2.372 12.389 -20.458 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -4.806 10.669 -21.082 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -4.679 12.405 -21.283 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -3.807 10.095 -24.381 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -4.854 9.703 -23.013 1.00 0.00 H new ATOM 364 N ARG A 27 -2.900 11.062 -17.898 1.00 0.00 N ATOM 365 CA ARG A 27 -3.364 11.097 -16.517 1.00 0.00 C ATOM 366 C ARG A 27 -2.269 11.615 -15.588 1.00 0.00 C ATOM 367 O ARG A 27 -1.169 11.944 -16.032 1.00 0.00 O ATOM 368 CB ARG A 27 -3.808 9.702 -16.071 1.00 0.00 C ATOM 369 CG ARG A 27 -5.062 9.209 -16.773 1.00 0.00 C ATOM 370 CD ARG A 27 -6.304 9.920 -16.259 1.00 0.00 C ATOM 371 NE ARG A 27 -7.325 10.055 -17.295 1.00 0.00 N ATOM 372 CZ ARG A 27 -8.622 10.184 -17.036 1.00 0.00 C ATOM 373 NH1 ARG A 27 -9.053 10.195 -15.783 1.00 0.00 N ATOM 374 NH2 ARG A 27 -9.490 10.302 -18.033 1.00 0.00 N ATOM 0 H ARG A 27 -2.012 10.578 -18.033 1.00 0.00 H new ATOM 0 HA ARG A 27 -4.214 11.777 -16.463 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -2.998 8.996 -16.254 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -3.984 9.713 -14.995 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -4.967 9.371 -17.847 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -5.167 8.135 -16.621 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -6.715 9.367 -15.415 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -6.029 10.908 -15.890 1.00 0.00 H new ATOM 0 HE ARG A 27 -7.026 10.050 -18.270 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -8.389 10.104 -15.014 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -10.049 10.294 -15.587 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -9.162 10.294 -18.999 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -10.485 10.401 -17.834 1.00 0.00 H new ATOM 388 N PHE A 28 -2.579 11.684 -14.298 1.00 0.00 N ATOM 389 CA PHE A 28 -1.623 12.164 -13.307 1.00 0.00 C ATOM 390 C PHE A 28 -1.933 11.587 -11.929 1.00 0.00 C ATOM 391 O PHE A 28 -3.064 11.668 -11.451 1.00 0.00 O ATOM 392 CB PHE A 28 -1.640 13.693 -13.248 1.00 0.00 C ATOM 393 CG PHE A 28 -1.606 14.345 -14.601 1.00 0.00 C ATOM 394 CD1 PHE A 28 -2.737 14.370 -15.401 1.00 0.00 C ATOM 395 CD2 PHE A 28 -0.443 14.933 -15.072 1.00 0.00 C ATOM 396 CE1 PHE A 28 -2.707 14.969 -16.646 1.00 0.00 C ATOM 397 CE2 PHE A 28 -0.408 15.533 -16.317 1.00 0.00 C ATOM 398 CZ PHE A 28 -1.542 15.552 -17.104 1.00 0.00 C ATOM 0 H PHE A 28 -3.485 11.414 -13.914 1.00 0.00 H new ATOM 0 HA PHE A 28 -0.629 11.831 -13.606 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -2.536 14.018 -12.719 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -0.784 14.036 -12.667 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -3.651 13.917 -15.048 1.00 0.00 H new ATOM 0 HD2 PHE A 28 0.446 14.922 -14.459 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -3.595 14.981 -17.261 1.00 0.00 H new ATOM 0 HE2 PHE A 28 0.505 15.986 -16.673 1.00 0.00 H new ATOM 0 HZ PHE A 28 -1.518 16.022 -18.076 1.00 0.00 H new ATOM 408 N TRP A 29 -0.920 11.006 -11.296 1.00 0.00 N ATOM 409 CA TRP A 29 -1.084 10.415 -9.973 1.00 0.00 C ATOM 410 C TRP A 29 -0.121 11.045 -8.972 1.00 0.00 C ATOM 411 O TRP A 29 1.042 11.298 -9.290 1.00 0.00 O ATOM 412 CB TRP A 29 -0.858 8.904 -10.035 1.00 0.00 C ATOM 413 CG TRP A 29 -1.897 8.180 -10.837 1.00 0.00 C ATOM 414 CD1 TRP A 29 -3.035 7.592 -10.363 1.00 0.00 C ATOM 415 CD2 TRP A 29 -1.893 7.967 -12.253 1.00 0.00 C ATOM 416 NE1 TRP A 29 -3.738 7.026 -11.399 1.00 0.00 N ATOM 417 CE2 TRP A 29 -3.059 7.243 -12.569 1.00 0.00 C ATOM 418 CE3 TRP A 29 -1.019 8.320 -13.284 1.00 0.00 C ATOM 419 CZ2 TRP A 29 -3.370 6.866 -13.872 1.00 0.00 C ATOM 420 CZ3 TRP A 29 -1.329 7.944 -14.577 1.00 0.00 C ATOM 421 CH2 TRP A 29 -2.496 7.224 -14.863 1.00 0.00 C ATOM 0 H TRP A 29 0.023 10.932 -11.677 1.00 0.00 H new ATOM 0 HA TRP A 29 -2.103 10.609 -9.640 1.00 0.00 H new ATOM 0 HB2 TRP A 29 0.124 8.708 -10.465 1.00 0.00 H new ATOM 0 HB3 TRP A 29 -0.848 8.504 -9.021 1.00 0.00 H new ATOM 0 HD1 TRP A 29 -3.338 7.575 -9.326 1.00 0.00 H new ATOM 0 HE1 TRP A 29 -4.622 6.525 -11.311 1.00 0.00 H new ATOM 0 HE3 TRP A 29 -0.118 8.877 -13.074 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 -4.269 6.311 -14.094 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 -0.659 8.210 -15.382 1.00 0.00 H new ATOM 0 HH2 TRP A 29 -2.710 6.946 -15.884 1.00 0.00 H new ATOM 432 N HIS A 30 -0.611 11.295 -7.762 1.00 0.00 N ATOM 433 CA HIS A 30 0.208 11.895 -6.715 1.00 0.00 C ATOM 434 C HIS A 30 1.380 10.987 -6.355 1.00 0.00 C ATOM 435 O HIS A 30 1.336 9.779 -6.586 1.00 0.00 O ATOM 436 CB HIS A 30 -0.638 12.171 -5.472 1.00 0.00 C ATOM 437 CG HIS A 30 -1.538 13.360 -5.612 1.00 0.00 C ATOM 438 ND1 HIS A 30 -2.900 13.255 -5.800 1.00 0.00 N ATOM 439 CD2 HIS A 30 -1.265 14.685 -5.590 1.00 0.00 C ATOM 440 CE1 HIS A 30 -3.425 14.464 -5.889 1.00 0.00 C ATOM 441 NE2 HIS A 30 -2.454 15.350 -5.764 1.00 0.00 N ATOM 0 H HIS A 30 -1.571 11.092 -7.482 1.00 0.00 H new ATOM 0 HA HIS A 30 0.604 12.838 -7.093 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -1.243 11.292 -5.252 1.00 0.00 H new ATOM 0 HB3 HIS A 30 0.023 12.325 -4.619 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -0.292 15.136 -5.460 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -4.471 14.689 -6.039 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -2.568 16.363 -5.792 1.00 0.00 H new ATOM 449 N ASP A 31 2.428 11.577 -5.790 1.00 0.00 N ATOM 450 CA ASP A 31 3.612 10.822 -5.398 1.00 0.00 C ATOM 451 C ASP A 31 3.243 9.688 -4.446 1.00 0.00 C ATOM 452 O ASP A 31 4.045 8.788 -4.194 1.00 0.00 O ATOM 453 CB ASP A 31 4.636 11.745 -4.737 1.00 0.00 C ATOM 454 CG ASP A 31 5.481 11.027 -3.703 1.00 0.00 C ATOM 455 OD1 ASP A 31 4.960 10.744 -2.605 1.00 0.00 O ATOM 456 OD2 ASP A 31 6.664 10.749 -3.992 1.00 0.00 O ATOM 0 H ASP A 31 2.481 12.576 -5.593 1.00 0.00 H new ATOM 0 HA ASP A 31 4.051 10.390 -6.297 1.00 0.00 H new ATOM 0 HB2 ASP A 31 5.286 12.169 -5.502 1.00 0.00 H new ATOM 0 HB3 ASP A 31 4.117 12.578 -4.263 1.00 0.00 H new ATOM 461 N THR A 32 2.023 9.737 -3.919 1.00 0.00 N ATOM 462 CA THR A 32 1.548 8.717 -2.994 1.00 0.00 C ATOM 463 C THR A 32 0.463 7.858 -3.633 1.00 0.00 C ATOM 464 O THR A 32 0.189 6.746 -3.179 1.00 0.00 O ATOM 465 CB THR A 32 0.995 9.344 -1.700 1.00 0.00 C ATOM 466 OG1 THR A 32 0.533 8.317 -0.816 1.00 0.00 O ATOM 467 CG2 THR A 32 -0.143 10.305 -2.009 1.00 0.00 C ATOM 0 H THR A 32 1.346 10.474 -4.118 1.00 0.00 H new ATOM 0 HA THR A 32 2.405 8.091 -2.747 1.00 0.00 H new ATOM 0 HB THR A 32 1.799 9.901 -1.219 1.00 0.00 H new ATOM 0 HG1 THR A 32 0.185 8.724 0.005 1.00 0.00 H new ATOM 0 HG21 THR A 32 -0.518 10.736 -1.080 1.00 0.00 H new ATOM 0 HG22 THR A 32 0.220 11.102 -2.658 1.00 0.00 H new ATOM 0 HG23 THR A 32 -0.948 9.767 -2.510 1.00 0.00 H new ATOM 475 N CYS A 33 -0.153 8.379 -4.689 1.00 0.00 N ATOM 476 CA CYS A 33 -1.209 7.660 -5.391 1.00 0.00 C ATOM 477 C CYS A 33 -0.621 6.709 -6.430 1.00 0.00 C ATOM 478 O CYS A 33 -1.044 5.558 -6.544 1.00 0.00 O ATOM 479 CB CYS A 33 -2.163 8.646 -6.068 1.00 0.00 C ATOM 480 SG CYS A 33 -3.294 9.494 -4.919 1.00 0.00 S ATOM 0 H CYS A 33 0.061 9.297 -5.077 1.00 0.00 H new ATOM 0 HA CYS A 33 -1.764 7.073 -4.659 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -1.577 9.394 -6.602 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -2.752 8.111 -6.813 1.00 0.00 H new ATOM 485 N PHE A 34 0.357 7.198 -7.186 1.00 0.00 N ATOM 486 CA PHE A 34 1.002 6.393 -8.216 1.00 0.00 C ATOM 487 C PHE A 34 1.640 5.146 -7.611 1.00 0.00 C ATOM 488 O PHE A 34 2.738 5.204 -7.057 1.00 0.00 O ATOM 489 CB PHE A 34 2.063 7.218 -8.948 1.00 0.00 C ATOM 490 CG PHE A 34 2.662 6.511 -10.130 1.00 0.00 C ATOM 491 CD1 PHE A 34 1.851 5.943 -11.099 1.00 0.00 C ATOM 492 CD2 PHE A 34 4.037 6.413 -10.271 1.00 0.00 C ATOM 493 CE1 PHE A 34 2.399 5.292 -12.188 1.00 0.00 C ATOM 494 CE2 PHE A 34 4.591 5.764 -11.358 1.00 0.00 C ATOM 495 CZ PHE A 34 3.771 5.201 -12.317 1.00 0.00 C ATOM 0 H PHE A 34 0.720 8.148 -7.104 1.00 0.00 H new ATOM 0 HA PHE A 34 0.239 6.080 -8.929 1.00 0.00 H new ATOM 0 HB2 PHE A 34 1.617 8.154 -9.283 1.00 0.00 H new ATOM 0 HB3 PHE A 34 2.858 7.476 -8.248 1.00 0.00 H new ATOM 0 HD1 PHE A 34 0.777 6.010 -11.002 1.00 0.00 H new ATOM 0 HD2 PHE A 34 4.683 6.849 -9.523 1.00 0.00 H new ATOM 0 HE1 PHE A 34 1.755 4.855 -12.937 1.00 0.00 H new ATOM 0 HE2 PHE A 34 5.664 5.697 -11.458 1.00 0.00 H new ATOM 0 HZ PHE A 34 4.202 4.691 -13.166 1.00 0.00 H new ATOM 505 N ARG A 35 0.944 4.019 -7.722 1.00 0.00 N ATOM 506 CA ARG A 35 1.440 2.758 -7.184 1.00 0.00 C ATOM 507 C ARG A 35 0.797 1.573 -7.898 1.00 0.00 C ATOM 508 O ARG A 35 -0.129 1.740 -8.692 1.00 0.00 O ATOM 509 CB ARG A 35 1.163 2.675 -5.682 1.00 0.00 C ATOM 510 CG ARG A 35 -0.313 2.554 -5.341 1.00 0.00 C ATOM 511 CD ARG A 35 -0.522 2.303 -3.856 1.00 0.00 C ATOM 512 NE ARG A 35 -0.645 3.548 -3.102 1.00 0.00 N ATOM 513 CZ ARG A 35 -1.250 3.637 -1.923 1.00 0.00 C ATOM 514 NH1 ARG A 35 -1.784 2.559 -1.366 1.00 0.00 N ATOM 515 NH2 ARG A 35 -1.321 4.805 -1.298 1.00 0.00 N ATOM 0 H ARG A 35 0.035 3.954 -8.180 1.00 0.00 H new ATOM 0 HA ARG A 35 2.517 2.719 -7.350 1.00 0.00 H new ATOM 0 HB2 ARG A 35 1.694 1.817 -5.270 1.00 0.00 H new ATOM 0 HB3 ARG A 35 1.568 3.563 -5.197 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -0.831 3.467 -5.633 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -0.755 1.739 -5.915 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -1.420 1.702 -3.713 1.00 0.00 H new ATOM 0 HD3 ARG A 35 0.314 1.724 -3.465 1.00 0.00 H new ATOM 0 HE ARG A 35 -0.244 4.396 -3.503 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -1.731 1.659 -1.843 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -2.248 2.630 -0.460 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -0.911 5.637 -1.723 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -1.786 4.872 -0.393 1.00 0.00 H new ATOM 529 N CYS A 36 1.294 0.375 -7.610 1.00 0.00 N ATOM 530 CA CYS A 36 0.770 -0.840 -8.223 1.00 0.00 C ATOM 531 C CYS A 36 -0.669 -1.094 -7.782 1.00 0.00 C ATOM 532 O CYS A 36 -1.143 -0.509 -6.809 1.00 0.00 O ATOM 533 CB CYS A 36 1.646 -2.039 -7.859 1.00 0.00 C ATOM 534 SG CYS A 36 1.348 -3.516 -8.884 1.00 0.00 S ATOM 0 H CYS A 36 2.060 0.219 -6.955 1.00 0.00 H new ATOM 0 HA CYS A 36 0.782 -0.706 -9.305 1.00 0.00 H new ATOM 0 HB2 CYS A 36 2.693 -1.751 -7.951 1.00 0.00 H new ATOM 0 HB3 CYS A 36 1.476 -2.295 -6.813 1.00 0.00 H new ATOM 539 N ALA A 37 -1.357 -1.972 -8.505 1.00 0.00 N ATOM 540 CA ALA A 37 -2.740 -2.306 -8.187 1.00 0.00 C ATOM 541 C ALA A 37 -2.840 -3.695 -7.566 1.00 0.00 C ATOM 542 O ALA A 37 -3.899 -4.095 -7.081 1.00 0.00 O ATOM 543 CB ALA A 37 -3.604 -2.221 -9.437 1.00 0.00 C ATOM 0 H ALA A 37 -0.979 -2.465 -9.314 1.00 0.00 H new ATOM 0 HA ALA A 37 -3.104 -1.583 -7.457 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -4.634 -2.473 -9.185 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -3.566 -1.208 -9.838 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -3.232 -2.921 -10.185 1.00 0.00 H new ATOM 549 N LYS A 38 -1.732 -4.428 -7.585 1.00 0.00 N ATOM 550 CA LYS A 38 -1.694 -5.773 -7.023 1.00 0.00 C ATOM 551 C LYS A 38 -0.918 -5.792 -5.710 1.00 0.00 C ATOM 552 O LYS A 38 -1.359 -6.386 -4.725 1.00 0.00 O ATOM 553 CB LYS A 38 -1.057 -6.745 -8.018 1.00 0.00 C ATOM 554 CG LYS A 38 -2.063 -7.434 -8.924 1.00 0.00 C ATOM 555 CD LYS A 38 -1.409 -8.525 -9.756 1.00 0.00 C ATOM 556 CE LYS A 38 -1.200 -9.795 -8.946 1.00 0.00 C ATOM 557 NZ LYS A 38 -0.010 -10.560 -9.410 1.00 0.00 N ATOM 0 H LYS A 38 -0.848 -4.113 -7.984 1.00 0.00 H new ATOM 0 HA LYS A 38 -2.719 -6.086 -6.824 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -0.338 -6.203 -8.633 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -0.499 -7.502 -7.467 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -2.862 -7.865 -8.321 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -2.523 -6.699 -9.584 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -2.031 -8.744 -10.624 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -0.450 -8.171 -10.133 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -1.079 -9.539 -7.894 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -2.087 -10.423 -9.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 0.098 -11.418 -8.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -0.136 -10.827 -10.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 0.841 -9.970 -9.315 1.00 0.00 H new ATOM 571 N CYS A 39 0.238 -5.138 -5.701 1.00 0.00 N ATOM 572 CA CYS A 39 1.075 -5.079 -4.509 1.00 0.00 C ATOM 573 C CYS A 39 0.977 -3.710 -3.843 1.00 0.00 C ATOM 574 O CYS A 39 1.478 -3.508 -2.736 1.00 0.00 O ATOM 575 CB CYS A 39 2.532 -5.380 -4.868 1.00 0.00 C ATOM 576 SG CYS A 39 3.296 -4.148 -5.971 1.00 0.00 S ATOM 0 H CYS A 39 0.617 -4.641 -6.507 1.00 0.00 H new ATOM 0 HA CYS A 39 0.717 -5.832 -3.807 1.00 0.00 H new ATOM 0 HB2 CYS A 39 3.116 -5.441 -3.950 1.00 0.00 H new ATOM 0 HB3 CYS A 39 2.583 -6.359 -5.344 1.00 0.00 H new ATOM 581 N LEU A 40 0.327 -2.772 -4.524 1.00 0.00 N ATOM 582 CA LEU A 40 0.162 -1.421 -3.998 1.00 0.00 C ATOM 583 C LEU A 40 1.511 -0.808 -3.638 1.00 0.00 C ATOM 584 O LEU A 40 1.707 -0.326 -2.522 1.00 0.00 O ATOM 585 CB LEU A 40 -0.748 -1.439 -2.769 1.00 0.00 C ATOM 586 CG LEU A 40 -2.182 -1.917 -3.002 1.00 0.00 C ATOM 587 CD1 LEU A 40 -2.916 -0.968 -3.936 1.00 0.00 C ATOM 588 CD2 LEU A 40 -2.188 -3.331 -3.562 1.00 0.00 C ATOM 0 H LEU A 40 -0.094 -2.922 -5.441 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.298 -0.809 -4.774 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.292 -2.078 -2.013 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.785 -0.432 -2.354 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.702 -1.925 -2.044 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -3.935 -1.324 -4.090 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -2.943 0.028 -3.495 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.397 -0.927 -4.894 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.216 -3.655 -3.722 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -1.651 -3.349 -4.510 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.701 -4.004 -2.856 1.00 0.00 H new ATOM 600 N HIS A 41 2.438 -0.828 -4.590 1.00 0.00 N ATOM 601 CA HIS A 41 3.769 -0.271 -4.374 1.00 0.00 C ATOM 602 C HIS A 41 4.008 0.933 -5.280 1.00 0.00 C ATOM 603 O HIS A 41 3.630 0.944 -6.451 1.00 0.00 O ATOM 604 CB HIS A 41 4.837 -1.335 -4.628 1.00 0.00 C ATOM 605 CG HIS A 41 6.237 -0.829 -4.466 1.00 0.00 C ATOM 606 ND1 HIS A 41 6.900 -0.823 -3.257 1.00 0.00 N ATOM 607 CD2 HIS A 41 7.101 -0.310 -5.370 1.00 0.00 C ATOM 608 CE1 HIS A 41 8.111 -0.322 -3.424 1.00 0.00 C ATOM 609 NE2 HIS A 41 8.258 -0.003 -4.697 1.00 0.00 N ATOM 0 H HIS A 41 2.292 -1.224 -5.519 1.00 0.00 H new ATOM 0 HA HIS A 41 3.834 0.059 -3.337 1.00 0.00 H new ATOM 0 HB2 HIS A 41 4.679 -2.168 -3.943 1.00 0.00 H new ATOM 0 HB3 HIS A 41 4.715 -1.726 -5.638 1.00 0.00 H new ATOM 0 HD2 HIS A 41 6.915 -0.165 -6.424 1.00 0.00 H new ATOM 0 HE1 HIS A 41 8.854 -0.195 -2.651 1.00 0.00 H new ATOM 0 HE2 HIS A 41 9.095 0.405 -5.113 1.00 0.00 H new ATOM 618 N PRO A 42 4.649 1.973 -4.726 1.00 0.00 N ATOM 619 CA PRO A 42 4.952 3.201 -5.466 1.00 0.00 C ATOM 620 C PRO A 42 6.019 2.986 -6.534 1.00 0.00 C ATOM 621 O PRO A 42 7.108 2.488 -6.247 1.00 0.00 O ATOM 622 CB PRO A 42 5.466 4.151 -4.381 1.00 0.00 C ATOM 623 CG PRO A 42 5.996 3.257 -3.314 1.00 0.00 C ATOM 624 CD PRO A 42 5.128 2.028 -3.334 1.00 0.00 C ATOM 0 HA PRO A 42 4.082 3.577 -6.005 1.00 0.00 H new ATOM 0 HB2 PRO A 42 6.244 4.810 -4.768 1.00 0.00 H new ATOM 0 HB3 PRO A 42 4.667 4.789 -4.002 1.00 0.00 H new ATOM 0 HG2 PRO A 42 7.039 3.001 -3.502 1.00 0.00 H new ATOM 0 HG3 PRO A 42 5.958 3.746 -2.341 1.00 0.00 H new ATOM 0 HD2 PRO A 42 5.691 1.134 -3.067 1.00 0.00 H new ATOM 0 HD3 PRO A 42 4.302 2.108 -2.627 1.00 0.00 H new ATOM 632 N LEU A 43 5.700 3.365 -7.766 1.00 0.00 N ATOM 633 CA LEU A 43 6.632 3.214 -8.879 1.00 0.00 C ATOM 634 C LEU A 43 7.301 4.544 -9.212 1.00 0.00 C ATOM 635 O LEU A 43 7.900 4.699 -10.276 1.00 0.00 O ATOM 636 CB LEU A 43 5.903 2.674 -10.110 1.00 0.00 C ATOM 637 CG LEU A 43 5.362 1.248 -9.998 1.00 0.00 C ATOM 638 CD1 LEU A 43 6.366 0.350 -9.294 1.00 0.00 C ATOM 639 CD2 LEU A 43 4.029 1.240 -9.264 1.00 0.00 C ATOM 0 H LEU A 43 4.803 3.779 -8.020 1.00 0.00 H new ATOM 0 HA LEU A 43 7.404 2.504 -8.582 1.00 0.00 H new ATOM 0 HB2 LEU A 43 5.070 3.340 -10.336 1.00 0.00 H new ATOM 0 HB3 LEU A 43 6.585 2.717 -10.959 1.00 0.00 H new ATOM 0 HG LEU A 43 5.202 0.860 -11.004 1.00 0.00 H new ATOM 0 HD11 LEU A 43 5.964 -0.661 -9.224 1.00 0.00 H new ATOM 0 HD12 LEU A 43 7.297 0.331 -9.860 1.00 0.00 H new ATOM 0 HD13 LEU A 43 6.558 0.735 -8.292 1.00 0.00 H new ATOM 0 HD21 LEU A 43 3.659 0.217 -9.193 1.00 0.00 H new ATOM 0 HD22 LEU A 43 4.163 1.647 -8.262 1.00 0.00 H new ATOM 0 HD23 LEU A 43 3.309 1.850 -9.810 1.00 0.00 H new ATOM 651 N ALA A 44 7.197 5.499 -8.294 1.00 0.00 N ATOM 652 CA ALA A 44 7.796 6.814 -8.489 1.00 0.00 C ATOM 653 C ALA A 44 9.287 6.699 -8.791 1.00 0.00 C ATOM 654 O ALA A 44 9.827 7.456 -9.596 1.00 0.00 O ATOM 655 CB ALA A 44 7.570 7.684 -7.262 1.00 0.00 C ATOM 0 H ALA A 44 6.704 5.387 -7.408 1.00 0.00 H new ATOM 0 HA ALA A 44 7.313 7.282 -9.347 1.00 0.00 H new ATOM 0 HB1 ALA A 44 8.022 8.663 -7.422 1.00 0.00 H new ATOM 0 HB2 ALA A 44 6.500 7.802 -7.092 1.00 0.00 H new ATOM 0 HB3 ALA A 44 8.025 7.211 -6.392 1.00 0.00 H new ATOM 661 N ASN A 45 9.946 5.747 -8.138 1.00 0.00 N ATOM 662 CA ASN A 45 11.375 5.535 -8.335 1.00 0.00 C ATOM 663 C ASN A 45 11.641 4.161 -8.944 1.00 0.00 C ATOM 664 O ASN A 45 12.778 3.831 -9.280 1.00 0.00 O ATOM 665 CB ASN A 45 12.121 5.669 -7.006 1.00 0.00 C ATOM 666 CG ASN A 45 11.417 4.947 -5.873 1.00 0.00 C ATOM 667 OD1 ASN A 45 10.996 3.799 -6.020 1.00 0.00 O ATOM 668 ND2 ASN A 45 11.286 5.618 -4.735 1.00 0.00 N ATOM 0 H ASN A 45 9.513 5.111 -7.468 1.00 0.00 H new ATOM 0 HA ASN A 45 11.738 6.296 -9.025 1.00 0.00 H new ATOM 0 HB2 ASN A 45 13.129 5.270 -7.117 1.00 0.00 H new ATOM 0 HB3 ASN A 45 12.222 6.725 -6.754 1.00 0.00 H new ATOM 0 HD21 ASN A 45 10.821 5.184 -3.938 1.00 0.00 H new ATOM 0 HD22 ASN A 45 11.650 6.568 -4.658 1.00 0.00 H new ATOM 675 N GLU A 46 10.585 3.366 -9.083 1.00 0.00 N ATOM 676 CA GLU A 46 10.705 2.029 -9.651 1.00 0.00 C ATOM 677 C GLU A 46 9.914 1.917 -10.951 1.00 0.00 C ATOM 678 O GLU A 46 8.862 2.537 -11.108 1.00 0.00 O ATOM 679 CB GLU A 46 10.215 0.980 -8.651 1.00 0.00 C ATOM 680 CG GLU A 46 9.914 -0.369 -9.283 1.00 0.00 C ATOM 681 CD GLU A 46 11.166 -1.183 -9.545 1.00 0.00 C ATOM 682 OE1 GLU A 46 12.120 -0.630 -10.131 1.00 0.00 O ATOM 683 OE2 GLU A 46 11.192 -2.372 -9.165 1.00 0.00 O ATOM 0 H GLU A 46 9.637 3.625 -8.810 1.00 0.00 H new ATOM 0 HA GLU A 46 11.757 1.848 -9.870 1.00 0.00 H new ATOM 0 HB2 GLU A 46 10.970 0.848 -7.876 1.00 0.00 H new ATOM 0 HB3 GLU A 46 9.315 1.351 -8.160 1.00 0.00 H new ATOM 0 HG2 GLU A 46 9.249 -0.932 -8.628 1.00 0.00 H new ATOM 0 HG3 GLU A 46 9.382 -0.216 -10.222 1.00 0.00 H new ATOM 690 N THR A 47 10.430 1.121 -11.884 1.00 0.00 N ATOM 691 CA THR A 47 9.774 0.928 -13.171 1.00 0.00 C ATOM 692 C THR A 47 8.336 0.455 -12.991 1.00 0.00 C ATOM 693 O THR A 47 7.969 -0.056 -11.932 1.00 0.00 O ATOM 694 CB THR A 47 10.533 -0.091 -14.041 1.00 0.00 C ATOM 695 OG1 THR A 47 10.626 -1.346 -13.357 1.00 0.00 O ATOM 696 CG2 THR A 47 11.928 0.414 -14.375 1.00 0.00 C ATOM 0 H THR A 47 11.300 0.600 -11.772 1.00 0.00 H new ATOM 0 HA THR A 47 9.774 1.895 -13.674 1.00 0.00 H new ATOM 0 HB THR A 47 9.980 -0.224 -14.971 1.00 0.00 H new ATOM 0 HG1 THR A 47 11.108 -1.989 -13.917 1.00 0.00 H new ATOM 0 HG21 THR A 47 12.444 -0.323 -14.990 1.00 0.00 H new ATOM 0 HG22 THR A 47 11.853 1.354 -14.921 1.00 0.00 H new ATOM 0 HG23 THR A 47 12.488 0.573 -13.453 1.00 0.00 H new ATOM 704 N PHE A 48 7.527 0.627 -14.030 1.00 0.00 N ATOM 705 CA PHE A 48 6.128 0.217 -13.986 1.00 0.00 C ATOM 706 C PHE A 48 5.714 -0.448 -15.295 1.00 0.00 C ATOM 707 O PHE A 48 6.445 -0.403 -16.285 1.00 0.00 O ATOM 708 CB PHE A 48 5.229 1.424 -13.707 1.00 0.00 C ATOM 709 CG PHE A 48 5.262 2.459 -14.795 1.00 0.00 C ATOM 710 CD1 PHE A 48 4.479 2.315 -15.930 1.00 0.00 C ATOM 711 CD2 PHE A 48 6.074 3.576 -14.684 1.00 0.00 C ATOM 712 CE1 PHE A 48 4.507 3.266 -16.932 1.00 0.00 C ATOM 713 CE2 PHE A 48 6.106 4.530 -15.683 1.00 0.00 C ATOM 714 CZ PHE A 48 5.321 4.375 -16.808 1.00 0.00 C ATOM 0 H PHE A 48 7.816 1.048 -14.913 1.00 0.00 H new ATOM 0 HA PHE A 48 6.013 -0.507 -13.179 1.00 0.00 H new ATOM 0 HB2 PHE A 48 4.203 1.080 -13.574 1.00 0.00 H new ATOM 0 HB3 PHE A 48 5.535 1.885 -12.768 1.00 0.00 H new ATOM 0 HD1 PHE A 48 3.840 1.450 -16.032 1.00 0.00 H new ATOM 0 HD2 PHE A 48 6.690 3.703 -13.806 1.00 0.00 H new ATOM 0 HE1 PHE A 48 3.893 3.142 -17.812 1.00 0.00 H new ATOM 0 HE2 PHE A 48 6.744 5.396 -15.584 1.00 0.00 H new ATOM 0 HZ PHE A 48 5.343 5.120 -17.590 1.00 0.00 H new ATOM 724 N VAL A 49 4.537 -1.065 -15.293 1.00 0.00 N ATOM 725 CA VAL A 49 4.025 -1.740 -16.479 1.00 0.00 C ATOM 726 C VAL A 49 2.523 -1.523 -16.629 1.00 0.00 C ATOM 727 O VAL A 49 1.767 -1.658 -15.667 1.00 0.00 O ATOM 728 CB VAL A 49 4.312 -3.252 -16.434 1.00 0.00 C ATOM 729 CG1 VAL A 49 3.773 -3.936 -17.681 1.00 0.00 C ATOM 730 CG2 VAL A 49 5.804 -3.506 -16.279 1.00 0.00 C ATOM 0 H VAL A 49 3.920 -1.111 -14.482 1.00 0.00 H new ATOM 0 HA VAL A 49 4.540 -1.306 -17.336 1.00 0.00 H new ATOM 0 HB VAL A 49 3.802 -3.675 -15.568 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.985 -5.004 -17.631 1.00 0.00 H new ATOM 0 HG12 VAL A 49 2.696 -3.783 -17.743 1.00 0.00 H new ATOM 0 HG13 VAL A 49 4.251 -3.512 -18.564 1.00 0.00 H new ATOM 0 HG21 VAL A 49 5.989 -4.580 -16.249 1.00 0.00 H new ATOM 0 HG22 VAL A 49 6.337 -3.069 -17.124 1.00 0.00 H new ATOM 0 HG23 VAL A 49 6.156 -3.051 -15.353 1.00 0.00 H new ATOM 740 N ALA A 50 2.097 -1.188 -17.843 1.00 0.00 N ATOM 741 CA ALA A 50 0.685 -0.955 -18.119 1.00 0.00 C ATOM 742 C ALA A 50 0.093 -2.092 -18.945 1.00 0.00 C ATOM 743 O ALA A 50 0.471 -2.297 -20.099 1.00 0.00 O ATOM 744 CB ALA A 50 0.500 0.373 -18.838 1.00 0.00 C ATOM 0 H ALA A 50 2.710 -1.072 -18.650 1.00 0.00 H new ATOM 0 HA ALA A 50 0.155 -0.917 -17.167 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -0.559 0.534 -19.038 1.00 0.00 H new ATOM 0 HB2 ALA A 50 0.878 1.181 -18.212 1.00 0.00 H new ATOM 0 HB3 ALA A 50 1.048 0.356 -19.780 1.00 0.00 H new ATOM 750 N LYS A 51 -0.836 -2.830 -18.347 1.00 0.00 N ATOM 751 CA LYS A 51 -1.482 -3.946 -19.027 1.00 0.00 C ATOM 752 C LYS A 51 -2.968 -4.003 -18.689 1.00 0.00 C ATOM 753 O LYS A 51 -3.354 -3.910 -17.524 1.00 0.00 O ATOM 754 CB LYS A 51 -0.809 -5.265 -18.639 1.00 0.00 C ATOM 755 CG LYS A 51 0.414 -5.594 -19.478 1.00 0.00 C ATOM 756 CD LYS A 51 1.292 -6.632 -18.800 1.00 0.00 C ATOM 757 CE LYS A 51 0.847 -8.046 -19.140 1.00 0.00 C ATOM 758 NZ LYS A 51 1.539 -8.569 -20.351 1.00 0.00 N ATOM 0 H LYS A 51 -1.159 -2.675 -17.392 1.00 0.00 H new ATOM 0 HA LYS A 51 -1.377 -3.794 -20.101 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -0.518 -5.220 -17.590 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -1.533 -6.074 -18.734 1.00 0.00 H new ATOM 0 HG2 LYS A 51 0.098 -5.964 -20.453 1.00 0.00 H new ATOM 0 HG3 LYS A 51 0.991 -4.686 -19.653 1.00 0.00 H new ATOM 0 HD2 LYS A 51 2.328 -6.491 -19.109 1.00 0.00 H new ATOM 0 HD3 LYS A 51 1.259 -6.489 -17.720 1.00 0.00 H new ATOM 0 HE2 LYS A 51 1.048 -8.703 -18.294 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -0.231 -8.058 -19.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 1.209 -9.535 -20.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 1.327 -7.956 -21.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 2.566 -8.582 -20.186 1.00 0.00 H new ATOM 772 N ASP A 52 -3.798 -4.159 -19.715 1.00 0.00 N ATOM 773 CA ASP A 52 -5.242 -4.231 -19.526 1.00 0.00 C ATOM 774 C ASP A 52 -5.755 -3.001 -18.784 1.00 0.00 C ATOM 775 O ASP A 52 -6.600 -3.107 -17.895 1.00 0.00 O ATOM 776 CB ASP A 52 -5.615 -5.499 -18.756 1.00 0.00 C ATOM 777 CG ASP A 52 -5.618 -6.732 -19.638 1.00 0.00 C ATOM 778 OD1 ASP A 52 -4.520 -7.203 -20.002 1.00 0.00 O ATOM 779 OD2 ASP A 52 -6.718 -7.225 -19.964 1.00 0.00 O ATOM 0 H ASP A 52 -3.495 -4.238 -20.686 1.00 0.00 H new ATOM 0 HA ASP A 52 -5.711 -4.262 -20.509 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -4.911 -5.644 -17.937 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -6.601 -5.373 -18.310 1.00 0.00 H new ATOM 784 N ASN A 53 -5.238 -1.834 -19.154 1.00 0.00 N ATOM 785 CA ASN A 53 -5.643 -0.583 -18.522 1.00 0.00 C ATOM 786 C ASN A 53 -5.483 -0.663 -17.007 1.00 0.00 C ATOM 787 O ASN A 53 -6.322 -0.166 -16.255 1.00 0.00 O ATOM 788 CB ASN A 53 -7.094 -0.255 -18.876 1.00 0.00 C ATOM 789 CG ASN A 53 -7.414 -0.542 -20.331 1.00 0.00 C ATOM 790 OD1 ASN A 53 -7.792 -1.659 -20.686 1.00 0.00 O ATOM 791 ND2 ASN A 53 -7.261 0.467 -21.180 1.00 0.00 N ATOM 0 H ASN A 53 -4.538 -1.728 -19.888 1.00 0.00 H new ATOM 0 HA ASN A 53 -4.997 0.211 -18.897 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -7.761 -0.836 -18.239 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -7.288 0.797 -18.665 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -7.459 0.334 -22.172 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -6.945 1.376 -20.841 1.00 0.00 H new ATOM 798 N LYS A 54 -4.399 -1.292 -16.564 1.00 0.00 N ATOM 799 CA LYS A 54 -4.127 -1.436 -15.139 1.00 0.00 C ATOM 800 C LYS A 54 -2.634 -1.302 -14.854 1.00 0.00 C ATOM 801 O LYS A 54 -1.809 -1.942 -15.507 1.00 0.00 O ATOM 802 CB LYS A 54 -4.633 -2.790 -14.636 1.00 0.00 C ATOM 803 CG LYS A 54 -6.147 -2.916 -14.648 1.00 0.00 C ATOM 804 CD LYS A 54 -6.614 -4.101 -13.821 1.00 0.00 C ATOM 805 CE LYS A 54 -6.560 -5.394 -14.620 1.00 0.00 C ATOM 806 NZ LYS A 54 -6.641 -6.594 -13.741 1.00 0.00 N ATOM 0 H LYS A 54 -3.695 -1.710 -17.172 1.00 0.00 H new ATOM 0 HA LYS A 54 -4.653 -0.640 -14.612 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -4.206 -3.580 -15.254 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -4.272 -2.949 -13.620 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -6.592 -2.001 -14.258 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -6.496 -3.028 -15.675 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -5.990 -4.195 -12.933 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -7.634 -3.927 -13.477 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -7.381 -5.413 -15.336 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -5.635 -5.427 -15.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -6.601 -7.454 -14.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -5.843 -6.590 -13.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -7.536 -6.576 -13.211 1.00 0.00 H new ATOM 820 N ILE A 55 -2.295 -0.470 -13.876 1.00 0.00 N ATOM 821 CA ILE A 55 -0.902 -0.255 -13.504 1.00 0.00 C ATOM 822 C ILE A 55 -0.366 -1.424 -12.683 1.00 0.00 C ATOM 823 O ILE A 55 -0.940 -1.791 -11.657 1.00 0.00 O ATOM 824 CB ILE A 55 -0.729 1.046 -12.698 1.00 0.00 C ATOM 825 CG1 ILE A 55 -1.331 2.228 -13.460 1.00 0.00 C ATOM 826 CG2 ILE A 55 0.743 1.294 -12.403 1.00 0.00 C ATOM 827 CD1 ILE A 55 -0.687 2.470 -14.807 1.00 0.00 C ATOM 0 H ILE A 55 -2.966 0.067 -13.326 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.336 -0.176 -14.432 1.00 0.00 H new ATOM 0 HB ILE A 55 -1.257 0.942 -11.750 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -2.397 2.053 -13.602 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -1.234 3.128 -12.853 1.00 0.00 H new ATOM 0 HG21 ILE A 55 0.849 2.217 -11.833 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.143 0.462 -11.824 1.00 0.00 H new ATOM 0 HG23 ILE A 55 1.292 1.381 -13.340 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -1.164 3.323 -15.290 1.00 0.00 H new ATOM 0 HD12 ILE A 55 0.374 2.677 -14.671 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -0.807 1.585 -15.432 1.00 0.00 H new ATOM 839 N LEU A 56 0.738 -2.003 -13.141 1.00 0.00 N ATOM 840 CA LEU A 56 1.354 -3.130 -12.448 1.00 0.00 C ATOM 841 C LEU A 56 2.873 -2.987 -12.421 1.00 0.00 C ATOM 842 O LEU A 56 3.465 -2.363 -13.302 1.00 0.00 O ATOM 843 CB LEU A 56 0.966 -4.445 -13.126 1.00 0.00 C ATOM 844 CG LEU A 56 -0.471 -4.917 -12.900 1.00 0.00 C ATOM 845 CD1 LEU A 56 -0.743 -6.191 -13.685 1.00 0.00 C ATOM 846 CD2 LEU A 56 -0.734 -5.136 -11.418 1.00 0.00 C ATOM 0 H LEU A 56 1.225 -1.711 -13.988 1.00 0.00 H new ATOM 0 HA LEU A 56 0.989 -3.137 -11.421 1.00 0.00 H new ATOM 0 HB2 LEU A 56 1.128 -4.339 -14.199 1.00 0.00 H new ATOM 0 HB3 LEU A 56 1.643 -5.225 -12.776 1.00 0.00 H new ATOM 0 HG LEU A 56 -1.148 -4.142 -13.258 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -1.770 -6.512 -13.512 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.596 -6.002 -14.748 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.058 -6.973 -13.358 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -1.761 -5.472 -11.276 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -0.049 -5.892 -11.035 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -0.580 -4.201 -10.879 1.00 0.00 H new ATOM 858 N CYS A 57 3.498 -3.572 -11.405 1.00 0.00 N ATOM 859 CA CYS A 57 4.948 -3.513 -11.263 1.00 0.00 C ATOM 860 C CYS A 57 5.592 -4.825 -11.703 1.00 0.00 C ATOM 861 O CYS A 57 4.914 -5.840 -11.856 1.00 0.00 O ATOM 862 CB CYS A 57 5.327 -3.207 -9.813 1.00 0.00 C ATOM 863 SG CYS A 57 5.187 -4.635 -8.690 1.00 0.00 S ATOM 0 H CYS A 57 3.023 -4.093 -10.668 1.00 0.00 H new ATOM 0 HA CYS A 57 5.319 -2.714 -11.905 1.00 0.00 H new ATOM 0 HB2 CYS A 57 6.352 -2.837 -9.787 1.00 0.00 H new ATOM 0 HB3 CYS A 57 4.689 -2.404 -9.444 1.00 0.00 H new ATOM 868 N ASN A 58 6.905 -4.795 -11.903 1.00 0.00 N ATOM 869 CA ASN A 58 7.641 -5.981 -12.325 1.00 0.00 C ATOM 870 C ASN A 58 7.372 -7.152 -11.384 1.00 0.00 C ATOM 871 O ASN A 58 6.993 -8.239 -11.820 1.00 0.00 O ATOM 872 CB ASN A 58 9.142 -5.686 -12.374 1.00 0.00 C ATOM 873 CG ASN A 58 9.603 -4.843 -11.201 1.00 0.00 C ATOM 874 OD1 ASN A 58 10.020 -5.371 -10.169 1.00 0.00 O ATOM 875 ND2 ASN A 58 9.531 -3.526 -11.354 1.00 0.00 N ATOM 0 H ASN A 58 7.481 -3.963 -11.780 1.00 0.00 H new ATOM 0 HA ASN A 58 7.299 -6.254 -13.323 1.00 0.00 H new ATOM 0 HB2 ASN A 58 9.694 -6.626 -12.382 1.00 0.00 H new ATOM 0 HB3 ASN A 58 9.378 -5.169 -13.304 1.00 0.00 H new ATOM 0 HD21 ASN A 58 9.828 -2.908 -10.599 1.00 0.00 H new ATOM 0 HD22 ASN A 58 9.179 -3.132 -12.227 1.00 0.00 H new ATOM 882 N LYS A 59 7.571 -6.921 -10.091 1.00 0.00 N ATOM 883 CA LYS A 59 7.350 -7.954 -9.086 1.00 0.00 C ATOM 884 C LYS A 59 6.081 -8.745 -9.390 1.00 0.00 C ATOM 885 O LYS A 59 6.067 -9.973 -9.303 1.00 0.00 O ATOM 886 CB LYS A 59 7.251 -7.328 -7.693 1.00 0.00 C ATOM 887 CG LYS A 59 7.659 -8.269 -6.573 1.00 0.00 C ATOM 888 CD LYS A 59 6.949 -7.929 -5.273 1.00 0.00 C ATOM 889 CE LYS A 59 7.496 -8.743 -4.110 1.00 0.00 C ATOM 890 NZ LYS A 59 6.784 -10.042 -3.960 1.00 0.00 N ATOM 0 H LYS A 59 7.885 -6.027 -9.714 1.00 0.00 H new ATOM 0 HA LYS A 59 8.199 -8.637 -9.111 1.00 0.00 H new ATOM 0 HB2 LYS A 59 7.881 -6.440 -7.657 1.00 0.00 H new ATOM 0 HB3 LYS A 59 6.226 -6.998 -7.524 1.00 0.00 H new ATOM 0 HG2 LYS A 59 7.428 -9.296 -6.857 1.00 0.00 H new ATOM 0 HG3 LYS A 59 8.737 -8.214 -6.425 1.00 0.00 H new ATOM 0 HD2 LYS A 59 7.065 -6.866 -5.061 1.00 0.00 H new ATOM 0 HD3 LYS A 59 5.881 -8.118 -5.380 1.00 0.00 H new ATOM 0 HE2 LYS A 59 8.559 -8.927 -4.264 1.00 0.00 H new ATOM 0 HE3 LYS A 59 7.402 -8.169 -3.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 7.186 -10.567 -3.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 5.773 -9.866 -3.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 6.895 -10.601 -4.830 1.00 0.00 H new ATOM 904 N CYS A 60 5.017 -8.034 -9.748 1.00 0.00 N ATOM 905 CA CYS A 60 3.744 -8.668 -10.066 1.00 0.00 C ATOM 906 C CYS A 60 3.789 -9.316 -11.447 1.00 0.00 C ATOM 907 O CYS A 60 3.687 -10.536 -11.577 1.00 0.00 O ATOM 908 CB CYS A 60 2.610 -7.642 -10.008 1.00 0.00 C ATOM 909 SG CYS A 60 2.119 -7.171 -8.319 1.00 0.00 S ATOM 0 H CYS A 60 5.012 -7.017 -9.825 1.00 0.00 H new ATOM 0 HA CYS A 60 3.559 -9.446 -9.325 1.00 0.00 H new ATOM 0 HB2 CYS A 60 2.917 -6.747 -10.549 1.00 0.00 H new ATOM 0 HB3 CYS A 60 1.742 -8.047 -10.528 1.00 0.00 H new ATOM 914 N THR A 61 3.942 -8.490 -12.477 1.00 0.00 N ATOM 915 CA THR A 61 4.000 -8.980 -13.848 1.00 0.00 C ATOM 916 C THR A 61 4.767 -10.295 -13.930 1.00 0.00 C ATOM 917 O THR A 61 4.349 -11.229 -14.615 1.00 0.00 O ATOM 918 CB THR A 61 4.663 -7.953 -14.785 1.00 0.00 C ATOM 919 OG1 THR A 61 6.024 -7.742 -14.396 1.00 0.00 O ATOM 920 CG2 THR A 61 3.911 -6.631 -14.757 1.00 0.00 C ATOM 0 H THR A 61 4.028 -7.478 -12.387 1.00 0.00 H new ATOM 0 HA THR A 61 2.971 -9.142 -14.169 1.00 0.00 H new ATOM 0 HB THR A 61 4.633 -8.348 -15.800 1.00 0.00 H new ATOM 0 HG1 THR A 61 6.118 -7.904 -13.434 1.00 0.00 H new ATOM 0 HG21 THR A 61 4.398 -5.921 -15.426 1.00 0.00 H new ATOM 0 HG22 THR A 61 2.883 -6.790 -15.082 1.00 0.00 H new ATOM 0 HG23 THR A 61 3.913 -6.233 -13.742 1.00 0.00 H new ATOM 928 N THR A 62 5.893 -10.363 -13.226 1.00 0.00 N ATOM 929 CA THR A 62 6.719 -11.563 -13.219 1.00 0.00 C ATOM 930 C THR A 62 6.182 -12.595 -12.234 1.00 0.00 C ATOM 931 O THR A 62 5.424 -12.261 -11.323 1.00 0.00 O ATOM 932 CB THR A 62 8.180 -11.238 -12.858 1.00 0.00 C ATOM 933 OG1 THR A 62 8.245 -10.665 -11.548 1.00 0.00 O ATOM 934 CG2 THR A 62 8.786 -10.275 -13.869 1.00 0.00 C ATOM 0 H THR A 62 6.253 -9.600 -12.653 1.00 0.00 H new ATOM 0 HA THR A 62 6.685 -11.975 -14.228 1.00 0.00 H new ATOM 0 HB THR A 62 8.751 -12.166 -12.877 1.00 0.00 H new ATOM 0 HG1 THR A 62 7.948 -9.732 -11.584 1.00 0.00 H new ATOM 0 HG21 THR A 62 9.818 -10.060 -13.593 1.00 0.00 H new ATOM 0 HG22 THR A 62 8.762 -10.726 -14.861 1.00 0.00 H new ATOM 0 HG23 THR A 62 8.212 -9.348 -13.878 1.00 0.00 H new ATOM 942 N ARG A 63 6.580 -13.849 -12.422 1.00 0.00 N ATOM 943 CA ARG A 63 6.137 -14.930 -11.549 1.00 0.00 C ATOM 944 C ARG A 63 4.617 -15.057 -11.569 1.00 0.00 C ATOM 945 O ARG A 63 3.991 -15.294 -10.536 1.00 0.00 O ATOM 946 CB ARG A 63 6.621 -14.689 -10.118 1.00 0.00 C ATOM 947 CG ARG A 63 8.127 -14.518 -10.005 1.00 0.00 C ATOM 948 CD ARG A 63 8.849 -15.851 -10.119 1.00 0.00 C ATOM 949 NE ARG A 63 10.171 -15.812 -9.500 1.00 0.00 N ATOM 950 CZ ARG A 63 10.377 -15.956 -8.196 1.00 0.00 C ATOM 951 NH1 ARG A 63 9.352 -16.147 -7.377 1.00 0.00 N ATOM 952 NH2 ARG A 63 11.610 -15.909 -7.708 1.00 0.00 N ATOM 0 H ARG A 63 7.208 -14.142 -13.171 1.00 0.00 H new ATOM 0 HA ARG A 63 6.567 -15.861 -11.919 1.00 0.00 H new ATOM 0 HB2 ARG A 63 6.132 -13.798 -9.723 1.00 0.00 H new ATOM 0 HB3 ARG A 63 6.311 -15.526 -9.493 1.00 0.00 H new ATOM 0 HG2 ARG A 63 8.478 -13.845 -10.788 1.00 0.00 H new ATOM 0 HG3 ARG A 63 8.371 -14.051 -9.051 1.00 0.00 H new ATOM 0 HD2 ARG A 63 8.250 -16.629 -9.646 1.00 0.00 H new ATOM 0 HD3 ARG A 63 8.949 -16.120 -11.170 1.00 0.00 H new ATOM 0 HE ARG A 63 10.981 -15.666 -10.103 1.00 0.00 H new ATOM 0 HH11 ARG A 63 8.403 -16.184 -7.748 1.00 0.00 H new ATOM 0 HH12 ARG A 63 9.513 -16.257 -6.376 1.00 0.00 H new ATOM 0 HH21 ARG A 63 12.401 -15.762 -8.335 1.00 0.00 H new ATOM 0 HH22 ARG A 63 11.767 -16.020 -6.706 1.00 0.00 H new ATOM 966 N GLU A 64 4.030 -14.896 -12.751 1.00 0.00 N ATOM 967 CA GLU A 64 2.583 -14.991 -12.903 1.00 0.00 C ATOM 968 C GLU A 64 2.218 -15.880 -14.089 1.00 0.00 C ATOM 969 O GLU A 64 1.988 -15.394 -15.196 1.00 0.00 O ATOM 970 CB GLU A 64 1.974 -13.600 -13.090 1.00 0.00 C ATOM 971 CG GLU A 64 0.460 -13.609 -13.212 1.00 0.00 C ATOM 972 CD GLU A 64 -0.208 -14.430 -12.127 1.00 0.00 C ATOM 973 OE1 GLU A 64 -0.243 -13.965 -10.969 1.00 0.00 O ATOM 974 OE2 GLU A 64 -0.696 -15.538 -12.436 1.00 0.00 O ATOM 0 H GLU A 64 4.534 -14.699 -13.616 1.00 0.00 H new ATOM 0 HA GLU A 64 2.177 -15.438 -11.996 1.00 0.00 H new ATOM 0 HB2 GLU A 64 2.258 -12.972 -12.246 1.00 0.00 H new ATOM 0 HB3 GLU A 64 2.399 -13.144 -13.984 1.00 0.00 H new ATOM 0 HG2 GLU A 64 0.090 -12.585 -13.167 1.00 0.00 H new ATOM 0 HG3 GLU A 64 0.180 -14.007 -14.187 1.00 0.00 H new ATOM 981 N ASP A 65 2.168 -17.186 -13.848 1.00 0.00 N ATOM 982 CA ASP A 65 1.831 -18.144 -14.894 1.00 0.00 C ATOM 983 C ASP A 65 0.375 -18.586 -14.778 1.00 0.00 C ATOM 984 O ASP A 65 0.086 -19.687 -14.309 1.00 0.00 O ATOM 985 CB ASP A 65 2.754 -19.361 -14.817 1.00 0.00 C ATOM 986 CG ASP A 65 4.196 -18.978 -14.547 1.00 0.00 C ATOM 987 OD1 ASP A 65 4.676 -18.004 -15.162 1.00 0.00 O ATOM 988 OD2 ASP A 65 4.845 -19.654 -13.721 1.00 0.00 O ATOM 0 H ASP A 65 2.357 -17.605 -12.937 1.00 0.00 H new ATOM 0 HA ASP A 65 1.967 -17.655 -15.858 1.00 0.00 H new ATOM 0 HB2 ASP A 65 2.405 -20.029 -14.029 1.00 0.00 H new ATOM 0 HB3 ASP A 65 2.698 -19.916 -15.754 1.00 0.00 H new ATOM 993 N SER A 66 -0.537 -17.720 -15.208 1.00 0.00 N ATOM 994 CA SER A 66 -1.963 -18.018 -15.148 1.00 0.00 C ATOM 995 C SER A 66 -2.304 -19.216 -16.029 1.00 0.00 C ATOM 996 O SER A 66 -1.612 -19.522 -17.000 1.00 0.00 O ATOM 997 CB SER A 66 -2.779 -16.801 -15.584 1.00 0.00 C ATOM 998 OG SER A 66 -3.090 -15.972 -14.478 1.00 0.00 O ATOM 0 H SER A 66 -0.314 -16.806 -15.602 1.00 0.00 H new ATOM 0 HA SER A 66 -2.215 -18.264 -14.116 1.00 0.00 H new ATOM 0 HB2 SER A 66 -2.219 -16.230 -16.324 1.00 0.00 H new ATOM 0 HB3 SER A 66 -3.700 -17.130 -16.066 1.00 0.00 H new ATOM 0 HG SER A 66 -2.299 -15.878 -13.907 1.00 0.00 H new ATOM 1004 N PRO A 67 -3.398 -19.912 -15.683 1.00 0.00 N ATOM 1005 CA PRO A 67 -3.857 -21.087 -16.428 1.00 0.00 C ATOM 1006 C PRO A 67 -4.405 -20.723 -17.804 1.00 0.00 C ATOM 1007 O PRO A 67 -4.941 -19.632 -18.002 1.00 0.00 O ATOM 1008 CB PRO A 67 -4.970 -21.656 -15.544 1.00 0.00 C ATOM 1009 CG PRO A 67 -5.464 -20.489 -14.760 1.00 0.00 C ATOM 1010 CD PRO A 67 -4.270 -19.604 -14.537 1.00 0.00 C ATOM 0 HA PRO A 67 -3.046 -21.789 -16.621 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -5.767 -22.096 -16.144 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -4.593 -22.442 -14.889 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -6.247 -19.958 -15.302 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -5.894 -20.810 -13.811 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -4.549 -18.551 -14.516 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -3.779 -19.823 -13.589 1.00 0.00 H new ATOM 1018 N LYS A 68 -4.268 -21.643 -18.753 1.00 0.00 N ATOM 1019 CA LYS A 68 -4.750 -21.420 -20.111 1.00 0.00 C ATOM 1020 C LYS A 68 -5.993 -22.260 -20.391 1.00 0.00 C ATOM 1021 O LYS A 68 -6.311 -23.185 -19.644 1.00 0.00 O ATOM 1022 CB LYS A 68 -3.655 -21.757 -21.125 1.00 0.00 C ATOM 1023 CG LYS A 68 -2.251 -21.459 -20.625 1.00 0.00 C ATOM 1024 CD LYS A 68 -1.623 -22.678 -19.971 1.00 0.00 C ATOM 1025 CE LYS A 68 -0.685 -23.402 -20.925 1.00 0.00 C ATOM 1026 NZ LYS A 68 -1.422 -24.324 -21.833 1.00 0.00 N ATOM 0 H LYS A 68 -3.827 -22.551 -18.606 1.00 0.00 H new ATOM 0 HA LYS A 68 -5.014 -20.367 -20.208 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -3.723 -22.814 -21.383 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -3.833 -21.193 -22.041 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -1.629 -21.130 -21.458 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -2.285 -20.638 -19.909 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -1.073 -22.372 -19.081 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -2.407 -23.360 -19.642 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -0.135 -22.671 -21.518 1.00 0.00 H new ATOM 0 HE3 LYS A 68 0.051 -23.967 -20.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -0.745 -24.824 -22.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -1.954 -25.016 -21.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -2.082 -23.777 -22.422 1.00 0.00 H new ATOM 1040 N CYS A 69 -6.690 -21.932 -21.474 1.00 0.00 N ATOM 1041 CA CYS A 69 -7.897 -22.656 -21.855 1.00 0.00 C ATOM 1042 C CYS A 69 -7.656 -23.494 -23.107 1.00 0.00 C ATOM 1043 O CYS A 69 -6.699 -23.266 -23.846 1.00 0.00 O ATOM 1044 CB CYS A 69 -9.049 -21.679 -22.095 1.00 0.00 C ATOM 1045 SG CYS A 69 -10.675 -22.478 -22.288 1.00 0.00 S ATOM 0 H CYS A 69 -6.440 -21.169 -22.103 1.00 0.00 H new ATOM 0 HA CYS A 69 -8.163 -23.325 -21.037 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -9.097 -20.979 -21.261 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -8.835 -21.095 -22.990 1.00 0.00 H new ATOM 1050 N LYS A 70 -8.533 -24.466 -23.339 1.00 0.00 N ATOM 1051 CA LYS A 70 -8.418 -25.338 -24.502 1.00 0.00 C ATOM 1052 C LYS A 70 -9.575 -25.109 -25.470 1.00 0.00 C ATOM 1053 O LYS A 70 -9.456 -25.366 -26.667 1.00 0.00 O ATOM 1054 CB LYS A 70 -8.388 -26.804 -24.065 1.00 0.00 C ATOM 1055 CG LYS A 70 -7.925 -27.755 -25.155 1.00 0.00 C ATOM 1056 CD LYS A 70 -6.416 -27.936 -25.133 1.00 0.00 C ATOM 1057 CE LYS A 70 -5.932 -28.723 -26.341 1.00 0.00 C ATOM 1058 NZ LYS A 70 -5.965 -30.191 -26.097 1.00 0.00 N ATOM 0 H LYS A 70 -9.331 -24.669 -22.737 1.00 0.00 H new ATOM 0 HA LYS A 70 -7.486 -25.099 -25.014 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -7.728 -26.904 -23.203 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -9.386 -27.097 -23.738 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -8.410 -28.722 -25.025 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -8.232 -27.372 -26.128 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -5.932 -26.960 -25.115 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -6.124 -28.453 -24.219 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -6.555 -28.484 -27.203 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -4.915 -28.419 -26.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -5.628 -30.691 -26.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -5.351 -30.423 -25.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -6.940 -30.486 -25.886 1.00 0.00 H new ATOM 1072 N GLY A 71 -10.695 -24.623 -24.942 1.00 0.00 N ATOM 1073 CA GLY A 71 -11.856 -24.367 -25.774 1.00 0.00 C ATOM 1074 C GLY A 71 -11.696 -23.123 -26.626 1.00 0.00 C ATOM 1075 O GLY A 71 -12.251 -23.036 -27.722 1.00 0.00 O ATOM 0 H GLY A 71 -10.818 -24.402 -23.954 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -12.032 -25.226 -26.421 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -12.736 -24.259 -25.141 1.00 0.00 H new ATOM 1079 N CYS A 72 -10.938 -22.156 -26.121 1.00 0.00 N ATOM 1080 CA CYS A 72 -10.708 -20.909 -26.841 1.00 0.00 C ATOM 1081 C CYS A 72 -9.214 -20.634 -26.988 1.00 0.00 C ATOM 1082 O CYS A 72 -8.801 -19.811 -27.805 1.00 0.00 O ATOM 1083 CB CYS A 72 -11.383 -19.744 -26.114 1.00 0.00 C ATOM 1084 SG CYS A 72 -10.796 -19.491 -24.409 1.00 0.00 S ATOM 0 H CYS A 72 -10.472 -22.212 -25.215 1.00 0.00 H new ATOM 0 HA CYS A 72 -11.141 -21.008 -27.836 1.00 0.00 H new ATOM 0 HB2 CYS A 72 -11.217 -18.829 -26.683 1.00 0.00 H new ATOM 0 HB3 CYS A 72 -12.459 -19.917 -26.094 1.00 0.00 H new ATOM 1089 N PHE A 73 -8.409 -21.328 -26.191 1.00 0.00 N ATOM 1090 CA PHE A 73 -6.961 -21.158 -26.232 1.00 0.00 C ATOM 1091 C PHE A 73 -6.570 -19.730 -25.865 1.00 0.00 C ATOM 1092 O PHE A 73 -5.792 -19.086 -26.570 1.00 0.00 O ATOM 1093 CB PHE A 73 -6.424 -21.506 -27.622 1.00 0.00 C ATOM 1094 CG PHE A 73 -6.781 -22.893 -28.073 1.00 0.00 C ATOM 1095 CD1 PHE A 73 -6.144 -23.998 -27.532 1.00 0.00 C ATOM 1096 CD2 PHE A 73 -7.754 -23.092 -29.040 1.00 0.00 C ATOM 1097 CE1 PHE A 73 -6.471 -25.276 -27.945 1.00 0.00 C ATOM 1098 CE2 PHE A 73 -8.086 -24.367 -29.456 1.00 0.00 C ATOM 1099 CZ PHE A 73 -7.442 -25.460 -28.909 1.00 0.00 C ATOM 0 H PHE A 73 -8.734 -22.013 -25.509 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.520 -21.835 -25.500 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -6.812 -20.787 -28.343 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -5.339 -21.401 -27.620 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -5.383 -23.859 -26.779 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -8.258 -22.241 -29.473 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -5.968 -26.129 -27.514 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -8.848 -24.509 -30.208 1.00 0.00 H new ATOM 0 HZ PHE A 73 -7.698 -26.457 -29.235 1.00 0.00 H new ATOM 1109 N LYS A 74 -7.116 -19.239 -24.758 1.00 0.00 N ATOM 1110 CA LYS A 74 -6.826 -17.887 -24.295 1.00 0.00 C ATOM 1111 C LYS A 74 -6.353 -17.898 -22.845 1.00 0.00 C ATOM 1112 O LYS A 74 -6.737 -18.768 -22.064 1.00 0.00 O ATOM 1113 CB LYS A 74 -8.066 -17.002 -24.432 1.00 0.00 C ATOM 1114 CG LYS A 74 -8.352 -16.572 -25.861 1.00 0.00 C ATOM 1115 CD LYS A 74 -9.831 -16.293 -26.074 1.00 0.00 C ATOM 1116 CE LYS A 74 -10.230 -14.941 -25.504 1.00 0.00 C ATOM 1117 NZ LYS A 74 -11.709 -14.784 -25.434 1.00 0.00 N ATOM 0 H LYS A 74 -7.763 -19.758 -24.164 1.00 0.00 H new ATOM 0 HA LYS A 74 -6.027 -17.481 -24.916 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -8.931 -17.540 -24.043 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -7.938 -16.114 -23.813 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -7.775 -15.678 -26.095 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -8.025 -17.352 -26.549 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -10.058 -16.321 -27.140 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -10.422 -17.077 -25.601 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -9.805 -14.827 -24.507 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -9.809 -14.148 -26.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -11.941 -13.850 -25.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -12.112 -14.867 -26.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -12.108 -15.526 -24.824 1.00 0.00 H new ATOM 1131 N ALA A 75 -5.521 -16.924 -22.491 1.00 0.00 N ATOM 1132 CA ALA A 75 -5.000 -16.820 -21.134 1.00 0.00 C ATOM 1133 C ALA A 75 -6.124 -16.584 -20.131 1.00 0.00 C ATOM 1134 O ALA A 75 -6.803 -15.558 -20.177 1.00 0.00 O ATOM 1135 CB ALA A 75 -3.969 -15.704 -21.048 1.00 0.00 C ATOM 0 H ALA A 75 -5.193 -16.196 -23.126 1.00 0.00 H new ATOM 0 HA ALA A 75 -4.518 -17.765 -20.883 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -3.589 -15.638 -20.029 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -3.145 -15.916 -21.730 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -4.434 -14.757 -21.324 1.00 0.00 H new ATOM 1141 N ILE A 76 -6.314 -17.538 -19.227 1.00 0.00 N ATOM 1142 CA ILE A 76 -7.356 -17.432 -18.213 1.00 0.00 C ATOM 1143 C ILE A 76 -6.943 -16.477 -17.098 1.00 0.00 C ATOM 1144 O ILE A 76 -5.794 -16.479 -16.658 1.00 0.00 O ATOM 1145 CB ILE A 76 -7.686 -18.806 -17.600 1.00 0.00 C ATOM 1146 CG1 ILE A 76 -7.977 -19.825 -18.703 1.00 0.00 C ATOM 1147 CG2 ILE A 76 -8.870 -18.691 -16.651 1.00 0.00 C ATOM 1148 CD1 ILE A 76 -7.962 -21.259 -18.222 1.00 0.00 C ATOM 0 H ILE A 76 -5.760 -18.393 -19.176 1.00 0.00 H new ATOM 0 HA ILE A 76 -8.243 -17.042 -18.712 1.00 0.00 H new ATOM 0 HB ILE A 76 -6.822 -19.151 -17.032 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -8.952 -19.607 -19.139 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -7.239 -19.709 -19.497 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -9.092 -19.670 -16.225 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -8.627 -17.993 -15.849 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -9.740 -18.327 -17.197 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -8.176 -21.925 -19.058 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -6.980 -21.495 -17.812 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -8.719 -21.391 -17.449 1.00 0.00 H new ATOM 1160 N VAL A 77 -7.890 -15.661 -16.645 1.00 0.00 N ATOM 1161 CA VAL A 77 -7.626 -14.702 -15.579 1.00 0.00 C ATOM 1162 C VAL A 77 -7.504 -15.399 -14.229 1.00 0.00 C ATOM 1163 O VAL A 77 -8.207 -16.372 -13.956 1.00 0.00 O ATOM 1164 CB VAL A 77 -8.736 -13.637 -15.496 1.00 0.00 C ATOM 1165 CG1 VAL A 77 -8.399 -12.596 -14.439 1.00 0.00 C ATOM 1166 CG2 VAL A 77 -8.948 -12.982 -16.852 1.00 0.00 C ATOM 0 H VAL A 77 -8.846 -15.645 -17.000 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.681 -14.215 -15.819 1.00 0.00 H new ATOM 0 HB VAL A 77 -9.665 -14.127 -15.206 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -9.194 -11.852 -14.395 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -8.302 -13.082 -13.468 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -7.459 -12.108 -14.696 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -9.736 -12.232 -16.775 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -8.023 -12.504 -17.174 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -9.238 -13.739 -17.580 1.00 0.00 H new ATOM 1176 N ALA A 78 -6.607 -14.896 -13.388 1.00 0.00 N ATOM 1177 CA ALA A 78 -6.394 -15.469 -12.065 1.00 0.00 C ATOM 1178 C ALA A 78 -7.719 -15.684 -11.340 1.00 0.00 C ATOM 1179 O ALA A 78 -7.998 -16.776 -10.848 1.00 0.00 O ATOM 1180 CB ALA A 78 -5.480 -14.573 -11.242 1.00 0.00 C ATOM 0 H ALA A 78 -6.016 -14.092 -13.600 1.00 0.00 H new ATOM 0 HA ALA A 78 -5.916 -16.440 -12.190 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -5.330 -15.014 -10.256 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -4.518 -14.474 -11.745 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -5.936 -13.589 -11.134 1.00 0.00 H new ATOM 1186 N GLY A 79 -8.532 -14.634 -11.278 1.00 0.00 N ATOM 1187 CA GLY A 79 -9.817 -14.728 -10.611 1.00 0.00 C ATOM 1188 C GLY A 79 -10.932 -15.131 -11.555 1.00 0.00 C ATOM 1189 O GLY A 79 -11.935 -14.428 -11.678 1.00 0.00 O ATOM 0 H GLY A 79 -8.323 -13.719 -11.678 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -9.750 -15.455 -9.801 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -10.059 -13.767 -10.158 1.00 0.00 H new ATOM 1193 N ASP A 80 -10.757 -16.265 -12.225 1.00 0.00 N ATOM 1194 CA ASP A 80 -11.757 -16.761 -13.164 1.00 0.00 C ATOM 1195 C ASP A 80 -12.119 -18.211 -12.858 1.00 0.00 C ATOM 1196 O ASP A 80 -11.252 -19.020 -12.530 1.00 0.00 O ATOM 1197 CB ASP A 80 -11.242 -16.643 -14.599 1.00 0.00 C ATOM 1198 CG ASP A 80 -12.358 -16.398 -15.596 1.00 0.00 C ATOM 1199 OD1 ASP A 80 -13.188 -15.498 -15.349 1.00 0.00 O ATOM 1200 OD2 ASP A 80 -12.401 -17.106 -16.624 1.00 0.00 O ATOM 0 H ASP A 80 -9.932 -16.858 -12.135 1.00 0.00 H new ATOM 0 HA ASP A 80 -12.654 -16.151 -13.056 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -10.521 -15.828 -14.657 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -10.712 -17.557 -14.868 1.00 0.00 H new ATOM 1205 N GLN A 81 -13.404 -18.530 -12.967 1.00 0.00 N ATOM 1206 CA GLN A 81 -13.880 -19.882 -12.699 1.00 0.00 C ATOM 1207 C GLN A 81 -13.487 -20.831 -13.828 1.00 0.00 C ATOM 1208 O GLN A 81 -14.201 -20.956 -14.822 1.00 0.00 O ATOM 1209 CB GLN A 81 -15.399 -19.885 -12.520 1.00 0.00 C ATOM 1210 CG GLN A 81 -15.868 -19.122 -11.292 1.00 0.00 C ATOM 1211 CD GLN A 81 -17.258 -18.540 -11.462 1.00 0.00 C ATOM 1212 OE1 GLN A 81 -18.255 -19.261 -11.417 1.00 0.00 O ATOM 1213 NE2 GLN A 81 -17.330 -17.229 -11.659 1.00 0.00 N ATOM 0 H GLN A 81 -14.134 -17.871 -13.239 1.00 0.00 H new ATOM 0 HA GLN A 81 -13.412 -20.229 -11.777 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -15.862 -19.451 -13.406 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -15.746 -20.916 -12.452 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -15.860 -19.789 -10.430 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -15.165 -18.317 -11.079 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -16.477 -16.670 -11.689 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -18.238 -16.781 -11.780 1.00 0.00 H new ATOM 1222 N ASN A 82 -12.348 -21.495 -13.666 1.00 0.00 N ATOM 1223 CA ASN A 82 -11.860 -22.432 -14.672 1.00 0.00 C ATOM 1224 C ASN A 82 -12.205 -23.868 -14.291 1.00 0.00 C ATOM 1225 O ASN A 82 -12.360 -24.189 -13.112 1.00 0.00 O ATOM 1226 CB ASN A 82 -10.346 -22.287 -14.842 1.00 0.00 C ATOM 1227 CG ASN A 82 -9.863 -20.881 -14.544 1.00 0.00 C ATOM 1228 OD1 ASN A 82 -10.601 -19.910 -14.712 1.00 0.00 O ATOM 1229 ND2 ASN A 82 -8.617 -20.765 -14.098 1.00 0.00 N ATOM 0 H ASN A 82 -11.745 -21.402 -12.848 1.00 0.00 H new ATOM 0 HA ASN A 82 -12.349 -22.199 -15.618 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -9.840 -22.990 -14.180 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -10.070 -22.554 -15.862 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -8.237 -19.844 -13.880 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -8.040 -21.597 -13.973 1.00 0.00 H new ATOM 1236 N VAL A 83 -12.322 -24.730 -15.296 1.00 0.00 N ATOM 1237 CA VAL A 83 -12.647 -26.132 -15.067 1.00 0.00 C ATOM 1238 C VAL A 83 -11.504 -27.040 -15.509 1.00 0.00 C ATOM 1239 O VAL A 83 -11.236 -27.180 -16.702 1.00 0.00 O ATOM 1240 CB VAL A 83 -13.931 -26.541 -15.814 1.00 0.00 C ATOM 1241 CG1 VAL A 83 -14.396 -27.917 -15.362 1.00 0.00 C ATOM 1242 CG2 VAL A 83 -15.023 -25.503 -15.602 1.00 0.00 C ATOM 0 H VAL A 83 -12.196 -24.481 -16.277 1.00 0.00 H new ATOM 0 HA VAL A 83 -12.807 -26.249 -13.995 1.00 0.00 H new ATOM 0 HB VAL A 83 -13.711 -26.591 -16.880 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -15.304 -28.189 -15.900 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -13.617 -28.651 -15.570 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -14.601 -27.898 -14.292 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -15.923 -25.807 -16.136 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -15.244 -25.419 -14.538 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -14.686 -24.538 -15.980 1.00 0.00 H new ATOM 1252 N GLU A 84 -10.835 -27.655 -14.539 1.00 0.00 N ATOM 1253 CA GLU A 84 -9.721 -28.550 -14.829 1.00 0.00 C ATOM 1254 C GLU A 84 -10.221 -29.958 -15.141 1.00 0.00 C ATOM 1255 O GLU A 84 -11.027 -30.521 -14.401 1.00 0.00 O ATOM 1256 CB GLU A 84 -8.751 -28.592 -13.647 1.00 0.00 C ATOM 1257 CG GLU A 84 -7.587 -27.625 -13.780 1.00 0.00 C ATOM 1258 CD GLU A 84 -6.835 -27.434 -12.477 1.00 0.00 C ATOM 1259 OE1 GLU A 84 -6.581 -28.441 -11.785 1.00 0.00 O ATOM 1260 OE2 GLU A 84 -6.500 -26.275 -12.151 1.00 0.00 O ATOM 0 H GLU A 84 -11.045 -27.550 -13.546 1.00 0.00 H new ATOM 0 HA GLU A 84 -9.199 -28.166 -15.705 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -9.297 -28.366 -12.731 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -8.361 -29.605 -13.544 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -6.899 -27.993 -14.541 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -7.959 -26.660 -14.125 1.00 0.00 H new ATOM 1267 N TYR A 85 -9.736 -30.520 -16.243 1.00 0.00 N ATOM 1268 CA TYR A 85 -10.135 -31.860 -16.656 1.00 0.00 C ATOM 1269 C TYR A 85 -9.021 -32.541 -17.447 1.00 0.00 C ATOM 1270 O TYR A 85 -8.779 -32.213 -18.608 1.00 0.00 O ATOM 1271 CB TYR A 85 -11.410 -31.799 -17.499 1.00 0.00 C ATOM 1272 CG TYR A 85 -11.923 -33.157 -17.920 1.00 0.00 C ATOM 1273 CD1 TYR A 85 -11.328 -33.855 -18.963 1.00 0.00 C ATOM 1274 CD2 TYR A 85 -13.005 -33.743 -17.273 1.00 0.00 C ATOM 1275 CE1 TYR A 85 -11.794 -35.096 -19.351 1.00 0.00 C ATOM 1276 CE2 TYR A 85 -13.477 -34.984 -17.653 1.00 0.00 C ATOM 1277 CZ TYR A 85 -12.869 -35.656 -18.693 1.00 0.00 C ATOM 1278 OH TYR A 85 -13.336 -36.893 -19.076 1.00 0.00 O ATOM 0 H TYR A 85 -9.066 -30.068 -16.866 1.00 0.00 H new ATOM 0 HA TYR A 85 -10.329 -32.446 -15.758 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.187 -31.287 -16.931 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -11.218 -31.200 -18.389 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -10.486 -33.420 -19.480 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -13.485 -33.219 -16.459 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -11.320 -35.625 -20.165 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -14.318 -35.426 -17.139 1.00 0.00 H new ATOM 0 HH TYR A 85 -14.096 -37.145 -18.511 1.00 0.00 H new ATOM 1288 N LYS A 86 -8.347 -33.491 -16.808 1.00 0.00 N ATOM 1289 CA LYS A 86 -7.260 -34.221 -17.449 1.00 0.00 C ATOM 1290 C LYS A 86 -6.045 -33.321 -17.652 1.00 0.00 C ATOM 1291 O LYS A 86 -5.228 -33.555 -18.541 1.00 0.00 O ATOM 1292 CB LYS A 86 -7.721 -34.784 -18.796 1.00 0.00 C ATOM 1293 CG LYS A 86 -7.010 -36.066 -19.194 1.00 0.00 C ATOM 1294 CD LYS A 86 -7.441 -37.236 -18.325 1.00 0.00 C ATOM 1295 CE LYS A 86 -8.680 -37.919 -18.883 1.00 0.00 C ATOM 1296 NZ LYS A 86 -8.330 -39.004 -19.841 1.00 0.00 N ATOM 0 H LYS A 86 -8.535 -33.774 -15.846 1.00 0.00 H new ATOM 0 HA LYS A 86 -6.975 -35.045 -16.795 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -8.794 -34.971 -18.754 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -7.558 -34.033 -19.569 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -7.221 -36.291 -20.239 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -5.932 -35.927 -19.110 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -6.627 -37.958 -18.255 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -7.643 -36.884 -17.313 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -9.267 -38.333 -18.063 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -9.308 -37.181 -19.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -9.201 -39.445 -20.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -7.792 -38.605 -20.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -7.752 -39.721 -19.357 1.00 0.00 H new ATOM 1310 N GLY A 87 -5.932 -32.291 -16.819 1.00 0.00 N ATOM 1311 CA GLY A 87 -4.813 -31.372 -16.923 1.00 0.00 C ATOM 1312 C GLY A 87 -5.174 -30.100 -17.664 1.00 0.00 C ATOM 1313 O GLY A 87 -4.699 -29.017 -17.322 1.00 0.00 O ATOM 0 H GLY A 87 -6.595 -32.076 -16.074 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -4.461 -31.119 -15.923 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -3.988 -31.866 -17.436 1.00 0.00 H new ATOM 1317 N THR A 88 -6.016 -30.230 -18.685 1.00 0.00 N ATOM 1318 CA THR A 88 -6.438 -29.083 -19.478 1.00 0.00 C ATOM 1319 C THR A 88 -7.594 -28.348 -18.811 1.00 0.00 C ATOM 1320 O THR A 88 -8.618 -28.948 -18.484 1.00 0.00 O ATOM 1321 CB THR A 88 -6.864 -29.507 -20.896 1.00 0.00 C ATOM 1322 OG1 THR A 88 -7.786 -30.601 -20.824 1.00 0.00 O ATOM 1323 CG2 THR A 88 -5.655 -29.910 -21.727 1.00 0.00 C ATOM 0 H THR A 88 -6.419 -31.119 -18.982 1.00 0.00 H new ATOM 0 HA THR A 88 -5.580 -28.415 -19.549 1.00 0.00 H new ATOM 0 HB THR A 88 -7.347 -28.656 -21.376 1.00 0.00 H new ATOM 0 HG1 THR A 88 -8.053 -30.864 -21.730 1.00 0.00 H new ATOM 0 HG21 THR A 88 -5.981 -30.205 -22.724 1.00 0.00 H new ATOM 0 HG22 THR A 88 -4.969 -29.066 -21.805 1.00 0.00 H new ATOM 0 HG23 THR A 88 -5.147 -30.747 -21.248 1.00 0.00 H new ATOM 1331 N VAL A 89 -7.425 -27.045 -18.611 1.00 0.00 N ATOM 1332 CA VAL A 89 -8.456 -26.227 -17.984 1.00 0.00 C ATOM 1333 C VAL A 89 -9.353 -25.575 -19.030 1.00 0.00 C ATOM 1334 O VAL A 89 -8.883 -25.144 -20.083 1.00 0.00 O ATOM 1335 CB VAL A 89 -7.839 -25.129 -17.097 1.00 0.00 C ATOM 1336 CG1 VAL A 89 -8.871 -24.590 -16.118 1.00 0.00 C ATOM 1337 CG2 VAL A 89 -6.620 -25.663 -16.359 1.00 0.00 C ATOM 0 H VAL A 89 -6.583 -26.533 -18.874 1.00 0.00 H new ATOM 0 HA VAL A 89 -9.054 -26.894 -17.362 1.00 0.00 H new ATOM 0 HB VAL A 89 -7.517 -24.308 -17.737 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -8.417 -23.816 -15.500 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -9.711 -24.168 -16.670 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -9.226 -25.400 -15.481 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -6.197 -24.874 -15.737 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -6.915 -26.503 -15.729 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.874 -25.995 -17.081 1.00 0.00 H new ATOM 1347 N TRP A 90 -10.645 -25.508 -18.733 1.00 0.00 N ATOM 1348 CA TRP A 90 -11.609 -24.908 -19.649 1.00 0.00 C ATOM 1349 C TRP A 90 -12.512 -23.920 -18.918 1.00 0.00 C ATOM 1350 O TRP A 90 -13.017 -24.211 -17.833 1.00 0.00 O ATOM 1351 CB TRP A 90 -12.455 -25.994 -20.315 1.00 0.00 C ATOM 1352 CG TRP A 90 -11.650 -27.166 -20.790 1.00 0.00 C ATOM 1353 CD1 TRP A 90 -10.959 -28.053 -20.016 1.00 0.00 C ATOM 1354 CD2 TRP A 90 -11.451 -27.575 -22.148 1.00 0.00 C ATOM 1355 NE1 TRP A 90 -10.342 -28.990 -20.811 1.00 0.00 N ATOM 1356 CE2 TRP A 90 -10.630 -28.719 -22.122 1.00 0.00 C ATOM 1357 CE3 TRP A 90 -11.889 -27.088 -23.382 1.00 0.00 C ATOM 1358 CZ2 TRP A 90 -10.238 -29.380 -23.284 1.00 0.00 C ATOM 1359 CZ3 TRP A 90 -11.499 -27.744 -24.534 1.00 0.00 C ATOM 1360 CH2 TRP A 90 -10.681 -28.881 -24.478 1.00 0.00 C ATOM 0 H TRP A 90 -11.050 -25.861 -17.866 1.00 0.00 H new ATOM 0 HA TRP A 90 -11.055 -24.367 -20.416 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -13.208 -26.342 -19.608 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -12.988 -25.561 -21.162 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -10.905 -28.023 -18.938 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -9.764 -29.762 -20.478 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -12.521 -26.214 -23.435 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -9.607 -30.255 -23.243 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -11.830 -27.375 -25.493 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -10.395 -29.373 -25.396 1.00 0.00 H new ATOM 1371 N HIS A 91 -12.712 -22.751 -19.519 1.00 0.00 N ATOM 1372 CA HIS A 91 -13.556 -21.720 -18.925 1.00 0.00 C ATOM 1373 C HIS A 91 -14.936 -22.276 -18.587 1.00 0.00 C ATOM 1374 O HIS A 91 -15.582 -22.912 -19.420 1.00 0.00 O ATOM 1375 CB HIS A 91 -13.691 -20.531 -19.876 1.00 0.00 C ATOM 1376 CG HIS A 91 -12.473 -19.661 -19.923 1.00 0.00 C ATOM 1377 ND1 HIS A 91 -11.732 -19.465 -21.070 1.00 0.00 N ATOM 1378 CD2 HIS A 91 -11.868 -18.931 -18.957 1.00 0.00 C ATOM 1379 CE1 HIS A 91 -10.723 -18.654 -20.806 1.00 0.00 C ATOM 1380 NE2 HIS A 91 -10.783 -18.315 -19.531 1.00 0.00 N ATOM 0 H HIS A 91 -12.301 -22.494 -20.417 1.00 0.00 H new ATOM 0 HA HIS A 91 -13.083 -21.385 -18.002 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -13.902 -20.901 -20.879 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -14.547 -19.928 -19.572 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -12.180 -18.848 -17.926 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -9.976 -18.324 -21.513 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -10.130 -17.696 -19.051 1.00 0.00 H new ATOM 1388 N LYS A 92 -15.382 -22.033 -17.359 1.00 0.00 N ATOM 1389 CA LYS A 92 -16.686 -22.508 -16.911 1.00 0.00 C ATOM 1390 C LYS A 92 -17.695 -22.489 -18.054 1.00 0.00 C ATOM 1391 O LYS A 92 -18.599 -23.322 -18.110 1.00 0.00 O ATOM 1392 CB LYS A 92 -17.194 -21.646 -15.753 1.00 0.00 C ATOM 1393 CG LYS A 92 -18.055 -22.408 -14.760 1.00 0.00 C ATOM 1394 CD LYS A 92 -18.987 -23.381 -15.462 1.00 0.00 C ATOM 1395 CE LYS A 92 -19.868 -24.124 -14.469 1.00 0.00 C ATOM 1396 NZ LYS A 92 -20.311 -25.443 -15.000 1.00 0.00 N ATOM 0 H LYS A 92 -14.860 -21.510 -16.656 1.00 0.00 H new ATOM 0 HA LYS A 92 -16.572 -23.537 -16.569 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -16.340 -21.218 -15.228 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -17.770 -20.813 -16.156 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -17.415 -22.952 -14.065 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -18.641 -21.704 -14.169 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -19.613 -22.839 -16.171 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -18.401 -24.098 -16.037 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -19.321 -24.272 -13.538 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -20.741 -23.516 -14.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -20.909 -25.918 -14.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -20.855 -25.300 -15.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -19.479 -26.033 -15.202 1.00 0.00 H new ATOM 1410 N ASP A 93 -17.534 -21.534 -18.964 1.00 0.00 N ATOM 1411 CA ASP A 93 -18.429 -21.409 -20.107 1.00 0.00 C ATOM 1412 C ASP A 93 -18.017 -22.358 -21.227 1.00 0.00 C ATOM 1413 O ASP A 93 -18.825 -23.152 -21.712 1.00 0.00 O ATOM 1414 CB ASP A 93 -18.437 -19.968 -20.621 1.00 0.00 C ATOM 1415 CG ASP A 93 -19.510 -19.731 -21.665 1.00 0.00 C ATOM 1416 OD1 ASP A 93 -20.654 -20.187 -21.455 1.00 0.00 O ATOM 1417 OD2 ASP A 93 -19.207 -19.088 -22.691 1.00 0.00 O ATOM 0 H ASP A 93 -16.792 -20.835 -18.931 1.00 0.00 H new ATOM 0 HA ASP A 93 -19.434 -21.676 -19.780 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -18.593 -19.288 -19.784 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -17.462 -19.732 -21.047 1.00 0.00 H new ATOM 1422 N CYS A 94 -16.755 -22.272 -21.635 1.00 0.00 N ATOM 1423 CA CYS A 94 -16.235 -23.122 -22.699 1.00 0.00 C ATOM 1424 C CYS A 94 -16.527 -24.592 -22.413 1.00 0.00 C ATOM 1425 O CYS A 94 -16.926 -25.342 -23.304 1.00 0.00 O ATOM 1426 CB CYS A 94 -14.728 -22.911 -22.858 1.00 0.00 C ATOM 1427 SG CYS A 94 -14.273 -21.293 -23.560 1.00 0.00 S ATOM 0 H CYS A 94 -16.073 -21.622 -21.244 1.00 0.00 H new ATOM 0 HA CYS A 94 -16.734 -22.845 -23.628 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -14.252 -23.019 -21.883 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -14.327 -23.698 -23.497 1.00 0.00 H new ATOM 1432 N PHE A 95 -16.326 -24.997 -21.163 1.00 0.00 N ATOM 1433 CA PHE A 95 -16.567 -26.377 -20.759 1.00 0.00 C ATOM 1434 C PHE A 95 -17.988 -26.807 -21.111 1.00 0.00 C ATOM 1435 O PHE A 95 -18.906 -25.988 -21.144 1.00 0.00 O ATOM 1436 CB PHE A 95 -16.331 -26.539 -19.256 1.00 0.00 C ATOM 1437 CG PHE A 95 -16.220 -27.971 -18.817 1.00 0.00 C ATOM 1438 CD1 PHE A 95 -15.057 -28.690 -19.040 1.00 0.00 C ATOM 1439 CD2 PHE A 95 -17.279 -28.598 -18.181 1.00 0.00 C ATOM 1440 CE1 PHE A 95 -14.953 -30.008 -18.638 1.00 0.00 C ATOM 1441 CE2 PHE A 95 -17.181 -29.916 -17.776 1.00 0.00 C ATOM 1442 CZ PHE A 95 -16.015 -30.622 -18.004 1.00 0.00 C ATOM 0 H PHE A 95 -15.997 -24.389 -20.413 1.00 0.00 H new ATOM 0 HA PHE A 95 -15.869 -27.015 -21.301 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -15.418 -26.011 -18.981 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -17.149 -26.064 -18.715 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -14.222 -28.215 -19.534 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -18.192 -28.051 -17.999 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -14.041 -30.558 -18.820 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -18.014 -30.393 -17.282 1.00 0.00 H new ATOM 0 HZ PHE A 95 -15.935 -31.651 -17.687 1.00 0.00 H new ATOM 1452 N SER A 96 -18.160 -28.098 -21.375 1.00 0.00 N ATOM 1453 CA SER A 96 -19.468 -28.638 -21.730 1.00 0.00 C ATOM 1454 C SER A 96 -20.148 -29.257 -20.513 1.00 0.00 C ATOM 1455 O SER A 96 -20.530 -30.427 -20.530 1.00 0.00 O ATOM 1456 CB SER A 96 -19.328 -29.684 -22.838 1.00 0.00 C ATOM 1457 OG SER A 96 -18.679 -29.139 -23.974 1.00 0.00 O ATOM 0 H SER A 96 -17.411 -28.790 -21.350 1.00 0.00 H new ATOM 0 HA SER A 96 -20.087 -27.817 -22.092 1.00 0.00 H new ATOM 0 HB2 SER A 96 -18.762 -30.538 -22.467 1.00 0.00 H new ATOM 0 HB3 SER A 96 -20.314 -30.053 -23.121 1.00 0.00 H new ATOM 0 HG SER A 96 -18.600 -29.827 -24.667 1.00 0.00 H new ATOM 1463 N GLY A 97 -20.296 -28.463 -19.457 1.00 0.00 N ATOM 1464 CA GLY A 97 -20.929 -28.950 -18.246 1.00 0.00 C ATOM 1465 C GLY A 97 -22.393 -28.563 -18.161 1.00 0.00 C ATOM 1466 O GLY A 97 -22.738 -27.395 -17.983 1.00 0.00 O ATOM 0 H GLY A 97 -19.989 -27.491 -19.419 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -20.840 -30.036 -18.205 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -20.401 -28.554 -17.379 1.00 0.00 H new ATOM 1470 N PRO A 98 -23.281 -29.559 -18.293 1.00 0.00 N ATOM 1471 CA PRO A 98 -24.729 -29.341 -18.235 1.00 0.00 C ATOM 1472 C PRO A 98 -25.204 -28.972 -16.834 1.00 0.00 C ATOM 1473 O PRO A 98 -25.920 -27.987 -16.650 1.00 0.00 O ATOM 1474 CB PRO A 98 -25.309 -30.694 -18.656 1.00 0.00 C ATOM 1475 CG PRO A 98 -24.251 -31.684 -18.309 1.00 0.00 C ATOM 1476 CD PRO A 98 -22.940 -30.976 -18.508 1.00 0.00 C ATOM 0 HA PRO A 98 -25.041 -28.511 -18.869 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -26.239 -30.907 -18.129 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -25.535 -30.713 -19.722 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -24.358 -32.025 -17.279 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -24.318 -32.566 -18.945 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -22.186 -31.320 -17.800 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -22.539 -31.146 -19.507 1.00 0.00 H new ATOM 1484 N SER A 99 -24.801 -29.767 -15.848 1.00 0.00 N ATOM 1485 CA SER A 99 -25.188 -29.525 -14.463 1.00 0.00 C ATOM 1486 C SER A 99 -26.627 -29.024 -14.381 1.00 0.00 C ATOM 1487 O SER A 99 -26.945 -28.143 -13.583 1.00 0.00 O ATOM 1488 CB SER A 99 -24.245 -28.508 -13.818 1.00 0.00 C ATOM 1489 OG SER A 99 -24.391 -27.229 -14.411 1.00 0.00 O ATOM 0 H SER A 99 -24.206 -30.585 -15.983 1.00 0.00 H new ATOM 0 HA SER A 99 -25.118 -30.469 -13.922 1.00 0.00 H new ATOM 0 HB2 SER A 99 -24.451 -28.443 -12.750 1.00 0.00 H new ATOM 0 HB3 SER A 99 -23.214 -28.846 -13.923 1.00 0.00 H new ATOM 0 HG SER A 99 -24.969 -27.298 -15.199 1.00 0.00 H new ATOM 1495 N SER A 100 -27.493 -29.593 -15.214 1.00 0.00 N ATOM 1496 CA SER A 100 -28.898 -29.203 -15.240 1.00 0.00 C ATOM 1497 C SER A 100 -29.502 -29.255 -13.840 1.00 0.00 C ATOM 1498 O SER A 100 -29.522 -30.305 -13.199 1.00 0.00 O ATOM 1499 CB SER A 100 -29.686 -30.116 -16.182 1.00 0.00 C ATOM 1500 OG SER A 100 -29.570 -29.683 -17.526 1.00 0.00 O ATOM 0 H SER A 100 -27.246 -30.325 -15.880 1.00 0.00 H new ATOM 0 HA SER A 100 -28.958 -28.178 -15.605 1.00 0.00 H new ATOM 0 HB2 SER A 100 -29.320 -31.139 -16.093 1.00 0.00 H new ATOM 0 HB3 SER A 100 -30.736 -30.127 -15.889 1.00 0.00 H new ATOM 0 HG SER A 100 -30.081 -30.283 -18.108 1.00 0.00 H new ATOM 1506 N GLY A 101 -29.994 -28.112 -13.371 1.00 0.00 N ATOM 1507 CA GLY A 101 -30.592 -28.048 -12.050 1.00 0.00 C ATOM 1508 C GLY A 101 -31.940 -27.354 -12.057 1.00 0.00 C ATOM 1509 O GLY A 101 -32.964 -28.033 -12.005 1.00 0.00 O ATOM 0 H GLY A 101 -29.989 -27.229 -13.882 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -30.709 -29.058 -11.658 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -29.918 -27.520 -11.375 1.00 0.00 H new TER 1513 GLY A 101 HETATM 1514 ZN ZN A 201 -4.274 11.318 -5.951 1.00 0.00 ZN HETATM 1515 ZN ZN A 401 2.962 -5.010 -8.112 1.00 0.00 ZN HETATM 1516 ZN ZN A 601 -12.094 -20.767 -22.961 1.00 0.00 ZN