USER MOD reduce.3.24.130724 H: found=0, std=0, add=744, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 739 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 Single : A 1 GLY N :NH3+ -118:sc= 0.0875 (180deg=0) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 143:sc= 1.83 (180deg=1.42) USER MOD Single : A 7 SER OG : rot 180:sc= 0.372 USER MOD Single : A 8 LYS NZ :NH3+ 159:sc= 1.28 (180deg=1.08) USER MOD Single : A 15 LYS NZ :NH3+ -156:sc= -2.7! (180deg=-3.9!) USER MOD Single : A 17 SER OG : rot -139:sc= 1.29 USER MOD Single : A 20 GLN : amide:sc= 0.185 K(o=0.18,f=-6.2!) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 HIS : no HE2:sc= -3.56! X(o=-3.6!,f=-3.8) USER MOD Single : A 28 LYS NZ :NH3+ 141:sc= 1.24 (180deg=-0.871!) USER MOD Single : A 33 ASN : amide:sc= 0.76 K(o=0.76,f=-8.8!) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0.956 (180deg=0.956) USER MOD Single : A 43 TYR OH : rot 30:sc= -0.0753 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 1.15 (180deg=1.15) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 86:sc= 1.16 USER MOD Single : A 54 HIS : no HD1:sc= 0.633 K(o=0.63,f=-5!) USER MOD Single : A 56 LYS NZ :NH3+ -146:sc= 2.29 (180deg=2.09) USER MOD Single : A 57 SER OG : rot 76:sc= 1.23 USER MOD Single : A 61 LYS NZ :NH3+ -131:sc= 0.763 (180deg=-1.23!) USER MOD Single : A 63 ASN : amide:sc= -0.0149 X(o=-0.015,f=0) USER MOD Single : A 65 ASN :FLIP amide:sc=-1.09e-05 F(o=-0.94,f=-1.1e-05) USER MOD Single : A 69 GLN : amide:sc= -0.433 X(o=-0.43,f=-0.43) USER MOD Single : A 70 GLN :FLIP amide:sc=-0.00895 F(o=-1,f=-0.009) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 87:sc= 1.24 USER MOD Single : A 73 THR OG1 : rot 62:sc= 1.18 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= -0.0321 USER MOD Single : A 79 GLN : amide:sc= -0.801 K(o=-0.8,f=-2.5) USER MOD Single : A 83 SER OG : rot -91:sc= 1.28 USER MOD Single : A 91 SER OG : rot 180:sc= 0.00574 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=-0.039) USER MOD Single : A 93 ASN : amide:sc= 0.602 K(o=0.6,f=-10!) USER MOD Single : A 96 THR OG1 : rot 170:sc= -0.0292 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.0382 USER MOD Single : A 100 ASN : amide:sc= 0.118 K(o=0.12,f=-4!) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.299 1.905 -13.049 1.00 0.00 N ATOM 2 CA GLY A 1 3.031 1.561 -11.810 1.00 0.00 C ATOM 3 C GLY A 1 2.450 0.342 -11.131 1.00 0.00 C ATOM 4 O GLY A 1 1.383 -0.143 -11.519 1.00 0.00 O ATOM 0 H1 GLY A 1 2.942 1.835 -13.863 1.00 0.00 H new ATOM 0 H2 GLY A 1 1.505 1.246 -13.177 1.00 0.00 H new ATOM 0 H3 GLY A 1 1.934 2.876 -12.978 1.00 0.00 H new ATOM 0 HA2 GLY A 1 4.079 1.379 -12.047 1.00 0.00 H new ATOM 0 HA3 GLY A 1 3.001 2.407 -11.124 1.00 0.00 H new ATOM 7 N ALA A 2 3.150 -0.150 -10.120 1.00 0.00 N ATOM 8 CA ALA A 2 2.731 -1.336 -9.388 1.00 0.00 C ATOM 9 C ALA A 2 3.466 -1.407 -8.055 1.00 0.00 C ATOM 10 O ALA A 2 4.119 -0.441 -7.652 1.00 0.00 O ATOM 11 CB ALA A 2 3.002 -2.587 -10.215 1.00 0.00 C ATOM 0 H ALA A 2 4.022 0.260 -9.785 1.00 0.00 H new ATOM 0 HA ALA A 2 1.660 -1.277 -9.195 1.00 0.00 H new ATOM 0 HB1 ALA A 2 2.684 -3.468 -9.657 1.00 0.00 H new ATOM 0 HB2 ALA A 2 2.447 -2.531 -11.152 1.00 0.00 H new ATOM 0 HB3 ALA A 2 4.068 -2.658 -10.429 1.00 0.00 H new ATOM 17 N MET A 3 3.352 -2.538 -7.368 1.00 0.00 N ATOM 18 CA MET A 3 4.090 -2.752 -6.127 1.00 0.00 C ATOM 19 C MET A 3 5.558 -3.042 -6.423 1.00 0.00 C ATOM 20 O MET A 3 6.411 -2.961 -5.540 1.00 0.00 O ATOM 21 CB MET A 3 3.487 -3.906 -5.323 1.00 0.00 C ATOM 22 CG MET A 3 2.101 -3.615 -4.771 1.00 0.00 C ATOM 23 SD MET A 3 2.087 -2.232 -3.613 1.00 0.00 S ATOM 24 CE MET A 3 0.376 -2.248 -3.082 1.00 0.00 C ATOM 0 H MET A 3 2.758 -3.319 -7.647 1.00 0.00 H new ATOM 0 HA MET A 3 4.018 -1.840 -5.534 1.00 0.00 H new ATOM 0 HB2 MET A 3 3.436 -4.790 -5.958 1.00 0.00 H new ATOM 0 HB3 MET A 3 4.154 -4.146 -4.495 1.00 0.00 H new ATOM 0 HG2 MET A 3 1.424 -3.398 -5.597 1.00 0.00 H new ATOM 0 HG3 MET A 3 1.719 -4.505 -4.271 1.00 0.00 H new ATOM 0 HE1 MET A 3 0.211 -1.447 -2.361 1.00 0.00 H new ATOM 0 HE2 MET A 3 -0.274 -2.100 -3.944 1.00 0.00 H new ATOM 0 HE3 MET A 3 0.148 -3.207 -2.617 1.00 0.00 H new ATOM 34 N GLY A 4 5.841 -3.374 -7.674 1.00 0.00 N ATOM 35 CA GLY A 4 7.194 -3.688 -8.079 1.00 0.00 C ATOM 36 C GLY A 4 7.249 -4.988 -8.847 1.00 0.00 C ATOM 37 O GLY A 4 6.512 -5.160 -9.821 1.00 0.00 O ATOM 0 H GLY A 4 5.150 -3.432 -8.422 1.00 0.00 H new ATOM 0 HA2 GLY A 4 7.587 -2.881 -8.697 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.833 -3.756 -7.199 1.00 0.00 H new ATOM 41 N PRO A 5 8.114 -5.927 -8.442 1.00 0.00 N ATOM 42 CA PRO A 5 8.171 -7.256 -9.040 1.00 0.00 C ATOM 43 C PRO A 5 7.001 -8.111 -8.580 1.00 0.00 C ATOM 44 O PRO A 5 6.392 -7.841 -7.541 1.00 0.00 O ATOM 45 CB PRO A 5 9.495 -7.843 -8.531 1.00 0.00 C ATOM 46 CG PRO A 5 10.187 -6.726 -7.819 1.00 0.00 C ATOM 47 CD PRO A 5 9.110 -5.777 -7.381 1.00 0.00 C ATOM 0 HA PRO A 5 8.115 -7.221 -10.128 1.00 0.00 H new ATOM 0 HB2 PRO A 5 9.318 -8.684 -7.861 1.00 0.00 H new ATOM 0 HB3 PRO A 5 10.101 -8.216 -9.357 1.00 0.00 H new ATOM 0 HG2 PRO A 5 10.749 -7.099 -6.963 1.00 0.00 H new ATOM 0 HG3 PRO A 5 10.900 -6.229 -8.476 1.00 0.00 H new ATOM 0 HD2 PRO A 5 8.707 -6.042 -6.404 1.00 0.00 H new ATOM 0 HD3 PRO A 5 9.475 -4.753 -7.308 1.00 0.00 H new ATOM 55 N LYS A 6 6.684 -9.139 -9.345 1.00 0.00 N ATOM 56 CA LYS A 6 5.568 -9.999 -9.017 1.00 0.00 C ATOM 57 C LYS A 6 5.890 -10.905 -7.838 1.00 0.00 C ATOM 58 O LYS A 6 6.974 -11.478 -7.749 1.00 0.00 O ATOM 59 CB LYS A 6 5.123 -10.800 -10.225 1.00 0.00 C ATOM 60 CG LYS A 6 6.199 -11.622 -10.893 1.00 0.00 C ATOM 61 CD LYS A 6 5.601 -12.334 -12.082 1.00 0.00 C ATOM 62 CE LYS A 6 4.699 -13.477 -11.651 1.00 0.00 C ATOM 63 NZ LYS A 6 3.759 -13.893 -12.723 1.00 0.00 N ATOM 0 H LYS A 6 7.184 -9.397 -10.196 1.00 0.00 H new ATOM 0 HA LYS A 6 4.737 -9.361 -8.717 1.00 0.00 H new ATOM 0 HB2 LYS A 6 4.317 -11.468 -9.920 1.00 0.00 H new ATOM 0 HB3 LYS A 6 4.706 -10.113 -10.961 1.00 0.00 H new ATOM 0 HG2 LYS A 6 7.021 -10.980 -11.212 1.00 0.00 H new ATOM 0 HG3 LYS A 6 6.613 -12.345 -10.190 1.00 0.00 H new ATOM 0 HD2 LYS A 6 5.030 -11.625 -12.682 1.00 0.00 H new ATOM 0 HD3 LYS A 6 6.400 -12.719 -12.716 1.00 0.00 H new ATOM 0 HE2 LYS A 6 5.312 -14.329 -11.359 1.00 0.00 H new ATOM 0 HE3 LYS A 6 4.131 -13.176 -10.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 3.638 -14.926 -12.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 2.838 -13.433 -12.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 4.141 -13.612 -13.648 1.00 0.00 H new ATOM 77 N SER A 7 4.930 -11.021 -6.939 1.00 0.00 N ATOM 78 CA SER A 7 5.129 -11.742 -5.695 1.00 0.00 C ATOM 79 C SER A 7 4.178 -12.933 -5.608 1.00 0.00 C ATOM 80 O SER A 7 3.612 -13.354 -6.621 1.00 0.00 O ATOM 81 CB SER A 7 4.924 -10.784 -4.512 1.00 0.00 C ATOM 82 OG SER A 7 5.258 -11.400 -3.280 1.00 0.00 O ATOM 0 H SER A 7 3.998 -10.622 -7.049 1.00 0.00 H new ATOM 0 HA SER A 7 6.147 -12.130 -5.661 1.00 0.00 H new ATOM 0 HB2 SER A 7 5.537 -9.894 -4.653 1.00 0.00 H new ATOM 0 HB3 SER A 7 3.885 -10.454 -4.485 1.00 0.00 H new ATOM 0 HG SER A 7 5.118 -10.764 -2.548 1.00 0.00 H new ATOM 88 N LYS A 8 4.009 -13.462 -4.397 1.00 0.00 N ATOM 89 CA LYS A 8 3.177 -14.635 -4.157 1.00 0.00 C ATOM 90 C LYS A 8 1.790 -14.454 -4.757 1.00 0.00 C ATOM 91 O LYS A 8 1.267 -15.354 -5.404 1.00 0.00 O ATOM 92 CB LYS A 8 3.030 -14.903 -2.660 1.00 0.00 C ATOM 93 CG LYS A 8 4.339 -15.082 -1.911 1.00 0.00 C ATOM 94 CD LYS A 8 4.082 -15.515 -0.477 1.00 0.00 C ATOM 95 CE LYS A 8 5.366 -15.601 0.329 1.00 0.00 C ATOM 96 NZ LYS A 8 5.984 -14.267 0.551 1.00 0.00 N ATOM 0 H LYS A 8 4.447 -13.087 -3.555 1.00 0.00 H new ATOM 0 HA LYS A 8 3.671 -15.482 -4.633 1.00 0.00 H new ATOM 0 HB2 LYS A 8 2.481 -14.076 -2.210 1.00 0.00 H new ATOM 0 HB3 LYS A 8 2.425 -15.799 -2.524 1.00 0.00 H new ATOM 0 HG2 LYS A 8 4.954 -15.827 -2.416 1.00 0.00 H new ATOM 0 HG3 LYS A 8 4.899 -14.147 -1.919 1.00 0.00 H new ATOM 0 HD2 LYS A 8 3.402 -14.809 -0.001 1.00 0.00 H new ATOM 0 HD3 LYS A 8 3.586 -16.486 -0.475 1.00 0.00 H new ATOM 0 HE2 LYS A 8 5.157 -16.067 1.292 1.00 0.00 H new ATOM 0 HE3 LYS A 8 6.075 -16.246 -0.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 6.625 -14.313 1.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 6.522 -13.988 -0.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 5.239 -13.565 0.734 1.00 0.00 H new ATOM 110 N GLU A 9 1.210 -13.274 -4.549 1.00 0.00 N ATOM 111 CA GLU A 9 -0.130 -12.975 -5.042 1.00 0.00 C ATOM 112 C GLU A 9 -0.205 -13.135 -6.559 1.00 0.00 C ATOM 113 O GLU A 9 -1.226 -13.553 -7.095 1.00 0.00 O ATOM 114 CB GLU A 9 -0.539 -11.552 -4.662 1.00 0.00 C ATOM 115 CG GLU A 9 0.380 -10.484 -5.230 1.00 0.00 C ATOM 116 CD GLU A 9 -0.252 -9.116 -5.212 1.00 0.00 C ATOM 117 OE1 GLU A 9 -1.262 -8.922 -5.914 1.00 0.00 O ATOM 118 OE2 GLU A 9 0.252 -8.228 -4.505 1.00 0.00 O ATOM 0 H GLU A 9 1.650 -12.507 -4.040 1.00 0.00 H new ATOM 0 HA GLU A 9 -0.816 -13.683 -4.578 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -1.555 -11.369 -5.012 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.555 -11.465 -3.576 1.00 0.00 H new ATOM 0 HG2 GLU A 9 1.306 -10.461 -4.655 1.00 0.00 H new ATOM 0 HG3 GLU A 9 0.647 -10.745 -6.254 1.00 0.00 H new ATOM 125 N GLU A 10 0.885 -12.808 -7.239 1.00 0.00 N ATOM 126 CA GLU A 10 0.927 -12.877 -8.690 1.00 0.00 C ATOM 127 C GLU A 10 1.101 -14.318 -9.135 1.00 0.00 C ATOM 128 O GLU A 10 0.394 -14.791 -10.016 1.00 0.00 O ATOM 129 CB GLU A 10 2.074 -12.019 -9.222 1.00 0.00 C ATOM 130 CG GLU A 10 1.637 -10.905 -10.161 1.00 0.00 C ATOM 131 CD GLU A 10 1.069 -11.420 -11.467 1.00 0.00 C ATOM 132 OE1 GLU A 10 1.841 -11.956 -12.292 1.00 0.00 O ATOM 133 OE2 GLU A 10 -0.149 -11.267 -11.688 1.00 0.00 O ATOM 0 H GLU A 10 1.753 -12.492 -6.807 1.00 0.00 H new ATOM 0 HA GLU A 10 -0.012 -12.495 -9.091 1.00 0.00 H new ATOM 0 HB2 GLU A 10 2.606 -11.580 -8.378 1.00 0.00 H new ATOM 0 HB3 GLU A 10 2.782 -12.662 -9.745 1.00 0.00 H new ATOM 0 HG2 GLU A 10 0.887 -10.290 -9.663 1.00 0.00 H new ATOM 0 HG3 GLU A 10 2.490 -10.260 -10.372 1.00 0.00 H new ATOM 140 N LEU A 11 2.027 -15.015 -8.490 1.00 0.00 N ATOM 141 CA LEU A 11 2.312 -16.408 -8.816 1.00 0.00 C ATOM 142 C LEU A 11 1.103 -17.288 -8.509 1.00 0.00 C ATOM 143 O LEU A 11 0.794 -18.224 -9.245 1.00 0.00 O ATOM 144 CB LEU A 11 3.518 -16.896 -8.003 1.00 0.00 C ATOM 145 CG LEU A 11 4.752 -15.991 -8.052 1.00 0.00 C ATOM 146 CD1 LEU A 11 5.800 -16.468 -7.059 1.00 0.00 C ATOM 147 CD2 LEU A 11 5.335 -15.951 -9.454 1.00 0.00 C ATOM 0 H LEU A 11 2.597 -14.637 -7.734 1.00 0.00 H new ATOM 0 HA LEU A 11 2.536 -16.475 -9.881 1.00 0.00 H new ATOM 0 HB2 LEU A 11 3.212 -17.009 -6.963 1.00 0.00 H new ATOM 0 HB3 LEU A 11 3.800 -17.886 -8.361 1.00 0.00 H new ATOM 0 HG LEU A 11 4.445 -14.981 -7.779 1.00 0.00 H new ATOM 0 HD11 LEU A 11 6.671 -15.814 -7.107 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.384 -16.446 -6.052 1.00 0.00 H new ATOM 0 HD13 LEU A 11 6.098 -17.487 -7.306 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.211 -15.302 -9.465 1.00 0.00 H new ATOM 0 HD22 LEU A 11 5.625 -16.957 -9.756 1.00 0.00 H new ATOM 0 HD23 LEU A 11 4.588 -15.565 -10.148 1.00 0.00 H new ATOM 159 N LEU A 12 0.424 -16.978 -7.412 1.00 0.00 N ATOM 160 CA LEU A 12 -0.733 -17.742 -6.989 1.00 0.00 C ATOM 161 C LEU A 12 -1.919 -17.500 -7.913 1.00 0.00 C ATOM 162 O LEU A 12 -2.612 -18.440 -8.292 1.00 0.00 O ATOM 163 CB LEU A 12 -1.105 -17.384 -5.549 1.00 0.00 C ATOM 164 CG LEU A 12 -2.305 -18.136 -4.978 1.00 0.00 C ATOM 165 CD1 LEU A 12 -2.017 -19.627 -4.903 1.00 0.00 C ATOM 166 CD2 LEU A 12 -2.667 -17.589 -3.609 1.00 0.00 C ATOM 0 H LEU A 12 0.660 -16.198 -6.799 1.00 0.00 H new ATOM 0 HA LEU A 12 -0.476 -18.800 -7.038 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -0.242 -17.573 -4.911 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -1.310 -16.315 -5.500 1.00 0.00 H new ATOM 0 HG LEU A 12 -3.155 -17.989 -5.644 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.884 -20.145 -4.494 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -1.806 -20.007 -5.902 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -1.154 -19.799 -4.259 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -3.524 -18.135 -3.214 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.819 -17.707 -2.934 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -2.918 -16.532 -3.694 1.00 0.00 H new ATOM 178 N ARG A 13 -2.141 -16.245 -8.299 1.00 0.00 N ATOM 179 CA ARG A 13 -3.286 -15.912 -9.135 1.00 0.00 C ATOM 180 C ARG A 13 -3.128 -16.506 -10.533 1.00 0.00 C ATOM 181 O ARG A 13 -4.097 -16.617 -11.277 1.00 0.00 O ATOM 182 CB ARG A 13 -3.509 -14.396 -9.212 1.00 0.00 C ATOM 183 CG ARG A 13 -2.468 -13.637 -10.016 1.00 0.00 C ATOM 184 CD ARG A 13 -2.824 -12.162 -10.118 1.00 0.00 C ATOM 185 NE ARG A 13 -2.723 -11.459 -8.834 1.00 0.00 N ATOM 186 CZ ARG A 13 -3.649 -10.612 -8.360 1.00 0.00 C ATOM 187 NH1 ARG A 13 -4.791 -10.423 -9.012 1.00 0.00 N ATOM 188 NH2 ARG A 13 -3.428 -9.943 -7.234 1.00 0.00 N ATOM 0 H ARG A 13 -1.550 -15.453 -8.049 1.00 0.00 H new ATOM 0 HA ARG A 13 -4.169 -16.351 -8.671 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -4.491 -14.209 -9.648 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -3.528 -13.994 -8.199 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -1.490 -13.747 -9.547 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -2.392 -14.066 -11.015 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -2.164 -11.683 -10.841 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -3.840 -12.064 -10.501 1.00 0.00 H new ATOM 0 HE ARG A 13 -1.894 -11.625 -8.264 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -4.971 -10.924 -9.882 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -5.488 -9.777 -8.643 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -2.552 -10.073 -6.727 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -4.134 -9.300 -6.876 1.00 0.00 H new ATOM 202 N GLU A 14 -1.904 -16.895 -10.877 1.00 0.00 N ATOM 203 CA GLU A 14 -1.655 -17.597 -12.127 1.00 0.00 C ATOM 204 C GLU A 14 -2.325 -18.968 -12.102 1.00 0.00 C ATOM 205 O GLU A 14 -2.879 -19.424 -13.103 1.00 0.00 O ATOM 206 CB GLU A 14 -0.153 -17.773 -12.361 1.00 0.00 C ATOM 207 CG GLU A 14 0.609 -16.468 -12.509 1.00 0.00 C ATOM 208 CD GLU A 14 2.082 -16.680 -12.786 1.00 0.00 C ATOM 209 OE1 GLU A 14 2.423 -17.245 -13.847 1.00 0.00 O ATOM 210 OE2 GLU A 14 2.914 -16.261 -11.955 1.00 0.00 O ATOM 0 H GLU A 14 -1.073 -16.736 -10.308 1.00 0.00 H new ATOM 0 HA GLU A 14 -2.072 -17.001 -12.939 1.00 0.00 H new ATOM 0 HB2 GLU A 14 0.270 -18.336 -11.529 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -0.004 -18.372 -13.259 1.00 0.00 H new ATOM 0 HG2 GLU A 14 0.171 -15.886 -13.320 1.00 0.00 H new ATOM 0 HG3 GLU A 14 0.496 -15.880 -11.598 1.00 0.00 H new ATOM 217 N LYS A 15 -2.270 -19.616 -10.947 1.00 0.00 N ATOM 218 CA LYS A 15 -2.811 -20.957 -10.788 1.00 0.00 C ATOM 219 C LYS A 15 -4.262 -20.920 -10.323 1.00 0.00 C ATOM 220 O LYS A 15 -4.929 -21.954 -10.238 1.00 0.00 O ATOM 221 CB LYS A 15 -1.957 -21.726 -9.797 1.00 0.00 C ATOM 222 CG LYS A 15 -0.482 -21.665 -10.138 1.00 0.00 C ATOM 223 CD LYS A 15 0.338 -22.561 -9.241 1.00 0.00 C ATOM 224 CE LYS A 15 0.329 -24.011 -9.715 1.00 0.00 C ATOM 225 NZ LYS A 15 -1.004 -24.656 -9.565 1.00 0.00 N ATOM 0 H LYS A 15 -1.852 -19.230 -10.100 1.00 0.00 H new ATOM 0 HA LYS A 15 -2.791 -21.458 -11.756 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -2.113 -21.322 -8.797 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -2.279 -22.767 -9.774 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -0.337 -21.960 -11.177 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -0.130 -20.638 -10.046 1.00 0.00 H new ATOM 0 HD2 LYS A 15 1.365 -22.197 -9.207 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -0.052 -22.510 -8.224 1.00 0.00 H new ATOM 0 HE2 LYS A 15 0.631 -24.049 -10.762 1.00 0.00 H new ATOM 0 HE3 LYS A 15 1.068 -24.578 -9.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -0.886 -25.687 -9.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -1.463 -24.307 -8.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -1.596 -24.425 -10.388 1.00 0.00 H new ATOM 239 N LEU A 16 -4.740 -19.727 -10.016 1.00 0.00 N ATOM 240 CA LEU A 16 -6.118 -19.539 -9.603 1.00 0.00 C ATOM 241 C LEU A 16 -6.999 -19.261 -10.810 1.00 0.00 C ATOM 242 O LEU A 16 -6.523 -18.789 -11.846 1.00 0.00 O ATOM 243 CB LEU A 16 -6.231 -18.381 -8.608 1.00 0.00 C ATOM 244 CG LEU A 16 -5.519 -18.589 -7.270 1.00 0.00 C ATOM 245 CD1 LEU A 16 -5.647 -17.348 -6.402 1.00 0.00 C ATOM 246 CD2 LEU A 16 -6.082 -19.802 -6.544 1.00 0.00 C ATOM 0 H LEU A 16 -4.189 -18.869 -10.046 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.453 -20.455 -9.118 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.830 -17.482 -9.077 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -7.287 -18.195 -8.412 1.00 0.00 H new ATOM 0 HG LEU A 16 -4.462 -18.767 -7.470 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -5.135 -17.513 -5.454 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -5.197 -16.498 -6.914 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -6.701 -17.142 -6.214 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -5.562 -19.932 -5.595 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -7.146 -19.653 -6.357 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.943 -20.691 -7.159 1.00 0.00 H new ATOM 258 N SER A 17 -8.279 -19.556 -10.673 1.00 0.00 N ATOM 259 CA SER A 17 -9.249 -19.254 -11.711 1.00 0.00 C ATOM 260 C SER A 17 -9.502 -17.749 -11.720 1.00 0.00 C ATOM 261 O SER A 17 -9.167 -17.069 -10.753 1.00 0.00 O ATOM 262 CB SER A 17 -10.545 -20.024 -11.446 1.00 0.00 C ATOM 263 OG SER A 17 -11.415 -19.974 -12.561 1.00 0.00 O ATOM 0 H SER A 17 -8.673 -20.007 -9.848 1.00 0.00 H new ATOM 0 HA SER A 17 -8.868 -19.558 -12.686 1.00 0.00 H new ATOM 0 HB2 SER A 17 -10.311 -21.063 -11.212 1.00 0.00 H new ATOM 0 HB3 SER A 17 -11.046 -19.606 -10.573 1.00 0.00 H new ATOM 0 HG SER A 17 -12.337 -19.851 -12.252 1.00 0.00 H new ATOM 269 N GLU A 18 -10.112 -17.222 -12.776 1.00 0.00 N ATOM 270 CA GLU A 18 -10.257 -15.777 -12.904 1.00 0.00 C ATOM 271 C GLU A 18 -11.310 -15.270 -11.935 1.00 0.00 C ATOM 272 O GLU A 18 -11.264 -14.127 -11.480 1.00 0.00 O ATOM 273 CB GLU A 18 -10.603 -15.385 -14.338 1.00 0.00 C ATOM 274 CG GLU A 18 -9.532 -15.783 -15.337 1.00 0.00 C ATOM 275 CD GLU A 18 -9.607 -14.998 -16.631 1.00 0.00 C ATOM 276 OE1 GLU A 18 -10.500 -15.278 -17.457 1.00 0.00 O ATOM 277 OE2 GLU A 18 -8.757 -14.104 -16.834 1.00 0.00 O ATOM 0 H GLU A 18 -10.508 -17.763 -13.544 1.00 0.00 H new ATOM 0 HA GLU A 18 -9.303 -15.312 -12.656 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -11.546 -15.853 -14.619 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -10.755 -14.307 -14.387 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -8.550 -15.637 -14.886 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -9.626 -16.846 -15.558 1.00 0.00 H new ATOM 284 N ASP A 19 -12.243 -16.147 -11.613 1.00 0.00 N ATOM 285 CA ASP A 19 -13.241 -15.882 -10.589 1.00 0.00 C ATOM 286 C ASP A 19 -12.591 -15.840 -9.211 1.00 0.00 C ATOM 287 O ASP A 19 -13.062 -15.150 -8.319 1.00 0.00 O ATOM 288 CB ASP A 19 -14.342 -16.945 -10.631 1.00 0.00 C ATOM 289 CG ASP A 19 -13.810 -18.360 -10.550 1.00 0.00 C ATOM 290 OD1 ASP A 19 -13.627 -18.867 -9.430 1.00 0.00 O ATOM 291 OD2 ASP A 19 -13.590 -18.976 -11.613 1.00 0.00 O ATOM 0 H ASP A 19 -12.332 -17.063 -12.053 1.00 0.00 H new ATOM 0 HA ASP A 19 -13.692 -14.909 -10.787 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -15.033 -16.776 -9.805 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -14.913 -16.831 -11.552 1.00 0.00 H new ATOM 296 N GLN A 20 -11.490 -16.564 -9.063 1.00 0.00 N ATOM 297 CA GLN A 20 -10.768 -16.618 -7.794 1.00 0.00 C ATOM 298 C GLN A 20 -9.804 -15.439 -7.667 1.00 0.00 C ATOM 299 O GLN A 20 -9.537 -14.964 -6.563 1.00 0.00 O ATOM 300 CB GLN A 20 -9.994 -17.935 -7.676 1.00 0.00 C ATOM 301 CG GLN A 20 -10.864 -19.169 -7.833 1.00 0.00 C ATOM 302 CD GLN A 20 -10.101 -20.458 -7.610 1.00 0.00 C ATOM 303 OE1 GLN A 20 -9.496 -21.007 -8.534 1.00 0.00 O ATOM 304 NE2 GLN A 20 -10.138 -20.962 -6.387 1.00 0.00 N ATOM 0 H GLN A 20 -11.074 -17.125 -9.807 1.00 0.00 H new ATOM 0 HA GLN A 20 -11.499 -16.560 -6.987 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -9.210 -17.955 -8.433 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -9.500 -17.970 -6.705 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -11.693 -19.116 -7.127 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -11.298 -19.177 -8.833 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -10.650 -20.476 -5.651 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -9.654 -21.836 -6.181 1.00 0.00 H new ATOM 313 N LYS A 21 -9.285 -14.972 -8.803 1.00 0.00 N ATOM 314 CA LYS A 21 -8.325 -13.865 -8.819 1.00 0.00 C ATOM 315 C LYS A 21 -8.947 -12.598 -8.246 1.00 0.00 C ATOM 316 O LYS A 21 -8.278 -11.818 -7.569 1.00 0.00 O ATOM 317 CB LYS A 21 -7.830 -13.596 -10.244 1.00 0.00 C ATOM 318 CG LYS A 21 -7.191 -14.802 -10.914 1.00 0.00 C ATOM 319 CD LYS A 21 -6.688 -14.468 -12.308 1.00 0.00 C ATOM 320 CE LYS A 21 -6.303 -15.723 -13.076 1.00 0.00 C ATOM 321 NZ LYS A 21 -5.664 -15.414 -14.381 1.00 0.00 N ATOM 0 H LYS A 21 -9.513 -15.343 -9.726 1.00 0.00 H new ATOM 0 HA LYS A 21 -7.477 -14.153 -8.197 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -8.669 -13.258 -10.852 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -7.106 -12.781 -10.219 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -6.362 -15.161 -10.304 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -7.917 -15.613 -10.973 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -7.461 -13.928 -12.855 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -5.826 -13.805 -12.236 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -5.620 -16.320 -12.472 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -7.193 -16.330 -13.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -5.420 -16.301 -14.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -6.324 -14.867 -14.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -4.800 -14.858 -14.221 1.00 0.00 H new ATOM 335 N THR A 22 -10.230 -12.403 -8.513 1.00 0.00 N ATOM 336 CA THR A 22 -10.942 -11.230 -8.032 1.00 0.00 C ATOM 337 C THR A 22 -10.989 -11.197 -6.504 1.00 0.00 C ATOM 338 O THR A 22 -10.811 -10.146 -5.885 1.00 0.00 O ATOM 339 CB THR A 22 -12.378 -11.211 -8.585 1.00 0.00 C ATOM 340 OG1 THR A 22 -12.348 -11.422 -10.002 1.00 0.00 O ATOM 341 CG2 THR A 22 -13.068 -9.888 -8.286 1.00 0.00 C ATOM 0 H THR A 22 -10.801 -13.045 -9.063 1.00 0.00 H new ATOM 0 HA THR A 22 -10.402 -10.351 -8.384 1.00 0.00 H new ATOM 0 HB THR A 22 -12.940 -12.008 -8.099 1.00 0.00 H new ATOM 0 HG1 THR A 22 -13.263 -11.412 -10.354 1.00 0.00 H new ATOM 0 HG21 THR A 22 -14.080 -9.906 -8.690 1.00 0.00 H new ATOM 0 HG22 THR A 22 -13.110 -9.735 -7.208 1.00 0.00 H new ATOM 0 HG23 THR A 22 -12.509 -9.074 -8.746 1.00 0.00 H new ATOM 349 N HIS A 23 -11.208 -12.358 -5.899 1.00 0.00 N ATOM 350 CA HIS A 23 -11.347 -12.449 -4.451 1.00 0.00 C ATOM 351 C HIS A 23 -9.991 -12.448 -3.769 1.00 0.00 C ATOM 352 O HIS A 23 -9.890 -12.192 -2.570 1.00 0.00 O ATOM 353 CB HIS A 23 -12.148 -13.695 -4.079 1.00 0.00 C ATOM 354 CG HIS A 23 -13.529 -13.663 -4.639 1.00 0.00 C ATOM 355 ND1 HIS A 23 -13.884 -14.433 -5.709 1.00 0.00 N ATOM 356 CD2 HIS A 23 -14.579 -12.901 -4.273 1.00 0.00 C ATOM 357 CE1 HIS A 23 -15.137 -14.123 -5.981 1.00 0.00 C ATOM 358 NE2 HIS A 23 -15.605 -13.197 -5.135 1.00 0.00 N ATOM 0 H HIS A 23 -11.293 -13.249 -6.388 1.00 0.00 H new ATOM 0 HA HIS A 23 -11.889 -11.571 -4.100 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -11.630 -14.581 -4.445 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -12.200 -13.781 -2.994 1.00 0.00 H new ATOM 0 HD1 HIS A 23 -13.299 -15.110 -6.199 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -14.607 -12.193 -3.458 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -15.712 -14.560 -6.784 1.00 0.00 H new ATOM 366 N LEU A 24 -8.951 -12.721 -4.539 1.00 0.00 N ATOM 367 CA LEU A 24 -7.594 -12.644 -4.031 1.00 0.00 C ATOM 368 C LEU A 24 -7.265 -11.193 -3.689 1.00 0.00 C ATOM 369 O LEU A 24 -6.808 -10.889 -2.587 1.00 0.00 O ATOM 370 CB LEU A 24 -6.609 -13.190 -5.068 1.00 0.00 C ATOM 371 CG LEU A 24 -5.169 -13.337 -4.582 1.00 0.00 C ATOM 372 CD1 LEU A 24 -5.088 -14.355 -3.455 1.00 0.00 C ATOM 373 CD2 LEU A 24 -4.263 -13.738 -5.732 1.00 0.00 C ATOM 0 H LEU A 24 -9.022 -12.998 -5.518 1.00 0.00 H new ATOM 0 HA LEU A 24 -7.508 -13.251 -3.130 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -6.963 -14.164 -5.404 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.617 -12.531 -5.936 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.832 -12.374 -4.197 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -4.054 -14.447 -3.121 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -5.710 -14.027 -2.623 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -5.441 -15.322 -3.812 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -3.240 -13.839 -5.371 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -4.598 -14.690 -6.144 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -4.300 -12.973 -6.508 1.00 0.00 H new ATOM 385 N ASP A 25 -7.535 -10.297 -4.632 1.00 0.00 N ATOM 386 CA ASP A 25 -7.343 -8.868 -4.414 1.00 0.00 C ATOM 387 C ASP A 25 -8.348 -8.344 -3.395 1.00 0.00 C ATOM 388 O ASP A 25 -8.060 -7.414 -2.640 1.00 0.00 O ATOM 389 CB ASP A 25 -7.483 -8.099 -5.729 1.00 0.00 C ATOM 390 CG ASP A 25 -6.375 -8.413 -6.714 1.00 0.00 C ATOM 391 OD1 ASP A 25 -5.202 -8.099 -6.418 1.00 0.00 O ATOM 392 OD2 ASP A 25 -6.670 -8.976 -7.790 1.00 0.00 O ATOM 0 H ASP A 25 -7.889 -10.536 -5.558 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.336 -8.716 -4.025 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -8.445 -8.337 -6.183 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.485 -7.029 -5.520 1.00 0.00 H new ATOM 397 N TRP A 26 -9.529 -8.953 -3.373 1.00 0.00 N ATOM 398 CA TRP A 26 -10.552 -8.603 -2.398 1.00 0.00 C ATOM 399 C TRP A 26 -10.032 -8.852 -0.987 1.00 0.00 C ATOM 400 O TRP A 26 -10.203 -8.022 -0.095 1.00 0.00 O ATOM 401 CB TRP A 26 -11.824 -9.422 -2.650 1.00 0.00 C ATOM 402 CG TRP A 26 -12.942 -9.132 -1.690 1.00 0.00 C ATOM 403 CD1 TRP A 26 -13.907 -8.175 -1.820 1.00 0.00 C ATOM 404 CD2 TRP A 26 -13.215 -9.812 -0.458 1.00 0.00 C ATOM 405 NE1 TRP A 26 -14.762 -8.219 -0.743 1.00 0.00 N ATOM 406 CE2 TRP A 26 -14.358 -9.214 0.106 1.00 0.00 C ATOM 407 CE3 TRP A 26 -12.603 -10.867 0.223 1.00 0.00 C ATOM 408 CZ2 TRP A 26 -14.898 -9.637 1.317 1.00 0.00 C ATOM 409 CZ3 TRP A 26 -13.140 -11.284 1.425 1.00 0.00 C ATOM 410 CH2 TRP A 26 -14.278 -10.672 1.961 1.00 0.00 C ATOM 0 H TRP A 26 -9.800 -9.692 -4.021 1.00 0.00 H new ATOM 0 HA TRP A 26 -10.794 -7.545 -2.501 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -12.172 -9.229 -3.665 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -11.577 -10.482 -2.594 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -13.987 -7.485 -2.647 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -15.567 -7.609 -0.600 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -11.726 -11.348 -0.183 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -15.775 -9.165 1.733 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -12.673 -12.097 1.961 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -14.675 -11.024 2.902 1.00 0.00 H new ATOM 421 N LEU A 27 -9.378 -9.993 -0.801 1.00 0.00 N ATOM 422 CA LEU A 27 -8.825 -10.361 0.497 1.00 0.00 C ATOM 423 C LEU A 27 -7.716 -9.397 0.909 1.00 0.00 C ATOM 424 O LEU A 27 -7.531 -9.121 2.095 1.00 0.00 O ATOM 425 CB LEU A 27 -8.293 -11.796 0.463 1.00 0.00 C ATOM 426 CG LEU A 27 -7.729 -12.314 1.786 1.00 0.00 C ATOM 427 CD1 LEU A 27 -8.777 -12.231 2.884 1.00 0.00 C ATOM 428 CD2 LEU A 27 -7.247 -13.742 1.623 1.00 0.00 C ATOM 0 H LEU A 27 -9.217 -10.682 -1.536 1.00 0.00 H new ATOM 0 HA LEU A 27 -9.624 -10.300 1.236 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -9.099 -12.458 0.147 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -7.513 -11.859 -0.295 1.00 0.00 H new ATOM 0 HG LEU A 27 -6.884 -11.688 2.072 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -8.356 -12.604 3.818 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -9.086 -11.194 3.014 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.641 -12.835 2.608 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -6.847 -14.101 2.571 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -8.080 -14.375 1.317 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -6.466 -13.778 0.863 1.00 0.00 H new ATOM 440 N LYS A 28 -6.990 -8.880 -0.075 1.00 0.00 N ATOM 441 CA LYS A 28 -5.949 -7.891 0.178 1.00 0.00 C ATOM 442 C LYS A 28 -6.543 -6.662 0.853 1.00 0.00 C ATOM 443 O LYS A 28 -6.035 -6.184 1.868 1.00 0.00 O ATOM 444 CB LYS A 28 -5.263 -7.488 -1.130 1.00 0.00 C ATOM 445 CG LYS A 28 -4.205 -6.411 -0.953 1.00 0.00 C ATOM 446 CD LYS A 28 -3.558 -6.029 -2.275 1.00 0.00 C ATOM 447 CE LYS A 28 -2.648 -7.127 -2.797 1.00 0.00 C ATOM 448 NZ LYS A 28 -1.869 -6.677 -3.979 1.00 0.00 N ATOM 0 H LYS A 28 -7.103 -9.130 -1.057 1.00 0.00 H new ATOM 0 HA LYS A 28 -5.206 -8.335 0.840 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -4.802 -8.369 -1.576 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -6.017 -7.133 -1.832 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -4.658 -5.528 -0.502 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -3.439 -6.764 -0.263 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -4.333 -5.819 -3.012 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -2.984 -5.112 -2.147 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -1.964 -7.439 -2.008 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -3.245 -7.999 -3.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -0.903 -7.059 -3.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -2.328 -7.018 -4.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -1.830 -5.638 -3.994 1.00 0.00 H new ATOM 462 N GLU A 29 -7.629 -6.166 0.282 1.00 0.00 N ATOM 463 CA GLU A 29 -8.342 -5.030 0.847 1.00 0.00 C ATOM 464 C GLU A 29 -9.019 -5.412 2.160 1.00 0.00 C ATOM 465 O GLU A 29 -9.081 -4.609 3.089 1.00 0.00 O ATOM 466 CB GLU A 29 -9.386 -4.509 -0.140 1.00 0.00 C ATOM 467 CG GLU A 29 -8.786 -3.854 -1.373 1.00 0.00 C ATOM 468 CD GLU A 29 -8.026 -2.587 -1.042 1.00 0.00 C ATOM 469 OE1 GLU A 29 -6.794 -2.659 -0.852 1.00 0.00 O ATOM 470 OE2 GLU A 29 -8.657 -1.510 -0.973 1.00 0.00 O ATOM 0 H GLU A 29 -8.038 -6.534 -0.577 1.00 0.00 H new ATOM 0 HA GLU A 29 -7.615 -4.242 1.045 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -10.023 -5.337 -0.452 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -10.026 -3.788 0.368 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -8.116 -4.558 -1.865 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -9.581 -3.623 -2.082 1.00 0.00 H new ATOM 477 N ALA A 30 -9.529 -6.637 2.220 1.00 0.00 N ATOM 478 CA ALA A 30 -10.217 -7.141 3.404 1.00 0.00 C ATOM 479 C ALA A 30 -9.293 -7.149 4.616 1.00 0.00 C ATOM 480 O ALA A 30 -9.657 -6.672 5.689 1.00 0.00 O ATOM 481 CB ALA A 30 -10.756 -8.540 3.147 1.00 0.00 C ATOM 0 H ALA A 30 -9.478 -7.307 1.453 1.00 0.00 H new ATOM 0 HA ALA A 30 -11.051 -6.473 3.617 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -11.267 -8.903 4.039 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -11.458 -8.512 2.313 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -9.930 -9.209 2.904 1.00 0.00 H new ATOM 487 N LEU A 31 -8.097 -7.697 4.432 1.00 0.00 N ATOM 488 CA LEU A 31 -7.108 -7.759 5.500 1.00 0.00 C ATOM 489 C LEU A 31 -6.498 -6.384 5.750 1.00 0.00 C ATOM 490 O LEU A 31 -6.072 -6.074 6.861 1.00 0.00 O ATOM 491 CB LEU A 31 -6.018 -8.777 5.150 1.00 0.00 C ATOM 492 CG LEU A 31 -6.487 -10.235 5.113 1.00 0.00 C ATOM 493 CD1 LEU A 31 -5.328 -11.156 4.789 1.00 0.00 C ATOM 494 CD2 LEU A 31 -7.124 -10.632 6.435 1.00 0.00 C ATOM 0 H LEU A 31 -7.789 -8.106 3.550 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.605 -8.080 6.416 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -5.600 -8.520 4.177 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -5.211 -8.688 5.877 1.00 0.00 H new ATOM 0 HG LEU A 31 -7.238 -10.330 4.329 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -5.678 -12.188 4.767 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -4.915 -10.892 3.816 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -4.556 -11.051 5.551 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -7.449 -11.671 6.385 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -6.396 -10.518 7.238 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.984 -9.992 6.631 1.00 0.00 H new ATOM 506 N GLY A 32 -6.443 -5.569 4.702 1.00 0.00 N ATOM 507 CA GLY A 32 -5.946 -4.211 4.831 1.00 0.00 C ATOM 508 C GLY A 32 -4.444 -4.158 5.023 1.00 0.00 C ATOM 509 O GLY A 32 -3.877 -3.090 5.249 1.00 0.00 O ATOM 0 H GLY A 32 -6.736 -5.827 3.760 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -6.215 -3.643 3.941 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -6.434 -3.728 5.677 1.00 0.00 H new ATOM 513 N ASN A 33 -3.804 -5.313 4.930 1.00 0.00 N ATOM 514 CA ASN A 33 -2.364 -5.408 5.100 1.00 0.00 C ATOM 515 C ASN A 33 -1.810 -6.461 4.159 1.00 0.00 C ATOM 516 O ASN A 33 -2.180 -7.633 4.243 1.00 0.00 O ATOM 517 CB ASN A 33 -2.020 -5.775 6.548 1.00 0.00 C ATOM 518 CG ASN A 33 -0.543 -5.614 6.867 1.00 0.00 C ATOM 519 OD1 ASN A 33 0.319 -5.764 6.003 1.00 0.00 O ATOM 520 ND2 ASN A 33 -0.242 -5.310 8.114 1.00 0.00 N ATOM 0 H ASN A 33 -4.263 -6.203 4.736 1.00 0.00 H new ATOM 0 HA ASN A 33 -1.917 -4.441 4.869 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -2.602 -5.149 7.224 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -2.316 -6.807 6.735 1.00 0.00 H new ATOM 0 HD21 ASN A 33 0.733 -5.191 8.389 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -0.984 -5.193 8.804 1.00 0.00 H new ATOM 527 N ASP A 34 -0.927 -6.041 3.268 1.00 0.00 N ATOM 528 CA ASP A 34 -0.314 -6.950 2.306 1.00 0.00 C ATOM 529 C ASP A 34 0.581 -7.966 3.008 1.00 0.00 C ATOM 530 O ASP A 34 0.838 -9.048 2.485 1.00 0.00 O ATOM 531 CB ASP A 34 0.490 -6.164 1.267 1.00 0.00 C ATOM 532 CG ASP A 34 -0.391 -5.408 0.286 1.00 0.00 C ATOM 533 OD1 ASP A 34 -0.345 -5.722 -0.921 1.00 0.00 O ATOM 534 OD2 ASP A 34 -1.128 -4.493 0.721 1.00 0.00 O ATOM 0 H ASP A 34 -0.616 -5.073 3.189 1.00 0.00 H new ATOM 0 HA ASP A 34 -1.111 -7.492 1.798 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.144 -5.458 1.779 1.00 0.00 H new ATOM 0 HB3 ASP A 34 1.132 -6.851 0.716 1.00 0.00 H new ATOM 539 N GLY A 35 1.040 -7.615 4.203 1.00 0.00 N ATOM 540 CA GLY A 35 1.855 -8.518 4.995 1.00 0.00 C ATOM 541 C GLY A 35 1.045 -9.661 5.580 1.00 0.00 C ATOM 542 O GLY A 35 1.505 -10.802 5.617 1.00 0.00 O ATOM 0 H GLY A 35 0.860 -6.712 4.642 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.654 -8.922 4.374 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.330 -7.961 5.803 1.00 0.00 H new ATOM 546 N GLU A 36 -0.166 -9.364 6.038 1.00 0.00 N ATOM 547 CA GLU A 36 -1.045 -10.399 6.571 1.00 0.00 C ATOM 548 C GLU A 36 -1.719 -11.145 5.434 1.00 0.00 C ATOM 549 O GLU A 36 -2.067 -12.313 5.557 1.00 0.00 O ATOM 550 CB GLU A 36 -2.087 -9.791 7.504 1.00 0.00 C ATOM 551 CG GLU A 36 -1.475 -9.109 8.713 1.00 0.00 C ATOM 552 CD GLU A 36 -2.515 -8.533 9.646 1.00 0.00 C ATOM 553 OE1 GLU A 36 -2.870 -7.347 9.486 1.00 0.00 O ATOM 554 OE2 GLU A 36 -2.979 -9.261 10.547 1.00 0.00 O ATOM 0 H GLU A 36 -0.559 -8.423 6.051 1.00 0.00 H new ATOM 0 HA GLU A 36 -0.445 -11.104 7.146 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -2.685 -9.067 6.950 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.766 -10.574 7.841 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -0.861 -9.826 9.258 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -0.812 -8.312 8.378 1.00 0.00 H new ATOM 561 N PHE A 37 -1.892 -10.459 4.319 1.00 0.00 N ATOM 562 CA PHE A 37 -2.401 -11.080 3.110 1.00 0.00 C ATOM 563 C PHE A 37 -1.356 -12.043 2.543 1.00 0.00 C ATOM 564 O PHE A 37 -1.682 -13.027 1.880 1.00 0.00 O ATOM 565 CB PHE A 37 -2.781 -9.984 2.107 1.00 0.00 C ATOM 566 CG PHE A 37 -3.129 -10.475 0.735 1.00 0.00 C ATOM 567 CD1 PHE A 37 -4.174 -11.364 0.543 1.00 0.00 C ATOM 568 CD2 PHE A 37 -2.412 -10.039 -0.365 1.00 0.00 C ATOM 569 CE1 PHE A 37 -4.499 -11.803 -0.724 1.00 0.00 C ATOM 570 CE2 PHE A 37 -2.733 -10.475 -1.633 1.00 0.00 C ATOM 571 CZ PHE A 37 -3.775 -11.358 -1.812 1.00 0.00 C ATOM 0 H PHE A 37 -1.686 -9.464 4.226 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.295 -11.664 3.328 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -3.630 -9.428 2.504 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.950 -9.283 2.026 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -4.739 -11.717 1.393 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -1.592 -9.350 -0.229 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -5.318 -12.493 -0.864 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -2.168 -10.125 -2.484 1.00 0.00 H new ATOM 0 HZ PHE A 37 -4.026 -11.702 -2.804 1.00 0.00 H new ATOM 581 N ASP A 38 -0.098 -11.759 2.856 1.00 0.00 N ATOM 582 CA ASP A 38 1.024 -12.608 2.470 1.00 0.00 C ATOM 583 C ASP A 38 0.900 -13.994 3.074 1.00 0.00 C ATOM 584 O ASP A 38 1.168 -15.000 2.417 1.00 0.00 O ATOM 585 CB ASP A 38 2.324 -11.987 2.954 1.00 0.00 C ATOM 586 CG ASP A 38 3.546 -12.795 2.570 1.00 0.00 C ATOM 587 OD1 ASP A 38 3.980 -12.715 1.404 1.00 0.00 O ATOM 588 OD2 ASP A 38 4.084 -13.512 3.442 1.00 0.00 O ATOM 0 H ASP A 38 0.175 -10.931 3.386 1.00 0.00 H new ATOM 0 HA ASP A 38 1.019 -12.693 1.383 1.00 0.00 H new ATOM 0 HB2 ASP A 38 2.416 -10.982 2.542 1.00 0.00 H new ATOM 0 HB3 ASP A 38 2.289 -11.885 4.039 1.00 0.00 H new ATOM 593 N LYS A 39 0.510 -14.032 4.341 1.00 0.00 N ATOM 594 CA LYS A 39 0.389 -15.299 5.068 1.00 0.00 C ATOM 595 C LYS A 39 -0.559 -16.260 4.345 1.00 0.00 C ATOM 596 O LYS A 39 -0.335 -17.470 4.325 1.00 0.00 O ATOM 597 CB LYS A 39 -0.088 -15.080 6.513 1.00 0.00 C ATOM 598 CG LYS A 39 -1.594 -14.959 6.667 1.00 0.00 C ATOM 599 CD LYS A 39 -2.021 -15.000 8.125 1.00 0.00 C ATOM 600 CE LYS A 39 -1.707 -16.344 8.769 1.00 0.00 C ATOM 601 NZ LYS A 39 -2.367 -16.488 10.091 1.00 0.00 N ATOM 0 H LYS A 39 0.272 -13.206 4.890 1.00 0.00 H new ATOM 0 HA LYS A 39 1.383 -15.744 5.101 1.00 0.00 H new ATOM 0 HB2 LYS A 39 0.262 -15.909 7.127 1.00 0.00 H new ATOM 0 HB3 LYS A 39 0.378 -14.175 6.903 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -1.931 -14.025 6.216 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -2.081 -15.769 6.124 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -1.514 -14.207 8.674 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -3.091 -14.804 8.196 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -2.034 -17.148 8.110 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -0.628 -16.447 8.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -2.130 -17.415 10.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -2.036 -15.735 10.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -3.398 -16.415 9.974 1.00 0.00 H new ATOM 615 N PHE A 40 -1.606 -15.706 3.741 1.00 0.00 N ATOM 616 CA PHE A 40 -2.580 -16.496 2.999 1.00 0.00 C ATOM 617 C PHE A 40 -1.953 -17.051 1.727 1.00 0.00 C ATOM 618 O PHE A 40 -2.246 -18.169 1.308 1.00 0.00 O ATOM 619 CB PHE A 40 -3.793 -15.625 2.659 1.00 0.00 C ATOM 620 CG PHE A 40 -4.836 -16.310 1.820 1.00 0.00 C ATOM 621 CD1 PHE A 40 -5.806 -17.112 2.402 1.00 0.00 C ATOM 622 CD2 PHE A 40 -4.851 -16.139 0.445 1.00 0.00 C ATOM 623 CE1 PHE A 40 -6.770 -17.727 1.628 1.00 0.00 C ATOM 624 CE2 PHE A 40 -5.810 -16.754 -0.333 1.00 0.00 C ATOM 625 CZ PHE A 40 -6.771 -17.549 0.260 1.00 0.00 C ATOM 0 H PHE A 40 -1.801 -14.705 3.752 1.00 0.00 H new ATOM 0 HA PHE A 40 -2.904 -17.335 3.615 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -4.255 -15.289 3.587 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -3.449 -14.734 2.133 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -5.808 -17.257 3.472 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -4.103 -15.517 -0.023 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -7.522 -18.347 2.093 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -5.809 -16.614 -1.404 1.00 0.00 H new ATOM 0 HZ PHE A 40 -7.523 -18.031 -0.347 1.00 0.00 H new ATOM 635 N LEU A 41 -1.069 -16.262 1.140 1.00 0.00 N ATOM 636 CA LEU A 41 -0.404 -16.618 -0.110 1.00 0.00 C ATOM 637 C LEU A 41 0.644 -17.713 0.104 1.00 0.00 C ATOM 638 O LEU A 41 1.225 -18.229 -0.852 1.00 0.00 O ATOM 639 CB LEU A 41 0.266 -15.378 -0.701 1.00 0.00 C ATOM 640 CG LEU A 41 -0.653 -14.170 -0.899 1.00 0.00 C ATOM 641 CD1 LEU A 41 0.154 -12.949 -1.307 1.00 0.00 C ATOM 642 CD2 LEU A 41 -1.719 -14.473 -1.940 1.00 0.00 C ATOM 0 H LEU A 41 -0.789 -15.355 1.514 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.158 -17.002 -0.798 1.00 0.00 H new ATOM 0 HB2 LEU A 41 1.089 -15.085 -0.050 1.00 0.00 H new ATOM 0 HB3 LEU A 41 0.701 -15.645 -1.664 1.00 0.00 H new ATOM 0 HG LEU A 41 -1.148 -13.957 0.049 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -0.515 -12.100 -1.444 1.00 0.00 H new ATOM 0 HD12 LEU A 41 0.881 -12.717 -0.529 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.676 -13.154 -2.242 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -2.362 -13.602 -2.066 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -1.242 -14.713 -2.890 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -2.318 -15.322 -1.611 1.00 0.00 H new ATOM 654 N GLY A 42 0.885 -18.053 1.364 1.00 0.00 N ATOM 655 CA GLY A 42 1.864 -19.071 1.684 1.00 0.00 C ATOM 656 C GLY A 42 1.217 -20.364 2.128 1.00 0.00 C ATOM 657 O GLY A 42 1.891 -21.268 2.620 1.00 0.00 O ATOM 0 H GLY A 42 0.418 -17.640 2.171 1.00 0.00 H new ATOM 0 HA2 GLY A 42 2.488 -19.260 0.811 1.00 0.00 H new ATOM 0 HA3 GLY A 42 2.521 -18.706 2.473 1.00 0.00 H new ATOM 661 N TYR A 43 -0.095 -20.454 1.956 1.00 0.00 N ATOM 662 CA TYR A 43 -0.832 -21.646 2.346 1.00 0.00 C ATOM 663 C TYR A 43 -0.892 -22.650 1.206 1.00 0.00 C ATOM 664 O TYR A 43 -0.372 -22.403 0.118 1.00 0.00 O ATOM 665 CB TYR A 43 -2.247 -21.285 2.795 1.00 0.00 C ATOM 666 CG TYR A 43 -2.324 -20.806 4.224 1.00 0.00 C ATOM 667 CD1 TYR A 43 -1.771 -21.561 5.245 1.00 0.00 C ATOM 668 CD2 TYR A 43 -2.971 -19.621 4.558 1.00 0.00 C ATOM 669 CE1 TYR A 43 -1.852 -21.155 6.558 1.00 0.00 C ATOM 670 CE2 TYR A 43 -3.054 -19.203 5.874 1.00 0.00 C ATOM 671 CZ TYR A 43 -2.495 -19.974 6.870 1.00 0.00 C ATOM 672 OH TYR A 43 -2.583 -19.565 8.182 1.00 0.00 O ATOM 0 H TYR A 43 -0.669 -19.716 1.549 1.00 0.00 H new ATOM 0 HA TYR A 43 -0.302 -22.102 3.182 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -2.640 -20.509 2.139 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -2.890 -22.157 2.678 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -1.267 -22.486 5.007 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -3.415 -19.019 3.779 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -1.415 -21.758 7.340 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -3.554 -18.278 6.119 1.00 0.00 H new ATOM 0 HH TYR A 43 -1.805 -19.893 8.680 1.00 0.00 H new ATOM 682 N ASP A 44 -1.512 -23.790 1.471 1.00 0.00 N ATOM 683 CA ASP A 44 -1.677 -24.823 0.450 1.00 0.00 C ATOM 684 C ASP A 44 -2.693 -24.388 -0.588 1.00 0.00 C ATOM 685 O ASP A 44 -3.715 -23.796 -0.244 1.00 0.00 O ATOM 686 CB ASP A 44 -2.150 -26.136 1.065 1.00 0.00 C ATOM 687 CG ASP A 44 -2.042 -27.292 0.094 1.00 0.00 C ATOM 688 OD1 ASP A 44 -0.974 -27.928 0.033 1.00 0.00 O ATOM 689 OD2 ASP A 44 -3.026 -27.565 -0.618 1.00 0.00 O ATOM 0 H ASP A 44 -1.909 -24.026 2.380 1.00 0.00 H new ATOM 0 HA ASP A 44 -0.704 -24.972 -0.018 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -1.558 -26.353 1.954 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -3.185 -26.031 1.390 1.00 0.00 H new ATOM 694 N GLU A 45 -2.427 -24.709 -1.848 1.00 0.00 N ATOM 695 CA GLU A 45 -3.334 -24.366 -2.937 1.00 0.00 C ATOM 696 C GLU A 45 -4.728 -24.922 -2.689 1.00 0.00 C ATOM 697 O GLU A 45 -5.726 -24.260 -2.970 1.00 0.00 O ATOM 698 CB GLU A 45 -2.804 -24.895 -4.263 1.00 0.00 C ATOM 699 CG GLU A 45 -2.456 -23.796 -5.245 1.00 0.00 C ATOM 700 CD GLU A 45 -2.076 -24.337 -6.603 1.00 0.00 C ATOM 701 OE1 GLU A 45 -2.979 -24.597 -7.424 1.00 0.00 O ATOM 702 OE2 GLU A 45 -0.871 -24.517 -6.857 1.00 0.00 O ATOM 0 H GLU A 45 -1.587 -25.208 -2.142 1.00 0.00 H new ATOM 0 HA GLU A 45 -3.396 -23.279 -2.982 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -1.918 -25.502 -4.077 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -3.551 -25.551 -4.710 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -3.307 -23.123 -5.350 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -1.630 -23.206 -4.848 1.00 0.00 H new ATOM 709 N SER A 46 -4.794 -26.128 -2.139 1.00 0.00 N ATOM 710 CA SER A 46 -6.069 -26.768 -1.880 1.00 0.00 C ATOM 711 C SER A 46 -6.828 -26.021 -0.793 1.00 0.00 C ATOM 712 O SER A 46 -8.051 -25.946 -0.828 1.00 0.00 O ATOM 713 CB SER A 46 -5.869 -28.231 -1.485 1.00 0.00 C ATOM 714 OG SER A 46 -5.150 -28.935 -2.490 1.00 0.00 O ATOM 0 H SER A 46 -3.980 -26.678 -1.866 1.00 0.00 H new ATOM 0 HA SER A 46 -6.659 -26.739 -2.796 1.00 0.00 H new ATOM 0 HB2 SER A 46 -5.329 -28.286 -0.540 1.00 0.00 H new ATOM 0 HB3 SER A 46 -6.838 -28.705 -1.326 1.00 0.00 H new ATOM 0 HG SER A 46 -5.032 -29.868 -2.215 1.00 0.00 H new ATOM 720 N LYS A 47 -6.103 -25.433 0.155 1.00 0.00 N ATOM 721 CA LYS A 47 -6.744 -24.677 1.218 1.00 0.00 C ATOM 722 C LYS A 47 -7.123 -23.295 0.702 1.00 0.00 C ATOM 723 O LYS A 47 -8.208 -22.787 0.985 1.00 0.00 O ATOM 724 CB LYS A 47 -5.816 -24.563 2.433 1.00 0.00 C ATOM 725 CG LYS A 47 -5.374 -25.908 2.993 1.00 0.00 C ATOM 726 CD LYS A 47 -4.467 -25.740 4.201 1.00 0.00 C ATOM 727 CE LYS A 47 -3.733 -27.031 4.539 1.00 0.00 C ATOM 728 NZ LYS A 47 -4.654 -28.116 4.966 1.00 0.00 N ATOM 0 H LYS A 47 -5.085 -25.466 0.206 1.00 0.00 H new ATOM 0 HA LYS A 47 -7.647 -25.200 1.532 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -4.933 -23.988 2.152 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -6.325 -24.003 3.217 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -6.251 -26.492 3.274 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -4.851 -26.471 2.220 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -3.742 -24.950 4.005 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -5.059 -25.423 5.059 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -3.167 -27.362 3.668 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -3.012 -26.838 5.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -4.105 -28.972 5.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -5.176 -27.815 5.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -5.326 -28.322 4.200 1.00 0.00 H new ATOM 742 N ILE A 48 -6.220 -22.709 -0.079 1.00 0.00 N ATOM 743 CA ILE A 48 -6.422 -21.390 -0.663 1.00 0.00 C ATOM 744 C ILE A 48 -7.656 -21.349 -1.560 1.00 0.00 C ATOM 745 O ILE A 48 -8.520 -20.483 -1.402 1.00 0.00 O ATOM 746 CB ILE A 48 -5.181 -20.967 -1.470 1.00 0.00 C ATOM 747 CG1 ILE A 48 -3.986 -20.790 -0.533 1.00 0.00 C ATOM 748 CG2 ILE A 48 -5.446 -19.693 -2.256 1.00 0.00 C ATOM 749 CD1 ILE A 48 -2.692 -20.454 -1.242 1.00 0.00 C ATOM 0 H ILE A 48 -5.327 -23.137 -0.324 1.00 0.00 H new ATOM 0 HA ILE A 48 -6.579 -20.692 0.159 1.00 0.00 H new ATOM 0 HB ILE A 48 -4.951 -21.754 -2.188 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -4.212 -19.999 0.182 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -3.847 -21.707 0.039 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -4.552 -19.418 -2.816 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -6.272 -19.858 -2.948 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -5.704 -18.888 -1.568 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -1.893 -20.345 -0.509 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -2.439 -21.255 -1.937 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -2.810 -19.520 -1.792 1.00 0.00 H new ATOM 761 N LYS A 49 -7.744 -22.288 -2.498 1.00 0.00 N ATOM 762 CA LYS A 49 -8.868 -22.321 -3.424 1.00 0.00 C ATOM 763 C LYS A 49 -10.179 -22.541 -2.677 1.00 0.00 C ATOM 764 O LYS A 49 -11.188 -21.925 -3.006 1.00 0.00 O ATOM 765 CB LYS A 49 -8.673 -23.398 -4.498 1.00 0.00 C ATOM 766 CG LYS A 49 -7.462 -23.156 -5.389 1.00 0.00 C ATOM 767 CD LYS A 49 -7.439 -24.099 -6.582 1.00 0.00 C ATOM 768 CE LYS A 49 -6.195 -23.890 -7.434 1.00 0.00 C ATOM 769 NZ LYS A 49 -6.258 -24.648 -8.711 1.00 0.00 N ATOM 0 H LYS A 49 -7.057 -23.029 -2.635 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.914 -21.353 -3.923 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -8.569 -24.369 -4.013 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -9.567 -23.446 -5.119 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -7.471 -22.125 -5.741 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -6.550 -23.286 -4.806 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -7.473 -25.131 -6.232 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -8.329 -23.939 -7.191 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -6.078 -22.828 -7.649 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -5.315 -24.201 -6.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -5.391 -24.477 -9.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -6.344 -25.664 -8.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -7.083 -24.334 -9.261 1.00 0.00 H new ATOM 783 N THR A 50 -10.151 -23.396 -1.659 1.00 0.00 N ATOM 784 CA THR A 50 -11.333 -23.653 -0.847 1.00 0.00 C ATOM 785 C THR A 50 -11.801 -22.369 -0.157 1.00 0.00 C ATOM 786 O THR A 50 -12.994 -22.056 -0.148 1.00 0.00 O ATOM 787 CB THR A 50 -11.049 -24.745 0.206 1.00 0.00 C ATOM 788 OG1 THR A 50 -10.613 -25.946 -0.446 1.00 0.00 O ATOM 789 CG2 THR A 50 -12.286 -25.047 1.034 1.00 0.00 C ATOM 0 H THR A 50 -9.323 -23.921 -1.378 1.00 0.00 H new ATOM 0 HA THR A 50 -12.125 -24.006 -1.508 1.00 0.00 H new ATOM 0 HB THR A 50 -10.268 -24.376 0.871 1.00 0.00 H new ATOM 0 HG1 THR A 50 -9.645 -25.906 -0.591 1.00 0.00 H new ATOM 0 HG21 THR A 50 -12.054 -25.820 1.767 1.00 0.00 H new ATOM 0 HG22 THR A 50 -12.608 -24.143 1.550 1.00 0.00 H new ATOM 0 HG23 THR A 50 -13.085 -25.395 0.380 1.00 0.00 H new ATOM 797 N ALA A 51 -10.852 -21.619 0.394 1.00 0.00 N ATOM 798 CA ALA A 51 -11.154 -20.367 1.074 1.00 0.00 C ATOM 799 C ALA A 51 -11.749 -19.345 0.108 1.00 0.00 C ATOM 800 O ALA A 51 -12.825 -18.800 0.352 1.00 0.00 O ATOM 801 CB ALA A 51 -9.898 -19.807 1.730 1.00 0.00 C ATOM 0 H ALA A 51 -9.861 -21.860 0.382 1.00 0.00 H new ATOM 0 HA ALA A 51 -11.895 -20.572 1.846 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -10.138 -18.871 2.235 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.517 -20.524 2.457 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -9.140 -19.625 0.968 1.00 0.00 H new ATOM 807 N LEU A 52 -11.051 -19.107 -0.998 1.00 0.00 N ATOM 808 CA LEU A 52 -11.466 -18.099 -1.974 1.00 0.00 C ATOM 809 C LEU A 52 -12.799 -18.456 -2.622 1.00 0.00 C ATOM 810 O LEU A 52 -13.660 -17.593 -2.796 1.00 0.00 O ATOM 811 CB LEU A 52 -10.397 -17.917 -3.056 1.00 0.00 C ATOM 812 CG LEU A 52 -9.084 -17.305 -2.575 1.00 0.00 C ATOM 813 CD1 LEU A 52 -8.086 -17.232 -3.717 1.00 0.00 C ATOM 814 CD2 LEU A 52 -9.324 -15.923 -1.987 1.00 0.00 C ATOM 0 H LEU A 52 -10.192 -19.599 -1.243 1.00 0.00 H new ATOM 0 HA LEU A 52 -11.591 -17.161 -1.433 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -10.185 -18.889 -3.502 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -10.806 -17.286 -3.846 1.00 0.00 H new ATOM 0 HG LEU A 52 -8.670 -17.943 -1.794 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -7.155 -16.793 -3.359 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -7.892 -18.236 -4.096 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -8.494 -16.614 -4.517 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -8.377 -15.502 -1.649 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -9.759 -15.274 -2.748 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -10.008 -16.001 -1.142 1.00 0.00 H new ATOM 826 N ASP A 53 -12.975 -19.727 -2.969 1.00 0.00 N ATOM 827 CA ASP A 53 -14.203 -20.165 -3.627 1.00 0.00 C ATOM 828 C ASP A 53 -15.378 -20.051 -2.665 1.00 0.00 C ATOM 829 O ASP A 53 -16.501 -19.747 -3.068 1.00 0.00 O ATOM 830 CB ASP A 53 -14.075 -21.603 -4.134 1.00 0.00 C ATOM 831 CG ASP A 53 -15.065 -21.916 -5.242 1.00 0.00 C ATOM 832 OD1 ASP A 53 -14.657 -21.909 -6.426 1.00 0.00 O ATOM 833 OD2 ASP A 53 -16.251 -22.155 -4.946 1.00 0.00 O ATOM 0 H ASP A 53 -12.291 -20.466 -2.808 1.00 0.00 H new ATOM 0 HA ASP A 53 -14.378 -19.518 -4.487 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -13.061 -21.768 -4.499 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -14.232 -22.293 -3.305 1.00 0.00 H new ATOM 838 N HIS A 54 -15.106 -20.281 -1.385 1.00 0.00 N ATOM 839 CA HIS A 54 -16.111 -20.110 -0.344 1.00 0.00 C ATOM 840 C HIS A 54 -16.497 -18.639 -0.232 1.00 0.00 C ATOM 841 O HIS A 54 -17.679 -18.300 -0.212 1.00 0.00 O ATOM 842 CB HIS A 54 -15.584 -20.631 0.996 1.00 0.00 C ATOM 843 CG HIS A 54 -16.563 -20.502 2.118 1.00 0.00 C ATOM 844 ND1 HIS A 54 -17.653 -21.331 2.225 1.00 0.00 N ATOM 845 CD2 HIS A 54 -16.572 -19.620 3.139 1.00 0.00 C ATOM 846 CE1 HIS A 54 -18.302 -20.930 3.305 1.00 0.00 C ATOM 847 NE2 HIS A 54 -17.681 -19.896 3.890 1.00 0.00 N ATOM 0 H HIS A 54 -14.195 -20.587 -1.044 1.00 0.00 H new ATOM 0 HA HIS A 54 -16.998 -20.686 -0.610 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -15.308 -21.680 0.885 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -14.675 -20.088 1.255 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -15.844 -18.845 3.327 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -19.215 -21.378 3.669 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -17.979 -19.408 4.735 1.00 0.00 H new ATOM 855 N ILE A 55 -15.492 -17.769 -0.173 1.00 0.00 N ATOM 856 CA ILE A 55 -15.718 -16.326 -0.161 1.00 0.00 C ATOM 857 C ILE A 55 -16.599 -15.913 -1.342 1.00 0.00 C ATOM 858 O ILE A 55 -17.563 -15.170 -1.176 1.00 0.00 O ATOM 859 CB ILE A 55 -14.382 -15.550 -0.215 1.00 0.00 C ATOM 860 CG1 ILE A 55 -13.540 -15.846 1.029 1.00 0.00 C ATOM 861 CG2 ILE A 55 -14.630 -14.055 -0.346 1.00 0.00 C ATOM 862 CD1 ILE A 55 -12.171 -15.191 1.010 1.00 0.00 C ATOM 0 H ILE A 55 -14.509 -18.040 -0.133 1.00 0.00 H new ATOM 0 HA ILE A 55 -16.225 -16.079 0.772 1.00 0.00 H new ATOM 0 HB ILE A 55 -13.831 -15.882 -1.095 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -14.082 -15.508 1.912 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -13.415 -16.925 1.124 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -13.676 -13.530 -0.382 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -15.188 -13.858 -1.261 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -15.205 -13.705 0.512 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -11.633 -15.446 1.923 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -11.609 -15.547 0.146 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -12.286 -14.109 0.947 1.00 0.00 H new ATOM 874 N LYS A 56 -16.265 -16.419 -2.524 1.00 0.00 N ATOM 875 CA LYS A 56 -17.050 -16.171 -3.730 1.00 0.00 C ATOM 876 C LYS A 56 -18.495 -16.628 -3.550 1.00 0.00 C ATOM 877 O LYS A 56 -19.427 -15.909 -3.900 1.00 0.00 O ATOM 878 CB LYS A 56 -16.404 -16.892 -4.918 1.00 0.00 C ATOM 879 CG LYS A 56 -17.244 -16.894 -6.192 1.00 0.00 C ATOM 880 CD LYS A 56 -16.517 -17.578 -7.348 1.00 0.00 C ATOM 881 CE LYS A 56 -15.716 -18.772 -6.861 1.00 0.00 C ATOM 882 NZ LYS A 56 -15.487 -19.794 -7.914 1.00 0.00 N ATOM 0 H LYS A 56 -15.447 -17.010 -2.674 1.00 0.00 H new ATOM 0 HA LYS A 56 -17.064 -15.098 -3.923 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -15.444 -16.423 -5.132 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -16.198 -17.924 -4.632 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -18.189 -17.404 -6.004 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -17.485 -15.868 -6.470 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -17.241 -17.902 -8.096 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -15.852 -16.865 -7.836 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -14.753 -18.426 -6.485 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -16.238 -19.234 -6.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -15.485 -20.741 -7.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -16.245 -19.737 -8.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -14.570 -19.620 -8.373 1.00 0.00 H new ATOM 896 N SER A 57 -18.670 -17.817 -2.989 1.00 0.00 N ATOM 897 CA SER A 57 -19.998 -18.371 -2.759 1.00 0.00 C ATOM 898 C SER A 57 -20.802 -17.493 -1.796 1.00 0.00 C ATOM 899 O SER A 57 -21.980 -17.211 -2.035 1.00 0.00 O ATOM 900 CB SER A 57 -19.875 -19.792 -2.213 1.00 0.00 C ATOM 901 OG SER A 57 -19.120 -20.607 -3.097 1.00 0.00 O ATOM 0 H SER A 57 -17.905 -18.419 -2.684 1.00 0.00 H new ATOM 0 HA SER A 57 -20.533 -18.398 -3.708 1.00 0.00 H new ATOM 0 HB2 SER A 57 -19.397 -19.770 -1.234 1.00 0.00 H new ATOM 0 HB3 SER A 57 -20.868 -20.220 -2.074 1.00 0.00 H new ATOM 0 HG SER A 57 -18.169 -20.385 -3.015 1.00 0.00 H new ATOM 907 N GLU A 58 -20.158 -17.060 -0.718 1.00 0.00 N ATOM 908 CA GLU A 58 -20.785 -16.170 0.244 1.00 0.00 C ATOM 909 C GLU A 58 -21.087 -14.807 -0.383 1.00 0.00 C ATOM 910 O GLU A 58 -22.188 -14.278 -0.241 1.00 0.00 O ATOM 911 CB GLU A 58 -19.888 -16.006 1.472 1.00 0.00 C ATOM 912 CG GLU A 58 -19.660 -17.302 2.236 1.00 0.00 C ATOM 913 CD GLU A 58 -20.955 -18.013 2.571 1.00 0.00 C ATOM 914 OE1 GLU A 58 -21.758 -17.469 3.358 1.00 0.00 O ATOM 915 OE2 GLU A 58 -21.190 -19.116 2.039 1.00 0.00 O ATOM 0 H GLU A 58 -19.197 -17.314 -0.490 1.00 0.00 H new ATOM 0 HA GLU A 58 -21.731 -16.614 0.554 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -18.925 -15.605 1.157 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -20.335 -15.272 2.143 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -19.029 -17.964 1.643 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -19.119 -17.087 3.157 1.00 0.00 H new ATOM 922 N LEU A 59 -20.116 -14.248 -1.091 1.00 0.00 N ATOM 923 CA LEU A 59 -20.275 -12.935 -1.710 1.00 0.00 C ATOM 924 C LEU A 59 -21.363 -12.949 -2.780 1.00 0.00 C ATOM 925 O LEU A 59 -22.048 -11.948 -2.990 1.00 0.00 O ATOM 926 CB LEU A 59 -18.945 -12.470 -2.307 1.00 0.00 C ATOM 927 CG LEU A 59 -17.873 -12.105 -1.277 1.00 0.00 C ATOM 928 CD1 LEU A 59 -16.628 -11.580 -1.961 1.00 0.00 C ATOM 929 CD2 LEU A 59 -18.405 -11.082 -0.287 1.00 0.00 C ATOM 0 H LEU A 59 -19.207 -14.682 -1.253 1.00 0.00 H new ATOM 0 HA LEU A 59 -20.583 -12.233 -0.935 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -18.556 -13.259 -2.951 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -19.130 -11.603 -2.941 1.00 0.00 H new ATOM 0 HG LEU A 59 -17.609 -13.010 -0.729 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -15.880 -11.327 -1.210 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -16.229 -12.345 -2.627 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -16.878 -10.690 -2.538 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -17.627 -10.837 0.436 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -18.702 -10.179 -0.821 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -19.268 -11.495 0.235 1.00 0.00 H new ATOM 941 N ASP A 60 -21.527 -14.091 -3.432 1.00 0.00 N ATOM 942 CA ASP A 60 -22.559 -14.267 -4.454 1.00 0.00 C ATOM 943 C ASP A 60 -23.963 -14.113 -3.862 1.00 0.00 C ATOM 944 O ASP A 60 -24.919 -13.796 -4.570 1.00 0.00 O ATOM 945 CB ASP A 60 -22.406 -15.641 -5.116 1.00 0.00 C ATOM 946 CG ASP A 60 -23.538 -15.972 -6.066 1.00 0.00 C ATOM 947 OD1 ASP A 60 -24.361 -16.852 -5.729 1.00 0.00 O ATOM 948 OD2 ASP A 60 -23.612 -15.361 -7.154 1.00 0.00 O ATOM 0 H ASP A 60 -20.954 -14.920 -3.272 1.00 0.00 H new ATOM 0 HA ASP A 60 -22.430 -13.489 -5.206 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -21.462 -15.672 -5.660 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -22.353 -16.407 -4.342 1.00 0.00 H new ATOM 953 N LYS A 61 -24.072 -14.317 -2.554 1.00 0.00 N ATOM 954 CA LYS A 61 -25.349 -14.192 -1.858 1.00 0.00 C ATOM 955 C LYS A 61 -25.737 -12.725 -1.692 1.00 0.00 C ATOM 956 O LYS A 61 -26.894 -12.402 -1.427 1.00 0.00 O ATOM 957 CB LYS A 61 -25.263 -14.854 -0.478 1.00 0.00 C ATOM 958 CG LYS A 61 -24.870 -16.319 -0.522 1.00 0.00 C ATOM 959 CD LYS A 61 -24.601 -16.862 0.873 1.00 0.00 C ATOM 960 CE LYS A 61 -24.197 -18.325 0.832 1.00 0.00 C ATOM 961 NZ LYS A 61 -23.879 -18.857 2.183 1.00 0.00 N ATOM 0 H LYS A 61 -23.289 -14.571 -1.952 1.00 0.00 H new ATOM 0 HA LYS A 61 -26.111 -14.691 -2.457 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -24.539 -14.312 0.130 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -26.229 -14.762 0.019 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -25.666 -16.897 -0.992 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -23.980 -16.440 -1.140 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -23.811 -16.278 1.346 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -25.494 -16.747 1.488 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -25.005 -18.911 0.393 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -23.329 -18.443 0.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -22.969 -19.359 2.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -23.819 -18.070 2.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -24.627 -19.515 2.482 1.00 0.00 H new ATOM 975 N CYS A 62 -24.766 -11.838 -1.854 1.00 0.00 N ATOM 976 CA CYS A 62 -24.988 -10.424 -1.624 1.00 0.00 C ATOM 977 C CYS A 62 -24.774 -9.604 -2.892 1.00 0.00 C ATOM 978 O CYS A 62 -23.656 -9.190 -3.206 1.00 0.00 O ATOM 979 CB CYS A 62 -24.075 -9.924 -0.503 1.00 0.00 C ATOM 980 SG CYS A 62 -24.875 -9.834 1.136 1.00 0.00 S ATOM 0 H CYS A 62 -23.817 -12.076 -2.144 1.00 0.00 H new ATOM 0 HA CYS A 62 -26.028 -10.295 -1.324 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -23.209 -10.582 -0.436 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -23.703 -8.934 -0.768 1.00 0.00 H new ATOM 985 N ASN A 63 -25.861 -9.368 -3.612 1.00 0.00 N ATOM 986 CA ASN A 63 -25.836 -8.521 -4.795 1.00 0.00 C ATOM 987 C ASN A 63 -26.889 -7.432 -4.670 1.00 0.00 C ATOM 988 O ASN A 63 -28.058 -7.644 -4.981 1.00 0.00 O ATOM 989 CB ASN A 63 -26.064 -9.331 -6.077 1.00 0.00 C ATOM 990 CG ASN A 63 -24.834 -10.105 -6.510 1.00 0.00 C ATOM 991 OD1 ASN A 63 -23.969 -9.576 -7.209 1.00 0.00 O ATOM 992 ND2 ASN A 63 -24.752 -11.363 -6.120 1.00 0.00 N ATOM 0 H ASN A 63 -26.779 -9.755 -3.395 1.00 0.00 H new ATOM 0 HA ASN A 63 -24.847 -8.067 -4.863 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -26.889 -10.026 -5.920 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -26.364 -8.656 -6.879 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -23.952 -11.932 -6.397 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -25.489 -11.767 -5.541 1.00 0.00 H new ATOM 999 N GLY A 64 -26.472 -6.283 -4.172 1.00 0.00 N ATOM 1000 CA GLY A 64 -27.383 -5.171 -3.986 1.00 0.00 C ATOM 1001 C GLY A 64 -26.721 -4.019 -3.262 1.00 0.00 C ATOM 1002 O GLY A 64 -25.512 -4.044 -3.033 1.00 0.00 O ATOM 0 H GLY A 64 -25.510 -6.096 -3.890 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -27.745 -4.831 -4.956 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -28.253 -5.504 -3.420 1.00 0.00 H new ATOM 1006 N ASN A 65 -27.513 -3.027 -2.877 1.00 0.00 N ATOM 1007 CA ASN A 65 -26.984 -1.830 -2.233 1.00 0.00 C ATOM 1008 C ASN A 65 -26.569 -2.136 -0.804 1.00 0.00 C ATOM 1009 O ASN A 65 -25.420 -1.920 -0.416 1.00 0.00 O ATOM 1010 CB ASN A 65 -28.024 -0.708 -2.229 1.00 0.00 C ATOM 1011 CG ASN A 65 -28.408 -0.230 -3.617 1.00 0.00 C ATOM 1012 OD1 ASN A 65 -27.474 -0.274 -4.555 1.00 0.00 O flip ATOM 1013 ND2 ASN A 65 -29.546 0.181 -3.844 1.00 0.00 N flip ATOM 0 H ASN A 65 -28.526 -3.027 -2.999 1.00 0.00 H new ATOM 0 HA ASN A 65 -26.113 -1.503 -2.801 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -28.919 -1.056 -1.713 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -27.634 0.135 -1.658 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -30.240 0.200 -3.097 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -29.795 0.502 -4.780 1.00 0.00 H new ATOM 1020 N ASP A 66 -27.515 -2.663 -0.037 1.00 0.00 N ATOM 1021 CA ASP A 66 -27.279 -3.013 1.363 1.00 0.00 C ATOM 1022 C ASP A 66 -26.259 -4.133 1.440 1.00 0.00 C ATOM 1023 O ASP A 66 -25.504 -4.255 2.407 1.00 0.00 O ATOM 1024 CB ASP A 66 -28.579 -3.479 2.026 1.00 0.00 C ATOM 1025 CG ASP A 66 -29.773 -2.638 1.634 1.00 0.00 C ATOM 1026 OD1 ASP A 66 -30.432 -2.979 0.629 1.00 0.00 O ATOM 1027 OD2 ASP A 66 -30.060 -1.639 2.319 1.00 0.00 O ATOM 0 H ASP A 66 -28.462 -2.860 -0.362 1.00 0.00 H new ATOM 0 HA ASP A 66 -26.908 -2.130 1.884 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -28.768 -4.518 1.754 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -28.460 -3.449 3.109 1.00 0.00 H new ATOM 1032 N ALA A 67 -26.241 -4.941 0.388 1.00 0.00 N ATOM 1033 CA ALA A 67 -25.366 -6.094 0.305 1.00 0.00 C ATOM 1034 C ALA A 67 -23.898 -5.685 0.327 1.00 0.00 C ATOM 1035 O ALA A 67 -23.041 -6.454 0.758 1.00 0.00 O ATOM 1036 CB ALA A 67 -25.680 -6.883 -0.952 1.00 0.00 C ATOM 0 H ALA A 67 -26.835 -4.812 -0.431 1.00 0.00 H new ATOM 0 HA ALA A 67 -25.542 -6.721 1.179 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -25.021 -7.749 -1.012 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -26.717 -7.217 -0.922 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -25.528 -6.250 -1.826 1.00 0.00 H new ATOM 1042 N ASP A 68 -23.610 -4.470 -0.132 1.00 0.00 N ATOM 1043 CA ASP A 68 -22.240 -3.969 -0.144 1.00 0.00 C ATOM 1044 C ASP A 68 -21.699 -3.872 1.275 1.00 0.00 C ATOM 1045 O ASP A 68 -20.574 -4.284 1.553 1.00 0.00 O ATOM 1046 CB ASP A 68 -22.166 -2.603 -0.819 1.00 0.00 C ATOM 1047 CG ASP A 68 -20.744 -2.087 -0.924 1.00 0.00 C ATOM 1048 OD1 ASP A 68 -20.079 -2.370 -1.945 1.00 0.00 O ATOM 1049 OD2 ASP A 68 -20.283 -1.400 0.004 1.00 0.00 O ATOM 0 H ASP A 68 -24.303 -3.818 -0.499 1.00 0.00 H new ATOM 0 HA ASP A 68 -21.630 -4.671 -0.712 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -22.600 -2.670 -1.817 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -22.768 -1.890 -0.256 1.00 0.00 H new ATOM 1054 N GLN A 69 -22.520 -3.351 2.178 1.00 0.00 N ATOM 1055 CA GLN A 69 -22.132 -3.222 3.576 1.00 0.00 C ATOM 1056 C GLN A 69 -21.934 -4.593 4.199 1.00 0.00 C ATOM 1057 O GLN A 69 -21.007 -4.802 4.977 1.00 0.00 O ATOM 1058 CB GLN A 69 -23.181 -2.435 4.363 1.00 0.00 C ATOM 1059 CG GLN A 69 -23.071 -0.924 4.210 1.00 0.00 C ATOM 1060 CD GLN A 69 -23.128 -0.469 2.764 1.00 0.00 C ATOM 1061 OE1 GLN A 69 -24.204 -0.251 2.213 1.00 0.00 O ATOM 1062 NE2 GLN A 69 -21.969 -0.304 2.148 1.00 0.00 N ATOM 0 H GLN A 69 -23.458 -3.011 1.967 1.00 0.00 H new ATOM 0 HA GLN A 69 -21.190 -2.676 3.616 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -24.173 -2.750 4.041 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -23.093 -2.690 5.419 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -23.878 -0.448 4.767 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -22.135 -0.586 4.655 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -21.097 -0.496 2.641 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -21.947 0.015 1.180 1.00 0.00 H new ATOM 1071 N GLN A 70 -22.805 -5.528 3.839 1.00 0.00 N ATOM 1072 CA GLN A 70 -22.701 -6.896 4.329 1.00 0.00 C ATOM 1073 C GLN A 70 -21.378 -7.520 3.891 1.00 0.00 C ATOM 1074 O GLN A 70 -20.693 -8.164 4.683 1.00 0.00 O ATOM 1075 CB GLN A 70 -23.875 -7.732 3.816 1.00 0.00 C ATOM 1076 CG GLN A 70 -25.237 -7.167 4.193 1.00 0.00 C ATOM 1077 CD GLN A 70 -25.482 -7.149 5.692 1.00 0.00 C ATOM 1078 OE1 GLN A 70 -24.930 -8.122 6.399 1.00 0.00 O flip ATOM 1079 NE2 GLN A 70 -26.176 -6.273 6.207 1.00 0.00 N flip ATOM 0 H GLN A 70 -23.591 -5.364 3.210 1.00 0.00 H new ATOM 0 HA GLN A 70 -22.732 -6.878 5.418 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -23.810 -7.807 2.731 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -23.789 -8.744 4.211 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -25.322 -6.152 3.805 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -26.015 -7.759 3.711 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -26.584 -5.539 5.628 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -26.343 -6.280 7.213 1.00 0.00 H new ATOM 1088 N LYS A 71 -21.013 -7.301 2.632 1.00 0.00 N ATOM 1089 CA LYS A 71 -19.759 -7.821 2.090 1.00 0.00 C ATOM 1090 C LYS A 71 -18.560 -7.106 2.706 1.00 0.00 C ATOM 1091 O LYS A 71 -17.522 -7.716 2.953 1.00 0.00 O ATOM 1092 CB LYS A 71 -19.737 -7.684 0.564 1.00 0.00 C ATOM 1093 CG LYS A 71 -20.798 -8.520 -0.134 1.00 0.00 C ATOM 1094 CD LYS A 71 -20.756 -8.341 -1.644 1.00 0.00 C ATOM 1095 CE LYS A 71 -21.052 -6.905 -2.043 1.00 0.00 C ATOM 1096 NZ LYS A 71 -21.079 -6.730 -3.517 1.00 0.00 N ATOM 0 H LYS A 71 -21.568 -6.766 1.965 1.00 0.00 H new ATOM 0 HA LYS A 71 -19.692 -8.878 2.346 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -19.878 -6.636 0.299 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -18.754 -7.976 0.195 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -20.651 -9.572 0.111 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -21.784 -8.240 0.238 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -19.774 -8.629 -2.018 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -21.482 -9.006 -2.111 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -22.012 -6.603 -1.625 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -20.297 -6.247 -1.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -21.284 -5.736 -3.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -20.155 -6.993 -3.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -21.817 -7.338 -3.925 1.00 0.00 H new ATOM 1110 N THR A 72 -18.709 -5.813 2.958 1.00 0.00 N ATOM 1111 CA THR A 72 -17.656 -5.036 3.602 1.00 0.00 C ATOM 1112 C THR A 72 -17.444 -5.511 5.044 1.00 0.00 C ATOM 1113 O THR A 72 -16.313 -5.579 5.529 1.00 0.00 O ATOM 1114 CB THR A 72 -17.987 -3.529 3.581 1.00 0.00 C ATOM 1115 OG1 THR A 72 -18.247 -3.111 2.233 1.00 0.00 O ATOM 1116 CG2 THR A 72 -16.843 -2.705 4.155 1.00 0.00 C ATOM 0 H THR A 72 -19.547 -5.279 2.727 1.00 0.00 H new ATOM 0 HA THR A 72 -16.734 -5.191 3.041 1.00 0.00 H new ATOM 0 HB THR A 72 -18.870 -3.367 4.199 1.00 0.00 H new ATOM 0 HG1 THR A 72 -19.192 -3.258 2.021 1.00 0.00 H new ATOM 0 HG21 THR A 72 -17.106 -1.648 4.127 1.00 0.00 H new ATOM 0 HG22 THR A 72 -16.660 -3.006 5.187 1.00 0.00 H new ATOM 0 HG23 THR A 72 -15.943 -2.871 3.563 1.00 0.00 H new ATOM 1124 N THR A 73 -18.535 -5.855 5.714 1.00 0.00 N ATOM 1125 CA THR A 73 -18.465 -6.417 7.056 1.00 0.00 C ATOM 1126 C THR A 73 -17.879 -7.828 7.007 1.00 0.00 C ATOM 1127 O THR A 73 -17.172 -8.258 7.919 1.00 0.00 O ATOM 1128 CB THR A 73 -19.863 -6.455 7.706 1.00 0.00 C ATOM 1129 OG1 THR A 73 -20.475 -5.163 7.611 1.00 0.00 O ATOM 1130 CG2 THR A 73 -19.778 -6.870 9.167 1.00 0.00 C ATOM 0 H THR A 73 -19.482 -5.754 5.349 1.00 0.00 H new ATOM 0 HA THR A 73 -17.818 -5.780 7.659 1.00 0.00 H new ATOM 0 HB THR A 73 -20.466 -7.191 7.174 1.00 0.00 H new ATOM 0 HG1 THR A 73 -20.590 -4.924 6.668 1.00 0.00 H new ATOM 0 HG21 THR A 73 -20.779 -6.888 9.599 1.00 0.00 H new ATOM 0 HG22 THR A 73 -19.334 -7.863 9.238 1.00 0.00 H new ATOM 0 HG23 THR A 73 -19.160 -6.157 9.712 1.00 0.00 H new ATOM 1138 N PHE A 74 -18.143 -8.520 5.906 1.00 0.00 N ATOM 1139 CA PHE A 74 -17.669 -9.884 5.707 1.00 0.00 C ATOM 1140 C PHE A 74 -16.147 -9.910 5.647 1.00 0.00 C ATOM 1141 O PHE A 74 -15.519 -10.908 5.989 1.00 0.00 O ATOM 1142 CB PHE A 74 -18.276 -10.454 4.424 1.00 0.00 C ATOM 1143 CG PHE A 74 -17.885 -11.873 4.113 1.00 0.00 C ATOM 1144 CD1 PHE A 74 -18.040 -12.879 5.054 1.00 0.00 C ATOM 1145 CD2 PHE A 74 -17.394 -12.202 2.862 1.00 0.00 C ATOM 1146 CE1 PHE A 74 -17.712 -14.187 4.749 1.00 0.00 C ATOM 1147 CE2 PHE A 74 -17.060 -13.505 2.552 1.00 0.00 C ATOM 1148 CZ PHE A 74 -17.220 -14.498 3.494 1.00 0.00 C ATOM 0 H PHE A 74 -18.690 -8.153 5.127 1.00 0.00 H new ATOM 0 HA PHE A 74 -17.983 -10.503 6.548 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -19.362 -10.400 4.498 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -17.982 -9.820 3.588 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -18.421 -12.639 6.036 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -17.270 -11.429 2.118 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -17.840 -14.964 5.488 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -16.674 -13.746 1.573 1.00 0.00 H new ATOM 0 HZ PHE A 74 -16.961 -15.518 3.253 1.00 0.00 H new ATOM 1158 N LYS A 75 -15.561 -8.798 5.217 1.00 0.00 N ATOM 1159 CA LYS A 75 -14.117 -8.640 5.208 1.00 0.00 C ATOM 1160 C LYS A 75 -13.544 -8.850 6.606 1.00 0.00 C ATOM 1161 O LYS A 75 -12.492 -9.460 6.769 1.00 0.00 O ATOM 1162 CB LYS A 75 -13.752 -7.248 4.696 1.00 0.00 C ATOM 1163 CG LYS A 75 -14.170 -7.002 3.260 1.00 0.00 C ATOM 1164 CD LYS A 75 -13.819 -5.599 2.814 1.00 0.00 C ATOM 1165 CE LYS A 75 -13.998 -5.441 1.316 1.00 0.00 C ATOM 1166 NZ LYS A 75 -13.491 -4.135 0.831 1.00 0.00 N ATOM 0 H LYS A 75 -16.072 -7.987 4.868 1.00 0.00 H new ATOM 0 HA LYS A 75 -13.688 -9.391 4.544 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -14.221 -6.500 5.336 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -12.674 -7.110 4.781 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -13.680 -7.726 2.608 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -15.244 -7.159 3.160 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -14.450 -4.880 3.337 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -12.787 -5.375 3.086 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -13.475 -6.247 0.801 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -15.054 -5.536 1.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -13.632 -4.068 -0.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -14.007 -3.365 1.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -12.477 -4.054 1.047 1.00 0.00 H new ATOM 1180 N GLN A 76 -14.261 -8.365 7.611 1.00 0.00 N ATOM 1181 CA GLN A 76 -13.832 -8.487 8.984 1.00 0.00 C ATOM 1182 C GLN A 76 -14.104 -9.892 9.509 1.00 0.00 C ATOM 1183 O GLN A 76 -13.401 -10.388 10.390 1.00 0.00 O ATOM 1184 CB GLN A 76 -14.541 -7.446 9.835 1.00 0.00 C ATOM 1185 CG GLN A 76 -14.113 -6.020 9.526 1.00 0.00 C ATOM 1186 CD GLN A 76 -14.665 -5.013 10.515 1.00 0.00 C ATOM 1187 OE1 GLN A 76 -14.035 -4.715 11.527 1.00 0.00 O ATOM 1188 NE2 GLN A 76 -15.841 -4.480 10.227 1.00 0.00 N ATOM 0 H GLN A 76 -15.150 -7.880 7.491 1.00 0.00 H new ATOM 0 HA GLN A 76 -12.757 -8.313 9.037 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -15.617 -7.535 9.684 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -14.348 -7.655 10.887 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -13.024 -5.964 9.527 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -14.445 -5.756 8.522 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -16.331 -4.755 9.376 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -16.258 -3.794 10.856 1.00 0.00 H new ATOM 1197 N THR A 77 -15.128 -10.527 8.958 1.00 0.00 N ATOM 1198 CA THR A 77 -15.414 -11.918 9.258 1.00 0.00 C ATOM 1199 C THR A 77 -14.275 -12.801 8.749 1.00 0.00 C ATOM 1200 O THR A 77 -13.760 -13.658 9.468 1.00 0.00 O ATOM 1201 CB THR A 77 -16.739 -12.352 8.606 1.00 0.00 C ATOM 1202 OG1 THR A 77 -17.756 -11.381 8.891 1.00 0.00 O ATOM 1203 CG2 THR A 77 -17.176 -13.715 9.116 1.00 0.00 C ATOM 0 H THR A 77 -15.776 -10.097 8.298 1.00 0.00 H new ATOM 0 HA THR A 77 -15.505 -12.029 10.339 1.00 0.00 H new ATOM 0 HB THR A 77 -16.587 -12.421 7.529 1.00 0.00 H new ATOM 0 HG1 THR A 77 -18.599 -11.658 8.474 1.00 0.00 H new ATOM 0 HG21 THR A 77 -18.115 -13.998 8.640 1.00 0.00 H new ATOM 0 HG22 THR A 77 -16.411 -14.455 8.879 1.00 0.00 H new ATOM 0 HG23 THR A 77 -17.316 -13.672 10.196 1.00 0.00 H new ATOM 1211 N VAL A 78 -13.874 -12.555 7.504 1.00 0.00 N ATOM 1212 CA VAL A 78 -12.728 -13.224 6.907 1.00 0.00 C ATOM 1213 C VAL A 78 -11.453 -12.888 7.686 1.00 0.00 C ATOM 1214 O VAL A 78 -10.567 -13.732 7.852 1.00 0.00 O ATOM 1215 CB VAL A 78 -12.580 -12.813 5.424 1.00 0.00 C ATOM 1216 CG1 VAL A 78 -11.381 -13.477 4.785 1.00 0.00 C ATOM 1217 CG2 VAL A 78 -13.844 -13.157 4.648 1.00 0.00 C ATOM 0 H VAL A 78 -14.335 -11.888 6.885 1.00 0.00 H new ATOM 0 HA VAL A 78 -12.888 -14.301 6.953 1.00 0.00 H new ATOM 0 HB VAL A 78 -12.426 -11.734 5.393 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -11.306 -13.167 3.743 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -10.476 -13.184 5.317 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -11.496 -14.560 4.834 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -13.723 -12.861 3.606 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -14.023 -14.231 4.702 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -14.692 -12.626 5.080 1.00 0.00 H new ATOM 1227 N GLN A 79 -11.385 -11.659 8.186 1.00 0.00 N ATOM 1228 CA GLN A 79 -10.291 -11.225 9.050 1.00 0.00 C ATOM 1229 C GLN A 79 -10.155 -12.132 10.271 1.00 0.00 C ATOM 1230 O GLN A 79 -9.047 -12.419 10.722 1.00 0.00 O ATOM 1231 CB GLN A 79 -10.529 -9.785 9.504 1.00 0.00 C ATOM 1232 CG GLN A 79 -9.835 -8.740 8.650 1.00 0.00 C ATOM 1233 CD GLN A 79 -8.364 -8.611 8.984 1.00 0.00 C ATOM 1234 OE1 GLN A 79 -7.721 -9.570 9.413 1.00 0.00 O ATOM 1235 NE2 GLN A 79 -7.822 -7.421 8.806 1.00 0.00 N ATOM 0 H GLN A 79 -12.083 -10.938 8.005 1.00 0.00 H new ATOM 0 HA GLN A 79 -9.365 -11.283 8.477 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -11.601 -9.587 9.500 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -10.189 -9.680 10.534 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -9.945 -9.002 7.598 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -10.323 -7.776 8.791 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -8.388 -6.651 8.449 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -6.837 -7.271 9.026 1.00 0.00 H new ATOM 1244 N GLY A 80 -11.284 -12.590 10.795 1.00 0.00 N ATOM 1245 CA GLY A 80 -11.267 -13.455 11.958 1.00 0.00 C ATOM 1246 C GLY A 80 -11.073 -14.914 11.590 1.00 0.00 C ATOM 1247 O GLY A 80 -11.042 -15.784 12.462 1.00 0.00 O ATOM 0 H GLY A 80 -12.214 -12.377 10.434 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -10.466 -13.142 12.628 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -12.203 -13.342 12.505 1.00 0.00 H new ATOM 1251 N ALA A 81 -10.951 -15.184 10.295 1.00 0.00 N ATOM 1252 CA ALA A 81 -10.759 -16.544 9.807 1.00 0.00 C ATOM 1253 C ALA A 81 -9.276 -16.865 9.608 1.00 0.00 C ATOM 1254 O ALA A 81 -8.714 -17.697 10.321 1.00 0.00 O ATOM 1255 CB ALA A 81 -11.539 -16.756 8.515 1.00 0.00 C ATOM 0 H ALA A 81 -10.982 -14.475 9.562 1.00 0.00 H new ATOM 0 HA ALA A 81 -11.141 -17.230 10.562 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -11.387 -17.776 8.161 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -12.600 -16.590 8.699 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -11.188 -16.054 7.759 1.00 0.00 H new ATOM 1261 N LEU A 82 -8.637 -16.182 8.661 1.00 0.00 N ATOM 1262 CA LEU A 82 -7.273 -16.512 8.256 1.00 0.00 C ATOM 1263 C LEU A 82 -6.236 -16.046 9.268 1.00 0.00 C ATOM 1264 O LEU A 82 -5.039 -16.287 9.112 1.00 0.00 O ATOM 1265 CB LEU A 82 -6.976 -15.929 6.877 1.00 0.00 C ATOM 1266 CG LEU A 82 -7.910 -16.412 5.768 1.00 0.00 C ATOM 1267 CD1 LEU A 82 -8.076 -17.921 5.815 1.00 0.00 C ATOM 1268 CD2 LEU A 82 -9.238 -15.699 5.836 1.00 0.00 C ATOM 0 H LEU A 82 -9.044 -15.394 8.158 1.00 0.00 H new ATOM 0 HA LEU A 82 -7.204 -17.599 8.210 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -7.035 -14.842 6.936 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -5.950 -16.178 6.605 1.00 0.00 H new ATOM 0 HG LEU A 82 -7.457 -16.166 4.808 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -8.745 -18.238 5.015 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -7.105 -18.398 5.686 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -8.498 -18.211 6.777 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -9.886 -16.059 5.037 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -9.707 -15.895 6.800 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -9.082 -14.627 5.720 1.00 0.00 H new ATOM 1280 N SER A 83 -6.705 -15.402 10.307 1.00 0.00 N ATOM 1281 CA SER A 83 -5.843 -14.991 11.399 1.00 0.00 C ATOM 1282 C SER A 83 -5.504 -16.198 12.263 1.00 0.00 C ATOM 1283 O SER A 83 -4.374 -16.355 12.722 1.00 0.00 O ATOM 1284 CB SER A 83 -6.529 -13.906 12.223 1.00 0.00 C ATOM 1285 OG SER A 83 -7.913 -14.184 12.362 1.00 0.00 O ATOM 0 H SER A 83 -7.686 -15.147 10.425 1.00 0.00 H new ATOM 0 HA SER A 83 -4.916 -14.580 10.999 1.00 0.00 H new ATOM 0 HB2 SER A 83 -6.065 -13.841 13.207 1.00 0.00 H new ATOM 0 HB3 SER A 83 -6.394 -12.937 11.743 1.00 0.00 H new ATOM 0 HG SER A 83 -8.407 -13.757 11.631 1.00 0.00 H new ATOM 1291 N GLY A 84 -6.490 -17.067 12.443 1.00 0.00 N ATOM 1292 CA GLY A 84 -6.281 -18.278 13.204 1.00 0.00 C ATOM 1293 C GLY A 84 -5.761 -19.409 12.342 1.00 0.00 C ATOM 1294 O GLY A 84 -4.897 -20.179 12.766 1.00 0.00 O ATOM 0 H GLY A 84 -7.434 -16.952 12.073 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -5.574 -18.082 14.010 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -7.219 -18.579 13.670 1.00 0.00 H new ATOM 1298 N GLY A 85 -6.270 -19.503 11.124 1.00 0.00 N ATOM 1299 CA GLY A 85 -5.850 -20.556 10.237 1.00 0.00 C ATOM 1300 C GLY A 85 -6.801 -20.733 9.082 1.00 0.00 C ATOM 1301 O GLY A 85 -7.990 -20.437 9.192 1.00 0.00 O ATOM 0 H GLY A 85 -6.967 -18.866 10.737 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -4.854 -20.333 9.855 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -5.777 -21.491 10.793 1.00 0.00 H new ATOM 1305 N ILE A 86 -6.278 -21.225 7.978 1.00 0.00 N ATOM 1306 CA ILE A 86 -7.064 -21.407 6.774 1.00 0.00 C ATOM 1307 C ILE A 86 -7.739 -22.777 6.776 1.00 0.00 C ATOM 1308 O ILE A 86 -8.739 -22.991 6.097 1.00 0.00 O ATOM 1309 CB ILE A 86 -6.176 -21.258 5.525 1.00 0.00 C ATOM 1310 CG1 ILE A 86 -7.020 -21.242 4.251 1.00 0.00 C ATOM 1311 CG2 ILE A 86 -5.154 -22.381 5.483 1.00 0.00 C ATOM 1312 CD1 ILE A 86 -6.226 -20.909 3.010 1.00 0.00 C ATOM 0 H ILE A 86 -5.302 -21.509 7.889 1.00 0.00 H new ATOM 0 HA ILE A 86 -7.836 -20.638 6.750 1.00 0.00 H new ATOM 0 HB ILE A 86 -5.650 -20.305 5.583 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -7.489 -22.217 4.122 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -7.824 -20.514 4.365 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -4.528 -22.271 4.597 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -4.530 -22.339 6.376 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -5.669 -23.341 5.446 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -6.887 -20.915 2.143 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -5.779 -19.921 3.119 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -5.439 -21.650 2.872 1.00 0.00 H new ATOM 1324 N ASP A 87 -7.200 -23.699 7.569 1.00 0.00 N ATOM 1325 CA ASP A 87 -7.752 -25.047 7.648 1.00 0.00 C ATOM 1326 C ASP A 87 -9.017 -25.040 8.501 1.00 0.00 C ATOM 1327 O ASP A 87 -9.750 -26.026 8.571 1.00 0.00 O ATOM 1328 CB ASP A 87 -6.730 -26.011 8.246 1.00 0.00 C ATOM 1329 CG ASP A 87 -6.782 -27.385 7.608 1.00 0.00 C ATOM 1330 OD1 ASP A 87 -7.889 -27.883 7.314 1.00 0.00 O ATOM 1331 OD2 ASP A 87 -5.705 -27.977 7.396 1.00 0.00 O ATOM 0 H ASP A 87 -6.386 -23.538 8.163 1.00 0.00 H new ATOM 0 HA ASP A 87 -7.998 -25.381 6.640 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.730 -25.596 8.124 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -6.908 -26.105 9.317 1.00 0.00 H new ATOM 1336 N GLY A 88 -9.251 -23.916 9.166 1.00 0.00 N ATOM 1337 CA GLY A 88 -10.459 -23.746 9.943 1.00 0.00 C ATOM 1338 C GLY A 88 -11.430 -22.810 9.256 1.00 0.00 C ATOM 1339 O GLY A 88 -12.426 -22.396 9.842 1.00 0.00 O ATOM 0 H GLY A 88 -8.620 -23.115 9.179 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -10.933 -24.715 10.098 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -10.208 -23.353 10.928 1.00 0.00 H new ATOM 1343 N PHE A 89 -11.131 -22.489 8.004 1.00 0.00 N ATOM 1344 CA PHE A 89 -11.946 -21.573 7.222 1.00 0.00 C ATOM 1345 C PHE A 89 -13.145 -22.314 6.645 1.00 0.00 C ATOM 1346 O PHE A 89 -12.988 -23.289 5.910 1.00 0.00 O ATOM 1347 CB PHE A 89 -11.101 -20.968 6.096 1.00 0.00 C ATOM 1348 CG PHE A 89 -11.723 -19.789 5.403 1.00 0.00 C ATOM 1349 CD1 PHE A 89 -12.737 -19.956 4.476 1.00 0.00 C ATOM 1350 CD2 PHE A 89 -11.271 -18.509 5.668 1.00 0.00 C ATOM 1351 CE1 PHE A 89 -13.288 -18.866 3.830 1.00 0.00 C ATOM 1352 CE2 PHE A 89 -11.816 -17.418 5.026 1.00 0.00 C ATOM 1353 CZ PHE A 89 -12.825 -17.597 4.106 1.00 0.00 C ATOM 0 H PHE A 89 -10.320 -22.855 7.505 1.00 0.00 H new ATOM 0 HA PHE A 89 -12.308 -20.769 7.863 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -10.139 -20.663 6.507 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -10.901 -21.742 5.355 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -13.101 -20.948 4.255 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -10.480 -18.362 6.388 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -14.080 -19.008 3.110 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -11.453 -16.425 5.244 1.00 0.00 H new ATOM 0 HZ PHE A 89 -13.253 -16.744 3.601 1.00 0.00 H new ATOM 1363 N GLY A 90 -14.332 -21.860 6.995 1.00 0.00 N ATOM 1364 CA GLY A 90 -15.538 -22.476 6.491 1.00 0.00 C ATOM 1365 C GLY A 90 -16.782 -21.732 6.920 1.00 0.00 C ATOM 1366 O GLY A 90 -16.704 -20.585 7.358 1.00 0.00 O ATOM 0 H GLY A 90 -14.485 -21.071 7.623 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -15.497 -22.514 5.402 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -15.593 -23.506 6.844 1.00 0.00 H new ATOM 1370 N SER A 91 -17.922 -22.397 6.833 1.00 0.00 N ATOM 1371 CA SER A 91 -19.207 -21.785 7.154 1.00 0.00 C ATOM 1372 C SER A 91 -19.383 -21.608 8.665 1.00 0.00 C ATOM 1373 O SER A 91 -20.383 -21.055 9.127 1.00 0.00 O ATOM 1374 CB SER A 91 -20.343 -22.630 6.574 1.00 0.00 C ATOM 1375 OG SER A 91 -20.218 -23.994 6.954 1.00 0.00 O ATOM 0 H SER A 91 -17.986 -23.372 6.540 1.00 0.00 H new ATOM 0 HA SER A 91 -19.234 -20.792 6.705 1.00 0.00 H new ATOM 0 HB2 SER A 91 -21.301 -22.241 6.918 1.00 0.00 H new ATOM 0 HB3 SER A 91 -20.339 -22.551 5.487 1.00 0.00 H new ATOM 0 HG SER A 91 -20.958 -24.510 6.571 1.00 0.00 H new ATOM 1381 N ASN A 92 -18.403 -22.076 9.425 1.00 0.00 N ATOM 1382 CA ASN A 92 -18.430 -21.947 10.875 1.00 0.00 C ATOM 1383 C ASN A 92 -17.942 -20.569 11.297 1.00 0.00 C ATOM 1384 O ASN A 92 -18.464 -19.980 12.242 1.00 0.00 O ATOM 1385 CB ASN A 92 -17.560 -23.036 11.522 1.00 0.00 C ATOM 1386 CG ASN A 92 -17.454 -22.894 13.032 1.00 0.00 C ATOM 1387 OD1 ASN A 92 -16.548 -22.237 13.547 1.00 0.00 O ATOM 1388 ND2 ASN A 92 -18.363 -23.527 13.755 1.00 0.00 N ATOM 0 H ASN A 92 -17.577 -22.550 9.060 1.00 0.00 H new ATOM 0 HA ASN A 92 -19.459 -22.070 11.213 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -17.976 -24.015 11.283 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -16.561 -23.000 11.088 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -18.328 -23.480 14.773 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -19.099 -24.062 13.294 1.00 0.00 H new ATOM 1395 N ASN A 93 -16.953 -20.047 10.584 1.00 0.00 N ATOM 1396 CA ASN A 93 -16.316 -18.802 10.988 1.00 0.00 C ATOM 1397 C ASN A 93 -16.420 -17.722 9.911 1.00 0.00 C ATOM 1398 O ASN A 93 -16.166 -16.550 10.184 1.00 0.00 O ATOM 1399 CB ASN A 93 -14.848 -19.056 11.351 1.00 0.00 C ATOM 1400 CG ASN A 93 -14.005 -19.528 10.178 1.00 0.00 C ATOM 1401 OD1 ASN A 93 -14.507 -20.117 9.218 1.00 0.00 O ATOM 1402 ND2 ASN A 93 -12.704 -19.307 10.265 1.00 0.00 N ATOM 0 H ASN A 93 -16.578 -20.462 9.731 1.00 0.00 H new ATOM 0 HA ASN A 93 -16.847 -18.432 11.865 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -14.417 -18.138 11.751 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -14.802 -19.802 12.144 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -12.082 -19.627 9.523 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -12.323 -18.816 11.074 1.00 0.00 H new ATOM 1409 N ALA A 94 -16.801 -18.105 8.699 1.00 0.00 N ATOM 1410 CA ALA A 94 -16.922 -17.151 7.602 1.00 0.00 C ATOM 1411 C ALA A 94 -18.178 -17.412 6.775 1.00 0.00 C ATOM 1412 O ALA A 94 -18.234 -18.366 6.002 1.00 0.00 O ATOM 1413 CB ALA A 94 -15.684 -17.206 6.713 1.00 0.00 C ATOM 0 H ALA A 94 -17.031 -19.067 8.450 1.00 0.00 H new ATOM 0 HA ALA A 94 -17.005 -16.154 8.034 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -15.789 -16.489 5.899 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -14.801 -16.959 7.303 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -15.576 -18.209 6.301 1.00 0.00 H new ATOM 1419 N VAL A 95 -19.190 -16.574 6.955 1.00 0.00 N ATOM 1420 CA VAL A 95 -20.424 -16.672 6.181 1.00 0.00 C ATOM 1421 C VAL A 95 -21.006 -15.296 5.932 1.00 0.00 C ATOM 1422 O VAL A 95 -20.761 -14.366 6.703 1.00 0.00 O ATOM 1423 CB VAL A 95 -21.501 -17.521 6.890 1.00 0.00 C ATOM 1424 CG1 VAL A 95 -21.213 -19.003 6.746 1.00 0.00 C ATOM 1425 CG2 VAL A 95 -21.608 -17.130 8.358 1.00 0.00 C ATOM 0 H VAL A 95 -19.182 -15.813 7.634 1.00 0.00 H new ATOM 0 HA VAL A 95 -20.155 -17.156 5.242 1.00 0.00 H new ATOM 0 HB VAL A 95 -22.459 -17.321 6.410 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -21.988 -19.575 7.255 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -21.200 -19.270 5.689 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -20.244 -19.230 7.190 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -22.372 -17.739 8.842 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -20.649 -17.294 8.849 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -21.880 -16.077 8.435 1.00 0.00 H new ATOM 1435 N THR A 96 -21.760 -15.163 4.856 1.00 0.00 N ATOM 1436 CA THR A 96 -22.506 -13.948 4.610 1.00 0.00 C ATOM 1437 C THR A 96 -23.968 -14.137 4.981 1.00 0.00 C ATOM 1438 O THR A 96 -24.690 -14.920 4.357 1.00 0.00 O ATOM 1439 CB THR A 96 -22.412 -13.511 3.144 1.00 0.00 C ATOM 1440 OG1 THR A 96 -22.666 -14.628 2.293 1.00 0.00 O ATOM 1441 CG2 THR A 96 -21.048 -12.920 2.831 1.00 0.00 C ATOM 0 H THR A 96 -21.870 -15.882 4.141 1.00 0.00 H new ATOM 0 HA THR A 96 -22.065 -13.169 5.232 1.00 0.00 H new ATOM 0 HB THR A 96 -23.161 -12.739 2.969 1.00 0.00 H new ATOM 0 HG1 THR A 96 -22.768 -14.319 1.369 1.00 0.00 H new ATOM 0 HG21 THR A 96 -21.013 -12.620 1.784 1.00 0.00 H new ATOM 0 HG22 THR A 96 -20.875 -12.050 3.464 1.00 0.00 H new ATOM 0 HG23 THR A 96 -20.276 -13.666 3.020 1.00 0.00 H new ATOM 1449 N THR A 97 -24.402 -13.430 6.007 1.00 0.00 N ATOM 1450 CA THR A 97 -25.793 -13.454 6.417 1.00 0.00 C ATOM 1451 C THR A 97 -26.656 -12.603 5.484 1.00 0.00 C ATOM 1452 O THR A 97 -27.415 -11.740 5.921 1.00 0.00 O ATOM 1453 CB THR A 97 -25.935 -12.968 7.871 1.00 0.00 C ATOM 1454 OG1 THR A 97 -25.033 -11.876 8.114 1.00 0.00 O ATOM 1455 CG2 THR A 97 -25.649 -14.096 8.849 1.00 0.00 C ATOM 0 H THR A 97 -23.806 -12.828 6.575 1.00 0.00 H new ATOM 0 HA THR A 97 -26.144 -14.484 6.357 1.00 0.00 H new ATOM 0 HB THR A 97 -26.961 -12.631 8.020 1.00 0.00 H new ATOM 0 HG1 THR A 97 -25.130 -11.571 9.040 1.00 0.00 H new ATOM 0 HG21 THR A 97 -25.756 -13.728 9.870 1.00 0.00 H new ATOM 0 HG22 THR A 97 -26.354 -14.910 8.681 1.00 0.00 H new ATOM 0 HG23 THR A 97 -24.632 -14.459 8.698 1.00 0.00 H new ATOM 1463 N CYS A 98 -26.555 -12.884 4.190 1.00 0.00 N ATOM 1464 CA CYS A 98 -27.272 -12.131 3.170 1.00 0.00 C ATOM 1465 C CYS A 98 -28.716 -12.620 3.047 1.00 0.00 C ATOM 1466 O CYS A 98 -29.210 -12.868 1.949 1.00 0.00 O ATOM 1467 CB CYS A 98 -26.560 -12.270 1.823 1.00 0.00 C ATOM 1468 SG CYS A 98 -24.815 -11.738 1.841 1.00 0.00 S ATOM 0 H CYS A 98 -25.976 -13.638 3.820 1.00 0.00 H new ATOM 0 HA CYS A 98 -27.287 -11.082 3.465 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -26.607 -13.312 1.506 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -27.099 -11.685 1.078 1.00 0.00 H new ATOM 1473 N GLY A 99 -29.391 -12.739 4.178 1.00 0.00 N ATOM 1474 CA GLY A 99 -30.769 -13.173 4.179 1.00 0.00 C ATOM 1475 C GLY A 99 -31.710 -11.995 4.203 1.00 0.00 C ATOM 1476 O GLY A 99 -32.439 -11.789 5.174 1.00 0.00 O ATOM 0 H GLY A 99 -29.005 -12.541 5.101 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -30.963 -13.779 3.294 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -30.953 -13.807 5.046 1.00 0.00 H new ATOM 1480 N ASN A 100 -31.685 -11.212 3.138 1.00 0.00 N ATOM 1481 CA ASN A 100 -32.473 -9.996 3.074 1.00 0.00 C ATOM 1482 C ASN A 100 -33.942 -10.308 2.806 1.00 0.00 C ATOM 1483 O ASN A 100 -34.276 -11.141 1.960 1.00 0.00 O ATOM 1484 CB ASN A 100 -31.921 -9.033 2.016 1.00 0.00 C ATOM 1485 CG ASN A 100 -31.952 -9.589 0.605 1.00 0.00 C ATOM 1486 OD1 ASN A 100 -31.804 -10.791 0.383 1.00 0.00 O ATOM 1487 ND2 ASN A 100 -32.134 -8.705 -0.358 1.00 0.00 N ATOM 0 H ASN A 100 -31.126 -11.398 2.305 1.00 0.00 H new ATOM 0 HA ASN A 100 -32.402 -9.506 4.045 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -32.497 -8.108 2.045 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -30.893 -8.777 2.273 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -32.156 -9.009 -1.332 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -32.252 -7.718 -0.129 1.00 0.00 H new ATOM 1494 N GLY A 101 -34.810 -9.645 3.553 1.00 0.00 N ATOM 1495 CA GLY A 101 -36.233 -9.847 3.407 1.00 0.00 C ATOM 1496 C GLY A 101 -36.977 -9.476 4.672 1.00 0.00 C ATOM 1497 O GLY A 101 -36.361 -9.280 5.722 1.00 0.00 O ATOM 0 H GLY A 101 -34.549 -8.963 4.265 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -36.604 -9.247 2.576 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -36.430 -10.890 3.160 1.00 0.00 H new ATOM 1501 N SER A 102 -38.290 -9.368 4.577 1.00 0.00 N ATOM 1502 CA SER A 102 -39.112 -9.030 5.724 1.00 0.00 C ATOM 1503 C SER A 102 -40.368 -9.894 5.736 1.00 0.00 C ATOM 1504 O SER A 102 -40.339 -10.972 6.365 1.00 0.00 O ATOM 1505 CB SER A 102 -39.483 -7.547 5.691 1.00 0.00 C ATOM 1506 OG SER A 102 -38.319 -6.730 5.655 1.00 0.00 O ATOM 0 H SER A 102 -38.812 -9.510 3.712 1.00 0.00 H new ATOM 0 HA SER A 102 -38.546 -9.223 6.635 1.00 0.00 H new ATOM 0 HB2 SER A 102 -40.102 -7.343 4.817 1.00 0.00 H new ATOM 0 HB3 SER A 102 -40.079 -7.298 6.569 1.00 0.00 H new ATOM 0 HG SER A 102 -38.582 -5.786 5.633 1.00 0.00 H new TER 1512 SER A 102