USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 1099 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 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -166:sc= 0 (180deg=-0.0737) USER MOD Single : A 5 LYS NZ :NH3+ -179:sc= -1.3 (180deg=-1.3) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 GLN : amide:sc= -0.291 K(o=-0.29,f=-2.2!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 TYR OH : rot 180:sc=-0.00688 USER MOD Single : A 31 LYS NZ :NH3+ 147:sc= -0.123 (180deg=-0.872) USER MOD Single : A 45 HIS : no HD1:sc= -1.44 K(o=-1.4,f=-2) USER MOD Single : A 47 CYS SG : rot 180:sc= -0.971 USER MOD Single : A 48 GLN : amide:sc= -0.0012 X(o=-0.0012,f=0) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0.00229 USER MOD Single : A 54 HIS : no HD1:sc= -4.2! C(o=-4.2!,f=-10!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 TYR OH : rot 30:sc= -0.367 USER MOD Single : A 67 HIS : no HD1:sc= -1.83! C(o=-1.8!,f=-4!) USER MOD Single : A 74 THR OG1 : rot -160:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 180:sc= -0.0871 USER MOD Single : A 102 TYR OH : rot 34:sc= 0.576 USER MOD Single : A 105 TYR OH : rot 180:sc= -0.27 USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.289 USER MOD Single : A 127 GLN : amide:sc= -3.18! K(o=-3.2!,f=-4.3) USER MOD Single : A 129 GLN : amide:sc= -0.0185 X(o=-0.019,f=-0.089) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 THR OG1 : rot -52:sc= 0.646 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.028 -5.442 6.638 1.00 0.00 N ATOM 2 CA MET A 1 11.912 -4.595 7.020 1.00 0.00 C ATOM 3 C MET A 1 11.128 -4.132 5.790 1.00 0.00 C ATOM 4 O MET A 1 11.694 -3.528 4.880 1.00 0.00 O ATOM 5 CB MET A 1 12.434 -3.375 7.782 1.00 0.00 C ATOM 6 CG MET A 1 12.780 -3.738 9.227 1.00 0.00 C ATOM 7 SD MET A 1 13.996 -2.599 9.868 1.00 0.00 S ATOM 8 CE MET A 1 12.923 -1.301 10.459 1.00 0.00 C ATOM 0 H1 MET A 1 13.397 -5.931 7.479 1.00 0.00 H new ATOM 0 H2 MET A 1 12.708 -6.145 5.941 1.00 0.00 H new ATOM 0 H3 MET A 1 13.780 -4.858 6.220 1.00 0.00 H new ATOM 0 HA MET A 1 11.243 -5.174 7.657 1.00 0.00 H new ATOM 0 HB2 MET A 1 13.318 -2.980 7.281 1.00 0.00 H new ATOM 0 HB3 MET A 1 11.682 -2.586 7.772 1.00 0.00 H new ATOM 0 HG2 MET A 1 11.881 -3.708 9.843 1.00 0.00 H new ATOM 0 HG3 MET A 1 13.164 -4.757 9.273 1.00 0.00 H new ATOM 0 HE1 MET A 1 13.524 -0.502 10.894 1.00 0.00 H new ATOM 0 HE2 MET A 1 12.340 -0.905 9.628 1.00 0.00 H new ATOM 0 HE3 MET A 1 12.250 -1.702 11.216 1.00 0.00 H new ATOM 18 N VAL A 2 9.838 -4.434 5.802 1.00 0.00 N ATOM 19 CA VAL A 2 8.971 -4.057 4.699 1.00 0.00 C ATOM 20 C VAL A 2 9.529 -4.636 3.397 1.00 0.00 C ATOM 21 O VAL A 2 10.708 -4.978 3.320 1.00 0.00 O ATOM 22 CB VAL A 2 8.810 -2.536 4.656 1.00 0.00 C ATOM 23 CG1 VAL A 2 8.604 -1.967 6.061 1.00 0.00 C ATOM 24 CG2 VAL A 2 10.007 -1.877 3.967 1.00 0.00 C ATOM 0 H VAL A 2 9.372 -4.936 6.558 1.00 0.00 H new ATOM 0 HA VAL A 2 7.973 -4.472 4.838 1.00 0.00 H new ATOM 0 HB VAL A 2 7.920 -2.310 4.069 1.00 0.00 H new ATOM 0 HG11 VAL A 2 8.492 -0.884 6.002 1.00 0.00 H new ATOM 0 HG12 VAL A 2 7.706 -2.401 6.501 1.00 0.00 H new ATOM 0 HG13 VAL A 2 9.466 -2.210 6.682 1.00 0.00 H new ATOM 0 HG21 VAL A 2 9.867 -0.796 3.950 1.00 0.00 H new ATOM 0 HG22 VAL A 2 10.919 -2.116 4.514 1.00 0.00 H new ATOM 0 HG23 VAL A 2 10.089 -2.249 2.946 1.00 0.00 H new ATOM 34 N PRO A 3 8.631 -4.731 2.379 1.00 0.00 N ATOM 35 CA PRO A 3 9.021 -5.262 1.084 1.00 0.00 C ATOM 36 C PRO A 3 9.854 -4.244 0.302 1.00 0.00 C ATOM 37 O PRO A 3 10.013 -3.104 0.734 1.00 0.00 O ATOM 38 CB PRO A 3 7.714 -5.616 0.394 1.00 0.00 C ATOM 39 CG PRO A 3 6.631 -4.845 1.132 1.00 0.00 C ATOM 40 CD PRO A 3 7.227 -4.335 2.434 1.00 0.00 C ATOM 0 HA PRO A 3 9.663 -6.139 1.165 1.00 0.00 H new ATOM 0 HB2 PRO A 3 7.741 -5.339 -0.660 1.00 0.00 H new ATOM 0 HB3 PRO A 3 7.528 -6.689 0.437 1.00 0.00 H new ATOM 0 HG2 PRO A 3 6.273 -4.014 0.525 1.00 0.00 H new ATOM 0 HG3 PRO A 3 5.773 -5.487 1.331 1.00 0.00 H new ATOM 0 HD2 PRO A 3 7.124 -3.253 2.520 1.00 0.00 H new ATOM 0 HD3 PRO A 3 6.726 -4.773 3.297 1.00 0.00 H new ATOM 48 N PRO A 4 10.375 -4.705 -0.867 1.00 0.00 N ATOM 49 CA PRO A 4 11.187 -3.848 -1.713 1.00 0.00 C ATOM 50 C PRO A 4 10.318 -2.834 -2.461 1.00 0.00 C ATOM 51 O PRO A 4 10.547 -1.629 -2.371 1.00 0.00 O ATOM 52 CB PRO A 4 11.925 -4.797 -2.642 1.00 0.00 C ATOM 53 CG PRO A 4 11.156 -6.107 -2.597 1.00 0.00 C ATOM 54 CD PRO A 4 10.207 -6.049 -1.410 1.00 0.00 C ATOM 0 HA PRO A 4 11.891 -3.241 -1.144 1.00 0.00 H new ATOM 0 HB2 PRO A 4 11.962 -4.400 -3.657 1.00 0.00 H new ATOM 0 HB3 PRO A 4 12.956 -4.938 -2.317 1.00 0.00 H new ATOM 0 HG2 PRO A 4 10.601 -6.256 -3.523 1.00 0.00 H new ATOM 0 HG3 PRO A 4 11.841 -6.949 -2.497 1.00 0.00 H new ATOM 0 HD2 PRO A 4 9.176 -6.226 -1.718 1.00 0.00 H new ATOM 0 HD3 PRO A 4 10.453 -6.809 -0.669 1.00 0.00 H new ATOM 62 N LYS A 5 9.340 -3.361 -3.183 1.00 0.00 N ATOM 63 CA LYS A 5 8.435 -2.517 -3.946 1.00 0.00 C ATOM 64 C LYS A 5 8.117 -1.257 -3.139 1.00 0.00 C ATOM 65 O LYS A 5 7.890 -0.191 -3.709 1.00 0.00 O ATOM 66 CB LYS A 5 7.194 -3.306 -4.368 1.00 0.00 C ATOM 67 CG LYS A 5 7.347 -3.848 -5.791 1.00 0.00 C ATOM 68 CD LYS A 5 7.671 -5.343 -5.777 1.00 0.00 C ATOM 69 CE LYS A 5 9.184 -5.575 -5.761 1.00 0.00 C ATOM 70 NZ LYS A 5 9.487 -6.989 -5.443 1.00 0.00 N ATOM 0 H LYS A 5 9.154 -4.361 -3.256 1.00 0.00 H new ATOM 0 HA LYS A 5 8.908 -2.192 -4.873 1.00 0.00 H new ATOM 0 HB2 LYS A 5 7.031 -4.132 -3.676 1.00 0.00 H new ATOM 0 HB3 LYS A 5 6.314 -2.665 -4.312 1.00 0.00 H new ATOM 0 HG2 LYS A 5 6.427 -3.677 -6.350 1.00 0.00 H new ATOM 0 HG3 LYS A 5 8.139 -3.306 -6.307 1.00 0.00 H new ATOM 0 HD2 LYS A 5 7.219 -5.809 -4.902 1.00 0.00 H new ATOM 0 HD3 LYS A 5 7.235 -5.822 -6.654 1.00 0.00 H new ATOM 0 HE2 LYS A 5 9.608 -5.315 -6.731 1.00 0.00 H new ATOM 0 HE3 LYS A 5 9.651 -4.922 -5.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 10.518 -7.126 -5.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 9.084 -7.230 -4.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 9.072 -7.605 -6.171 1.00 0.00 H new ATOM 84 N LEU A 6 8.112 -1.420 -1.824 1.00 0.00 N ATOM 85 CA LEU A 6 7.826 -0.309 -0.933 1.00 0.00 C ATOM 86 C LEU A 6 9.128 0.425 -0.605 1.00 0.00 C ATOM 87 O LEU A 6 9.318 1.570 -1.011 1.00 0.00 O ATOM 88 CB LEU A 6 7.066 -0.795 0.303 1.00 0.00 C ATOM 89 CG LEU A 6 6.500 0.296 1.215 1.00 0.00 C ATOM 90 CD1 LEU A 6 5.265 0.947 0.589 1.00 0.00 C ATOM 91 CD2 LEU A 6 6.212 -0.254 2.614 1.00 0.00 C ATOM 0 H LEU A 6 8.302 -2.305 -1.354 1.00 0.00 H new ATOM 0 HA LEU A 6 7.168 0.410 -1.421 1.00 0.00 H new ATOM 0 HB2 LEU A 6 6.242 -1.428 -0.027 1.00 0.00 H new ATOM 0 HB3 LEU A 6 7.734 -1.423 0.892 1.00 0.00 H new ATOM 0 HG LEU A 6 7.254 1.075 1.325 1.00 0.00 H new ATOM 0 HD11 LEU A 6 4.882 1.719 1.257 1.00 0.00 H new ATOM 0 HD12 LEU A 6 5.535 1.396 -0.367 1.00 0.00 H new ATOM 0 HD13 LEU A 6 4.496 0.191 0.430 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.811 0.541 3.242 1.00 0.00 H new ATOM 0 HD22 LEU A 6 5.485 -1.063 2.544 1.00 0.00 H new ATOM 0 HD23 LEU A 6 7.135 -0.632 3.053 1.00 0.00 H new ATOM 103 N LYS A 7 9.990 -0.265 0.127 1.00 0.00 N ATOM 104 CA LYS A 7 11.269 0.306 0.514 1.00 0.00 C ATOM 105 C LYS A 7 11.838 1.111 -0.656 1.00 0.00 C ATOM 106 O LYS A 7 12.527 2.109 -0.451 1.00 0.00 O ATOM 107 CB LYS A 7 12.211 -0.785 1.025 1.00 0.00 C ATOM 108 CG LYS A 7 13.197 -0.223 2.051 1.00 0.00 C ATOM 109 CD LYS A 7 12.622 -0.304 3.466 1.00 0.00 C ATOM 110 CE LYS A 7 13.228 0.775 4.367 1.00 0.00 C ATOM 111 NZ LYS A 7 12.833 0.555 5.776 1.00 0.00 N ATOM 0 H LYS A 7 9.828 -1.215 0.462 1.00 0.00 H new ATOM 0 HA LYS A 7 11.140 0.999 1.346 1.00 0.00 H new ATOM 0 HB2 LYS A 7 11.630 -1.589 1.476 1.00 0.00 H new ATOM 0 HB3 LYS A 7 12.759 -1.218 0.188 1.00 0.00 H new ATOM 0 HG2 LYS A 7 14.133 -0.779 2.003 1.00 0.00 H new ATOM 0 HG3 LYS A 7 13.429 0.814 1.808 1.00 0.00 H new ATOM 0 HD2 LYS A 7 11.539 -0.186 3.430 1.00 0.00 H new ATOM 0 HD3 LYS A 7 12.822 -1.289 3.888 1.00 0.00 H new ATOM 0 HE2 LYS A 7 14.315 0.761 4.281 1.00 0.00 H new ATOM 0 HE3 LYS A 7 12.895 1.760 4.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 13.252 1.296 6.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 11.797 0.591 5.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 13.172 -0.377 6.090 1.00 0.00 H new ATOM 125 N GLN A 8 11.528 0.648 -1.858 1.00 0.00 N ATOM 126 CA GLN A 8 12.000 1.312 -3.061 1.00 0.00 C ATOM 127 C GLN A 8 11.184 2.580 -3.321 1.00 0.00 C ATOM 128 O GLN A 8 11.741 3.672 -3.420 1.00 0.00 O ATOM 129 CB GLN A 8 11.947 0.369 -4.264 1.00 0.00 C ATOM 130 CG GLN A 8 13.331 0.212 -4.898 1.00 0.00 C ATOM 131 CD GLN A 8 13.379 0.868 -6.280 1.00 0.00 C ATOM 132 OE1 GLN A 8 12.496 1.612 -6.673 1.00 0.00 O ATOM 133 NE2 GLN A 8 14.457 0.551 -6.991 1.00 0.00 N ATOM 0 H GLN A 8 10.955 -0.180 -2.025 1.00 0.00 H new ATOM 0 HA GLN A 8 13.041 1.598 -2.911 1.00 0.00 H new ATOM 0 HB2 GLN A 8 11.574 -0.606 -3.950 1.00 0.00 H new ATOM 0 HB3 GLN A 8 11.246 0.756 -5.003 1.00 0.00 H new ATOM 0 HG2 GLN A 8 14.084 0.662 -4.251 1.00 0.00 H new ATOM 0 HG3 GLN A 8 13.577 -0.846 -4.985 1.00 0.00 H new ATOM 0 HE21 GLN A 8 15.158 -0.079 -6.601 1.00 0.00 H new ATOM 0 HE22 GLN A 8 14.583 0.937 -7.927 1.00 0.00 H new ATOM 142 N ALA A 9 9.876 2.393 -3.426 1.00 0.00 N ATOM 143 CA ALA A 9 8.978 3.508 -3.674 1.00 0.00 C ATOM 144 C ALA A 9 9.304 4.645 -2.703 1.00 0.00 C ATOM 145 O ALA A 9 9.403 5.802 -3.108 1.00 0.00 O ATOM 146 CB ALA A 9 7.529 3.034 -3.550 1.00 0.00 C ATOM 0 H ALA A 9 9.417 1.486 -3.344 1.00 0.00 H new ATOM 0 HA ALA A 9 9.111 3.890 -4.686 1.00 0.00 H new ATOM 0 HB1 ALA A 9 6.855 3.870 -3.736 1.00 0.00 H new ATOM 0 HB2 ALA A 9 7.340 2.247 -4.280 1.00 0.00 H new ATOM 0 HB3 ALA A 9 7.358 2.647 -2.546 1.00 0.00 H new ATOM 152 N LEU A 10 9.463 4.276 -1.441 1.00 0.00 N ATOM 153 CA LEU A 10 9.776 5.250 -0.409 1.00 0.00 C ATOM 154 C LEU A 10 11.168 5.829 -0.667 1.00 0.00 C ATOM 155 O LEU A 10 11.309 7.021 -0.935 1.00 0.00 O ATOM 156 CB LEU A 10 9.614 4.631 0.980 1.00 0.00 C ATOM 157 CG LEU A 10 8.182 4.305 1.407 1.00 0.00 C ATOM 158 CD1 LEU A 10 8.167 3.266 2.530 1.00 0.00 C ATOM 159 CD2 LEU A 10 7.422 5.576 1.791 1.00 0.00 C ATOM 0 H LEU A 10 9.381 3.315 -1.109 1.00 0.00 H new ATOM 0 HA LEU A 10 9.073 6.082 -0.444 1.00 0.00 H new ATOM 0 HB2 LEU A 10 10.201 3.713 1.017 1.00 0.00 H new ATOM 0 HB3 LEU A 10 10.044 5.314 1.713 1.00 0.00 H new ATOM 0 HG LEU A 10 7.663 3.865 0.555 1.00 0.00 H new ATOM 0 HD11 LEU A 10 7.137 3.053 2.814 1.00 0.00 H new ATOM 0 HD12 LEU A 10 8.645 2.350 2.184 1.00 0.00 H new ATOM 0 HD13 LEU A 10 8.708 3.655 3.393 1.00 0.00 H new ATOM 0 HD21 LEU A 10 6.407 5.316 2.091 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.931 6.067 2.620 1.00 0.00 H new ATOM 0 HD23 LEU A 10 7.386 6.251 0.936 1.00 0.00 H new ATOM 171 N GLU A 11 12.162 4.958 -0.575 1.00 0.00 N ATOM 172 CA GLU A 11 13.539 5.368 -0.795 1.00 0.00 C ATOM 173 C GLU A 11 13.624 6.328 -1.983 1.00 0.00 C ATOM 174 O GLU A 11 14.379 7.298 -1.949 1.00 0.00 O ATOM 175 CB GLU A 11 14.446 4.154 -1.005 1.00 0.00 C ATOM 176 CG GLU A 11 14.939 3.599 0.332 1.00 0.00 C ATOM 177 CD GLU A 11 16.347 3.015 0.198 1.00 0.00 C ATOM 178 OE1 GLU A 11 16.500 2.087 -0.625 1.00 0.00 O ATOM 179 OE2 GLU A 11 17.238 3.509 0.922 1.00 0.00 O ATOM 0 H GLU A 11 12.042 3.970 -0.351 1.00 0.00 H new ATOM 0 HA GLU A 11 13.888 5.891 0.095 1.00 0.00 H new ATOM 0 HB2 GLU A 11 13.903 3.379 -1.546 1.00 0.00 H new ATOM 0 HB3 GLU A 11 15.299 4.436 -1.622 1.00 0.00 H new ATOM 0 HG2 GLU A 11 14.940 4.391 1.081 1.00 0.00 H new ATOM 0 HG3 GLU A 11 14.254 2.828 0.685 1.00 0.00 H new ATOM 186 N LEU A 12 12.839 6.024 -3.006 1.00 0.00 N ATOM 187 CA LEU A 12 12.816 6.848 -4.202 1.00 0.00 C ATOM 188 C LEU A 12 12.144 8.186 -3.883 1.00 0.00 C ATOM 189 O LEU A 12 12.624 9.240 -4.296 1.00 0.00 O ATOM 190 CB LEU A 12 12.161 6.093 -5.361 1.00 0.00 C ATOM 191 CG LEU A 12 11.938 6.896 -6.644 1.00 0.00 C ATOM 192 CD1 LEU A 12 13.271 7.311 -7.270 1.00 0.00 C ATOM 193 CD2 LEU A 12 11.059 6.122 -7.629 1.00 0.00 C ATOM 0 H LEU A 12 12.214 5.218 -3.031 1.00 0.00 H new ATOM 0 HA LEU A 12 13.832 7.071 -4.529 1.00 0.00 H new ATOM 0 HB2 LEU A 12 12.779 5.228 -5.600 1.00 0.00 H new ATOM 0 HB3 LEU A 12 11.197 5.712 -5.022 1.00 0.00 H new ATOM 0 HG LEU A 12 11.405 7.811 -6.386 1.00 0.00 H new ATOM 0 HD11 LEU A 12 13.084 7.880 -8.180 1.00 0.00 H new ATOM 0 HD12 LEU A 12 13.828 7.928 -6.565 1.00 0.00 H new ATOM 0 HD13 LEU A 12 13.852 6.421 -7.512 1.00 0.00 H new ATOM 0 HD21 LEU A 12 10.916 6.715 -8.532 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.543 5.180 -7.886 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.091 5.919 -7.171 1.00 0.00 H new ATOM 205 N PHE A 13 11.044 8.099 -3.149 1.00 0.00 N ATOM 206 CA PHE A 13 10.302 9.289 -2.769 1.00 0.00 C ATOM 207 C PHE A 13 11.227 10.334 -2.141 1.00 0.00 C ATOM 208 O PHE A 13 11.178 11.509 -2.503 1.00 0.00 O ATOM 209 CB PHE A 13 9.264 8.856 -1.732 1.00 0.00 C ATOM 210 CG PHE A 13 8.265 9.953 -1.357 1.00 0.00 C ATOM 211 CD1 PHE A 13 7.180 10.183 -2.145 1.00 0.00 C ATOM 212 CD2 PHE A 13 8.461 10.697 -0.236 1.00 0.00 C ATOM 213 CE1 PHE A 13 6.253 11.201 -1.797 1.00 0.00 C ATOM 214 CE2 PHE A 13 7.534 11.715 0.112 1.00 0.00 C ATOM 215 CZ PHE A 13 6.450 11.945 -0.675 1.00 0.00 C ATOM 0 H PHE A 13 10.649 7.223 -2.807 1.00 0.00 H new ATOM 0 HA PHE A 13 9.838 9.735 -3.648 1.00 0.00 H new ATOM 0 HB2 PHE A 13 8.716 7.996 -2.118 1.00 0.00 H new ATOM 0 HB3 PHE A 13 9.781 8.526 -0.831 1.00 0.00 H new ATOM 0 HD1 PHE A 13 7.024 9.591 -3.035 1.00 0.00 H new ATOM 0 HD2 PHE A 13 9.322 10.514 0.390 1.00 0.00 H new ATOM 0 HE1 PHE A 13 5.392 11.385 -2.423 1.00 0.00 H new ATOM 0 HE2 PHE A 13 7.690 12.306 1.002 1.00 0.00 H new ATOM 0 HZ PHE A 13 5.745 12.719 -0.410 1.00 0.00 H new ATOM 225 N LYS A 14 12.048 9.869 -1.211 1.00 0.00 N ATOM 226 CA LYS A 14 12.982 10.749 -0.530 1.00 0.00 C ATOM 227 C LYS A 14 13.960 11.336 -1.550 1.00 0.00 C ATOM 228 O LYS A 14 14.255 12.529 -1.518 1.00 0.00 O ATOM 229 CB LYS A 14 13.665 10.015 0.625 1.00 0.00 C ATOM 230 CG LYS A 14 14.729 10.896 1.283 1.00 0.00 C ATOM 231 CD LYS A 14 15.669 10.062 2.156 1.00 0.00 C ATOM 232 CE LYS A 14 16.875 9.574 1.352 1.00 0.00 C ATOM 233 NZ LYS A 14 17.531 8.439 2.040 1.00 0.00 N ATOM 0 H LYS A 14 12.086 8.894 -0.913 1.00 0.00 H new ATOM 0 HA LYS A 14 12.453 11.587 -0.076 1.00 0.00 H new ATOM 0 HB2 LYS A 14 12.921 9.723 1.366 1.00 0.00 H new ATOM 0 HB3 LYS A 14 14.124 9.098 0.257 1.00 0.00 H new ATOM 0 HG2 LYS A 14 15.304 11.413 0.515 1.00 0.00 H new ATOM 0 HG3 LYS A 14 14.247 11.662 1.890 1.00 0.00 H new ATOM 0 HD2 LYS A 14 16.009 10.658 3.003 1.00 0.00 H new ATOM 0 HD3 LYS A 14 15.129 9.207 2.564 1.00 0.00 H new ATOM 0 HE2 LYS A 14 16.556 9.268 0.356 1.00 0.00 H new ATOM 0 HE3 LYS A 14 17.587 10.389 1.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 18.348 8.120 1.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 17.853 8.743 2.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 16.854 7.656 2.142 1.00 0.00 H new ATOM 247 N SER A 15 14.437 10.469 -2.431 1.00 0.00 N ATOM 248 CA SER A 15 15.375 10.886 -3.459 1.00 0.00 C ATOM 249 C SER A 15 14.679 11.808 -4.461 1.00 0.00 C ATOM 250 O SER A 15 15.309 12.691 -5.040 1.00 0.00 O ATOM 251 CB SER A 15 15.977 9.677 -4.179 1.00 0.00 C ATOM 252 OG SER A 15 16.806 10.064 -5.271 1.00 0.00 O ATOM 0 H SER A 15 14.191 9.479 -2.454 1.00 0.00 H new ATOM 0 HA SER A 15 16.188 11.431 -2.979 1.00 0.00 H new ATOM 0 HB2 SER A 15 16.561 9.088 -3.472 1.00 0.00 H new ATOM 0 HB3 SER A 15 15.175 9.035 -4.543 1.00 0.00 H new ATOM 0 HG SER A 15 17.172 9.264 -5.703 1.00 0.00 H new ATOM 258 N LEU A 16 13.387 11.571 -4.636 1.00 0.00 N ATOM 259 CA LEU A 16 12.597 12.370 -5.558 1.00 0.00 C ATOM 260 C LEU A 16 12.661 13.839 -5.137 1.00 0.00 C ATOM 261 O LEU A 16 12.838 14.144 -3.959 1.00 0.00 O ATOM 262 CB LEU A 16 11.173 11.820 -5.659 1.00 0.00 C ATOM 263 CG LEU A 16 10.976 10.638 -6.610 1.00 0.00 C ATOM 264 CD1 LEU A 16 9.498 10.258 -6.714 1.00 0.00 C ATOM 265 CD2 LEU A 16 11.590 10.929 -7.981 1.00 0.00 C ATOM 0 H LEU A 16 12.867 10.837 -4.155 1.00 0.00 H new ATOM 0 HA LEU A 16 13.009 12.309 -6.565 1.00 0.00 H new ATOM 0 HB2 LEU A 16 10.850 11.517 -4.663 1.00 0.00 H new ATOM 0 HB3 LEU A 16 10.514 12.629 -5.975 1.00 0.00 H new ATOM 0 HG LEU A 16 11.502 9.777 -6.197 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.386 9.415 -7.396 1.00 0.00 H new ATOM 0 HD12 LEU A 16 9.124 9.980 -5.729 1.00 0.00 H new ATOM 0 HD13 LEU A 16 8.929 11.108 -7.091 1.00 0.00 H new ATOM 0 HD21 LEU A 16 11.436 10.073 -8.638 1.00 0.00 H new ATOM 0 HD22 LEU A 16 11.114 11.809 -8.414 1.00 0.00 H new ATOM 0 HD23 LEU A 16 12.659 11.113 -7.869 1.00 0.00 H new ATOM 277 N PRO A 17 12.509 14.734 -6.150 1.00 0.00 N ATOM 278 CA PRO A 17 12.548 16.164 -5.897 1.00 0.00 C ATOM 279 C PRO A 17 11.252 16.639 -5.236 1.00 0.00 C ATOM 280 O PRO A 17 10.165 16.201 -5.608 1.00 0.00 O ATOM 281 CB PRO A 17 12.788 16.798 -7.257 1.00 0.00 C ATOM 282 CG PRO A 17 12.413 15.741 -8.282 1.00 0.00 C ATOM 283 CD PRO A 17 12.298 14.410 -7.557 1.00 0.00 C ATOM 0 HA PRO A 17 13.334 16.446 -5.197 1.00 0.00 H new ATOM 0 HB2 PRO A 17 12.182 17.695 -7.382 1.00 0.00 H new ATOM 0 HB3 PRO A 17 13.830 17.099 -7.369 1.00 0.00 H new ATOM 0 HG2 PRO A 17 11.470 15.995 -8.765 1.00 0.00 H new ATOM 0 HG3 PRO A 17 13.168 15.685 -9.066 1.00 0.00 H new ATOM 0 HD2 PRO A 17 11.320 13.956 -7.716 1.00 0.00 H new ATOM 0 HD3 PRO A 17 13.042 13.699 -7.915 1.00 0.00 H new ATOM 291 N LYS A 18 11.411 17.530 -4.268 1.00 0.00 N ATOM 292 CA LYS A 18 10.267 18.069 -3.553 1.00 0.00 C ATOM 293 C LYS A 18 9.086 18.204 -4.516 1.00 0.00 C ATOM 294 O LYS A 18 8.099 17.480 -4.399 1.00 0.00 O ATOM 295 CB LYS A 18 10.641 19.376 -2.851 1.00 0.00 C ATOM 296 CG LYS A 18 9.418 20.012 -2.187 1.00 0.00 C ATOM 297 CD LYS A 18 9.745 21.411 -1.660 1.00 0.00 C ATOM 298 CE LYS A 18 8.872 21.760 -0.453 1.00 0.00 C ATOM 299 NZ LYS A 18 9.226 23.097 0.073 1.00 0.00 N ATOM 0 H LYS A 18 12.314 17.892 -3.962 1.00 0.00 H new ATOM 0 HA LYS A 18 9.957 17.387 -2.762 1.00 0.00 H new ATOM 0 HB2 LYS A 18 11.408 19.183 -2.100 1.00 0.00 H new ATOM 0 HB3 LYS A 18 11.070 20.071 -3.573 1.00 0.00 H new ATOM 0 HG2 LYS A 18 8.600 20.072 -2.905 1.00 0.00 H new ATOM 0 HG3 LYS A 18 9.076 19.381 -1.366 1.00 0.00 H new ATOM 0 HD2 LYS A 18 10.797 21.461 -1.379 1.00 0.00 H new ATOM 0 HD3 LYS A 18 9.591 22.146 -2.450 1.00 0.00 H new ATOM 0 HE2 LYS A 18 7.821 21.742 -0.740 1.00 0.00 H new ATOM 0 HE3 LYS A 18 9.002 21.010 0.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 8.624 23.318 0.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 10.224 23.102 0.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 9.079 23.812 -0.668 1.00 0.00 H new ATOM 313 N GLU A 19 9.226 19.137 -5.446 1.00 0.00 N ATOM 314 CA GLU A 19 8.183 19.377 -6.429 1.00 0.00 C ATOM 315 C GLU A 19 7.482 18.065 -6.790 1.00 0.00 C ATOM 316 O GLU A 19 6.260 17.963 -6.692 1.00 0.00 O ATOM 317 CB GLU A 19 8.751 20.056 -7.676 1.00 0.00 C ATOM 318 CG GLU A 19 10.189 19.607 -7.939 1.00 0.00 C ATOM 319 CD GLU A 19 11.181 20.727 -7.620 1.00 0.00 C ATOM 320 OE1 GLU A 19 11.523 20.858 -6.425 1.00 0.00 O ATOM 321 OE2 GLU A 19 11.574 21.428 -8.578 1.00 0.00 O ATOM 0 H GLU A 19 10.046 19.736 -5.540 1.00 0.00 H new ATOM 0 HA GLU A 19 7.447 20.051 -5.992 1.00 0.00 H new ATOM 0 HB2 GLU A 19 8.129 19.818 -8.539 1.00 0.00 H new ATOM 0 HB3 GLU A 19 8.722 21.138 -7.550 1.00 0.00 H new ATOM 0 HG2 GLU A 19 10.417 18.731 -7.332 1.00 0.00 H new ATOM 0 HG3 GLU A 19 10.295 19.308 -8.982 1.00 0.00 H new ATOM 328 N LEU A 20 8.286 17.095 -7.200 1.00 0.00 N ATOM 329 CA LEU A 20 7.759 15.795 -7.576 1.00 0.00 C ATOM 330 C LEU A 20 7.158 15.117 -6.343 1.00 0.00 C ATOM 331 O LEU A 20 6.064 14.557 -6.408 1.00 0.00 O ATOM 332 CB LEU A 20 8.836 14.961 -8.272 1.00 0.00 C ATOM 333 CG LEU A 20 9.075 15.274 -9.750 1.00 0.00 C ATOM 334 CD1 LEU A 20 9.987 14.226 -10.392 1.00 0.00 C ATOM 335 CD2 LEU A 20 7.751 15.419 -10.502 1.00 0.00 C ATOM 0 H LEU A 20 9.299 17.184 -7.280 1.00 0.00 H new ATOM 0 HA LEU A 20 6.955 15.906 -8.303 1.00 0.00 H new ATOM 0 HB2 LEU A 20 9.775 15.096 -7.736 1.00 0.00 H new ATOM 0 HB3 LEU A 20 8.567 13.909 -8.183 1.00 0.00 H new ATOM 0 HG LEU A 20 9.589 16.233 -9.817 1.00 0.00 H new ATOM 0 HD11 LEU A 20 10.141 14.472 -11.443 1.00 0.00 H new ATOM 0 HD12 LEU A 20 10.948 14.216 -9.877 1.00 0.00 H new ATOM 0 HD13 LEU A 20 9.523 13.243 -10.314 1.00 0.00 H new ATOM 0 HD21 LEU A 20 7.950 15.641 -11.550 1.00 0.00 H new ATOM 0 HD22 LEU A 20 7.187 14.489 -10.429 1.00 0.00 H new ATOM 0 HD23 LEU A 20 7.170 16.230 -10.063 1.00 0.00 H new ATOM 347 N ARG A 21 7.899 15.190 -5.247 1.00 0.00 N ATOM 348 CA ARG A 21 7.452 14.591 -4.000 1.00 0.00 C ATOM 349 C ARG A 21 6.005 14.990 -3.708 1.00 0.00 C ATOM 350 O ARG A 21 5.307 14.304 -2.963 1.00 0.00 O ATOM 351 CB ARG A 21 8.340 15.025 -2.832 1.00 0.00 C ATOM 352 CG ARG A 21 9.758 14.471 -2.984 1.00 0.00 C ATOM 353 CD ARG A 21 10.478 14.427 -1.635 1.00 0.00 C ATOM 354 NE ARG A 21 11.873 14.896 -1.791 1.00 0.00 N ATOM 355 CZ ARG A 21 12.612 15.399 -0.793 1.00 0.00 C ATOM 356 NH1 ARG A 21 12.094 15.502 0.439 1.00 0.00 N ATOM 357 NH2 ARG A 21 13.869 15.799 -1.026 1.00 0.00 N ATOM 0 H ARG A 21 8.806 15.655 -5.196 1.00 0.00 H new ATOM 0 HA ARG A 21 7.518 13.509 -4.109 1.00 0.00 H new ATOM 0 HB2 ARG A 21 8.375 16.113 -2.782 1.00 0.00 H new ATOM 0 HB3 ARG A 21 7.908 14.676 -1.894 1.00 0.00 H new ATOM 0 HG2 ARG A 21 9.717 13.469 -3.411 1.00 0.00 H new ATOM 0 HG3 ARG A 21 10.322 15.091 -3.681 1.00 0.00 H new ATOM 0 HD2 ARG A 21 9.954 15.053 -0.913 1.00 0.00 H new ATOM 0 HD3 ARG A 21 10.469 13.411 -1.242 1.00 0.00 H new ATOM 0 HE ARG A 21 12.298 14.832 -2.716 1.00 0.00 H new ATOM 0 HH11 ARG A 21 11.137 15.197 0.617 1.00 0.00 H new ATOM 0 HH12 ARG A 21 12.657 15.885 1.199 1.00 0.00 H new ATOM 0 HH21 ARG A 21 14.264 15.721 -1.963 1.00 0.00 H new ATOM 0 HH22 ARG A 21 14.431 16.182 -0.266 1.00 0.00 H new ATOM 371 N SER A 22 5.596 16.097 -4.310 1.00 0.00 N ATOM 372 CA SER A 22 4.244 16.595 -4.124 1.00 0.00 C ATOM 373 C SER A 22 3.302 15.945 -5.139 1.00 0.00 C ATOM 374 O SER A 22 2.128 15.721 -4.847 1.00 0.00 O ATOM 375 CB SER A 22 4.195 18.119 -4.255 1.00 0.00 C ATOM 376 OG SER A 22 3.331 18.710 -3.289 1.00 0.00 O ATOM 0 H SER A 22 6.178 16.663 -4.927 1.00 0.00 H new ATOM 0 HA SER A 22 3.919 16.333 -3.117 1.00 0.00 H new ATOM 0 HB2 SER A 22 5.200 18.525 -4.139 1.00 0.00 H new ATOM 0 HB3 SER A 22 3.856 18.386 -5.256 1.00 0.00 H new ATOM 0 HG SER A 22 3.328 19.683 -3.404 1.00 0.00 H new ATOM 382 N GLN A 23 3.852 15.659 -6.310 1.00 0.00 N ATOM 383 CA GLN A 23 3.075 15.039 -7.370 1.00 0.00 C ATOM 384 C GLN A 23 2.888 13.547 -7.087 1.00 0.00 C ATOM 385 O GLN A 23 1.773 13.032 -7.162 1.00 0.00 O ATOM 386 CB GLN A 23 3.733 15.260 -8.733 1.00 0.00 C ATOM 387 CG GLN A 23 3.882 16.752 -9.034 1.00 0.00 C ATOM 388 CD GLN A 23 2.785 17.231 -9.987 1.00 0.00 C ATOM 389 OE1 GLN A 23 1.718 17.661 -9.579 1.00 0.00 O ATOM 390 NE2 GLN A 23 3.105 17.134 -11.274 1.00 0.00 N ATOM 0 H GLN A 23 4.826 15.845 -6.548 1.00 0.00 H new ATOM 0 HA GLN A 23 2.092 15.510 -7.397 1.00 0.00 H new ATOM 0 HB2 GLN A 23 4.713 14.782 -8.750 1.00 0.00 H new ATOM 0 HB3 GLN A 23 3.134 14.786 -9.511 1.00 0.00 H new ATOM 0 HG2 GLN A 23 3.836 17.320 -8.105 1.00 0.00 H new ATOM 0 HG3 GLN A 23 4.860 16.942 -9.475 1.00 0.00 H new ATOM 0 HE21 GLN A 23 4.016 16.765 -11.547 1.00 0.00 H new ATOM 0 HE22 GLN A 23 2.440 17.429 -11.989 1.00 0.00 H new ATOM 399 N VAL A 24 3.995 12.894 -6.767 1.00 0.00 N ATOM 400 CA VAL A 24 3.967 11.471 -6.472 1.00 0.00 C ATOM 401 C VAL A 24 2.773 11.166 -5.566 1.00 0.00 C ATOM 402 O VAL A 24 1.907 10.368 -5.921 1.00 0.00 O ATOM 403 CB VAL A 24 5.303 11.036 -5.867 1.00 0.00 C ATOM 404 CG1 VAL A 24 5.928 12.166 -5.047 1.00 0.00 C ATOM 405 CG2 VAL A 24 5.136 9.772 -5.022 1.00 0.00 C ATOM 0 H VAL A 24 4.918 13.324 -6.705 1.00 0.00 H new ATOM 0 HA VAL A 24 3.836 10.894 -7.387 1.00 0.00 H new ATOM 0 HB VAL A 24 5.982 10.803 -6.687 1.00 0.00 H new ATOM 0 HG11 VAL A 24 6.877 11.830 -4.628 1.00 0.00 H new ATOM 0 HG12 VAL A 24 6.100 13.029 -5.690 1.00 0.00 H new ATOM 0 HG13 VAL A 24 5.253 12.445 -4.238 1.00 0.00 H new ATOM 0 HG21 VAL A 24 6.100 9.484 -4.604 1.00 0.00 H new ATOM 0 HG22 VAL A 24 4.432 9.966 -4.212 1.00 0.00 H new ATOM 0 HG23 VAL A 24 4.756 8.964 -5.647 1.00 0.00 H new ATOM 415 N LEU A 25 2.764 11.819 -4.413 1.00 0.00 N ATOM 416 CA LEU A 25 1.690 11.627 -3.453 1.00 0.00 C ATOM 417 C LEU A 25 0.351 11.592 -4.192 1.00 0.00 C ATOM 418 O LEU A 25 -0.496 10.747 -3.910 1.00 0.00 O ATOM 419 CB LEU A 25 1.758 12.689 -2.354 1.00 0.00 C ATOM 420 CG LEU A 25 3.008 12.663 -1.472 1.00 0.00 C ATOM 421 CD1 LEU A 25 3.097 13.924 -0.609 1.00 0.00 C ATOM 422 CD2 LEU A 25 3.058 11.387 -0.629 1.00 0.00 C ATOM 0 H LEU A 25 3.483 12.481 -4.122 1.00 0.00 H new ATOM 0 HA LEU A 25 1.800 10.668 -2.946 1.00 0.00 H new ATOM 0 HB2 LEU A 25 1.687 13.671 -2.821 1.00 0.00 H new ATOM 0 HB3 LEU A 25 0.883 12.577 -1.713 1.00 0.00 H new ATOM 0 HG LEU A 25 3.884 12.655 -2.121 1.00 0.00 H new ATOM 0 HD11 LEU A 25 3.994 13.880 0.008 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.142 14.803 -1.252 1.00 0.00 H new ATOM 0 HD13 LEU A 25 2.218 13.989 0.033 1.00 0.00 H new ATOM 0 HD21 LEU A 25 3.956 11.394 -0.011 1.00 0.00 H new ATOM 0 HD22 LEU A 25 2.177 11.339 0.012 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.076 10.517 -1.286 1.00 0.00 H new ATOM 434 N LEU A 26 0.202 12.522 -5.125 1.00 0.00 N ATOM 435 CA LEU A 26 -1.020 12.608 -5.907 1.00 0.00 C ATOM 436 C LEU A 26 -1.105 11.403 -6.846 1.00 0.00 C ATOM 437 O LEU A 26 -2.134 10.732 -6.908 1.00 0.00 O ATOM 438 CB LEU A 26 -1.101 13.955 -6.627 1.00 0.00 C ATOM 439 CG LEU A 26 -1.805 15.081 -5.866 1.00 0.00 C ATOM 440 CD1 LEU A 26 -3.283 14.751 -5.645 1.00 0.00 C ATOM 441 CD2 LEU A 26 -1.084 15.391 -4.553 1.00 0.00 C ATOM 0 H LEU A 26 0.907 13.222 -5.357 1.00 0.00 H new ATOM 0 HA LEU A 26 -1.893 12.568 -5.256 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -0.088 14.280 -6.862 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.616 13.807 -7.576 1.00 0.00 H new ATOM 0 HG LEU A 26 -1.763 15.984 -6.476 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -3.761 15.567 -5.102 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -3.775 14.620 -6.609 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -3.368 13.831 -5.066 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -1.605 16.195 -4.033 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.072 14.500 -3.925 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.060 15.700 -4.764 1.00 0.00 H new ATOM 453 N GLU A 27 -0.010 11.165 -7.553 1.00 0.00 N ATOM 454 CA GLU A 27 0.052 10.053 -8.486 1.00 0.00 C ATOM 455 C GLU A 27 -0.515 8.787 -7.840 1.00 0.00 C ATOM 456 O GLU A 27 -1.428 8.166 -8.381 1.00 0.00 O ATOM 457 CB GLU A 27 1.484 9.826 -8.974 1.00 0.00 C ATOM 458 CG GLU A 27 1.952 10.985 -9.857 1.00 0.00 C ATOM 459 CD GLU A 27 2.463 10.474 -11.206 1.00 0.00 C ATOM 460 OE1 GLU A 27 3.669 10.151 -11.270 1.00 0.00 O ATOM 461 OE2 GLU A 27 1.637 10.419 -12.142 1.00 0.00 O ATOM 0 H GLU A 27 0.842 11.724 -7.498 1.00 0.00 H new ATOM 0 HA GLU A 27 -0.558 10.298 -9.355 1.00 0.00 H new ATOM 0 HB2 GLU A 27 2.152 9.723 -8.119 1.00 0.00 H new ATOM 0 HB3 GLU A 27 1.538 8.893 -9.534 1.00 0.00 H new ATOM 0 HG2 GLU A 27 1.129 11.681 -10.016 1.00 0.00 H new ATOM 0 HG3 GLU A 27 2.743 11.537 -9.350 1.00 0.00 H new ATOM 468 N TYR A 28 0.051 8.442 -6.693 1.00 0.00 N ATOM 469 CA TYR A 28 -0.386 7.261 -5.968 1.00 0.00 C ATOM 470 C TYR A 28 -1.911 7.137 -5.992 1.00 0.00 C ATOM 471 O TYR A 28 -2.446 6.100 -6.380 1.00 0.00 O ATOM 472 CB TYR A 28 0.076 7.459 -4.523 1.00 0.00 C ATOM 473 CG TYR A 28 1.589 7.341 -4.331 1.00 0.00 C ATOM 474 CD1 TYR A 28 2.325 6.510 -5.150 1.00 0.00 C ATOM 475 CD2 TYR A 28 2.217 8.066 -3.339 1.00 0.00 C ATOM 476 CE1 TYR A 28 3.750 6.398 -4.970 1.00 0.00 C ATOM 477 CE2 TYR A 28 3.642 7.955 -3.158 1.00 0.00 C ATOM 478 CZ TYR A 28 4.338 7.126 -3.983 1.00 0.00 C ATOM 479 OH TYR A 28 5.683 7.021 -3.812 1.00 0.00 O ATOM 0 H TYR A 28 0.809 8.960 -6.248 1.00 0.00 H new ATOM 0 HA TYR A 28 0.027 6.358 -6.419 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -0.248 8.442 -4.181 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -0.419 6.722 -3.890 1.00 0.00 H new ATOM 0 HD1 TYR A 28 1.833 5.943 -5.926 1.00 0.00 H new ATOM 0 HD2 TYR A 28 1.640 8.717 -2.698 1.00 0.00 H new ATOM 0 HE1 TYR A 28 4.338 5.751 -5.604 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.146 8.517 -2.386 1.00 0.00 H new ATOM 0 HH TYR A 28 5.965 7.598 -3.072 1.00 0.00 H new ATOM 489 N ALA A 29 -2.566 8.208 -5.571 1.00 0.00 N ATOM 490 CA ALA A 29 -4.019 8.232 -5.539 1.00 0.00 C ATOM 491 C ALA A 29 -4.561 7.862 -6.921 1.00 0.00 C ATOM 492 O ALA A 29 -5.569 7.164 -7.029 1.00 0.00 O ATOM 493 CB ALA A 29 -4.497 9.609 -5.074 1.00 0.00 C ATOM 0 H ALA A 29 -2.118 9.066 -5.249 1.00 0.00 H new ATOM 0 HA ALA A 29 -4.400 7.498 -4.828 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -5.587 9.627 -5.050 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -4.109 9.811 -4.076 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -4.137 10.372 -5.765 1.00 0.00 H new ATOM 499 N ALA A 30 -3.870 8.345 -7.942 1.00 0.00 N ATOM 500 CA ALA A 30 -4.269 8.074 -9.312 1.00 0.00 C ATOM 501 C ALA A 30 -4.048 6.592 -9.619 1.00 0.00 C ATOM 502 O ALA A 30 -4.715 6.027 -10.485 1.00 0.00 O ATOM 503 CB ALA A 30 -3.493 8.989 -10.261 1.00 0.00 C ATOM 0 H ALA A 30 -3.035 8.923 -7.848 1.00 0.00 H new ATOM 0 HA ALA A 30 -5.329 8.285 -9.452 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -3.793 8.785 -11.289 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -3.708 10.030 -10.020 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -2.424 8.805 -10.151 1.00 0.00 H new ATOM 509 N LYS A 31 -3.108 6.004 -8.893 1.00 0.00 N ATOM 510 CA LYS A 31 -2.790 4.598 -9.078 1.00 0.00 C ATOM 511 C LYS A 31 -3.512 3.772 -8.011 1.00 0.00 C ATOM 512 O LYS A 31 -2.928 2.863 -7.424 1.00 0.00 O ATOM 513 CB LYS A 31 -1.274 4.389 -9.095 1.00 0.00 C ATOM 514 CG LYS A 31 -0.642 5.068 -10.312 1.00 0.00 C ATOM 515 CD LYS A 31 0.147 6.312 -9.898 1.00 0.00 C ATOM 516 CE LYS A 31 1.643 6.122 -10.150 1.00 0.00 C ATOM 517 NZ LYS A 31 1.895 5.824 -11.578 1.00 0.00 N ATOM 0 H LYS A 31 -2.557 6.475 -8.176 1.00 0.00 H new ATOM 0 HA LYS A 31 -3.148 4.251 -10.047 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -0.837 4.792 -8.181 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -1.050 3.322 -9.112 1.00 0.00 H new ATOM 0 HG2 LYS A 31 0.019 4.367 -10.822 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -1.420 5.346 -11.023 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -0.212 7.177 -10.456 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -0.024 6.520 -8.842 1.00 0.00 H new ATOM 0 HE2 LYS A 31 2.184 7.023 -9.860 1.00 0.00 H new ATOM 0 HE3 LYS A 31 2.022 5.309 -9.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 2.810 6.229 -11.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 1.914 4.794 -11.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 1.138 6.239 -12.158 1.00 0.00 H new ATOM 531 N VAL A 32 -4.773 4.118 -7.794 1.00 0.00 N ATOM 532 CA VAL A 32 -5.581 3.420 -6.809 1.00 0.00 C ATOM 533 C VAL A 32 -6.950 3.099 -7.413 1.00 0.00 C ATOM 534 O VAL A 32 -7.838 3.950 -7.433 1.00 0.00 O ATOM 535 CB VAL A 32 -5.673 4.248 -5.526 1.00 0.00 C ATOM 536 CG1 VAL A 32 -6.636 3.604 -4.526 1.00 0.00 C ATOM 537 CG2 VAL A 32 -4.290 4.449 -4.903 1.00 0.00 C ATOM 0 H VAL A 32 -5.254 4.872 -8.284 1.00 0.00 H new ATOM 0 HA VAL A 32 -5.116 2.473 -6.536 1.00 0.00 H new ATOM 0 HB VAL A 32 -6.068 5.229 -5.788 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -6.683 4.212 -3.623 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -7.629 3.536 -4.970 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -6.282 2.605 -4.272 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -4.384 5.041 -3.992 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -3.855 3.479 -4.662 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -3.645 4.971 -5.610 1.00 0.00 H new ATOM 547 N PRO A 33 -7.081 1.837 -7.902 1.00 0.00 N ATOM 548 CA PRO A 33 -8.327 1.394 -8.505 1.00 0.00 C ATOM 549 C PRO A 33 -9.388 1.127 -7.436 1.00 0.00 C ATOM 550 O PRO A 33 -9.074 1.045 -6.250 1.00 0.00 O ATOM 551 CB PRO A 33 -7.959 0.152 -9.300 1.00 0.00 C ATOM 552 CG PRO A 33 -6.626 -0.320 -8.743 1.00 0.00 C ATOM 553 CD PRO A 33 -6.051 0.803 -7.895 1.00 0.00 C ATOM 0 HA PRO A 33 -8.773 2.148 -9.154 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -8.722 -0.620 -9.194 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -7.880 0.378 -10.363 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -6.760 -1.221 -8.144 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -5.943 -0.575 -9.553 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -5.837 0.464 -6.881 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -5.115 1.174 -8.311 1.00 0.00 H new ATOM 561 N PRO A 34 -10.657 0.995 -7.907 1.00 0.00 N ATOM 562 CA PRO A 34 -11.768 0.739 -7.005 1.00 0.00 C ATOM 563 C PRO A 34 -11.759 -0.713 -6.523 1.00 0.00 C ATOM 564 O PRO A 34 -11.223 -1.591 -7.198 1.00 0.00 O ATOM 565 CB PRO A 34 -13.012 1.093 -7.803 1.00 0.00 C ATOM 566 CG PRO A 34 -12.587 1.088 -9.262 1.00 0.00 C ATOM 567 CD PRO A 34 -11.068 1.086 -9.305 1.00 0.00 C ATOM 0 HA PRO A 34 -11.715 1.332 -6.092 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -13.808 0.370 -7.626 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -13.398 2.070 -7.512 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -12.984 0.211 -9.772 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -12.982 1.963 -9.778 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -10.690 0.244 -9.884 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -10.684 1.993 -9.772 1.00 0.00 H new ATOM 575 N PRO A 35 -12.373 -0.926 -5.329 1.00 0.00 N ATOM 576 CA PRO A 35 -12.441 -2.256 -4.749 1.00 0.00 C ATOM 577 C PRO A 35 -13.476 -3.119 -5.475 1.00 0.00 C ATOM 578 O PRO A 35 -14.358 -2.596 -6.154 1.00 0.00 O ATOM 579 CB PRO A 35 -12.779 -2.030 -3.284 1.00 0.00 C ATOM 580 CG PRO A 35 -13.343 -0.621 -3.199 1.00 0.00 C ATOM 581 CD PRO A 35 -13.018 0.090 -4.502 1.00 0.00 C ATOM 0 HA PRO A 35 -11.505 -2.806 -4.848 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -13.505 -2.763 -2.933 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -11.893 -2.134 -2.658 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -14.421 -0.650 -3.039 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -12.909 -0.086 -2.354 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -13.920 0.474 -4.979 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -12.358 0.941 -4.334 1.00 0.00 H new ATOM 589 N PRO A 36 -13.330 -4.460 -5.301 1.00 0.00 N ATOM 590 CA PRO A 36 -14.241 -5.400 -5.931 1.00 0.00 C ATOM 591 C PRO A 36 -15.592 -5.419 -5.213 1.00 0.00 C ATOM 592 O PRO A 36 -15.703 -4.958 -4.079 1.00 0.00 O ATOM 593 CB PRO A 36 -13.522 -6.738 -5.881 1.00 0.00 C ATOM 594 CG PRO A 36 -12.446 -6.594 -4.817 1.00 0.00 C ATOM 595 CD PRO A 36 -12.297 -5.114 -4.503 1.00 0.00 C ATOM 0 HA PRO A 36 -14.480 -5.130 -6.960 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -14.213 -7.543 -5.631 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -13.084 -6.982 -6.849 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -12.720 -7.149 -3.920 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -11.501 -7.006 -5.171 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -12.435 -4.919 -3.440 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -11.304 -4.751 -4.767 1.00 0.00 H new ATOM 603 N PRO A 37 -16.612 -5.972 -5.923 1.00 0.00 N ATOM 604 CA PRO A 37 -17.951 -6.058 -5.366 1.00 0.00 C ATOM 605 C PRO A 37 -18.037 -7.165 -4.313 1.00 0.00 C ATOM 606 O PRO A 37 -19.109 -7.426 -3.768 1.00 0.00 O ATOM 607 CB PRO A 37 -18.859 -6.302 -6.560 1.00 0.00 C ATOM 608 CG PRO A 37 -17.956 -6.805 -7.674 1.00 0.00 C ATOM 609 CD PRO A 37 -16.518 -6.528 -7.269 1.00 0.00 C ATOM 0 HA PRO A 37 -18.246 -5.151 -4.837 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -19.630 -7.035 -6.321 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -19.371 -5.386 -6.855 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -18.108 -7.872 -7.836 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -18.192 -6.303 -8.612 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -15.921 -7.440 -7.280 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -16.042 -5.827 -7.954 1.00 0.00 H new ATOM 617 N GLY A 38 -16.895 -7.785 -4.058 1.00 0.00 N ATOM 618 CA GLY A 38 -16.827 -8.858 -3.081 1.00 0.00 C ATOM 619 C GLY A 38 -15.666 -8.642 -2.108 1.00 0.00 C ATOM 620 O GLY A 38 -14.710 -9.415 -2.096 1.00 0.00 O ATOM 0 H GLY A 38 -16.008 -7.565 -4.511 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -17.765 -8.911 -2.528 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -16.705 -9.813 -3.592 1.00 0.00 H new ATOM 624 N VAL A 39 -15.788 -7.586 -1.316 1.00 0.00 N ATOM 625 CA VAL A 39 -14.760 -7.258 -0.343 1.00 0.00 C ATOM 626 C VAL A 39 -15.367 -6.387 0.759 1.00 0.00 C ATOM 627 O VAL A 39 -16.103 -5.444 0.474 1.00 0.00 O ATOM 628 CB VAL A 39 -13.570 -6.597 -1.041 1.00 0.00 C ATOM 629 CG1 VAL A 39 -13.989 -5.293 -1.722 1.00 0.00 C ATOM 630 CG2 VAL A 39 -12.421 -6.359 -0.059 1.00 0.00 C ATOM 0 H VAL A 39 -16.583 -6.947 -1.329 1.00 0.00 H new ATOM 0 HA VAL A 39 -14.379 -8.163 0.130 1.00 0.00 H new ATOM 0 HB VAL A 39 -13.214 -7.279 -1.814 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -13.124 -4.844 -2.211 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -14.758 -5.502 -2.466 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -14.383 -4.603 -0.976 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -11.588 -5.888 -0.581 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -12.760 -5.707 0.746 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -12.096 -7.312 0.358 1.00 0.00 H new ATOM 640 N GLU A 40 -15.035 -6.734 1.994 1.00 0.00 N ATOM 641 CA GLU A 40 -15.537 -5.995 3.139 1.00 0.00 C ATOM 642 C GLU A 40 -14.453 -5.066 3.689 1.00 0.00 C ATOM 643 O GLU A 40 -13.417 -5.528 4.164 1.00 0.00 O ATOM 644 CB GLU A 40 -16.047 -6.945 4.224 1.00 0.00 C ATOM 645 CG GLU A 40 -17.200 -6.315 5.008 1.00 0.00 C ATOM 646 CD GLU A 40 -17.346 -6.965 6.385 1.00 0.00 C ATOM 647 OE1 GLU A 40 -17.850 -8.108 6.423 1.00 0.00 O ATOM 648 OE2 GLU A 40 -16.951 -6.304 7.370 1.00 0.00 O ATOM 0 H GLU A 40 -14.424 -7.517 2.226 1.00 0.00 H new ATOM 0 HA GLU A 40 -16.379 -5.385 2.812 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -16.379 -7.878 3.768 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -15.233 -7.195 4.905 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -17.024 -5.245 5.124 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -18.129 -6.427 4.449 1.00 0.00 H new ATOM 655 N LEU A 41 -14.729 -3.772 3.606 1.00 0.00 N ATOM 656 CA LEU A 41 -13.790 -2.774 4.089 1.00 0.00 C ATOM 657 C LEU A 41 -14.163 -2.380 5.519 1.00 0.00 C ATOM 658 O LEU A 41 -15.341 -2.360 5.875 1.00 0.00 O ATOM 659 CB LEU A 41 -13.722 -1.590 3.122 1.00 0.00 C ATOM 660 CG LEU A 41 -13.417 -1.933 1.663 1.00 0.00 C ATOM 661 CD1 LEU A 41 -14.441 -1.292 0.724 1.00 0.00 C ATOM 662 CD2 LEU A 41 -11.983 -1.546 1.297 1.00 0.00 C ATOM 0 H LEU A 41 -15.590 -3.392 3.211 1.00 0.00 H new ATOM 0 HA LEU A 41 -12.781 -3.185 4.124 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -14.674 -1.061 3.159 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.959 -0.898 3.479 1.00 0.00 H new ATOM 0 HG LEU A 41 -13.500 -3.013 1.541 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -14.201 -1.551 -0.307 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -15.438 -1.659 0.968 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -14.414 -0.209 0.841 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -11.792 -1.801 0.254 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -11.848 -0.474 1.439 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -11.286 -2.087 1.936 1.00 0.00 H new ATOM 674 N GLU A 42 -13.138 -2.074 6.302 1.00 0.00 N ATOM 675 CA GLU A 42 -13.344 -1.681 7.685 1.00 0.00 C ATOM 676 C GLU A 42 -13.142 -0.173 7.844 1.00 0.00 C ATOM 677 O GLU A 42 -12.265 0.410 7.208 1.00 0.00 O ATOM 678 CB GLU A 42 -12.416 -2.460 8.620 1.00 0.00 C ATOM 679 CG GLU A 42 -12.884 -2.350 10.073 1.00 0.00 C ATOM 680 CD GLU A 42 -11.877 -3.000 11.024 1.00 0.00 C ATOM 681 OE1 GLU A 42 -11.761 -4.244 10.964 1.00 0.00 O ATOM 682 OE2 GLU A 42 -11.246 -2.240 11.788 1.00 0.00 O ATOM 0 H GLU A 42 -12.163 -2.091 6.004 1.00 0.00 H new ATOM 0 HA GLU A 42 -14.370 -1.921 7.962 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -12.389 -3.508 8.321 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -11.399 -2.077 8.532 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -13.015 -1.301 10.338 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -13.856 -2.831 10.183 1.00 0.00 H new ATOM 689 N ARG A 43 -13.968 0.416 8.696 1.00 0.00 N ATOM 690 CA ARG A 43 -13.891 1.845 8.947 1.00 0.00 C ATOM 691 C ARG A 43 -12.706 2.160 9.861 1.00 0.00 C ATOM 692 O ARG A 43 -12.558 1.556 10.923 1.00 0.00 O ATOM 693 CB ARG A 43 -15.178 2.361 9.594 1.00 0.00 C ATOM 694 CG ARG A 43 -14.941 3.701 10.293 1.00 0.00 C ATOM 695 CD ARG A 43 -14.787 4.831 9.273 1.00 0.00 C ATOM 696 NE ARG A 43 -13.756 5.790 9.731 1.00 0.00 N ATOM 697 CZ ARG A 43 -13.988 6.784 10.599 1.00 0.00 C ATOM 698 NH1 ARG A 43 -15.216 6.956 11.108 1.00 0.00 N ATOM 699 NH2 ARG A 43 -12.993 7.606 10.958 1.00 0.00 N ATOM 0 H ARG A 43 -14.694 -0.071 9.221 1.00 0.00 H new ATOM 0 HA ARG A 43 -13.756 2.344 7.987 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -15.951 2.475 8.834 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -15.545 1.631 10.315 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -15.775 3.920 10.960 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -14.045 3.640 10.911 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -14.508 4.420 8.303 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -15.739 5.344 9.140 1.00 0.00 H new ATOM 0 HE ARG A 43 -12.810 5.688 9.363 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -15.974 6.330 10.835 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -15.393 7.713 11.769 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -12.059 7.475 10.571 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -13.170 8.363 11.619 1.00 0.00 H new ATOM 713 N VAL A 44 -11.892 3.107 9.417 1.00 0.00 N ATOM 714 CA VAL A 44 -10.724 3.509 10.183 1.00 0.00 C ATOM 715 C VAL A 44 -11.071 4.739 11.024 1.00 0.00 C ATOM 716 O VAL A 44 -10.889 5.872 10.580 1.00 0.00 O ATOM 717 CB VAL A 44 -9.538 3.742 9.245 1.00 0.00 C ATOM 718 CG1 VAL A 44 -8.295 4.169 10.028 1.00 0.00 C ATOM 719 CG2 VAL A 44 -9.254 2.498 8.400 1.00 0.00 C ATOM 0 H VAL A 44 -12.018 3.607 8.537 1.00 0.00 H new ATOM 0 HA VAL A 44 -10.427 2.717 10.871 1.00 0.00 H new ATOM 0 HB VAL A 44 -9.802 4.554 8.567 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -7.467 4.328 9.337 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -8.503 5.095 10.564 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -8.028 3.389 10.741 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.407 2.691 7.742 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -9.021 1.658 9.055 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -10.132 2.258 7.800 1.00 0.00 H new ATOM 729 N HIS A 45 -11.565 4.475 12.225 1.00 0.00 N ATOM 730 CA HIS A 45 -11.940 5.546 13.133 1.00 0.00 C ATOM 731 C HIS A 45 -10.747 6.481 13.342 1.00 0.00 C ATOM 732 O HIS A 45 -10.918 7.692 13.470 1.00 0.00 O ATOM 733 CB HIS A 45 -12.487 4.980 14.444 1.00 0.00 C ATOM 734 CG HIS A 45 -13.708 4.107 14.274 1.00 0.00 C ATOM 735 ND1 HIS A 45 -14.701 4.378 13.350 1.00 0.00 N ATOM 736 CD2 HIS A 45 -14.084 2.966 14.920 1.00 0.00 C ATOM 737 CE1 HIS A 45 -15.628 3.437 13.443 1.00 0.00 C ATOM 738 NE2 HIS A 45 -15.244 2.563 14.417 1.00 0.00 N ATOM 0 H HIS A 45 -11.714 3.535 12.590 1.00 0.00 H new ATOM 0 HA HIS A 45 -12.746 6.134 12.695 1.00 0.00 H new ATOM 0 HB2 HIS A 45 -11.704 4.400 14.932 1.00 0.00 H new ATOM 0 HB3 HIS A 45 -12.734 5.807 15.110 1.00 0.00 H new ATOM 0 HD2 HIS A 45 -13.532 2.474 15.707 1.00 0.00 H new ATOM 0 HE1 HIS A 45 -16.529 3.373 12.852 1.00 0.00 H new ATOM 0 HE2 HIS A 45 -15.763 1.736 14.711 1.00 0.00 H new ATOM 746 N GLU A 46 -9.565 5.883 13.372 1.00 0.00 N ATOM 747 CA GLU A 46 -8.344 6.647 13.564 1.00 0.00 C ATOM 748 C GLU A 46 -8.276 7.799 12.560 1.00 0.00 C ATOM 749 O GLU A 46 -7.897 8.915 12.915 1.00 0.00 O ATOM 750 CB GLU A 46 -7.111 5.748 13.452 1.00 0.00 C ATOM 751 CG GLU A 46 -6.349 5.695 14.778 1.00 0.00 C ATOM 752 CD GLU A 46 -7.067 4.798 15.788 1.00 0.00 C ATOM 753 OE1 GLU A 46 -6.790 3.579 15.763 1.00 0.00 O ATOM 754 OE2 GLU A 46 -7.878 5.351 16.562 1.00 0.00 O ATOM 0 H GLU A 46 -9.427 4.878 13.267 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.356 7.067 14.570 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.415 4.742 13.163 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -6.455 6.121 12.666 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.340 5.320 14.607 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.251 6.701 15.185 1.00 0.00 H new ATOM 761 N CYS A 47 -8.647 7.490 11.326 1.00 0.00 N ATOM 762 CA CYS A 47 -8.633 8.486 10.269 1.00 0.00 C ATOM 763 C CYS A 47 -9.867 9.376 10.430 1.00 0.00 C ATOM 764 O CYS A 47 -10.996 8.911 10.277 1.00 0.00 O ATOM 765 CB CYS A 47 -8.572 7.839 8.883 1.00 0.00 C ATOM 766 SG CYS A 47 -7.237 8.604 7.893 1.00 0.00 S ATOM 0 H CYS A 47 -8.959 6.564 11.035 1.00 0.00 H new ATOM 0 HA CYS A 47 -7.734 9.096 10.353 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -8.396 6.768 8.980 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -9.528 7.960 8.374 1.00 0.00 H new ATOM 0 HG CYS A 47 -7.193 8.046 6.720 1.00 0.00 H new ATOM 772 N GLN A 48 -9.610 10.639 10.735 1.00 0.00 N ATOM 773 CA GLN A 48 -10.686 11.598 10.919 1.00 0.00 C ATOM 774 C GLN A 48 -11.793 11.357 9.890 1.00 0.00 C ATOM 775 O GLN A 48 -12.975 11.367 10.230 1.00 0.00 O ATOM 776 CB GLN A 48 -10.162 13.033 10.835 1.00 0.00 C ATOM 777 CG GLN A 48 -9.119 13.300 11.922 1.00 0.00 C ATOM 778 CD GLN A 48 -9.631 14.331 12.931 1.00 0.00 C ATOM 779 OE1 GLN A 48 -10.454 14.046 13.785 1.00 0.00 O ATOM 780 NE2 GLN A 48 -9.099 15.541 12.784 1.00 0.00 N ATOM 0 H GLN A 48 -8.672 11.021 10.859 1.00 0.00 H new ATOM 0 HA GLN A 48 -11.106 11.457 11.915 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -9.722 13.206 9.853 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -10.990 13.733 10.941 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -8.879 12.370 12.437 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -8.197 13.659 11.466 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -8.414 15.711 12.047 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -9.376 16.299 13.408 1.00 0.00 H new ATOM 789 N THR A 49 -11.370 11.147 8.652 1.00 0.00 N ATOM 790 CA THR A 49 -12.310 10.905 7.571 1.00 0.00 C ATOM 791 C THR A 49 -12.751 9.439 7.566 1.00 0.00 C ATOM 792 O THR A 49 -12.072 8.581 8.128 1.00 0.00 O ATOM 793 CB THR A 49 -11.651 11.345 6.262 1.00 0.00 C ATOM 794 OG1 THR A 49 -10.542 10.461 6.118 1.00 0.00 O ATOM 795 CG2 THR A 49 -11.011 12.731 6.367 1.00 0.00 C ATOM 0 H THR A 49 -10.389 11.139 8.374 1.00 0.00 H new ATOM 0 HA THR A 49 -13.222 11.487 7.703 1.00 0.00 H new ATOM 0 HB THR A 49 -12.393 11.347 5.464 1.00 0.00 H new ATOM 0 HG1 THR A 49 -10.059 10.674 5.293 1.00 0.00 H new ATOM 0 HG21 THR A 49 -10.558 12.996 5.412 1.00 0.00 H new ATOM 0 HG22 THR A 49 -11.774 13.466 6.622 1.00 0.00 H new ATOM 0 HG23 THR A 49 -10.244 12.720 7.142 1.00 0.00 H new ATOM 803 N PRO A 50 -13.915 9.191 6.908 1.00 0.00 N ATOM 804 CA PRO A 50 -14.454 7.845 6.823 1.00 0.00 C ATOM 805 C PRO A 50 -13.667 7.001 5.818 1.00 0.00 C ATOM 806 O PRO A 50 -14.124 6.775 4.699 1.00 0.00 O ATOM 807 CB PRO A 50 -15.911 8.029 6.431 1.00 0.00 C ATOM 808 CG PRO A 50 -16.015 9.434 5.860 1.00 0.00 C ATOM 809 CD PRO A 50 -14.746 10.183 6.231 1.00 0.00 C ATOM 0 HA PRO A 50 -14.374 7.300 7.763 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -16.214 7.285 5.695 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -16.566 7.909 7.294 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -16.134 9.398 4.777 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -16.891 9.945 6.260 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -14.248 10.580 5.347 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -14.962 11.030 6.882 1.00 0.00 H new ATOM 817 N PHE A 51 -12.496 6.560 6.254 1.00 0.00 N ATOM 818 CA PHE A 51 -11.641 5.746 5.407 1.00 0.00 C ATOM 819 C PHE A 51 -11.960 4.259 5.571 1.00 0.00 C ATOM 820 O PHE A 51 -12.249 3.801 6.676 1.00 0.00 O ATOM 821 CB PHE A 51 -10.199 5.999 5.853 1.00 0.00 C ATOM 822 CG PHE A 51 -9.146 5.537 4.844 1.00 0.00 C ATOM 823 CD1 PHE A 51 -9.349 5.728 3.513 1.00 0.00 C ATOM 824 CD2 PHE A 51 -8.006 4.934 5.278 1.00 0.00 C ATOM 825 CE1 PHE A 51 -8.371 5.299 2.577 1.00 0.00 C ATOM 826 CE2 PHE A 51 -7.029 4.505 4.342 1.00 0.00 C ATOM 827 CZ PHE A 51 -7.232 4.697 3.011 1.00 0.00 C ATOM 0 H PHE A 51 -12.119 6.751 7.183 1.00 0.00 H new ATOM 0 HA PHE A 51 -11.796 6.009 4.361 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -10.068 7.065 6.037 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -10.028 5.489 6.801 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -10.254 6.206 3.168 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -7.845 4.782 6.335 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -8.532 5.451 1.520 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -6.124 4.026 4.687 1.00 0.00 H new ATOM 0 HZ PHE A 51 -6.488 4.371 2.299 1.00 0.00 H new ATOM 837 N PHE A 52 -11.897 3.546 4.456 1.00 0.00 N ATOM 838 CA PHE A 52 -12.176 2.120 4.463 1.00 0.00 C ATOM 839 C PHE A 52 -11.089 1.345 3.717 1.00 0.00 C ATOM 840 O PHE A 52 -10.677 1.740 2.627 1.00 0.00 O ATOM 841 CB PHE A 52 -13.512 1.922 3.744 1.00 0.00 C ATOM 842 CG PHE A 52 -14.646 2.796 4.285 1.00 0.00 C ATOM 843 CD1 PHE A 52 -15.066 2.647 5.570 1.00 0.00 C ATOM 844 CD2 PHE A 52 -15.234 3.722 3.480 1.00 0.00 C ATOM 845 CE1 PHE A 52 -16.118 3.457 6.072 1.00 0.00 C ATOM 846 CE2 PHE A 52 -16.286 4.532 3.982 1.00 0.00 C ATOM 847 CZ PHE A 52 -16.706 4.383 5.267 1.00 0.00 C ATOM 0 H PHE A 52 -11.657 3.929 3.542 1.00 0.00 H new ATOM 0 HA PHE A 52 -12.208 1.752 5.489 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -13.377 2.135 2.684 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -13.804 0.875 3.824 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -14.599 1.912 6.209 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -14.900 3.841 2.460 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -16.452 3.338 7.092 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -16.753 5.267 3.343 1.00 0.00 H new ATOM 0 HZ PHE A 52 -17.506 5.000 5.648 1.00 0.00 H new ATOM 857 N VAL A 53 -10.655 0.256 4.333 1.00 0.00 N ATOM 858 CA VAL A 53 -9.623 -0.578 3.741 1.00 0.00 C ATOM 859 C VAL A 53 -9.874 -2.039 4.119 1.00 0.00 C ATOM 860 O VAL A 53 -10.604 -2.322 5.069 1.00 0.00 O ATOM 861 CB VAL A 53 -8.240 -0.081 4.166 1.00 0.00 C ATOM 862 CG1 VAL A 53 -7.884 -0.579 5.568 1.00 0.00 C ATOM 863 CG2 VAL A 53 -7.173 -0.494 3.150 1.00 0.00 C ATOM 0 H VAL A 53 -10.999 -0.069 5.237 1.00 0.00 H new ATOM 0 HA VAL A 53 -9.658 -0.513 2.654 1.00 0.00 H new ATOM 0 HB VAL A 53 -8.271 1.008 4.196 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -6.896 -0.211 5.845 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.621 -0.212 6.282 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -7.881 -1.669 5.577 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -6.199 -0.128 3.476 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -7.145 -1.581 3.073 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -7.413 -0.067 2.176 1.00 0.00 H new ATOM 873 N HIS A 54 -9.256 -2.930 3.357 1.00 0.00 N ATOM 874 CA HIS A 54 -9.404 -4.355 3.600 1.00 0.00 C ATOM 875 C HIS A 54 -8.095 -5.071 3.266 1.00 0.00 C ATOM 876 O HIS A 54 -7.519 -4.854 2.200 1.00 0.00 O ATOM 877 CB HIS A 54 -10.601 -4.916 2.830 1.00 0.00 C ATOM 878 CG HIS A 54 -10.800 -6.403 3.002 1.00 0.00 C ATOM 879 ND1 HIS A 54 -11.275 -6.965 4.175 1.00 0.00 N ATOM 880 CD2 HIS A 54 -10.583 -7.437 2.140 1.00 0.00 C ATOM 881 CE1 HIS A 54 -11.337 -8.278 4.014 1.00 0.00 C ATOM 882 NE2 HIS A 54 -10.908 -8.569 2.752 1.00 0.00 N ATOM 0 H HIS A 54 -8.651 -2.692 2.571 1.00 0.00 H new ATOM 0 HA HIS A 54 -9.613 -4.528 4.656 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -11.504 -4.399 3.155 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -10.473 -4.697 1.770 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -10.210 -7.350 1.130 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -11.669 -8.993 4.752 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -10.847 -9.503 2.346 1.00 0.00 H new ATOM 890 N ALA A 55 -7.662 -5.910 4.195 1.00 0.00 N ATOM 891 CA ALA A 55 -6.431 -6.660 4.013 1.00 0.00 C ATOM 892 C ALA A 55 -6.745 -8.157 4.016 1.00 0.00 C ATOM 893 O ALA A 55 -7.492 -8.636 4.868 1.00 0.00 O ATOM 894 CB ALA A 55 -5.430 -6.272 5.103 1.00 0.00 C ATOM 0 H ALA A 55 -8.142 -6.087 5.077 1.00 0.00 H new ATOM 0 HA ALA A 55 -5.975 -6.421 3.052 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -4.507 -6.835 4.966 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -5.217 -5.205 5.039 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.852 -6.499 6.082 1.00 0.00 H new ATOM 900 N ASP A 56 -6.159 -8.854 3.054 1.00 0.00 N ATOM 901 CA ASP A 56 -6.368 -10.287 2.935 1.00 0.00 C ATOM 902 C ASP A 56 -5.299 -10.879 2.014 1.00 0.00 C ATOM 903 O ASP A 56 -4.599 -10.145 1.318 1.00 0.00 O ATOM 904 CB ASP A 56 -7.738 -10.596 2.329 1.00 0.00 C ATOM 905 CG ASP A 56 -8.869 -10.772 3.344 1.00 0.00 C ATOM 906 OD1 ASP A 56 -8.553 -10.767 4.553 1.00 0.00 O ATOM 907 OD2 ASP A 56 -10.026 -10.906 2.888 1.00 0.00 O ATOM 0 H ASP A 56 -5.540 -8.453 2.350 1.00 0.00 H new ATOM 0 HA ASP A 56 -6.310 -10.720 3.934 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -8.006 -9.791 1.645 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -7.659 -11.506 1.734 1.00 0.00 H new ATOM 912 N VAL A 57 -5.208 -12.201 2.039 1.00 0.00 N ATOM 913 CA VAL A 57 -4.236 -12.899 1.215 1.00 0.00 C ATOM 914 C VAL A 57 -4.905 -14.111 0.563 1.00 0.00 C ATOM 915 O VAL A 57 -5.519 -14.928 1.247 1.00 0.00 O ATOM 916 CB VAL A 57 -3.010 -13.271 2.052 1.00 0.00 C ATOM 917 CG1 VAL A 57 -3.416 -13.660 3.475 1.00 0.00 C ATOM 918 CG2 VAL A 57 -2.209 -14.390 1.384 1.00 0.00 C ATOM 0 H VAL A 57 -5.791 -12.807 2.617 1.00 0.00 H new ATOM 0 HA VAL A 57 -3.880 -12.252 0.413 1.00 0.00 H new ATOM 0 HB VAL A 57 -2.368 -12.392 2.115 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -2.527 -13.920 4.049 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -3.923 -12.821 3.951 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -4.088 -14.517 3.440 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -1.343 -14.635 1.999 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -2.839 -15.273 1.275 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -1.874 -14.060 0.401 1.00 0.00 H new ATOM 928 N GLU A 58 -4.762 -14.190 -0.752 1.00 0.00 N ATOM 929 CA GLU A 58 -5.344 -15.288 -1.504 1.00 0.00 C ATOM 930 C GLU A 58 -4.254 -16.051 -2.260 1.00 0.00 C ATOM 931 O GLU A 58 -3.788 -15.600 -3.305 1.00 0.00 O ATOM 932 CB GLU A 58 -6.426 -14.785 -2.461 1.00 0.00 C ATOM 933 CG GLU A 58 -7.821 -15.171 -1.965 1.00 0.00 C ATOM 934 CD GLU A 58 -8.442 -16.247 -2.857 1.00 0.00 C ATOM 935 OE1 GLU A 58 -8.396 -16.057 -4.091 1.00 0.00 O ATOM 936 OE2 GLU A 58 -8.949 -17.236 -2.284 1.00 0.00 O ATOM 0 H GLU A 58 -4.251 -13.511 -1.316 1.00 0.00 H new ATOM 0 HA GLU A 58 -5.818 -15.973 -0.801 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -6.357 -13.701 -2.556 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -6.261 -15.203 -3.454 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -7.758 -15.535 -0.940 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -8.463 -14.290 -1.951 1.00 0.00 H new ATOM 943 N GLY A 59 -3.880 -17.193 -1.702 1.00 0.00 N ATOM 944 CA GLY A 59 -2.854 -18.022 -2.311 1.00 0.00 C ATOM 945 C GLY A 59 -1.489 -17.765 -1.669 1.00 0.00 C ATOM 946 O GLY A 59 -1.063 -18.510 -0.788 1.00 0.00 O ATOM 0 H GLY A 59 -4.269 -17.564 -0.835 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -3.119 -19.074 -2.202 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -2.802 -17.816 -3.380 1.00 0.00 H new ATOM 950 N GLY A 60 -0.842 -16.707 -2.135 1.00 0.00 N ATOM 951 CA GLY A 60 0.466 -16.342 -1.618 1.00 0.00 C ATOM 952 C GLY A 60 0.722 -14.843 -1.784 1.00 0.00 C ATOM 953 O GLY A 60 1.870 -14.400 -1.767 1.00 0.00 O ATOM 0 H GLY A 60 -1.199 -16.091 -2.865 1.00 0.00 H new ATOM 0 HA2 GLY A 60 0.533 -16.611 -0.564 1.00 0.00 H new ATOM 0 HA3 GLY A 60 1.238 -16.907 -2.141 1.00 0.00 H new ATOM 957 N LYS A 61 -0.365 -14.103 -1.941 1.00 0.00 N ATOM 958 CA LYS A 61 -0.272 -12.663 -2.111 1.00 0.00 C ATOM 959 C LYS A 61 -1.353 -11.984 -1.267 1.00 0.00 C ATOM 960 O LYS A 61 -2.417 -12.557 -1.036 1.00 0.00 O ATOM 961 CB LYS A 61 -0.328 -12.293 -3.594 1.00 0.00 C ATOM 962 CG LYS A 61 0.965 -12.693 -4.308 1.00 0.00 C ATOM 963 CD LYS A 61 0.911 -12.322 -5.791 1.00 0.00 C ATOM 964 CE LYS A 61 1.948 -13.111 -6.592 1.00 0.00 C ATOM 965 NZ LYS A 61 1.341 -13.663 -7.824 1.00 0.00 N ATOM 0 H LYS A 61 -1.315 -14.473 -1.954 1.00 0.00 H new ATOM 0 HA LYS A 61 0.691 -12.299 -1.752 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -1.176 -12.790 -4.065 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -0.489 -11.220 -3.699 1.00 0.00 H new ATOM 0 HG2 LYS A 61 1.813 -12.197 -3.836 1.00 0.00 H new ATOM 0 HG3 LYS A 61 1.125 -13.766 -4.204 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -0.086 -12.522 -6.183 1.00 0.00 H new ATOM 0 HD3 LYS A 61 1.091 -11.254 -5.909 1.00 0.00 H new ATOM 0 HE2 LYS A 61 2.786 -12.463 -6.851 1.00 0.00 H new ATOM 0 HE3 LYS A 61 2.348 -13.921 -5.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 2.059 -14.196 -8.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 0.556 -14.297 -7.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 0.981 -12.885 -8.412 1.00 0.00 H new ATOM 979 N VAL A 62 -1.044 -10.772 -0.830 1.00 0.00 N ATOM 980 CA VAL A 62 -1.975 -10.009 -0.017 1.00 0.00 C ATOM 981 C VAL A 62 -2.740 -9.029 -0.909 1.00 0.00 C ATOM 982 O VAL A 62 -2.135 -8.250 -1.644 1.00 0.00 O ATOM 983 CB VAL A 62 -1.228 -9.318 1.126 1.00 0.00 C ATOM 984 CG1 VAL A 62 0.012 -10.117 1.531 1.00 0.00 C ATOM 985 CG2 VAL A 62 -0.858 -7.882 0.750 1.00 0.00 C ATOM 0 H VAL A 62 -0.161 -10.299 -1.024 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.709 -10.670 0.445 1.00 0.00 H new ATOM 0 HB VAL A 62 -1.895 -9.276 1.987 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.525 -9.605 2.345 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -0.288 -11.112 1.860 1.00 0.00 H new ATOM 0 HG13 VAL A 62 0.683 -10.204 0.677 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.328 -7.414 1.580 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -0.217 -7.890 -0.132 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -1.765 -7.317 0.534 1.00 0.00 H new ATOM 995 N ARG A 63 -4.060 -9.100 -0.816 1.00 0.00 N ATOM 996 CA ARG A 63 -4.914 -8.229 -1.606 1.00 0.00 C ATOM 997 C ARG A 63 -5.291 -6.984 -0.800 1.00 0.00 C ATOM 998 O ARG A 63 -5.985 -7.081 0.211 1.00 0.00 O ATOM 999 CB ARG A 63 -6.190 -8.954 -2.039 1.00 0.00 C ATOM 1000 CG ARG A 63 -5.871 -10.090 -3.013 1.00 0.00 C ATOM 1001 CD ARG A 63 -5.437 -9.541 -4.373 1.00 0.00 C ATOM 1002 NE ARG A 63 -6.398 -9.959 -5.418 1.00 0.00 N ATOM 1003 CZ ARG A 63 -6.504 -9.373 -6.618 1.00 0.00 C ATOM 1004 NH1 ARG A 63 -5.709 -8.341 -6.933 1.00 0.00 N ATOM 1005 NH2 ARG A 63 -7.405 -9.819 -7.504 1.00 0.00 N ATOM 0 H ARG A 63 -4.559 -9.747 -0.206 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.357 -7.936 -2.496 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.701 -9.354 -1.163 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.872 -8.247 -2.510 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.080 -10.716 -2.600 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.748 -10.725 -3.136 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.380 -8.453 -4.334 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.439 -9.904 -4.619 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.018 -10.742 -5.212 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -5.023 -8.001 -6.259 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -5.790 -7.895 -7.847 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -8.010 -10.605 -7.265 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -7.486 -9.373 -8.418 1.00 0.00 H new ATOM 1019 N LEU A 64 -4.819 -5.842 -1.280 1.00 0.00 N ATOM 1020 CA LEU A 64 -5.098 -4.580 -0.617 1.00 0.00 C ATOM 1021 C LEU A 64 -6.277 -3.895 -1.311 1.00 0.00 C ATOM 1022 O LEU A 64 -6.394 -3.941 -2.535 1.00 0.00 O ATOM 1023 CB LEU A 64 -3.836 -3.717 -0.553 1.00 0.00 C ATOM 1024 CG LEU A 64 -2.907 -3.974 0.635 1.00 0.00 C ATOM 1025 CD1 LEU A 64 -1.593 -3.207 0.479 1.00 0.00 C ATOM 1026 CD2 LEU A 64 -3.606 -3.651 1.957 1.00 0.00 C ATOM 0 H LEU A 64 -4.245 -5.765 -2.120 1.00 0.00 H new ATOM 0 HA LEU A 64 -5.392 -4.750 0.419 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -3.269 -3.869 -1.472 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -4.137 -2.670 -0.534 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.660 -5.035 0.652 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -0.951 -3.407 1.337 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -1.090 -3.528 -0.433 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -1.800 -2.138 0.422 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.924 -3.842 2.785 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -3.902 -2.602 1.965 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -4.491 -4.278 2.063 1.00 0.00 H new ATOM 1038 N TYR A 65 -7.121 -3.274 -0.500 1.00 0.00 N ATOM 1039 CA TYR A 65 -8.286 -2.581 -1.020 1.00 0.00 C ATOM 1040 C TYR A 65 -8.559 -1.299 -0.231 1.00 0.00 C ATOM 1041 O TYR A 65 -8.627 -1.324 0.997 1.00 0.00 O ATOM 1042 CB TYR A 65 -9.465 -3.539 -0.837 1.00 0.00 C ATOM 1043 CG TYR A 65 -9.308 -4.867 -1.580 1.00 0.00 C ATOM 1044 CD1 TYR A 65 -9.496 -4.919 -2.946 1.00 0.00 C ATOM 1045 CD2 TYR A 65 -8.980 -6.013 -0.884 1.00 0.00 C ATOM 1046 CE1 TYR A 65 -9.348 -6.169 -3.646 1.00 0.00 C ATOM 1047 CE2 TYR A 65 -8.832 -7.263 -1.584 1.00 0.00 C ATOM 1048 CZ TYR A 65 -9.024 -7.279 -2.930 1.00 0.00 C ATOM 1049 OH TYR A 65 -8.885 -8.460 -3.591 1.00 0.00 O ATOM 0 H TYR A 65 -7.020 -3.237 0.514 1.00 0.00 H new ATOM 0 HA TYR A 65 -8.132 -2.302 -2.063 1.00 0.00 H new ATOM 0 HB2 TYR A 65 -9.593 -3.742 0.226 1.00 0.00 H new ATOM 0 HB3 TYR A 65 -10.376 -3.048 -1.180 1.00 0.00 H new ATOM 0 HD1 TYR A 65 -9.754 -4.023 -3.490 1.00 0.00 H new ATOM 0 HD2 TYR A 65 -8.834 -5.972 0.185 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -9.491 -6.224 -4.715 1.00 0.00 H new ATOM 0 HE2 TYR A 65 -8.574 -8.167 -1.052 1.00 0.00 H new ATOM 0 HH TYR A 65 -8.577 -8.289 -4.505 1.00 0.00 H new ATOM 1059 N PHE A 66 -8.708 -0.208 -0.968 1.00 0.00 N ATOM 1060 CA PHE A 66 -8.972 1.081 -0.352 1.00 0.00 C ATOM 1061 C PHE A 66 -10.239 1.716 -0.930 1.00 0.00 C ATOM 1062 O PHE A 66 -10.673 1.358 -2.024 1.00 0.00 O ATOM 1063 CB PHE A 66 -7.776 1.981 -0.668 1.00 0.00 C ATOM 1064 CG PHE A 66 -6.486 1.575 0.047 1.00 0.00 C ATOM 1065 CD1 PHE A 66 -6.289 1.927 1.346 1.00 0.00 C ATOM 1066 CD2 PHE A 66 -5.536 0.863 -0.615 1.00 0.00 C ATOM 1067 CE1 PHE A 66 -5.092 1.551 2.010 1.00 0.00 C ATOM 1068 CE2 PHE A 66 -4.339 0.486 0.049 1.00 0.00 C ATOM 1069 CZ PHE A 66 -4.142 0.838 1.348 1.00 0.00 C ATOM 0 H PHE A 66 -8.651 -0.190 -1.986 1.00 0.00 H new ATOM 0 HA PHE A 66 -9.116 0.958 0.721 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -7.601 1.972 -1.744 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -8.024 3.007 -0.394 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -7.043 2.493 1.872 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -5.692 0.584 -1.647 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -4.936 1.831 3.041 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -3.585 -0.080 -0.477 1.00 0.00 H new ATOM 0 HZ PHE A 66 -3.232 0.551 1.853 1.00 0.00 H new ATOM 1079 N HIS A 67 -10.796 2.646 -0.169 1.00 0.00 N ATOM 1080 CA HIS A 67 -12.004 3.334 -0.592 1.00 0.00 C ATOM 1081 C HIS A 67 -12.081 4.702 0.089 1.00 0.00 C ATOM 1082 O HIS A 67 -12.103 4.789 1.315 1.00 0.00 O ATOM 1083 CB HIS A 67 -13.240 2.471 -0.330 1.00 0.00 C ATOM 1084 CG HIS A 67 -14.549 3.192 -0.545 1.00 0.00 C ATOM 1085 ND1 HIS A 67 -14.877 4.364 0.114 1.00 0.00 N ATOM 1086 CD2 HIS A 67 -15.608 2.896 -1.352 1.00 0.00 C ATOM 1087 CE1 HIS A 67 -16.081 4.747 -0.285 1.00 0.00 C ATOM 1088 NE2 HIS A 67 -16.533 3.835 -1.194 1.00 0.00 N ATOM 0 H HIS A 67 -10.433 2.939 0.738 1.00 0.00 H new ATOM 0 HA HIS A 67 -11.972 3.504 -1.668 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -13.206 1.598 -0.982 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -13.203 2.104 0.696 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -15.682 2.042 -2.009 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -16.611 5.626 0.050 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -17.433 3.869 -1.673 1.00 0.00 H new ATOM 1096 N VAL A 68 -12.119 5.737 -0.738 1.00 0.00 N ATOM 1097 CA VAL A 68 -12.193 7.097 -0.231 1.00 0.00 C ATOM 1098 C VAL A 68 -13.377 7.815 -0.881 1.00 0.00 C ATOM 1099 O VAL A 68 -13.383 8.041 -2.090 1.00 0.00 O ATOM 1100 CB VAL A 68 -10.861 7.813 -0.458 1.00 0.00 C ATOM 1101 CG1 VAL A 68 -10.874 9.209 0.169 1.00 0.00 C ATOM 1102 CG2 VAL A 68 -9.693 6.983 0.078 1.00 0.00 C ATOM 0 H VAL A 68 -12.100 5.661 -1.755 1.00 0.00 H new ATOM 0 HA VAL A 68 -12.366 7.095 0.845 1.00 0.00 H new ATOM 0 HB VAL A 68 -10.724 7.930 -1.533 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -9.915 9.696 -0.007 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -11.670 9.802 -0.281 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -11.046 9.124 1.242 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -8.758 7.515 -0.096 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -9.823 6.820 1.148 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.664 6.022 -0.435 1.00 0.00 H new ATOM 1112 N PRO A 69 -14.377 8.164 -0.028 1.00 0.00 N ATOM 1113 CA PRO A 69 -15.563 8.853 -0.507 1.00 0.00 C ATOM 1114 C PRO A 69 -15.261 10.322 -0.808 1.00 0.00 C ATOM 1115 O PRO A 69 -15.307 10.745 -1.962 1.00 0.00 O ATOM 1116 CB PRO A 69 -16.595 8.672 0.595 1.00 0.00 C ATOM 1117 CG PRO A 69 -15.811 8.295 1.841 1.00 0.00 C ATOM 1118 CD PRO A 69 -14.404 7.914 1.410 1.00 0.00 C ATOM 0 HA PRO A 69 -15.931 8.449 -1.450 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -17.163 9.589 0.753 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -17.312 7.894 0.334 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -15.783 9.130 2.541 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -16.291 7.463 2.356 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -13.655 8.511 1.930 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -14.190 6.869 1.634 1.00 0.00 H new ATOM 1126 N ASP A 70 -14.957 11.059 0.250 1.00 0.00 N ATOM 1127 CA ASP A 70 -14.647 12.472 0.114 1.00 0.00 C ATOM 1128 C ASP A 70 -13.660 12.664 -1.039 1.00 0.00 C ATOM 1129 O ASP A 70 -13.618 13.728 -1.655 1.00 0.00 O ATOM 1130 CB ASP A 70 -13.999 13.019 1.387 1.00 0.00 C ATOM 1131 CG ASP A 70 -14.167 14.525 1.602 1.00 0.00 C ATOM 1132 OD1 ASP A 70 -14.704 15.174 0.679 1.00 0.00 O ATOM 1133 OD2 ASP A 70 -13.753 14.993 2.685 1.00 0.00 O ATOM 0 H ASP A 70 -14.919 10.704 1.205 1.00 0.00 H new ATOM 0 HA ASP A 70 -15.579 13.005 -0.074 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -14.420 12.495 2.245 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.934 12.787 1.363 1.00 0.00 H new ATOM 1138 N GLU A 71 -12.889 11.618 -1.296 1.00 0.00 N ATOM 1139 CA GLU A 71 -11.905 11.658 -2.364 1.00 0.00 C ATOM 1140 C GLU A 71 -10.788 12.645 -2.020 1.00 0.00 C ATOM 1141 O GLU A 71 -10.482 13.541 -2.806 1.00 0.00 O ATOM 1142 CB GLU A 71 -12.559 12.015 -3.700 1.00 0.00 C ATOM 1143 CG GLU A 71 -12.872 10.755 -4.512 1.00 0.00 C ATOM 1144 CD GLU A 71 -12.789 11.036 -6.013 1.00 0.00 C ATOM 1145 OE1 GLU A 71 -13.434 12.016 -6.444 1.00 0.00 O ATOM 1146 OE2 GLU A 71 -12.082 10.265 -6.697 1.00 0.00 O ATOM 0 H GLU A 71 -12.926 10.737 -0.783 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.468 10.665 -2.465 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.477 12.574 -3.521 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -11.896 12.665 -4.271 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.171 9.964 -4.247 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -13.869 10.394 -4.260 1.00 0.00 H new ATOM 1153 N ALA A 72 -10.209 12.448 -0.845 1.00 0.00 N ATOM 1154 CA ALA A 72 -9.132 13.310 -0.387 1.00 0.00 C ATOM 1155 C ALA A 72 -7.829 12.902 -1.077 1.00 0.00 C ATOM 1156 O ALA A 72 -7.501 11.718 -1.141 1.00 0.00 O ATOM 1157 CB ALA A 72 -9.032 13.236 1.138 1.00 0.00 C ATOM 0 H ALA A 72 -10.465 11.704 -0.196 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.333 14.348 -0.651 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -8.224 13.882 1.481 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -9.973 13.564 1.581 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.828 12.209 1.440 1.00 0.00 H new ATOM 1163 N PRO A 73 -7.103 13.932 -1.589 1.00 0.00 N ATOM 1164 CA PRO A 73 -5.843 13.692 -2.272 1.00 0.00 C ATOM 1165 C PRO A 73 -4.733 13.360 -1.273 1.00 0.00 C ATOM 1166 O PRO A 73 -3.737 12.733 -1.633 1.00 0.00 O ATOM 1167 CB PRO A 73 -5.574 14.964 -3.058 1.00 0.00 C ATOM 1168 CG PRO A 73 -6.445 16.037 -2.426 1.00 0.00 C ATOM 1169 CD PRO A 73 -7.461 15.346 -1.532 1.00 0.00 C ATOM 0 HA PRO A 73 -5.882 12.829 -2.937 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -4.520 15.238 -3.009 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -5.820 14.832 -4.111 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -5.836 16.731 -1.846 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -6.949 16.622 -3.196 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -7.414 15.726 -0.511 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -8.478 15.512 -1.887 1.00 0.00 H new ATOM 1177 N THR A 74 -4.941 13.794 -0.039 1.00 0.00 N ATOM 1178 CA THR A 74 -3.970 13.551 1.014 1.00 0.00 C ATOM 1179 C THR A 74 -4.212 12.184 1.657 1.00 0.00 C ATOM 1180 O THR A 74 -3.291 11.580 2.204 1.00 0.00 O ATOM 1181 CB THR A 74 -4.049 14.712 2.007 1.00 0.00 C ATOM 1182 OG1 THR A 74 -5.195 14.414 2.799 1.00 0.00 O ATOM 1183 CG2 THR A 74 -4.398 16.039 1.330 1.00 0.00 C ATOM 0 H THR A 74 -5.768 14.313 0.255 1.00 0.00 H new ATOM 0 HA THR A 74 -2.956 13.513 0.616 1.00 0.00 H new ATOM 0 HB THR A 74 -3.096 14.810 2.527 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.510 15.231 3.240 1.00 0.00 H new ATOM 0 HG21 THR A 74 -4.441 16.829 2.079 1.00 0.00 H new ATOM 0 HG22 THR A 74 -3.635 16.282 0.590 1.00 0.00 H new ATOM 0 HG23 THR A 74 -5.367 15.953 0.837 1.00 0.00 H new ATOM 1191 N VAL A 75 -5.456 11.736 1.569 1.00 0.00 N ATOM 1192 CA VAL A 75 -5.830 10.452 2.136 1.00 0.00 C ATOM 1193 C VAL A 75 -5.598 9.354 1.096 1.00 0.00 C ATOM 1194 O VAL A 75 -4.992 8.326 1.398 1.00 0.00 O ATOM 1195 CB VAL A 75 -7.274 10.503 2.639 1.00 0.00 C ATOM 1196 CG1 VAL A 75 -7.721 9.136 3.162 1.00 0.00 C ATOM 1197 CG2 VAL A 75 -7.444 11.582 3.710 1.00 0.00 C ATOM 0 H VAL A 75 -6.217 12.239 1.114 1.00 0.00 H new ATOM 0 HA VAL A 75 -5.207 10.219 3.000 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.913 10.765 1.796 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -8.751 9.200 3.513 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.656 8.401 2.360 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -7.075 8.832 3.986 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -8.479 11.597 4.050 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.788 11.364 4.553 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.186 12.555 3.291 1.00 0.00 H new ATOM 1207 N LYS A 76 -6.092 9.608 -0.107 1.00 0.00 N ATOM 1208 CA LYS A 76 -5.946 8.653 -1.193 1.00 0.00 C ATOM 1209 C LYS A 76 -4.460 8.477 -1.514 1.00 0.00 C ATOM 1210 O LYS A 76 -3.989 7.355 -1.694 1.00 0.00 O ATOM 1211 CB LYS A 76 -6.789 9.078 -2.396 1.00 0.00 C ATOM 1212 CG LYS A 76 -7.388 7.860 -3.103 1.00 0.00 C ATOM 1213 CD LYS A 76 -8.128 8.274 -4.377 1.00 0.00 C ATOM 1214 CE LYS A 76 -8.334 7.076 -5.305 1.00 0.00 C ATOM 1215 NZ LYS A 76 -9.514 7.290 -6.173 1.00 0.00 N ATOM 0 H LYS A 76 -6.594 10.461 -0.354 1.00 0.00 H new ATOM 0 HA LYS A 76 -6.327 7.676 -0.896 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -7.589 9.742 -2.068 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -6.172 9.642 -3.096 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -6.596 7.153 -3.352 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -8.074 7.346 -2.430 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -9.094 8.707 -4.116 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -7.562 9.047 -4.896 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -7.446 6.927 -5.919 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -8.469 6.170 -4.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -9.640 6.467 -6.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -10.362 7.410 -5.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -9.370 8.143 -6.750 1.00 0.00 H new ATOM 1229 N ALA A 77 -3.764 9.603 -1.577 1.00 0.00 N ATOM 1230 CA ALA A 77 -2.341 9.587 -1.874 1.00 0.00 C ATOM 1231 C ALA A 77 -1.687 8.408 -1.151 1.00 0.00 C ATOM 1232 O ALA A 77 -1.114 7.525 -1.787 1.00 0.00 O ATOM 1233 CB ALA A 77 -1.722 10.929 -1.481 1.00 0.00 C ATOM 0 H ALA A 77 -4.158 10.532 -1.428 1.00 0.00 H new ATOM 0 HA ALA A 77 -2.173 9.452 -2.943 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -0.655 10.917 -1.704 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -2.201 11.730 -2.044 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -1.868 11.099 -0.414 1.00 0.00 H new ATOM 1239 N PHE A 78 -1.794 8.432 0.170 1.00 0.00 N ATOM 1240 CA PHE A 78 -1.220 7.377 0.986 1.00 0.00 C ATOM 1241 C PHE A 78 -1.685 6.000 0.509 1.00 0.00 C ATOM 1242 O PHE A 78 -0.867 5.109 0.282 1.00 0.00 O ATOM 1243 CB PHE A 78 -1.712 7.601 2.417 1.00 0.00 C ATOM 1244 CG PHE A 78 -0.876 6.888 3.482 1.00 0.00 C ATOM 1245 CD1 PHE A 78 0.437 7.204 3.639 1.00 0.00 C ATOM 1246 CD2 PHE A 78 -1.446 5.938 4.271 1.00 0.00 C ATOM 1247 CE1 PHE A 78 1.213 6.542 4.627 1.00 0.00 C ATOM 1248 CE2 PHE A 78 -0.670 5.276 5.259 1.00 0.00 C ATOM 1249 CZ PHE A 78 0.643 5.592 5.416 1.00 0.00 C ATOM 0 H PHE A 78 -2.270 9.166 0.695 1.00 0.00 H new ATOM 0 HA PHE A 78 -0.132 7.406 0.920 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -1.713 8.671 2.627 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -2.745 7.261 2.493 1.00 0.00 H new ATOM 0 HD1 PHE A 78 0.890 7.958 3.012 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.489 5.687 4.146 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.256 6.793 4.752 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -1.123 4.522 5.886 1.00 0.00 H new ATOM 0 HZ PHE A 78 1.233 5.089 6.167 1.00 0.00 H new ATOM 1259 N ALA A 79 -2.996 5.868 0.371 1.00 0.00 N ATOM 1260 CA ALA A 79 -3.579 4.614 -0.075 1.00 0.00 C ATOM 1261 C ALA A 79 -2.765 4.067 -1.249 1.00 0.00 C ATOM 1262 O ALA A 79 -2.339 2.913 -1.229 1.00 0.00 O ATOM 1263 CB ALA A 79 -5.049 4.836 -0.438 1.00 0.00 C ATOM 0 H ALA A 79 -3.671 6.609 0.560 1.00 0.00 H new ATOM 0 HA ALA A 79 -3.548 3.871 0.722 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -5.487 3.896 -0.773 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -5.589 5.197 0.437 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -5.119 5.574 -1.237 1.00 0.00 H new ATOM 1269 N GLY A 80 -2.572 4.921 -2.243 1.00 0.00 N ATOM 1270 CA GLY A 80 -1.816 4.537 -3.423 1.00 0.00 C ATOM 1271 C GLY A 80 -0.362 4.226 -3.066 1.00 0.00 C ATOM 1272 O GLY A 80 0.276 3.396 -3.711 1.00 0.00 O ATOM 0 H GLY A 80 -2.926 5.878 -2.256 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -2.275 3.663 -3.885 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -1.850 5.341 -4.158 1.00 0.00 H new ATOM 1276 N LEU A 81 0.120 4.910 -2.038 1.00 0.00 N ATOM 1277 CA LEU A 81 1.488 4.717 -1.587 1.00 0.00 C ATOM 1278 C LEU A 81 1.581 3.408 -0.800 1.00 0.00 C ATOM 1279 O LEU A 81 2.639 2.782 -0.754 1.00 0.00 O ATOM 1280 CB LEU A 81 1.971 5.940 -0.805 1.00 0.00 C ATOM 1281 CG LEU A 81 2.944 5.661 0.343 1.00 0.00 C ATOM 1282 CD1 LEU A 81 4.276 5.126 -0.184 1.00 0.00 C ATOM 1283 CD2 LEU A 81 3.130 6.903 1.217 1.00 0.00 C ATOM 0 H LEU A 81 -0.412 5.598 -1.505 1.00 0.00 H new ATOM 0 HA LEU A 81 2.161 4.626 -2.439 1.00 0.00 H new ATOM 0 HB2 LEU A 81 2.451 6.626 -1.503 1.00 0.00 H new ATOM 0 HB3 LEU A 81 1.100 6.455 -0.400 1.00 0.00 H new ATOM 0 HG LEU A 81 2.513 4.884 0.975 1.00 0.00 H new ATOM 0 HD11 LEU A 81 4.948 4.936 0.653 1.00 0.00 H new ATOM 0 HD12 LEU A 81 4.105 4.198 -0.730 1.00 0.00 H new ATOM 0 HD13 LEU A 81 4.725 5.862 -0.851 1.00 0.00 H new ATOM 0 HD21 LEU A 81 3.826 6.678 2.025 1.00 0.00 H new ATOM 0 HD22 LEU A 81 3.528 7.718 0.612 1.00 0.00 H new ATOM 0 HD23 LEU A 81 2.169 7.199 1.637 1.00 0.00 H new ATOM 1295 N LEU A 82 0.461 3.034 -0.200 1.00 0.00 N ATOM 1296 CA LEU A 82 0.403 1.811 0.582 1.00 0.00 C ATOM 1297 C LEU A 82 0.383 0.607 -0.362 1.00 0.00 C ATOM 1298 O LEU A 82 1.138 -0.346 -0.174 1.00 0.00 O ATOM 1299 CB LEU A 82 -0.780 1.851 1.552 1.00 0.00 C ATOM 1300 CG LEU A 82 -0.702 2.901 2.662 1.00 0.00 C ATOM 1301 CD1 LEU A 82 -2.006 2.953 3.460 1.00 0.00 C ATOM 1302 CD2 LEU A 82 0.511 2.658 3.562 1.00 0.00 C ATOM 0 H LEU A 82 -0.414 3.557 -0.240 1.00 0.00 H new ATOM 0 HA LEU A 82 1.293 1.714 1.204 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -1.690 2.025 0.977 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.878 0.869 2.014 1.00 0.00 H new ATOM 0 HG LEU A 82 -0.569 3.879 2.199 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -1.924 3.707 4.243 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -2.830 3.209 2.794 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -2.195 1.980 3.913 1.00 0.00 H new ATOM 0 HD21 LEU A 82 0.543 3.418 4.343 1.00 0.00 H new ATOM 0 HD22 LEU A 82 0.433 1.672 4.019 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.422 2.711 2.966 1.00 0.00 H new ATOM 1314 N ARG A 83 -0.487 0.690 -1.358 1.00 0.00 N ATOM 1315 CA ARG A 83 -0.614 -0.381 -2.331 1.00 0.00 C ATOM 1316 C ARG A 83 0.573 -0.364 -3.297 1.00 0.00 C ATOM 1317 O ARG A 83 0.845 -1.358 -3.968 1.00 0.00 O ATOM 1318 CB ARG A 83 -1.913 -0.248 -3.129 1.00 0.00 C ATOM 1319 CG ARG A 83 -1.694 0.571 -4.402 1.00 0.00 C ATOM 1320 CD ARG A 83 -3.027 1.039 -4.989 1.00 0.00 C ATOM 1321 NE ARG A 83 -3.257 0.393 -6.301 1.00 0.00 N ATOM 1322 CZ ARG A 83 -3.799 -0.823 -6.456 1.00 0.00 C ATOM 1323 NH1 ARG A 83 -4.171 -1.532 -5.381 1.00 0.00 N ATOM 1324 NH2 ARG A 83 -3.969 -1.329 -7.684 1.00 0.00 N ATOM 0 H ARG A 83 -1.111 1.482 -1.512 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.630 -1.325 -1.786 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -2.287 -1.238 -3.389 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.675 0.228 -2.513 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -1.067 1.435 -4.180 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -1.159 -0.030 -5.138 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -3.841 0.794 -4.306 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -3.023 2.123 -5.104 1.00 0.00 H new ATOM 0 HE ARG A 83 -2.986 0.906 -7.140 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -4.042 -1.146 -4.446 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -4.584 -2.457 -5.498 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -3.686 -0.789 -8.502 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -4.381 -2.254 -7.802 1.00 0.00 H new ATOM 1338 N GLU A 84 1.247 0.776 -3.336 1.00 0.00 N ATOM 1339 CA GLU A 84 2.398 0.935 -4.208 1.00 0.00 C ATOM 1340 C GLU A 84 3.435 -0.152 -3.921 1.00 0.00 C ATOM 1341 O GLU A 84 4.037 -0.700 -4.844 1.00 0.00 O ATOM 1342 CB GLU A 84 3.010 2.329 -4.059 1.00 0.00 C ATOM 1343 CG GLU A 84 2.756 3.176 -5.309 1.00 0.00 C ATOM 1344 CD GLU A 84 3.215 2.442 -6.570 1.00 0.00 C ATOM 1345 OE1 GLU A 84 4.445 2.402 -6.788 1.00 0.00 O ATOM 1346 OE2 GLU A 84 2.325 1.937 -7.289 1.00 0.00 O ATOM 0 H GLU A 84 1.018 1.598 -2.778 1.00 0.00 H new ATOM 0 HA GLU A 84 2.065 0.829 -5.240 1.00 0.00 H new ATOM 0 HB2 GLU A 84 2.585 2.825 -3.187 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.083 2.243 -3.886 1.00 0.00 H new ATOM 0 HG2 GLU A 84 1.694 3.409 -5.385 1.00 0.00 H new ATOM 0 HG3 GLU A 84 3.285 4.125 -5.223 1.00 0.00 H new ATOM 1353 N GLY A 85 3.613 -0.433 -2.638 1.00 0.00 N ATOM 1354 CA GLY A 85 4.567 -1.445 -2.219 1.00 0.00 C ATOM 1355 C GLY A 85 3.926 -2.429 -1.238 1.00 0.00 C ATOM 1356 O GLY A 85 4.489 -2.714 -0.182 1.00 0.00 O ATOM 0 H GLY A 85 3.112 0.023 -1.875 1.00 0.00 H new ATOM 0 HA2 GLY A 85 4.937 -1.984 -3.091 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.427 -0.967 -1.751 1.00 0.00 H new ATOM 1360 N LEU A 86 2.758 -2.922 -1.622 1.00 0.00 N ATOM 1361 CA LEU A 86 2.035 -3.868 -0.789 1.00 0.00 C ATOM 1362 C LEU A 86 1.122 -4.722 -1.671 1.00 0.00 C ATOM 1363 O LEU A 86 1.050 -5.939 -1.502 1.00 0.00 O ATOM 1364 CB LEU A 86 1.297 -3.138 0.335 1.00 0.00 C ATOM 1365 CG LEU A 86 2.172 -2.351 1.312 1.00 0.00 C ATOM 1366 CD1 LEU A 86 1.317 -1.493 2.246 1.00 0.00 C ATOM 1367 CD2 LEU A 86 3.107 -3.284 2.084 1.00 0.00 C ATOM 0 H LEU A 86 2.294 -2.684 -2.499 1.00 0.00 H new ATOM 0 HA LEU A 86 2.729 -4.548 -0.294 1.00 0.00 H new ATOM 0 HB2 LEU A 86 0.580 -2.451 -0.114 1.00 0.00 H new ATOM 0 HB3 LEU A 86 0.723 -3.871 0.902 1.00 0.00 H new ATOM 0 HG LEU A 86 2.800 -1.671 0.737 1.00 0.00 H new ATOM 0 HD11 LEU A 86 1.964 -0.944 2.930 1.00 0.00 H new ATOM 0 HD12 LEU A 86 0.730 -0.788 1.657 1.00 0.00 H new ATOM 0 HD13 LEU A 86 0.646 -2.135 2.817 1.00 0.00 H new ATOM 0 HD21 LEU A 86 3.718 -2.699 2.772 1.00 0.00 H new ATOM 0 HD22 LEU A 86 2.516 -4.006 2.648 1.00 0.00 H new ATOM 0 HD23 LEU A 86 3.754 -3.812 1.383 1.00 0.00 H new ATOM 1379 N GLU A 87 0.446 -4.052 -2.593 1.00 0.00 N ATOM 1380 CA GLU A 87 -0.460 -4.735 -3.501 1.00 0.00 C ATOM 1381 C GLU A 87 0.267 -5.874 -4.218 1.00 0.00 C ATOM 1382 O GLU A 87 1.170 -5.634 -5.017 1.00 0.00 O ATOM 1383 CB GLU A 87 -1.070 -3.755 -4.506 1.00 0.00 C ATOM 1384 CG GLU A 87 -1.930 -4.491 -5.535 1.00 0.00 C ATOM 1385 CD GLU A 87 -1.302 -4.417 -6.928 1.00 0.00 C ATOM 1386 OE1 GLU A 87 -0.220 -5.020 -7.095 1.00 0.00 O ATOM 1387 OE2 GLU A 87 -1.918 -3.761 -7.795 1.00 0.00 O ATOM 0 H GLU A 87 0.508 -3.043 -2.731 1.00 0.00 H new ATOM 0 HA GLU A 87 -1.276 -5.161 -2.918 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -1.677 -3.019 -3.979 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -0.276 -3.208 -5.015 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -2.045 -5.534 -5.239 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -2.928 -4.054 -5.559 1.00 0.00 H new ATOM 1394 N GLY A 88 -0.155 -7.091 -3.906 1.00 0.00 N ATOM 1395 CA GLY A 88 0.445 -8.269 -4.511 1.00 0.00 C ATOM 1396 C GLY A 88 1.700 -8.698 -3.748 1.00 0.00 C ATOM 1397 O GLY A 88 2.610 -9.291 -4.326 1.00 0.00 O ATOM 0 H GLY A 88 -0.905 -7.287 -3.243 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -0.277 -9.086 -4.519 1.00 0.00 H new ATOM 0 HA3 GLY A 88 0.700 -8.059 -5.550 1.00 0.00 H new ATOM 1401 N GLU A 89 1.709 -8.381 -2.461 1.00 0.00 N ATOM 1402 CA GLU A 89 2.837 -8.727 -1.614 1.00 0.00 C ATOM 1403 C GLU A 89 2.481 -9.910 -0.712 1.00 0.00 C ATOM 1404 O GLU A 89 1.409 -10.498 -0.847 1.00 0.00 O ATOM 1405 CB GLU A 89 3.290 -7.523 -0.786 1.00 0.00 C ATOM 1406 CG GLU A 89 3.976 -6.477 -1.667 1.00 0.00 C ATOM 1407 CD GLU A 89 5.231 -7.054 -2.326 1.00 0.00 C ATOM 1408 OE1 GLU A 89 5.983 -7.746 -1.606 1.00 0.00 O ATOM 1409 OE2 GLU A 89 5.409 -6.791 -3.535 1.00 0.00 O ATOM 0 H GLU A 89 0.953 -7.889 -1.985 1.00 0.00 H new ATOM 0 HA GLU A 89 3.669 -9.021 -2.253 1.00 0.00 H new ATOM 0 HB2 GLU A 89 2.430 -7.076 -0.288 1.00 0.00 H new ATOM 0 HB3 GLU A 89 3.976 -7.852 -0.005 1.00 0.00 H new ATOM 0 HG2 GLU A 89 3.283 -6.132 -2.435 1.00 0.00 H new ATOM 0 HG3 GLU A 89 4.243 -5.608 -1.065 1.00 0.00 H new ATOM 1416 N SER A 90 3.400 -10.224 0.189 1.00 0.00 N ATOM 1417 CA SER A 90 3.197 -11.327 1.113 1.00 0.00 C ATOM 1418 C SER A 90 2.602 -10.808 2.424 1.00 0.00 C ATOM 1419 O SER A 90 2.733 -9.628 2.745 1.00 0.00 O ATOM 1420 CB SER A 90 4.507 -12.070 1.382 1.00 0.00 C ATOM 1421 OG SER A 90 5.580 -11.175 1.661 1.00 0.00 O ATOM 0 H SER A 90 4.288 -9.734 0.299 1.00 0.00 H new ATOM 0 HA SER A 90 2.500 -12.030 0.658 1.00 0.00 H new ATOM 0 HB2 SER A 90 4.373 -12.749 2.224 1.00 0.00 H new ATOM 0 HB3 SER A 90 4.761 -12.682 0.517 1.00 0.00 H new ATOM 0 HG SER A 90 6.398 -11.688 1.829 1.00 0.00 H new ATOM 1427 N PRO A 91 1.945 -11.739 3.166 1.00 0.00 N ATOM 1428 CA PRO A 91 1.330 -11.388 4.434 1.00 0.00 C ATOM 1429 C PRO A 91 2.387 -11.214 5.527 1.00 0.00 C ATOM 1430 O PRO A 91 2.083 -10.737 6.619 1.00 0.00 O ATOM 1431 CB PRO A 91 0.355 -12.517 4.725 1.00 0.00 C ATOM 1432 CG PRO A 91 0.793 -13.681 3.852 1.00 0.00 C ATOM 1433 CD PRO A 91 1.770 -13.146 2.817 1.00 0.00 C ATOM 0 HA PRO A 91 0.810 -10.431 4.398 1.00 0.00 H new ATOM 0 HB2 PRO A 91 0.377 -12.790 5.780 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -0.668 -12.219 4.494 1.00 0.00 H new ATOM 0 HG2 PRO A 91 1.264 -14.456 4.457 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -0.068 -14.137 3.364 1.00 0.00 H new ATOM 0 HD2 PRO A 91 2.718 -13.684 2.852 1.00 0.00 H new ATOM 0 HD3 PRO A 91 1.377 -13.258 1.806 1.00 0.00 H new ATOM 1441 N GLU A 92 3.606 -11.611 5.193 1.00 0.00 N ATOM 1442 CA GLU A 92 4.710 -11.505 6.133 1.00 0.00 C ATOM 1443 C GLU A 92 5.464 -10.190 5.920 1.00 0.00 C ATOM 1444 O GLU A 92 5.934 -9.579 6.878 1.00 0.00 O ATOM 1445 CB GLU A 92 5.653 -12.704 6.008 1.00 0.00 C ATOM 1446 CG GLU A 92 4.873 -14.020 6.038 1.00 0.00 C ATOM 1447 CD GLU A 92 5.223 -14.836 7.284 1.00 0.00 C ATOM 1448 OE1 GLU A 92 4.595 -14.570 8.332 1.00 0.00 O ATOM 1449 OE2 GLU A 92 6.111 -15.707 7.161 1.00 0.00 O ATOM 0 H GLU A 92 3.854 -12.006 4.286 1.00 0.00 H new ATOM 0 HA GLU A 92 4.303 -11.508 7.144 1.00 0.00 H new ATOM 0 HB2 GLU A 92 6.217 -12.632 5.078 1.00 0.00 H new ATOM 0 HB3 GLU A 92 6.378 -12.688 6.822 1.00 0.00 H new ATOM 0 HG2 GLU A 92 3.803 -13.813 6.023 1.00 0.00 H new ATOM 0 HG3 GLU A 92 5.098 -14.601 5.143 1.00 0.00 H new ATOM 1456 N ALA A 93 5.555 -9.795 4.659 1.00 0.00 N ATOM 1457 CA ALA A 93 6.244 -8.564 4.308 1.00 0.00 C ATOM 1458 C ALA A 93 5.345 -7.371 4.638 1.00 0.00 C ATOM 1459 O ALA A 93 5.831 -6.319 5.052 1.00 0.00 O ATOM 1460 CB ALA A 93 6.642 -8.605 2.832 1.00 0.00 C ATOM 0 H ALA A 93 5.163 -10.305 3.867 1.00 0.00 H new ATOM 0 HA ALA A 93 7.160 -8.457 4.889 1.00 0.00 H new ATOM 0 HB1 ALA A 93 7.159 -7.682 2.569 1.00 0.00 H new ATOM 0 HB2 ALA A 93 7.303 -9.454 2.657 1.00 0.00 H new ATOM 0 HB3 ALA A 93 5.748 -8.709 2.217 1.00 0.00 H new ATOM 1466 N VAL A 94 4.051 -7.574 4.441 1.00 0.00 N ATOM 1467 CA VAL A 94 3.080 -6.527 4.712 1.00 0.00 C ATOM 1468 C VAL A 94 2.945 -6.342 6.225 1.00 0.00 C ATOM 1469 O VAL A 94 2.433 -5.323 6.686 1.00 0.00 O ATOM 1470 CB VAL A 94 1.751 -6.856 4.029 1.00 0.00 C ATOM 1471 CG1 VAL A 94 0.628 -5.960 4.555 1.00 0.00 C ATOM 1472 CG2 VAL A 94 1.874 -6.746 2.508 1.00 0.00 C ATOM 0 H VAL A 94 3.652 -8.447 4.097 1.00 0.00 H new ATOM 0 HA VAL A 94 3.417 -5.577 4.297 1.00 0.00 H new ATOM 0 HB VAL A 94 1.497 -7.888 4.270 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -0.306 -6.214 4.053 1.00 0.00 H new ATOM 0 HG12 VAL A 94 0.516 -6.110 5.629 1.00 0.00 H new ATOM 0 HG13 VAL A 94 0.873 -4.916 4.358 1.00 0.00 H new ATOM 0 HG21 VAL A 94 0.916 -6.985 2.047 1.00 0.00 H new ATOM 0 HG22 VAL A 94 2.163 -5.730 2.239 1.00 0.00 H new ATOM 0 HG23 VAL A 94 2.631 -7.445 2.153 1.00 0.00 H new ATOM 1482 N LEU A 95 3.413 -7.343 6.956 1.00 0.00 N ATOM 1483 CA LEU A 95 3.351 -7.304 8.407 1.00 0.00 C ATOM 1484 C LEU A 95 4.671 -6.760 8.955 1.00 0.00 C ATOM 1485 O LEU A 95 4.701 -6.156 10.026 1.00 0.00 O ATOM 1486 CB LEU A 95 2.973 -8.678 8.964 1.00 0.00 C ATOM 1487 CG LEU A 95 1.476 -8.939 9.147 1.00 0.00 C ATOM 1488 CD1 LEU A 95 1.205 -10.424 9.398 1.00 0.00 C ATOM 1489 CD2 LEU A 95 0.896 -8.055 10.253 1.00 0.00 C ATOM 0 H LEU A 95 3.837 -8.187 6.570 1.00 0.00 H new ATOM 0 HA LEU A 95 2.565 -6.625 8.737 1.00 0.00 H new ATOM 0 HB2 LEU A 95 3.376 -9.441 8.298 1.00 0.00 H new ATOM 0 HB3 LEU A 95 3.464 -8.805 9.929 1.00 0.00 H new ATOM 0 HG LEU A 95 0.967 -8.671 8.221 1.00 0.00 H new ATOM 0 HD11 LEU A 95 0.134 -10.582 9.525 1.00 0.00 H new ATOM 0 HD12 LEU A 95 1.560 -11.007 8.548 1.00 0.00 H new ATOM 0 HD13 LEU A 95 1.728 -10.742 10.300 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -0.169 -8.261 10.362 1.00 0.00 H new ATOM 0 HD22 LEU A 95 1.405 -8.268 11.193 1.00 0.00 H new ATOM 0 HD23 LEU A 95 1.038 -7.006 9.993 1.00 0.00 H new ATOM 1501 N GLU A 96 5.731 -6.994 8.195 1.00 0.00 N ATOM 1502 CA GLU A 96 7.052 -6.535 8.592 1.00 0.00 C ATOM 1503 C GLU A 96 7.124 -5.007 8.530 1.00 0.00 C ATOM 1504 O GLU A 96 8.121 -4.412 8.936 1.00 0.00 O ATOM 1505 CB GLU A 96 8.137 -7.170 7.721 1.00 0.00 C ATOM 1506 CG GLU A 96 8.260 -8.669 8.003 1.00 0.00 C ATOM 1507 CD GLU A 96 9.460 -8.960 8.907 1.00 0.00 C ATOM 1508 OE1 GLU A 96 9.311 -8.759 10.131 1.00 0.00 O ATOM 1509 OE2 GLU A 96 10.500 -9.377 8.352 1.00 0.00 O ATOM 0 H GLU A 96 5.702 -7.495 7.307 1.00 0.00 H new ATOM 0 HA GLU A 96 7.229 -6.846 9.621 1.00 0.00 H new ATOM 0 HB2 GLU A 96 7.902 -7.013 6.668 1.00 0.00 H new ATOM 0 HB3 GLU A 96 9.093 -6.681 7.910 1.00 0.00 H new ATOM 0 HG2 GLU A 96 7.347 -9.030 8.477 1.00 0.00 H new ATOM 0 HG3 GLU A 96 8.367 -9.212 7.064 1.00 0.00 H new ATOM 1516 N VAL A 97 6.053 -4.417 8.019 1.00 0.00 N ATOM 1517 CA VAL A 97 5.982 -2.970 7.899 1.00 0.00 C ATOM 1518 C VAL A 97 5.536 -2.374 9.236 1.00 0.00 C ATOM 1519 O VAL A 97 4.430 -2.642 9.701 1.00 0.00 O ATOM 1520 CB VAL A 97 5.064 -2.586 6.737 1.00 0.00 C ATOM 1521 CG1 VAL A 97 5.294 -1.134 6.314 1.00 0.00 C ATOM 1522 CG2 VAL A 97 5.251 -3.537 5.553 1.00 0.00 C ATOM 0 H VAL A 97 5.228 -4.914 7.684 1.00 0.00 H new ATOM 0 HA VAL A 97 6.964 -2.556 7.670 1.00 0.00 H new ATOM 0 HB VAL A 97 4.033 -2.677 7.080 1.00 0.00 H new ATOM 0 HG11 VAL A 97 4.629 -0.886 5.486 1.00 0.00 H new ATOM 0 HG12 VAL A 97 5.088 -0.473 7.156 1.00 0.00 H new ATOM 0 HG13 VAL A 97 6.329 -1.007 5.998 1.00 0.00 H new ATOM 0 HG21 VAL A 97 4.587 -3.242 4.741 1.00 0.00 H new ATOM 0 HG22 VAL A 97 6.285 -3.493 5.211 1.00 0.00 H new ATOM 0 HG23 VAL A 97 5.015 -4.555 5.863 1.00 0.00 H new ATOM 1532 N PRO A 98 6.444 -1.554 9.830 1.00 0.00 N ATOM 1533 CA PRO A 98 6.155 -0.917 11.104 1.00 0.00 C ATOM 1534 C PRO A 98 5.173 0.243 10.927 1.00 0.00 C ATOM 1535 O PRO A 98 4.811 0.588 9.803 1.00 0.00 O ATOM 1536 CB PRO A 98 7.508 -0.473 11.637 1.00 0.00 C ATOM 1537 CG PRO A 98 8.444 -0.460 10.440 1.00 0.00 C ATOM 1538 CD PRO A 98 7.764 -1.213 9.308 1.00 0.00 C ATOM 0 HA PRO A 98 5.664 -1.589 11.808 1.00 0.00 H new ATOM 0 HB2 PRO A 98 7.443 0.515 12.093 1.00 0.00 H new ATOM 0 HB3 PRO A 98 7.868 -1.156 12.407 1.00 0.00 H new ATOM 0 HG2 PRO A 98 8.664 0.564 10.139 1.00 0.00 H new ATOM 0 HG3 PRO A 98 9.395 -0.929 10.694 1.00 0.00 H new ATOM 0 HD2 PRO A 98 7.688 -0.597 8.412 1.00 0.00 H new ATOM 0 HD3 PRO A 98 8.325 -2.107 9.034 1.00 0.00 H new ATOM 1546 N PRO A 99 4.759 0.827 12.083 1.00 0.00 N ATOM 1547 CA PRO A 99 3.825 1.940 12.067 1.00 0.00 C ATOM 1548 C PRO A 99 4.518 3.230 11.623 1.00 0.00 C ATOM 1549 O PRO A 99 3.873 4.267 11.479 1.00 0.00 O ATOM 1550 CB PRO A 99 3.278 2.016 13.483 1.00 0.00 C ATOM 1551 CG PRO A 99 4.262 1.249 14.351 1.00 0.00 C ATOM 1552 CD PRO A 99 5.166 0.444 13.432 1.00 0.00 C ATOM 0 HA PRO A 99 3.016 1.800 11.350 1.00 0.00 H new ATOM 0 HB2 PRO A 99 3.190 3.051 13.813 1.00 0.00 H new ATOM 0 HB3 PRO A 99 2.282 1.578 13.541 1.00 0.00 H new ATOM 0 HG2 PRO A 99 4.850 1.936 14.959 1.00 0.00 H new ATOM 0 HG3 PRO A 99 3.732 0.590 15.038 1.00 0.00 H new ATOM 0 HD2 PRO A 99 6.217 0.674 13.609 1.00 0.00 H new ATOM 0 HD3 PRO A 99 5.043 -0.627 13.594 1.00 0.00 H new ATOM 1560 N GLY A 100 5.823 3.123 11.420 1.00 0.00 N ATOM 1561 CA GLY A 100 6.610 4.268 10.996 1.00 0.00 C ATOM 1562 C GLY A 100 7.621 3.870 9.918 1.00 0.00 C ATOM 1563 O GLY A 100 8.817 4.121 10.060 1.00 0.00 O ATOM 0 H GLY A 100 6.355 2.261 11.541 1.00 0.00 H new ATOM 0 HA2 GLY A 100 5.950 5.045 10.611 1.00 0.00 H new ATOM 0 HA3 GLY A 100 7.134 4.691 11.853 1.00 0.00 H new ATOM 1567 N PHE A 101 7.103 3.256 8.864 1.00 0.00 N ATOM 1568 CA PHE A 101 7.945 2.821 7.763 1.00 0.00 C ATOM 1569 C PHE A 101 8.216 3.972 6.792 1.00 0.00 C ATOM 1570 O PHE A 101 9.037 3.843 5.885 1.00 0.00 O ATOM 1571 CB PHE A 101 7.183 1.717 7.026 1.00 0.00 C ATOM 1572 CG PHE A 101 6.019 2.227 6.173 1.00 0.00 C ATOM 1573 CD1 PHE A 101 6.267 2.948 5.046 1.00 0.00 C ATOM 1574 CD2 PHE A 101 4.738 1.960 6.541 1.00 0.00 C ATOM 1575 CE1 PHE A 101 5.188 3.421 4.255 1.00 0.00 C ATOM 1576 CE2 PHE A 101 3.658 2.434 5.749 1.00 0.00 C ATOM 1577 CZ PHE A 101 3.906 3.154 4.623 1.00 0.00 C ATOM 0 H PHE A 101 6.111 3.050 8.749 1.00 0.00 H new ATOM 0 HA PHE A 101 8.904 2.469 8.144 1.00 0.00 H new ATOM 0 HB2 PHE A 101 7.879 1.175 6.386 1.00 0.00 H new ATOM 0 HB3 PHE A 101 6.800 1.004 7.756 1.00 0.00 H new ATOM 0 HD1 PHE A 101 7.285 3.160 4.754 1.00 0.00 H new ATOM 0 HD2 PHE A 101 4.541 1.388 7.435 1.00 0.00 H new ATOM 0 HE1 PHE A 101 5.385 3.993 3.360 1.00 0.00 H new ATOM 0 HE2 PHE A 101 2.640 2.222 6.041 1.00 0.00 H new ATOM 0 HZ PHE A 101 3.085 3.514 4.021 1.00 0.00 H new ATOM 1587 N TYR A 102 7.512 5.071 7.016 1.00 0.00 N ATOM 1588 CA TYR A 102 7.666 6.244 6.173 1.00 0.00 C ATOM 1589 C TYR A 102 8.495 7.321 6.877 1.00 0.00 C ATOM 1590 O TYR A 102 9.391 7.912 6.276 1.00 0.00 O ATOM 1591 CB TYR A 102 6.254 6.781 5.933 1.00 0.00 C ATOM 1592 CG TYR A 102 5.583 7.350 7.184 1.00 0.00 C ATOM 1593 CD1 TYR A 102 4.954 6.505 8.075 1.00 0.00 C ATOM 1594 CD2 TYR A 102 5.608 8.709 7.422 1.00 0.00 C ATOM 1595 CE1 TYR A 102 4.323 7.041 9.253 1.00 0.00 C ATOM 1596 CE2 TYR A 102 4.977 9.246 8.600 1.00 0.00 C ATOM 1597 CZ TYR A 102 4.366 8.385 9.458 1.00 0.00 C ATOM 1598 OH TYR A 102 3.770 8.892 10.570 1.00 0.00 O ATOM 0 H TYR A 102 6.833 5.174 7.770 1.00 0.00 H new ATOM 0 HA TYR A 102 8.178 5.985 5.246 1.00 0.00 H new ATOM 0 HB2 TYR A 102 6.297 7.559 5.171 1.00 0.00 H new ATOM 0 HB3 TYR A 102 5.634 5.978 5.534 1.00 0.00 H new ATOM 0 HD1 TYR A 102 4.935 5.441 7.889 1.00 0.00 H new ATOM 0 HD2 TYR A 102 6.101 9.370 6.725 1.00 0.00 H new ATOM 0 HE1 TYR A 102 3.827 6.391 9.958 1.00 0.00 H new ATOM 0 HE2 TYR A 102 4.989 10.308 8.798 1.00 0.00 H new ATOM 0 HH TYR A 102 3.858 8.253 11.308 1.00 0.00 H new ATOM 1608 N ARG A 103 8.165 7.543 8.141 1.00 0.00 N ATOM 1609 CA ARG A 103 8.868 8.538 8.934 1.00 0.00 C ATOM 1610 C ARG A 103 10.348 8.575 8.549 1.00 0.00 C ATOM 1611 O ARG A 103 11.041 7.562 8.637 1.00 0.00 O ATOM 1612 CB ARG A 103 8.744 8.239 10.429 1.00 0.00 C ATOM 1613 CG ARG A 103 7.295 8.388 10.900 1.00 0.00 C ATOM 1614 CD ARG A 103 7.208 8.340 12.426 1.00 0.00 C ATOM 1615 NE ARG A 103 7.552 9.662 12.996 1.00 0.00 N ATOM 1616 CZ ARG A 103 7.822 9.875 14.290 1.00 0.00 C ATOM 1617 NH1 ARG A 103 7.790 8.855 15.158 1.00 0.00 N ATOM 1618 NH2 ARG A 103 8.124 11.109 14.718 1.00 0.00 N ATOM 0 H ARG A 103 7.421 7.051 8.636 1.00 0.00 H new ATOM 0 HA ARG A 103 8.412 9.507 8.730 1.00 0.00 H new ATOM 0 HB2 ARG A 103 9.094 7.227 10.631 1.00 0.00 H new ATOM 0 HB3 ARG A 103 9.385 8.916 10.993 1.00 0.00 H new ATOM 0 HG2 ARG A 103 6.886 9.332 10.538 1.00 0.00 H new ATOM 0 HG3 ARG A 103 6.686 7.592 10.472 1.00 0.00 H new ATOM 0 HD2 ARG A 103 6.202 8.054 12.732 1.00 0.00 H new ATOM 0 HD3 ARG A 103 7.887 7.580 12.813 1.00 0.00 H new ATOM 0 HE ARG A 103 7.585 10.461 12.363 1.00 0.00 H new ATOM 0 HH11 ARG A 103 7.560 7.916 14.833 1.00 0.00 H new ATOM 0 HH12 ARG A 103 7.996 9.018 16.144 1.00 0.00 H new ATOM 0 HH21 ARG A 103 8.148 11.886 14.058 1.00 0.00 H new ATOM 0 HH22 ARG A 103 8.330 11.271 15.704 1.00 0.00 H new ATOM 1632 N GLY A 104 10.789 9.752 8.130 1.00 0.00 N ATOM 1633 CA GLY A 104 12.174 9.934 7.732 1.00 0.00 C ATOM 1634 C GLY A 104 12.267 10.612 6.364 1.00 0.00 C ATOM 1635 O GLY A 104 12.615 11.789 6.272 1.00 0.00 O ATOM 0 H GLY A 104 10.211 10.589 8.058 1.00 0.00 H new ATOM 0 HA2 GLY A 104 12.694 10.537 8.477 1.00 0.00 H new ATOM 0 HA3 GLY A 104 12.676 8.967 7.698 1.00 0.00 H new ATOM 1639 N TYR A 105 11.949 9.842 5.334 1.00 0.00 N ATOM 1640 CA TYR A 105 11.992 10.354 3.975 1.00 0.00 C ATOM 1641 C TYR A 105 11.530 11.812 3.923 1.00 0.00 C ATOM 1642 O TYR A 105 12.308 12.702 3.584 1.00 0.00 O ATOM 1643 CB TYR A 105 11.016 9.494 3.169 1.00 0.00 C ATOM 1644 CG TYR A 105 11.269 7.989 3.288 1.00 0.00 C ATOM 1645 CD1 TYR A 105 12.480 7.459 2.890 1.00 0.00 C ATOM 1646 CD2 TYR A 105 10.286 7.162 3.792 1.00 0.00 C ATOM 1647 CE1 TYR A 105 12.717 6.044 3.001 1.00 0.00 C ATOM 1648 CE2 TYR A 105 10.524 5.747 3.904 1.00 0.00 C ATOM 1649 CZ TYR A 105 11.728 5.257 3.503 1.00 0.00 C ATOM 1650 OH TYR A 105 11.952 3.920 3.609 1.00 0.00 O ATOM 0 H TYR A 105 11.660 8.867 5.413 1.00 0.00 H new ATOM 0 HA TYR A 105 13.008 10.314 3.582 1.00 0.00 H new ATOM 0 HB2 TYR A 105 10.000 9.709 3.500 1.00 0.00 H new ATOM 0 HB3 TYR A 105 11.077 9.781 2.119 1.00 0.00 H new ATOM 0 HD1 TYR A 105 13.249 8.106 2.495 1.00 0.00 H new ATOM 0 HD2 TYR A 105 9.338 7.576 4.102 1.00 0.00 H new ATOM 0 HE1 TYR A 105 13.660 5.616 2.692 1.00 0.00 H new ATOM 0 HE2 TYR A 105 9.764 5.089 4.298 1.00 0.00 H new ATOM 0 HH TYR A 105 11.159 3.484 3.985 1.00 0.00 H new ATOM 1660 N GLY A 106 10.266 12.011 4.265 1.00 0.00 N ATOM 1661 CA GLY A 106 9.691 13.345 4.262 1.00 0.00 C ATOM 1662 C GLY A 106 8.263 13.326 3.713 1.00 0.00 C ATOM 1663 O GLY A 106 7.981 13.939 2.685 1.00 0.00 O ATOM 0 H GLY A 106 9.624 11.270 4.546 1.00 0.00 H new ATOM 0 HA2 GLY A 106 9.689 13.746 5.275 1.00 0.00 H new ATOM 0 HA3 GLY A 106 10.308 14.009 3.657 1.00 0.00 H new ATOM 1667 N LEU A 107 7.399 12.615 4.424 1.00 0.00 N ATOM 1668 CA LEU A 107 6.007 12.508 4.020 1.00 0.00 C ATOM 1669 C LEU A 107 5.160 13.456 4.871 1.00 0.00 C ATOM 1670 O LEU A 107 4.102 13.907 4.436 1.00 0.00 O ATOM 1671 CB LEU A 107 5.544 11.051 4.077 1.00 0.00 C ATOM 1672 CG LEU A 107 5.990 10.160 2.915 1.00 0.00 C ATOM 1673 CD1 LEU A 107 6.930 9.055 3.401 1.00 0.00 C ATOM 1674 CD2 LEU A 107 4.783 9.596 2.162 1.00 0.00 C ATOM 0 H LEU A 107 7.636 12.108 5.277 1.00 0.00 H new ATOM 0 HA LEU A 107 5.886 12.817 2.982 1.00 0.00 H new ATOM 0 HB2 LEU A 107 5.907 10.611 5.006 1.00 0.00 H new ATOM 0 HB3 LEU A 107 4.455 11.038 4.122 1.00 0.00 H new ATOM 0 HG LEU A 107 6.551 10.773 2.210 1.00 0.00 H new ATOM 0 HD11 LEU A 107 7.232 8.436 2.556 1.00 0.00 H new ATOM 0 HD12 LEU A 107 7.813 9.503 3.857 1.00 0.00 H new ATOM 0 HD13 LEU A 107 6.416 8.437 4.137 1.00 0.00 H new ATOM 0 HD21 LEU A 107 5.128 8.967 1.342 1.00 0.00 H new ATOM 0 HD22 LEU A 107 4.174 9.002 2.844 1.00 0.00 H new ATOM 0 HD23 LEU A 107 4.187 10.417 1.764 1.00 0.00 H new ATOM 1686 N GLU A 108 5.657 13.730 6.068 1.00 0.00 N ATOM 1687 CA GLU A 108 4.959 14.616 6.984 1.00 0.00 C ATOM 1688 C GLU A 108 4.837 16.016 6.378 1.00 0.00 C ATOM 1689 O GLU A 108 3.782 16.642 6.463 1.00 0.00 O ATOM 1690 CB GLU A 108 5.662 14.665 8.342 1.00 0.00 C ATOM 1691 CG GLU A 108 6.103 13.268 8.782 1.00 0.00 C ATOM 1692 CD GLU A 108 6.033 13.125 10.304 1.00 0.00 C ATOM 1693 OE1 GLU A 108 6.760 13.885 10.980 1.00 0.00 O ATOM 1694 OE2 GLU A 108 5.253 12.259 10.757 1.00 0.00 O ATOM 0 H GLU A 108 6.535 13.354 6.425 1.00 0.00 H new ATOM 0 HA GLU A 108 3.955 14.223 7.146 1.00 0.00 H new ATOM 0 HB2 GLU A 108 6.530 15.322 8.283 1.00 0.00 H new ATOM 0 HB3 GLU A 108 4.990 15.090 9.088 1.00 0.00 H new ATOM 0 HG2 GLU A 108 5.467 12.517 8.313 1.00 0.00 H new ATOM 0 HG3 GLU A 108 7.121 13.080 8.442 1.00 0.00 H new ATOM 1701 N GLU A 109 5.931 16.465 5.781 1.00 0.00 N ATOM 1702 CA GLU A 109 5.959 17.779 5.162 1.00 0.00 C ATOM 1703 C GLU A 109 4.692 18.003 4.334 1.00 0.00 C ATOM 1704 O GLU A 109 4.232 19.135 4.191 1.00 0.00 O ATOM 1705 CB GLU A 109 7.213 17.953 4.302 1.00 0.00 C ATOM 1706 CG GLU A 109 7.368 16.793 3.317 1.00 0.00 C ATOM 1707 CD GLU A 109 8.844 16.519 3.020 1.00 0.00 C ATOM 1708 OE1 GLU A 109 9.593 16.324 4.001 1.00 0.00 O ATOM 1709 OE2 GLU A 109 9.189 16.510 1.819 1.00 0.00 O ATOM 0 H GLU A 109 6.804 15.942 5.713 1.00 0.00 H new ATOM 0 HA GLU A 109 5.992 18.530 5.951 1.00 0.00 H new ATOM 0 HB2 GLU A 109 7.155 18.894 3.755 1.00 0.00 H new ATOM 0 HB3 GLU A 109 8.093 18.010 4.943 1.00 0.00 H new ATOM 0 HG2 GLU A 109 6.904 15.897 3.729 1.00 0.00 H new ATOM 0 HG3 GLU A 109 6.844 17.026 2.390 1.00 0.00 H new ATOM 1716 N PHE A 110 4.164 16.907 3.810 1.00 0.00 N ATOM 1717 CA PHE A 110 2.959 16.969 3.000 1.00 0.00 C ATOM 1718 C PHE A 110 1.727 16.578 3.819 1.00 0.00 C ATOM 1719 O PHE A 110 0.723 17.288 3.815 1.00 0.00 O ATOM 1720 CB PHE A 110 3.136 15.969 1.857 1.00 0.00 C ATOM 1721 CG PHE A 110 4.410 16.181 1.036 1.00 0.00 C ATOM 1722 CD1 PHE A 110 4.558 17.308 0.290 1.00 0.00 C ATOM 1723 CD2 PHE A 110 5.393 15.241 1.052 1.00 0.00 C ATOM 1724 CE1 PHE A 110 5.740 17.505 -0.472 1.00 0.00 C ATOM 1725 CE2 PHE A 110 6.575 15.438 0.290 1.00 0.00 C ATOM 1726 CZ PHE A 110 6.724 16.565 -0.456 1.00 0.00 C ATOM 0 H PHE A 110 4.549 15.970 3.931 1.00 0.00 H new ATOM 0 HA PHE A 110 2.810 17.984 2.632 1.00 0.00 H new ATOM 0 HB2 PHE A 110 3.145 14.960 2.269 1.00 0.00 H new ATOM 0 HB3 PHE A 110 2.274 16.035 1.194 1.00 0.00 H new ATOM 0 HD1 PHE A 110 3.777 18.053 0.277 1.00 0.00 H new ATOM 0 HD2 PHE A 110 5.275 14.345 1.644 1.00 0.00 H new ATOM 0 HE1 PHE A 110 5.858 18.401 -1.064 1.00 0.00 H new ATOM 0 HE2 PHE A 110 7.356 14.692 0.303 1.00 0.00 H new ATOM 0 HZ PHE A 110 7.623 16.714 -1.036 1.00 0.00 H new ATOM 1736 N PHE A 111 1.845 15.449 4.502 1.00 0.00 N ATOM 1737 CA PHE A 111 0.754 14.954 5.324 1.00 0.00 C ATOM 1738 C PHE A 111 0.877 15.461 6.762 1.00 0.00 C ATOM 1739 O PHE A 111 1.852 15.160 7.449 1.00 0.00 O ATOM 1740 CB PHE A 111 0.850 13.427 5.324 1.00 0.00 C ATOM 1741 CG PHE A 111 0.741 12.796 3.934 1.00 0.00 C ATOM 1742 CD1 PHE A 111 -0.273 13.156 3.102 1.00 0.00 C ATOM 1743 CD2 PHE A 111 1.657 11.876 3.531 1.00 0.00 C ATOM 1744 CE1 PHE A 111 -0.374 12.571 1.812 1.00 0.00 C ATOM 1745 CE2 PHE A 111 1.556 11.290 2.242 1.00 0.00 C ATOM 1746 CZ PHE A 111 0.542 11.650 1.409 1.00 0.00 C ATOM 0 H PHE A 111 2.680 14.863 4.503 1.00 0.00 H new ATOM 0 HA PHE A 111 -0.199 15.301 4.925 1.00 0.00 H new ATOM 0 HB2 PHE A 111 1.799 13.133 5.772 1.00 0.00 H new ATOM 0 HB3 PHE A 111 0.060 13.024 5.958 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -1.001 13.887 3.422 1.00 0.00 H new ATOM 0 HD2 PHE A 111 2.462 11.591 4.192 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -1.178 12.858 1.151 1.00 0.00 H new ATOM 0 HE2 PHE A 111 2.284 10.559 1.923 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.465 11.205 0.428 1.00 0.00 H new ATOM 1756 N THR A 112 -0.126 16.222 7.176 1.00 0.00 N ATOM 1757 CA THR A 112 -0.143 16.773 8.520 1.00 0.00 C ATOM 1758 C THR A 112 0.206 15.692 9.544 1.00 0.00 C ATOM 1759 O THR A 112 0.066 14.502 9.268 1.00 0.00 O ATOM 1760 CB THR A 112 -1.513 17.412 8.752 1.00 0.00 C ATOM 1761 OG1 THR A 112 -2.425 16.517 8.119 1.00 0.00 O ATOM 1762 CG2 THR A 112 -1.686 18.724 7.985 1.00 0.00 C ATOM 0 H THR A 112 -0.933 16.470 6.604 1.00 0.00 H new ATOM 0 HA THR A 112 0.616 17.546 8.640 1.00 0.00 H new ATOM 0 HB THR A 112 -1.652 17.594 9.818 1.00 0.00 H new ATOM 0 HG1 THR A 112 -3.339 16.854 8.223 1.00 0.00 H new ATOM 0 HG21 THR A 112 -2.676 19.135 8.185 1.00 0.00 H new ATOM 0 HG22 THR A 112 -0.926 19.436 8.306 1.00 0.00 H new ATOM 0 HG23 THR A 112 -1.580 18.537 6.916 1.00 0.00 H new ATOM 1770 N PRO A 113 0.665 16.157 10.737 1.00 0.00 N ATOM 1771 CA PRO A 113 1.035 15.243 11.804 1.00 0.00 C ATOM 1772 C PRO A 113 -0.207 14.651 12.474 1.00 0.00 C ATOM 1773 O PRO A 113 -0.101 13.735 13.288 1.00 0.00 O ATOM 1774 CB PRO A 113 1.884 16.071 12.755 1.00 0.00 C ATOM 1775 CG PRO A 113 1.576 17.524 12.431 1.00 0.00 C ATOM 1776 CD PRO A 113 0.844 17.560 11.100 1.00 0.00 C ATOM 0 HA PRO A 113 1.593 14.379 11.443 1.00 0.00 H new ATOM 0 HB2 PRO A 113 1.643 15.843 13.793 1.00 0.00 H new ATOM 0 HB3 PRO A 113 2.944 15.857 12.619 1.00 0.00 H new ATOM 0 HG2 PRO A 113 0.964 17.968 13.216 1.00 0.00 H new ATOM 0 HG3 PRO A 113 2.496 18.106 12.377 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -0.114 18.071 11.189 1.00 0.00 H new ATOM 0 HD3 PRO A 113 1.421 18.094 10.345 1.00 0.00 H new ATOM 1784 N LEU A 114 -1.356 15.199 12.106 1.00 0.00 N ATOM 1785 CA LEU A 114 -2.617 14.737 12.661 1.00 0.00 C ATOM 1786 C LEU A 114 -3.193 13.640 11.763 1.00 0.00 C ATOM 1787 O LEU A 114 -3.380 12.507 12.204 1.00 0.00 O ATOM 1788 CB LEU A 114 -3.569 15.914 12.882 1.00 0.00 C ATOM 1789 CG LEU A 114 -3.720 16.393 14.327 1.00 0.00 C ATOM 1790 CD1 LEU A 114 -4.180 15.252 15.237 1.00 0.00 C ATOM 1791 CD2 LEU A 114 -2.428 17.040 14.828 1.00 0.00 C ATOM 0 H LEU A 114 -1.440 15.959 11.430 1.00 0.00 H new ATOM 0 HA LEU A 114 -2.461 14.295 13.645 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -3.225 16.752 12.276 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -4.554 15.634 12.508 1.00 0.00 H new ATOM 0 HG LEU A 114 -4.495 17.159 14.354 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -4.280 15.619 16.259 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -5.143 14.876 14.891 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -3.446 14.447 15.211 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -2.563 17.372 15.858 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -1.616 16.314 14.784 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -2.183 17.897 14.200 1.00 0.00 H new ATOM 1803 N ARG A 115 -3.457 14.015 10.521 1.00 0.00 N ATOM 1804 CA ARG A 115 -4.008 13.077 9.557 1.00 0.00 C ATOM 1805 C ARG A 115 -3.159 11.806 9.509 1.00 0.00 C ATOM 1806 O ARG A 115 -3.690 10.706 9.363 1.00 0.00 O ATOM 1807 CB ARG A 115 -4.068 13.696 8.159 1.00 0.00 C ATOM 1808 CG ARG A 115 -5.332 13.255 7.418 1.00 0.00 C ATOM 1809 CD ARG A 115 -5.263 13.642 5.939 1.00 0.00 C ATOM 1810 NE ARG A 115 -5.462 15.100 5.787 1.00 0.00 N ATOM 1811 CZ ARG A 115 -6.656 15.706 5.853 1.00 0.00 C ATOM 1812 NH1 ARG A 115 -7.763 14.983 6.069 1.00 0.00 N ATOM 1813 NH2 ARG A 115 -6.742 17.035 5.704 1.00 0.00 N ATOM 0 H ARG A 115 -3.300 14.956 10.159 1.00 0.00 H new ATOM 0 HA ARG A 115 -5.021 12.830 9.876 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -4.049 14.783 8.238 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -3.187 13.402 7.589 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -5.454 12.176 7.510 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -6.207 13.715 7.878 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -4.297 13.353 5.524 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -6.026 13.102 5.378 1.00 0.00 H new ATOM 0 HE ARG A 115 -4.640 15.680 5.622 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -7.697 13.972 6.183 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -8.671 15.444 6.119 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -5.899 17.585 5.540 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -7.650 17.496 5.754 1.00 0.00 H new ATOM 1827 N LEU A 116 -1.854 11.998 9.635 1.00 0.00 N ATOM 1828 CA LEU A 116 -0.926 10.881 9.607 1.00 0.00 C ATOM 1829 C LEU A 116 -1.437 9.777 10.536 1.00 0.00 C ATOM 1830 O LEU A 116 -1.557 8.623 10.127 1.00 0.00 O ATOM 1831 CB LEU A 116 0.491 11.353 9.936 1.00 0.00 C ATOM 1832 CG LEU A 116 1.394 11.649 8.736 1.00 0.00 C ATOM 1833 CD1 LEU A 116 2.621 12.459 9.160 1.00 0.00 C ATOM 1834 CD2 LEU A 116 1.782 10.360 8.010 1.00 0.00 C ATOM 0 H LEU A 116 -1.417 12.912 9.757 1.00 0.00 H new ATOM 0 HA LEU A 116 -0.871 10.456 8.605 1.00 0.00 H new ATOM 0 HB2 LEU A 116 0.420 12.255 10.544 1.00 0.00 H new ATOM 0 HB3 LEU A 116 0.973 10.592 10.550 1.00 0.00 H new ATOM 0 HG LEU A 116 0.833 12.260 8.029 1.00 0.00 H new ATOM 0 HD11 LEU A 116 3.246 12.656 8.289 1.00 0.00 H new ATOM 0 HD12 LEU A 116 2.300 13.404 9.597 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.193 11.895 9.897 1.00 0.00 H new ATOM 0 HD21 LEU A 116 2.423 10.599 7.162 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.317 9.703 8.696 1.00 0.00 H new ATOM 0 HD23 LEU A 116 0.882 9.858 7.654 1.00 0.00 H new ATOM 1846 N ARG A 117 -1.725 10.170 11.768 1.00 0.00 N ATOM 1847 CA ARG A 117 -2.220 9.228 12.757 1.00 0.00 C ATOM 1848 C ARG A 117 -3.189 8.237 12.109 1.00 0.00 C ATOM 1849 O ARG A 117 -3.104 7.033 12.348 1.00 0.00 O ATOM 1850 CB ARG A 117 -2.933 9.954 13.900 1.00 0.00 C ATOM 1851 CG ARG A 117 -1.925 10.541 14.890 1.00 0.00 C ATOM 1852 CD ARG A 117 -2.053 12.064 14.964 1.00 0.00 C ATOM 1853 NE ARG A 117 -1.214 12.590 16.064 1.00 0.00 N ATOM 1854 CZ ARG A 117 -1.534 12.500 17.362 1.00 0.00 C ATOM 1855 NH1 ARG A 117 -2.677 11.905 17.731 1.00 0.00 N ATOM 1856 NH2 ARG A 117 -0.712 13.006 18.292 1.00 0.00 N ATOM 0 H ARG A 117 -1.625 11.128 12.104 1.00 0.00 H new ATOM 0 HA ARG A 117 -1.362 8.691 13.161 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -3.558 10.751 13.496 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -3.596 9.261 14.418 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -2.087 10.110 15.878 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -0.913 10.272 14.587 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -1.747 12.509 14.017 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -3.095 12.342 15.125 1.00 0.00 H new ATOM 0 HE ARG A 117 -0.337 13.050 15.819 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -3.303 11.521 17.024 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -2.920 11.837 18.719 1.00 0.00 H new ATOM 0 HH21 ARG A 117 0.157 13.460 18.012 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -0.956 12.937 19.280 1.00 0.00 H new ATOM 1870 N GLY A 118 -4.088 8.780 11.301 1.00 0.00 N ATOM 1871 CA GLY A 118 -5.071 7.958 10.616 1.00 0.00 C ATOM 1872 C GLY A 118 -4.404 7.058 9.575 1.00 0.00 C ATOM 1873 O GLY A 118 -4.564 5.838 9.610 1.00 0.00 O ATOM 0 H GLY A 118 -4.156 9.779 11.105 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -5.607 7.346 11.341 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -5.809 8.596 10.130 1.00 0.00 H new ATOM 1877 N LEU A 119 -3.670 7.693 8.673 1.00 0.00 N ATOM 1878 CA LEU A 119 -2.978 6.964 7.624 1.00 0.00 C ATOM 1879 C LEU A 119 -2.340 5.707 8.218 1.00 0.00 C ATOM 1880 O LEU A 119 -2.676 4.590 7.825 1.00 0.00 O ATOM 1881 CB LEU A 119 -1.984 7.877 6.903 1.00 0.00 C ATOM 1882 CG LEU A 119 -2.587 9.069 6.158 1.00 0.00 C ATOM 1883 CD1 LEU A 119 -1.492 10.013 5.656 1.00 0.00 C ATOM 1884 CD2 LEU A 119 -3.504 8.601 5.025 1.00 0.00 C ATOM 0 H LEU A 119 -3.540 8.704 8.647 1.00 0.00 H new ATOM 0 HA LEU A 119 -3.683 6.634 6.861 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -1.271 8.255 7.636 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -1.420 7.276 6.190 1.00 0.00 H new ATOM 0 HG LEU A 119 -3.203 9.633 6.858 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -1.948 10.852 5.130 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -0.916 10.386 6.503 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -0.831 9.475 4.977 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -3.920 9.468 4.512 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -2.931 8.001 4.318 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -4.315 8.001 5.438 1.00 0.00 H new ATOM 1896 N GLU A 120 -1.429 5.930 9.154 1.00 0.00 N ATOM 1897 CA GLU A 120 -0.740 4.829 9.806 1.00 0.00 C ATOM 1898 C GLU A 120 -1.742 3.753 10.229 1.00 0.00 C ATOM 1899 O GLU A 120 -1.641 2.604 9.801 1.00 0.00 O ATOM 1900 CB GLU A 120 0.072 5.324 11.004 1.00 0.00 C ATOM 1901 CG GLU A 120 1.238 6.204 10.551 1.00 0.00 C ATOM 1902 CD GLU A 120 1.827 6.984 11.728 1.00 0.00 C ATOM 1903 OE1 GLU A 120 1.070 7.793 12.308 1.00 0.00 O ATOM 1904 OE2 GLU A 120 3.020 6.755 12.021 1.00 0.00 O ATOM 0 H GLU A 120 -1.152 6.857 9.477 1.00 0.00 H new ATOM 0 HA GLU A 120 -0.043 4.388 9.094 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -0.574 5.888 11.677 1.00 0.00 H new ATOM 0 HB3 GLU A 120 0.452 4.472 11.567 1.00 0.00 H new ATOM 0 HG2 GLU A 120 2.011 5.584 10.098 1.00 0.00 H new ATOM 0 HG3 GLU A 120 0.897 6.899 9.784 1.00 0.00 H new ATOM 1911 N ALA A 121 -2.685 4.163 11.064 1.00 0.00 N ATOM 1912 CA ALA A 121 -3.704 3.248 11.550 1.00 0.00 C ATOM 1913 C ALA A 121 -4.052 2.247 10.446 1.00 0.00 C ATOM 1914 O ALA A 121 -4.114 1.043 10.692 1.00 0.00 O ATOM 1915 CB ALA A 121 -4.923 4.043 12.021 1.00 0.00 C ATOM 0 H ALA A 121 -2.765 5.117 11.417 1.00 0.00 H new ATOM 0 HA ALA A 121 -3.335 2.682 12.405 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -5.687 3.356 12.385 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -4.629 4.718 12.825 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -5.323 4.622 11.189 1.00 0.00 H new ATOM 1921 N ALA A 122 -4.271 2.782 9.254 1.00 0.00 N ATOM 1922 CA ALA A 122 -4.611 1.950 8.112 1.00 0.00 C ATOM 1923 C ALA A 122 -3.723 0.705 8.110 1.00 0.00 C ATOM 1924 O ALA A 122 -4.222 -0.418 8.070 1.00 0.00 O ATOM 1925 CB ALA A 122 -4.472 2.768 6.826 1.00 0.00 C ATOM 0 H ALA A 122 -4.220 3.781 9.054 1.00 0.00 H new ATOM 0 HA ALA A 122 -5.646 1.615 8.176 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -4.727 2.145 5.969 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -5.145 3.624 6.865 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.445 3.119 6.727 1.00 0.00 H new ATOM 1931 N LEU A 123 -2.421 0.946 8.153 1.00 0.00 N ATOM 1932 CA LEU A 123 -1.458 -0.142 8.157 1.00 0.00 C ATOM 1933 C LEU A 123 -1.688 -1.016 9.392 1.00 0.00 C ATOM 1934 O LEU A 123 -1.765 -2.239 9.285 1.00 0.00 O ATOM 1935 CB LEU A 123 -0.032 0.403 8.047 1.00 0.00 C ATOM 1936 CG LEU A 123 1.092 -0.599 8.317 1.00 0.00 C ATOM 1937 CD1 LEU A 123 1.456 -1.369 7.046 1.00 0.00 C ATOM 1938 CD2 LEU A 123 2.307 0.094 8.936 1.00 0.00 C ATOM 0 H LEU A 123 -2.010 1.879 8.185 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.599 -0.779 7.284 1.00 0.00 H new ATOM 0 HB2 LEU A 123 0.104 0.810 7.045 1.00 0.00 H new ATOM 0 HB3 LEU A 123 0.073 1.233 8.745 1.00 0.00 H new ATOM 0 HG LEU A 123 0.733 -1.328 9.043 1.00 0.00 H new ATOM 0 HD11 LEU A 123 2.257 -2.075 7.265 1.00 0.00 H new ATOM 0 HD12 LEU A 123 0.582 -1.912 6.687 1.00 0.00 H new ATOM 0 HD13 LEU A 123 1.788 -0.669 6.279 1.00 0.00 H new ATOM 0 HD21 LEU A 123 3.091 -0.641 9.118 1.00 0.00 H new ATOM 0 HD22 LEU A 123 2.677 0.858 8.253 1.00 0.00 H new ATOM 0 HD23 LEU A 123 2.019 0.559 9.879 1.00 0.00 H new ATOM 1950 N LEU A 124 -1.791 -0.355 10.535 1.00 0.00 N ATOM 1951 CA LEU A 124 -2.010 -1.057 11.788 1.00 0.00 C ATOM 1952 C LEU A 124 -3.207 -1.998 11.638 1.00 0.00 C ATOM 1953 O LEU A 124 -3.143 -3.158 12.043 1.00 0.00 O ATOM 1954 CB LEU A 124 -2.153 -0.061 12.942 1.00 0.00 C ATOM 1955 CG LEU A 124 -0.872 0.661 13.366 1.00 0.00 C ATOM 1956 CD1 LEU A 124 0.084 -0.293 14.083 1.00 0.00 C ATOM 1957 CD2 LEU A 124 -0.208 1.347 12.170 1.00 0.00 C ATOM 0 H LEU A 124 -1.727 0.659 10.620 1.00 0.00 H new ATOM 0 HA LEU A 124 -1.146 -1.675 12.034 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -2.893 0.688 12.660 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -2.551 -0.592 13.807 1.00 0.00 H new ATOM 0 HG LEU A 124 -1.140 1.442 14.077 1.00 0.00 H new ATOM 0 HD11 LEU A 124 0.986 0.246 14.373 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -0.401 -0.694 14.973 1.00 0.00 H new ATOM 0 HD13 LEU A 124 0.350 -1.112 13.415 1.00 0.00 H new ATOM 0 HD21 LEU A 124 0.700 1.853 12.499 1.00 0.00 H new ATOM 0 HD22 LEU A 124 0.045 0.601 11.417 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -0.895 2.077 11.742 1.00 0.00 H new ATOM 1969 N ARG A 125 -4.269 -1.465 11.054 1.00 0.00 N ATOM 1970 CA ARG A 125 -5.478 -2.243 10.844 1.00 0.00 C ATOM 1971 C ARG A 125 -5.200 -3.411 9.896 1.00 0.00 C ATOM 1972 O ARG A 125 -5.418 -4.568 10.250 1.00 0.00 O ATOM 1973 CB ARG A 125 -6.597 -1.377 10.262 1.00 0.00 C ATOM 1974 CG ARG A 125 -7.409 -0.710 11.375 1.00 0.00 C ATOM 1975 CD ARG A 125 -7.528 0.797 11.139 1.00 0.00 C ATOM 1976 NE ARG A 125 -8.377 1.408 12.185 1.00 0.00 N ATOM 1977 CZ ARG A 125 -7.940 1.745 13.406 1.00 0.00 C ATOM 1978 NH1 ARG A 125 -6.660 1.532 13.741 1.00 0.00 N ATOM 1979 NH2 ARG A 125 -8.782 2.294 14.292 1.00 0.00 N ATOM 0 H ARG A 125 -4.318 -0.503 10.719 1.00 0.00 H new ATOM 0 HA ARG A 125 -5.798 -2.626 11.813 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -6.170 -0.614 9.611 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -7.254 -1.991 9.646 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -8.403 -1.154 11.421 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -6.933 -0.894 12.338 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -6.539 1.254 11.149 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -7.956 0.986 10.155 1.00 0.00 H new ATOM 0 HE ARG A 125 -9.357 1.584 11.963 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -6.019 1.114 13.067 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -6.327 1.788 14.670 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -9.756 2.456 14.037 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -8.449 2.550 15.221 1.00 0.00 H new ATOM 1993 N LEU A 126 -4.724 -3.066 8.708 1.00 0.00 N ATOM 1994 CA LEU A 126 -4.414 -4.071 7.706 1.00 0.00 C ATOM 1995 C LEU A 126 -3.561 -5.172 8.340 1.00 0.00 C ATOM 1996 O LEU A 126 -3.811 -6.357 8.125 1.00 0.00 O ATOM 1997 CB LEU A 126 -3.768 -3.423 6.479 1.00 0.00 C ATOM 1998 CG LEU A 126 -4.556 -2.283 5.830 1.00 0.00 C ATOM 1999 CD1 LEU A 126 -3.613 -1.237 5.233 1.00 0.00 C ATOM 2000 CD2 LEU A 126 -5.545 -2.821 4.794 1.00 0.00 C ATOM 0 H LEU A 126 -4.546 -2.105 8.417 1.00 0.00 H new ATOM 0 HA LEU A 126 -5.328 -4.543 7.345 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -2.788 -3.043 6.767 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -3.602 -4.197 5.729 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.140 -1.786 6.605 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -4.198 -0.438 4.778 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -2.983 -0.823 6.021 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -2.985 -1.704 4.474 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -6.092 -1.991 4.348 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -5.001 -3.357 4.016 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.247 -3.499 5.279 1.00 0.00 H new ATOM 2012 N GLN A 127 -2.573 -4.741 9.110 1.00 0.00 N ATOM 2013 CA GLN A 127 -1.682 -5.676 9.777 1.00 0.00 C ATOM 2014 C GLN A 127 -2.455 -6.505 10.804 1.00 0.00 C ATOM 2015 O GLN A 127 -2.055 -7.620 11.135 1.00 0.00 O ATOM 2016 CB GLN A 127 -0.510 -4.943 10.434 1.00 0.00 C ATOM 2017 CG GLN A 127 0.469 -4.421 9.381 1.00 0.00 C ATOM 2018 CD GLN A 127 1.901 -4.412 9.921 1.00 0.00 C ATOM 2019 OE1 GLN A 127 2.141 -4.427 11.117 1.00 0.00 O ATOM 2020 NE2 GLN A 127 2.836 -4.385 8.975 1.00 0.00 N ATOM 0 H GLN A 127 -2.370 -3.757 9.287 1.00 0.00 H new ATOM 0 HA GLN A 127 -1.271 -6.353 9.028 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -0.885 -4.112 11.031 1.00 0.00 H new ATOM 0 HB3 GLN A 127 0.009 -5.617 11.116 1.00 0.00 H new ATOM 0 HG2 GLN A 127 0.417 -5.046 8.489 1.00 0.00 H new ATOM 0 HG3 GLN A 127 0.183 -3.413 9.081 1.00 0.00 H new ATOM 0 HE21 GLN A 127 2.566 -4.374 7.991 1.00 0.00 H new ATOM 0 HE22 GLN A 127 3.823 -4.376 9.233 1.00 0.00 H new ATOM 2029 N ALA A 128 -3.549 -5.928 11.280 1.00 0.00 N ATOM 2030 CA ALA A 128 -4.382 -6.600 12.263 1.00 0.00 C ATOM 2031 C ALA A 128 -5.312 -7.583 11.551 1.00 0.00 C ATOM 2032 O ALA A 128 -5.830 -8.512 12.168 1.00 0.00 O ATOM 2033 CB ALA A 128 -5.150 -5.558 13.080 1.00 0.00 C ATOM 0 H ALA A 128 -3.878 -5.003 11.003 1.00 0.00 H new ATOM 0 HA ALA A 128 -3.768 -7.172 12.959 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -5.775 -6.062 13.817 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -4.444 -4.903 13.590 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -5.779 -4.966 12.415 1.00 0.00 H new ATOM 2039 N GLN A 129 -5.496 -7.345 10.260 1.00 0.00 N ATOM 2040 CA GLN A 129 -6.355 -8.198 9.457 1.00 0.00 C ATOM 2041 C GLN A 129 -5.536 -9.317 8.809 1.00 0.00 C ATOM 2042 O GLN A 129 -6.027 -10.432 8.639 1.00 0.00 O ATOM 2043 CB GLN A 129 -7.103 -7.383 8.400 1.00 0.00 C ATOM 2044 CG GLN A 129 -8.036 -6.362 9.053 1.00 0.00 C ATOM 2045 CD GLN A 129 -9.258 -6.093 8.173 1.00 0.00 C ATOM 2046 OE1 GLN A 129 -10.006 -6.988 7.814 1.00 0.00 O ATOM 2047 NE2 GLN A 129 -9.418 -4.814 7.845 1.00 0.00 N ATOM 0 H GLN A 129 -5.065 -6.574 9.751 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.099 -8.652 10.112 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.387 -6.869 7.759 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.680 -8.052 7.761 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -8.359 -6.730 10.027 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -7.497 -5.431 9.227 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -8.755 -4.115 8.179 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -10.204 -4.532 7.259 1.00 0.00 H new ATOM 2056 N VAL A 130 -4.302 -8.980 8.465 1.00 0.00 N ATOM 2057 CA VAL A 130 -3.411 -9.942 7.839 1.00 0.00 C ATOM 2058 C VAL A 130 -3.210 -11.131 8.780 1.00 0.00 C ATOM 2059 O VAL A 130 -3.443 -12.276 8.397 1.00 0.00 O ATOM 2060 CB VAL A 130 -2.097 -9.261 7.448 1.00 0.00 C ATOM 2061 CG1 VAL A 130 -1.077 -10.285 6.948 1.00 0.00 C ATOM 2062 CG2 VAL A 130 -2.336 -8.169 6.403 1.00 0.00 C ATOM 0 H VAL A 130 -3.898 -8.054 8.608 1.00 0.00 H new ATOM 0 HA VAL A 130 -3.850 -10.326 6.918 1.00 0.00 H new ATOM 0 HB VAL A 130 -1.686 -8.787 8.340 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -0.153 -9.775 6.677 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -0.874 -11.010 7.736 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -1.477 -10.800 6.075 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -1.387 -7.701 6.142 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -2.780 -8.610 5.511 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -3.012 -7.417 6.811 1.00 0.00 H new ATOM 2072 N ARG A 131 -2.779 -10.818 9.994 1.00 0.00 N ATOM 2073 CA ARG A 131 -2.544 -11.847 10.993 1.00 0.00 C ATOM 2074 C ARG A 131 -3.688 -12.863 10.987 1.00 0.00 C ATOM 2075 O ARG A 131 -3.489 -14.030 11.323 1.00 0.00 O ATOM 2076 CB ARG A 131 -2.418 -11.239 12.391 1.00 0.00 C ATOM 2077 CG ARG A 131 -0.974 -10.827 12.681 1.00 0.00 C ATOM 2078 CD ARG A 131 -0.910 -9.832 13.842 1.00 0.00 C ATOM 2079 NE ARG A 131 0.130 -10.248 14.809 1.00 0.00 N ATOM 2080 CZ ARG A 131 0.702 -9.425 15.698 1.00 0.00 C ATOM 2081 NH1 ARG A 131 0.338 -8.137 15.749 1.00 0.00 N ATOM 2082 NH2 ARG A 131 1.638 -9.891 16.537 1.00 0.00 N ATOM 0 H ARG A 131 -2.587 -9.867 10.308 1.00 0.00 H new ATOM 0 HA ARG A 131 -1.608 -12.346 10.741 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -3.071 -10.371 12.474 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -2.751 -11.961 13.137 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -0.381 -11.710 12.921 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -0.534 -10.380 11.790 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -0.689 -8.834 13.464 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -1.879 -9.777 14.339 1.00 0.00 H new ATOM 0 HE ARG A 131 0.430 -11.223 14.798 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -0.375 -7.783 15.111 1.00 0.00 H new ATOM 0 HH12 ARG A 131 0.773 -7.510 16.426 1.00 0.00 H new ATOM 0 HH21 ARG A 131 1.915 -10.872 16.498 1.00 0.00 H new ATOM 0 HH22 ARG A 131 2.074 -9.265 17.214 1.00 0.00 H new ATOM 2096 N LYS A 132 -4.862 -12.383 10.603 1.00 0.00 N ATOM 2097 CA LYS A 132 -6.038 -13.235 10.549 1.00 0.00 C ATOM 2098 C LYS A 132 -5.894 -14.223 9.391 1.00 0.00 C ATOM 2099 O LYS A 132 -6.229 -15.399 9.528 1.00 0.00 O ATOM 2100 CB LYS A 132 -7.310 -12.388 10.481 1.00 0.00 C ATOM 2101 CG LYS A 132 -7.217 -11.182 11.418 1.00 0.00 C ATOM 2102 CD LYS A 132 -6.754 -11.606 12.813 1.00 0.00 C ATOM 2103 CE LYS A 132 -7.783 -12.523 13.477 1.00 0.00 C ATOM 2104 NZ LYS A 132 -7.461 -12.712 14.909 1.00 0.00 N ATOM 0 H LYS A 132 -5.024 -11.415 10.326 1.00 0.00 H new ATOM 0 HA LYS A 132 -6.124 -13.824 11.462 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -7.470 -12.047 9.458 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -8.172 -12.998 10.752 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -6.521 -10.450 11.007 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -8.189 -10.694 11.486 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -5.796 -12.121 12.741 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -6.596 -10.723 13.432 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -8.780 -12.094 13.376 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -7.799 -13.488 12.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -8.169 -13.337 15.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -6.518 -13.142 14.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -7.469 -11.791 15.391 1.00 0.00 H new ATOM 2118 N ALA A 133 -5.395 -13.710 8.275 1.00 0.00 N ATOM 2119 CA ALA A 133 -5.203 -14.533 7.094 1.00 0.00 C ATOM 2120 C ALA A 133 -4.275 -15.700 7.436 1.00 0.00 C ATOM 2121 O ALA A 133 -4.547 -16.843 7.070 1.00 0.00 O ATOM 2122 CB ALA A 133 -4.659 -13.671 5.953 1.00 0.00 C ATOM 0 H ALA A 133 -5.118 -12.735 8.165 1.00 0.00 H new ATOM 0 HA ALA A 133 -6.152 -14.953 6.761 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -4.515 -14.289 5.067 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -5.368 -12.875 5.729 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -3.705 -13.234 6.250 1.00 0.00 H new ATOM 2128 N LEU A 134 -3.197 -15.373 8.133 1.00 0.00 N ATOM 2129 CA LEU A 134 -2.226 -16.379 8.528 1.00 0.00 C ATOM 2130 C LEU A 134 -2.960 -17.578 9.133 1.00 0.00 C ATOM 2131 O LEU A 134 -2.582 -18.725 8.897 1.00 0.00 O ATOM 2132 CB LEU A 134 -1.171 -15.772 9.455 1.00 0.00 C ATOM 2133 CG LEU A 134 -0.156 -14.837 8.794 1.00 0.00 C ATOM 2134 CD1 LEU A 134 -0.852 -13.627 8.167 1.00 0.00 C ATOM 2135 CD2 LEU A 134 0.933 -14.422 9.785 1.00 0.00 C ATOM 0 H LEU A 134 -2.974 -14.424 8.435 1.00 0.00 H new ATOM 0 HA LEU A 134 -1.679 -16.744 7.658 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -1.683 -15.221 10.244 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -0.627 -16.585 9.936 1.00 0.00 H new ATOM 0 HG LEU A 134 0.334 -15.381 7.986 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -0.108 -12.979 7.704 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -1.559 -13.966 7.410 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -1.385 -13.073 8.940 1.00 0.00 H new ATOM 0 HD21 LEU A 134 1.641 -13.758 9.290 1.00 0.00 H new ATOM 0 HD22 LEU A 134 0.478 -13.903 10.629 1.00 0.00 H new ATOM 0 HD23 LEU A 134 1.456 -15.309 10.143 1.00 0.00 H new ATOM 2147 N THR A 135 -3.994 -17.272 9.902 1.00 0.00 N ATOM 2148 CA THR A 135 -4.783 -18.310 10.543 1.00 0.00 C ATOM 2149 C THR A 135 -6.221 -18.286 10.020 1.00 0.00 C ATOM 2150 O THR A 135 -7.146 -18.699 10.717 1.00 0.00 O ATOM 2151 CB THR A 135 -4.684 -18.112 12.057 1.00 0.00 C ATOM 2152 OG1 THR A 135 -5.257 -19.299 12.600 1.00 0.00 O ATOM 2153 CG2 THR A 135 -5.597 -16.993 12.562 1.00 0.00 C ATOM 0 H THR A 135 -4.304 -16.320 10.096 1.00 0.00 H new ATOM 0 HA THR A 135 -4.400 -19.302 10.305 1.00 0.00 H new ATOM 0 HB THR A 135 -3.652 -17.888 12.327 1.00 0.00 H new ATOM 0 HG1 THR A 135 -6.137 -19.452 12.196 1.00 0.00 H new ATOM 0 HG21 THR A 135 -5.488 -16.894 13.642 1.00 0.00 H new ATOM 0 HG22 THR A 135 -5.321 -16.054 12.082 1.00 0.00 H new ATOM 0 HG23 THR A 135 -6.633 -17.232 12.322 1.00 0.00 H new ATOM 2161 N SER A 136 -6.363 -17.799 8.796 1.00 0.00 N ATOM 2162 CA SER A 136 -7.673 -17.716 8.171 1.00 0.00 C ATOM 2163 C SER A 136 -7.527 -17.319 6.701 1.00 0.00 C ATOM 2164 O SER A 136 -6.953 -18.064 5.907 1.00 0.00 O ATOM 2165 CB SER A 136 -8.570 -16.717 8.904 1.00 0.00 C ATOM 2166 OG SER A 136 -9.949 -16.917 8.602 1.00 0.00 O ATOM 0 H SER A 136 -5.593 -17.458 8.220 1.00 0.00 H new ATOM 0 HA SER A 136 -8.143 -18.697 8.231 1.00 0.00 H new ATOM 0 HB2 SER A 136 -8.417 -16.813 9.979 1.00 0.00 H new ATOM 0 HB3 SER A 136 -8.282 -15.702 8.630 1.00 0.00 H new ATOM 0 HG SER A 136 -10.489 -16.261 9.090 1.00 0.00 H new TER 2172 SER A 136