USER MOD reduce.3.24.130724 H: found=0, std=0, add=676, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 674 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 124 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 128 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Set 2.1: A 41 MET CE :methyl -136:sc= -0.136 (180deg=-0.898) USER MOD Set 2.2: A 116 CYS SG : rot 76:sc= 0.913 USER MOD Set 3.1: A 79 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 83 ASN :FLIP amide:sc=-0.00907 F(o=-0.59,f=-0.0091) USER MOD Single : A 33 SER OG : rot 100:sc= -0.359! USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 HIS : no HE2:sc= -1.86 K(o=-1.9,f=-11!) USER MOD Single : A 48 LYS NZ :NH3+ -165:sc= 0.502! (180deg=-0.916!) USER MOD Single : A 49 HIS :FLIP no HD1:sc= -0.395 F(o=-1.2,f=-0.4) USER MOD Single : A 57 SER OG : rot 32:sc= 0.00265 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ -160:sc= -0.0115 (180deg=-0.254) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 CYS SG : rot -49:sc= -6.17! USER MOD Single : A 84 GLN : amide:sc= -5.97! C(o=-6!,f=-7.9!) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl -154:sc= -0.145 (180deg=-1.04) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= -0.727 K(o=-0.73,f=-2.9!) USER MOD Single : A 98 HIS : no HD1:sc= -0.091 X(o=-0.091,f=-0.0023) USER MOD Single : A 105 THR OG1 : rot -32:sc= 0.0511 USER MOD Single : A 106 THR OG1 : rot 180:sc= -0.698 USER MOD Single : A 114 GLN : amide:sc= -0.244 X(o=-0.24,f=-0.33) USER MOD Single : A 120 LYS NZ :NH3+ -169:sc= 0.869 (180deg=0.364) USER MOD Single : A 127 GLN : amide:sc= -0.583 K(o=-0.58,f=-4.6!) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 133 N SER A 33 -0.068 -12.697 8.738 1.00 0.00 N ATOM 134 CA SER A 33 -0.605 -12.281 10.032 1.00 0.00 C ATOM 135 C SER A 33 -1.889 -13.047 10.348 1.00 0.00 C ATOM 136 O SER A 33 -1.952 -13.791 11.327 1.00 0.00 O ATOM 137 CB SER A 33 -0.889 -10.783 10.018 1.00 0.00 C ATOM 138 OG SER A 33 -2.061 -10.539 9.253 1.00 0.00 O ATOM 0 HA SER A 33 0.134 -12.501 10.803 1.00 0.00 H new ATOM 0 HB2 SER A 33 -1.021 -10.416 11.036 1.00 0.00 H new ATOM 0 HB3 SER A 33 -0.043 -10.244 9.592 1.00 0.00 H new ATOM 0 HG SER A 33 -2.825 -10.416 9.855 1.00 0.00 H new ATOM 144 N LEU A 34 -2.907 -12.863 9.510 1.00 0.00 N ATOM 145 CA LEU A 34 -4.184 -13.545 9.709 1.00 0.00 C ATOM 146 C LEU A 34 -3.973 -14.962 10.187 1.00 0.00 C ATOM 147 O LEU A 34 -4.670 -15.427 11.088 1.00 0.00 O ATOM 148 CB LEU A 34 -4.988 -13.537 8.417 1.00 0.00 C ATOM 149 CG LEU A 34 -6.355 -14.184 8.672 1.00 0.00 C ATOM 150 CD1 LEU A 34 -7.138 -13.373 9.718 1.00 0.00 C ATOM 151 CD2 LEU A 34 -7.140 -14.224 7.365 1.00 0.00 C ATOM 0 H LEU A 34 -2.874 -12.253 8.693 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.742 -13.009 10.477 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.116 -12.515 8.060 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.454 -14.081 7.638 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.210 -15.197 9.048 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -8.107 -13.842 9.891 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -6.576 -13.345 10.652 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -7.287 -12.357 9.354 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -8.113 -14.683 7.539 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.279 -13.209 6.993 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -6.590 -14.809 6.628 1.00 0.00 H new ATOM 163 N GLU A 35 -3.001 -15.633 9.607 1.00 0.00 N ATOM 164 CA GLU A 35 -2.697 -16.997 10.003 1.00 0.00 C ATOM 165 C GLU A 35 -2.177 -17.055 11.436 1.00 0.00 C ATOM 166 O GLU A 35 -2.585 -17.914 12.219 1.00 0.00 O ATOM 167 CB GLU A 35 -1.661 -17.585 9.046 1.00 0.00 C ATOM 168 CG GLU A 35 -1.139 -18.905 9.606 1.00 0.00 C ATOM 169 CD GLU A 35 -0.304 -19.628 8.557 1.00 0.00 C ATOM 170 OE1 GLU A 35 -0.015 -20.796 8.761 1.00 0.00 O ATOM 171 OE2 GLU A 35 0.032 -19.008 7.561 1.00 0.00 O ATOM 0 H GLU A 35 -2.409 -15.262 8.864 1.00 0.00 H new ATOM 0 HA GLU A 35 -3.615 -17.583 9.957 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -2.107 -17.746 8.065 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -0.837 -16.884 8.911 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -0.537 -18.718 10.495 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -1.975 -19.534 9.913 1.00 0.00 H new ATOM 178 N GLU A 36 -1.276 -16.144 11.771 1.00 0.00 N ATOM 179 CA GLU A 36 -0.706 -16.108 13.109 1.00 0.00 C ATOM 180 C GLU A 36 -1.773 -15.773 14.142 1.00 0.00 C ATOM 181 O GLU A 36 -1.810 -16.361 15.222 1.00 0.00 O ATOM 182 CB GLU A 36 0.404 -15.066 13.170 1.00 0.00 C ATOM 183 CG GLU A 36 1.588 -15.523 12.309 1.00 0.00 C ATOM 184 CD GLU A 36 2.632 -14.414 12.222 1.00 0.00 C ATOM 185 OE1 GLU A 36 2.237 -13.272 12.055 1.00 0.00 O ATOM 186 OE2 GLU A 36 3.809 -14.720 12.323 1.00 0.00 O ATOM 0 H GLU A 36 -0.926 -15.424 11.139 1.00 0.00 H new ATOM 0 HA GLU A 36 -0.298 -17.093 13.334 1.00 0.00 H new ATOM 0 HB2 GLU A 36 0.033 -14.104 12.815 1.00 0.00 H new ATOM 0 HB3 GLU A 36 0.726 -14.923 14.202 1.00 0.00 H new ATOM 0 HG2 GLU A 36 2.034 -16.420 12.738 1.00 0.00 H new ATOM 0 HG3 GLU A 36 1.241 -15.786 11.310 1.00 0.00 H new ATOM 193 N LYS A 37 -2.643 -14.828 13.805 1.00 0.00 N ATOM 194 CA LYS A 37 -3.704 -14.433 14.723 1.00 0.00 C ATOM 195 C LYS A 37 -4.564 -15.629 15.102 1.00 0.00 C ATOM 196 O LYS A 37 -4.862 -15.839 16.277 1.00 0.00 O ATOM 197 CB LYS A 37 -4.586 -13.379 14.062 1.00 0.00 C ATOM 198 CG LYS A 37 -3.909 -12.013 14.132 1.00 0.00 C ATOM 199 CD LYS A 37 -4.858 -10.953 13.575 1.00 0.00 C ATOM 200 CE LYS A 37 -5.132 -11.239 12.103 1.00 0.00 C ATOM 201 NZ LYS A 37 -5.654 -10.038 11.388 1.00 0.00 N ATOM 0 H LYS A 37 -2.636 -14.327 12.916 1.00 0.00 H new ATOM 0 HA LYS A 37 -3.244 -14.028 15.624 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -4.772 -13.649 13.022 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.555 -13.340 14.560 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -3.646 -11.777 15.163 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -2.981 -12.024 13.560 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -5.792 -10.955 14.137 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -4.420 -9.961 13.688 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -4.214 -11.576 11.622 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -5.853 -12.052 12.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -5.827 -10.276 10.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -6.544 -9.730 11.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -4.956 -9.269 11.445 1.00 0.00 H new ATOM 215 N ILE A 38 -4.957 -16.414 14.106 1.00 0.00 N ATOM 216 CA ILE A 38 -5.780 -17.590 14.361 1.00 0.00 C ATOM 217 C ILE A 38 -5.011 -18.604 15.206 1.00 0.00 C ATOM 218 O ILE A 38 -5.553 -19.179 16.149 1.00 0.00 O ATOM 219 CB ILE A 38 -6.190 -18.232 13.035 1.00 0.00 C ATOM 220 CG1 ILE A 38 -7.122 -17.284 12.280 1.00 0.00 C ATOM 221 CG2 ILE A 38 -6.929 -19.544 13.310 1.00 0.00 C ATOM 222 CD1 ILE A 38 -7.323 -17.796 10.852 1.00 0.00 C ATOM 0 H ILE A 38 -4.723 -16.261 13.125 1.00 0.00 H new ATOM 0 HA ILE A 38 -6.672 -17.281 14.906 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.300 -18.429 12.438 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -8.082 -17.216 12.792 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.699 -16.280 12.261 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -7.221 -20.002 12.365 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -6.274 -20.223 13.855 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -7.819 -19.342 13.906 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -7.987 -17.120 10.313 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -6.360 -17.841 10.343 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -7.765 -18.792 10.881 1.00 0.00 H new ATOM 234 N LYS A 39 -3.745 -18.815 14.862 1.00 0.00 N ATOM 235 CA LYS A 39 -2.913 -19.762 15.594 1.00 0.00 C ATOM 236 C LYS A 39 -2.782 -19.335 17.049 1.00 0.00 C ATOM 237 O LYS A 39 -2.814 -20.169 17.954 1.00 0.00 O ATOM 238 CB LYS A 39 -1.527 -19.831 14.952 1.00 0.00 C ATOM 239 CG LYS A 39 -1.616 -20.609 13.632 1.00 0.00 C ATOM 240 CD LYS A 39 -0.381 -20.339 12.760 1.00 0.00 C ATOM 241 CE LYS A 39 0.773 -21.244 13.176 1.00 0.00 C ATOM 242 NZ LYS A 39 1.864 -21.148 12.172 1.00 0.00 N ATOM 0 H LYS A 39 -3.276 -18.347 14.087 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.382 -20.745 15.556 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -1.148 -18.825 14.770 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -0.825 -20.319 15.628 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -1.696 -21.676 13.838 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -2.518 -20.320 13.093 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -0.625 -20.509 11.711 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -0.084 -19.294 12.853 1.00 0.00 H new ATOM 0 HE2 LYS A 39 1.142 -20.952 14.159 1.00 0.00 H new ATOM 0 HE3 LYS A 39 0.429 -22.275 13.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 2.652 -21.765 12.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 1.507 -21.447 11.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 2.198 -20.165 12.115 1.00 0.00 H new ATOM 256 N LEU A 40 -2.629 -18.034 17.269 1.00 0.00 N ATOM 257 CA LEU A 40 -2.494 -17.517 18.625 1.00 0.00 C ATOM 258 C LEU A 40 -3.789 -17.705 19.412 1.00 0.00 C ATOM 259 O LEU A 40 -3.778 -18.184 20.546 1.00 0.00 O ATOM 260 CB LEU A 40 -2.137 -16.030 18.580 1.00 0.00 C ATOM 261 CG LEU A 40 -2.025 -15.482 20.006 1.00 0.00 C ATOM 262 CD1 LEU A 40 -0.977 -16.284 20.782 1.00 0.00 C ATOM 263 CD2 LEU A 40 -1.606 -14.011 19.954 1.00 0.00 C ATOM 0 H LEU A 40 -2.596 -17.326 16.536 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.700 -18.072 19.124 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.195 -15.888 18.051 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -2.899 -15.480 18.028 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.990 -15.569 20.505 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.898 -15.893 21.797 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.275 -17.332 20.819 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.011 -16.198 20.284 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.526 -13.619 20.968 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.641 -13.925 19.454 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -2.352 -13.439 19.402 1.00 0.00 H new ATOM 275 N MET A 41 -4.904 -17.319 18.801 1.00 0.00 N ATOM 276 CA MET A 41 -6.205 -17.440 19.446 1.00 0.00 C ATOM 277 C MET A 41 -6.571 -18.906 19.622 1.00 0.00 C ATOM 278 O MET A 41 -7.269 -19.275 20.566 1.00 0.00 O ATOM 279 CB MET A 41 -7.274 -16.728 18.613 1.00 0.00 C ATOM 280 CG MET A 41 -6.994 -15.222 18.592 1.00 0.00 C ATOM 281 SD MET A 41 -7.112 -14.555 20.271 1.00 0.00 S ATOM 282 CE MET A 41 -8.909 -14.688 20.447 1.00 0.00 C ATOM 0 H MET A 41 -4.932 -16.921 17.862 1.00 0.00 H new ATOM 0 HA MET A 41 -6.153 -16.971 20.429 1.00 0.00 H new ATOM 0 HB2 MET A 41 -7.278 -17.121 17.596 1.00 0.00 H new ATOM 0 HB3 MET A 41 -8.262 -16.918 19.032 1.00 0.00 H new ATOM 0 HG2 MET A 41 -6.001 -15.033 18.184 1.00 0.00 H new ATOM 0 HG3 MET A 41 -7.708 -14.719 17.940 1.00 0.00 H new ATOM 0 HE1 MET A 41 -9.299 -13.775 20.898 1.00 0.00 H new ATOM 0 HE2 MET A 41 -9.361 -14.830 19.465 1.00 0.00 H new ATOM 0 HE3 MET A 41 -9.150 -15.539 21.084 1.00 0.00 H new ATOM 292 N ARG A 42 -6.101 -19.737 18.703 1.00 0.00 N ATOM 293 CA ARG A 42 -6.393 -21.161 18.764 1.00 0.00 C ATOM 294 C ARG A 42 -5.765 -21.782 20.005 1.00 0.00 C ATOM 295 O ARG A 42 -6.155 -22.868 20.428 1.00 0.00 O ATOM 296 CB ARG A 42 -5.870 -21.873 17.504 1.00 0.00 C ATOM 297 CG ARG A 42 -6.951 -21.910 16.418 1.00 0.00 C ATOM 298 CD ARG A 42 -6.637 -23.034 15.440 1.00 0.00 C ATOM 299 NE ARG A 42 -5.330 -22.831 14.811 1.00 0.00 N ATOM 300 CZ ARG A 42 -5.207 -22.513 13.527 1.00 0.00 C ATOM 301 NH1 ARG A 42 -4.022 -22.344 13.007 1.00 0.00 N ATOM 302 NH2 ARG A 42 -6.271 -22.370 12.786 1.00 0.00 N ATOM 0 H ARG A 42 -5.521 -19.453 17.913 1.00 0.00 H new ATOM 0 HA ARG A 42 -7.475 -21.284 18.816 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -4.987 -21.357 17.128 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -5.563 -22.889 17.754 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -7.931 -22.066 16.868 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -6.990 -20.955 15.894 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -6.648 -23.990 15.963 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -7.410 -23.081 14.673 1.00 0.00 H new ATOM 0 HE ARG A 42 -4.488 -22.937 15.377 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -3.190 -22.456 13.586 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -3.928 -22.100 12.021 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.197 -22.502 13.192 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -6.177 -22.126 11.800 1.00 0.00 H new ATOM 316 N LEU A 43 -4.799 -21.085 20.581 1.00 0.00 N ATOM 317 CA LEU A 43 -4.131 -21.578 21.779 1.00 0.00 C ATOM 318 C LEU A 43 -4.780 -21.009 23.032 1.00 0.00 C ATOM 319 O LEU A 43 -4.898 -21.695 24.047 1.00 0.00 O ATOM 320 CB LEU A 43 -2.650 -21.202 21.744 1.00 0.00 C ATOM 321 CG LEU A 43 -1.874 -22.232 20.917 1.00 0.00 C ATOM 322 CD1 LEU A 43 -0.423 -21.773 20.775 1.00 0.00 C ATOM 323 CD2 LEU A 43 -1.914 -23.608 21.613 1.00 0.00 C ATOM 0 H LEU A 43 -4.461 -20.184 20.244 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.226 -22.664 21.803 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.527 -20.208 21.313 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -2.251 -21.161 22.758 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.331 -22.320 19.932 1.00 0.00 H new ATOM 0 HD11 LEU A 43 0.134 -22.503 20.187 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -0.395 -20.806 20.274 1.00 0.00 H new ATOM 0 HD13 LEU A 43 0.028 -21.683 21.763 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -1.360 -24.333 21.017 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -1.462 -23.529 22.602 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.949 -23.935 21.713 1.00 0.00 H new ATOM 335 N VAL A 44 -5.191 -19.751 22.959 1.00 0.00 N ATOM 336 CA VAL A 44 -5.817 -19.101 24.103 1.00 0.00 C ATOM 337 C VAL A 44 -7.122 -19.804 24.464 1.00 0.00 C ATOM 338 O VAL A 44 -7.387 -20.082 25.633 1.00 0.00 O ATOM 339 CB VAL A 44 -6.092 -17.629 23.776 1.00 0.00 C ATOM 340 CG1 VAL A 44 -6.706 -16.915 24.994 1.00 0.00 C ATOM 341 CG2 VAL A 44 -4.781 -16.939 23.386 1.00 0.00 C ATOM 0 H VAL A 44 -5.104 -19.165 22.129 1.00 0.00 H new ATOM 0 HA VAL A 44 -5.140 -19.161 24.955 1.00 0.00 H new ATOM 0 HB VAL A 44 -6.796 -17.578 22.946 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -6.896 -15.871 24.746 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -7.644 -17.400 25.265 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -6.014 -16.969 25.834 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -4.976 -15.892 23.153 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -4.076 -17.001 24.215 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.357 -17.432 22.511 1.00 0.00 H new ATOM 351 N VAL A 45 -7.933 -20.085 23.452 1.00 0.00 N ATOM 352 CA VAL A 45 -9.209 -20.753 23.671 1.00 0.00 C ATOM 353 C VAL A 45 -8.990 -22.158 24.215 1.00 0.00 C ATOM 354 O VAL A 45 -9.697 -22.606 25.114 1.00 0.00 O ATOM 355 CB VAL A 45 -10.003 -20.817 22.368 1.00 0.00 C ATOM 356 CG1 VAL A 45 -11.222 -21.720 22.555 1.00 0.00 C ATOM 357 CG2 VAL A 45 -10.472 -19.408 21.991 1.00 0.00 C ATOM 0 H VAL A 45 -7.732 -19.862 22.477 1.00 0.00 H new ATOM 0 HA VAL A 45 -9.776 -20.179 24.404 1.00 0.00 H new ATOM 0 HB VAL A 45 -9.370 -21.219 21.577 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -11.788 -21.765 21.624 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -10.894 -22.723 22.829 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -11.855 -21.317 23.346 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -11.039 -19.450 21.061 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -11.105 -19.011 22.785 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.606 -18.759 21.859 1.00 0.00 H new ATOM 367 N ARG A 46 -8.007 -22.850 23.655 1.00 0.00 N ATOM 368 CA ARG A 46 -7.703 -24.208 24.084 1.00 0.00 C ATOM 369 C ARG A 46 -7.191 -24.216 25.522 1.00 0.00 C ATOM 370 O ARG A 46 -7.126 -25.266 26.160 1.00 0.00 O ATOM 371 CB ARG A 46 -6.648 -24.824 23.161 1.00 0.00 C ATOM 372 CG ARG A 46 -6.672 -26.351 23.299 1.00 0.00 C ATOM 373 CD ARG A 46 -7.704 -26.938 22.334 1.00 0.00 C ATOM 374 NE ARG A 46 -7.745 -28.389 22.460 1.00 0.00 N ATOM 375 CZ ARG A 46 -8.529 -28.979 23.356 1.00 0.00 C ATOM 376 NH1 ARG A 46 -8.548 -30.281 23.449 1.00 0.00 N ATOM 377 NH2 ARG A 46 -9.278 -28.257 24.143 1.00 0.00 N ATOM 0 H ARG A 46 -7.410 -22.496 22.907 1.00 0.00 H new ATOM 0 HA ARG A 46 -8.619 -24.797 24.034 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -6.844 -24.539 22.127 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -5.660 -24.441 23.415 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -5.685 -26.761 23.085 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -6.918 -26.630 24.324 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -8.688 -26.520 22.545 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -7.453 -26.662 21.310 1.00 0.00 H new ATOM 0 HE ARG A 46 -7.162 -28.962 21.850 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -7.961 -30.845 22.834 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -9.150 -30.734 24.137 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -9.262 -27.240 24.070 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -9.880 -28.710 24.831 1.00 0.00 H new ATOM 391 N HIS A 47 -6.826 -23.039 26.024 1.00 0.00 N ATOM 392 CA HIS A 47 -6.317 -22.921 27.390 1.00 0.00 C ATOM 393 C HIS A 47 -7.070 -21.834 28.152 1.00 0.00 C ATOM 394 O HIS A 47 -6.523 -21.205 29.055 1.00 0.00 O ATOM 395 CB HIS A 47 -4.825 -22.590 27.357 1.00 0.00 C ATOM 396 CG HIS A 47 -4.096 -23.647 26.572 1.00 0.00 C ATOM 397 ND1 HIS A 47 -4.194 -23.742 25.193 1.00 0.00 N ATOM 398 CD2 HIS A 47 -3.252 -24.660 26.958 1.00 0.00 C ATOM 399 CE1 HIS A 47 -3.429 -24.777 24.801 1.00 0.00 C ATOM 400 NE2 HIS A 47 -2.832 -25.372 25.837 1.00 0.00 N ATOM 0 H HIS A 47 -6.872 -22.159 25.511 1.00 0.00 H new ATOM 0 HA HIS A 47 -6.468 -23.872 27.901 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -4.668 -21.611 26.903 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -4.430 -22.538 28.372 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -4.746 -23.137 24.585 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -2.959 -24.872 27.976 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -3.312 -25.089 23.774 1.00 0.00 H new ATOM 407 N LYS A 48 -8.325 -21.619 27.779 1.00 0.00 N ATOM 408 CA LYS A 48 -9.153 -20.609 28.425 1.00 0.00 C ATOM 409 C LYS A 48 -9.505 -21.035 29.850 1.00 0.00 C ATOM 410 O LYS A 48 -9.682 -20.197 30.737 1.00 0.00 O ATOM 411 CB LYS A 48 -10.428 -20.408 27.590 1.00 0.00 C ATOM 412 CG LYS A 48 -11.242 -21.678 27.566 1.00 0.00 C ATOM 413 CD LYS A 48 -12.480 -21.446 26.698 1.00 0.00 C ATOM 414 CE LYS A 48 -13.309 -22.724 26.660 1.00 0.00 C ATOM 415 NZ LYS A 48 -14.511 -22.514 25.807 1.00 0.00 N ATOM 0 H LYS A 48 -8.792 -22.132 27.031 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.604 -19.669 28.486 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -11.021 -19.595 28.009 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -10.163 -20.118 26.573 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -10.649 -22.501 27.167 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -11.536 -21.958 28.577 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.073 -20.625 27.101 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.183 -21.160 25.689 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -12.711 -23.546 26.267 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -13.611 -23.004 27.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -15.196 -23.277 25.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.946 -21.599 26.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -14.231 -22.520 24.805 1.00 0.00 H new ATOM 429 N HIS A 49 -9.600 -22.342 30.058 1.00 0.00 N ATOM 430 CA HIS A 49 -9.928 -22.877 31.375 1.00 0.00 C ATOM 431 C HIS A 49 -8.760 -22.701 32.339 1.00 0.00 C ATOM 432 O HIS A 49 -8.955 -22.408 33.519 1.00 0.00 O ATOM 433 CB HIS A 49 -10.281 -24.360 31.267 1.00 0.00 C ATOM 434 CG HIS A 49 -11.658 -24.506 30.678 1.00 0.00 C ATOM 435 ND1 HIS A 49 -12.906 -24.259 31.194 1.00 0.00 N flip ATOM 436 CD2 HIS A 49 -11.867 -24.964 29.387 1.00 0.00 C flip ATOM 437 CE1 HIS A 49 -13.875 -24.556 30.240 1.00 0.00 C flip ATOM 438 NE2 HIS A 49 -13.194 -24.977 29.171 1.00 0.00 N flip ATOM 0 H HIS A 49 -9.456 -23.049 29.337 1.00 0.00 H new ATOM 0 HA HIS A 49 -10.786 -22.326 31.760 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -9.550 -24.874 30.643 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -10.244 -24.826 32.251 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -11.103 -25.257 28.682 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -14.946 -24.466 30.342 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -13.628 -25.273 28.297 1.00 0.00 H new ATOM 445 N GLU A 50 -7.545 -22.891 31.832 1.00 0.00 N ATOM 446 CA GLU A 50 -6.354 -22.758 32.662 1.00 0.00 C ATOM 447 C GLU A 50 -6.306 -21.386 33.323 1.00 0.00 C ATOM 448 O GLU A 50 -6.154 -20.364 32.653 1.00 0.00 O ATOM 449 CB GLU A 50 -5.100 -22.957 31.808 1.00 0.00 C ATOM 450 CG GLU A 50 -5.018 -24.414 31.350 1.00 0.00 C ATOM 451 CD GLU A 50 -3.815 -24.606 30.432 1.00 0.00 C ATOM 452 OE1 GLU A 50 -3.131 -23.629 30.175 1.00 0.00 O ATOM 453 OE2 GLU A 50 -3.596 -25.725 30.002 1.00 0.00 O ATOM 0 H GLU A 50 -7.361 -23.135 30.859 1.00 0.00 H new ATOM 0 HA GLU A 50 -6.392 -23.520 33.440 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -5.128 -22.294 30.943 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -4.211 -22.695 32.382 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -4.934 -25.072 32.215 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -5.933 -24.691 30.827 1.00 0.00 H new ATOM 567 N SER A 57 -0.567 -13.079 35.180 1.00 0.00 N ATOM 568 CA SER A 57 0.391 -13.206 34.086 1.00 0.00 C ATOM 569 C SER A 57 0.687 -14.674 33.801 1.00 0.00 C ATOM 570 O SER A 57 0.947 -15.054 32.659 1.00 0.00 O ATOM 571 CB SER A 57 1.689 -12.479 34.435 1.00 0.00 C ATOM 572 OG SER A 57 1.470 -11.075 34.376 1.00 0.00 O ATOM 0 HA SER A 57 -0.045 -12.755 33.195 1.00 0.00 H new ATOM 0 HB2 SER A 57 2.023 -12.765 35.432 1.00 0.00 H new ATOM 0 HB3 SER A 57 2.478 -12.765 33.740 1.00 0.00 H new ATOM 0 HG SER A 57 0.547 -10.877 34.639 1.00 0.00 H new ATOM 578 N GLU A 58 0.660 -15.493 34.848 1.00 0.00 N ATOM 579 CA GLU A 58 0.939 -16.917 34.699 1.00 0.00 C ATOM 580 C GLU A 58 0.229 -17.481 33.475 1.00 0.00 C ATOM 581 O GLU A 58 0.673 -18.467 32.888 1.00 0.00 O ATOM 582 CB GLU A 58 0.492 -17.674 35.952 1.00 0.00 C ATOM 583 CG GLU A 58 0.840 -19.156 35.802 1.00 0.00 C ATOM 584 CD GLU A 58 0.593 -19.885 37.118 1.00 0.00 C ATOM 585 OE1 GLU A 58 0.030 -19.277 38.013 1.00 0.00 O ATOM 586 OE2 GLU A 58 0.972 -21.040 37.212 1.00 0.00 O ATOM 0 H GLU A 58 0.450 -15.198 35.802 1.00 0.00 H new ATOM 0 HA GLU A 58 2.014 -17.043 34.566 1.00 0.00 H new ATOM 0 HB2 GLU A 58 0.982 -17.261 36.834 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -0.581 -17.554 36.099 1.00 0.00 H new ATOM 0 HG2 GLU A 58 0.237 -19.602 35.011 1.00 0.00 H new ATOM 0 HG3 GLU A 58 1.884 -19.265 35.507 1.00 0.00 H new ATOM 593 N PHE A 59 -0.875 -16.849 33.091 1.00 0.00 N ATOM 594 CA PHE A 59 -1.634 -17.300 31.931 1.00 0.00 C ATOM 595 C PHE A 59 -0.973 -16.836 30.637 1.00 0.00 C ATOM 596 O PHE A 59 -0.478 -17.647 29.852 1.00 0.00 O ATOM 597 CB PHE A 59 -3.060 -16.754 32.000 1.00 0.00 C ATOM 598 CG PHE A 59 -3.771 -17.043 30.701 1.00 0.00 C ATOM 599 CD1 PHE A 59 -4.017 -18.366 30.319 1.00 0.00 C ATOM 600 CD2 PHE A 59 -4.186 -15.988 29.880 1.00 0.00 C ATOM 601 CE1 PHE A 59 -4.680 -18.635 29.115 1.00 0.00 C ATOM 602 CE2 PHE A 59 -4.848 -16.257 28.676 1.00 0.00 C ATOM 603 CZ PHE A 59 -5.095 -17.581 28.293 1.00 0.00 C ATOM 0 H PHE A 59 -1.261 -16.030 33.561 1.00 0.00 H new ATOM 0 HA PHE A 59 -1.658 -18.390 31.939 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -3.597 -17.212 32.831 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -3.041 -15.680 32.186 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -3.696 -19.180 30.952 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -3.996 -14.967 30.175 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -4.871 -19.656 28.821 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -5.168 -15.443 28.042 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.605 -17.789 27.364 1.00 0.00 H new ATOM 613 N TYR A 60 -0.973 -15.527 30.419 1.00 0.00 N ATOM 614 CA TYR A 60 -0.380 -14.964 29.219 1.00 0.00 C ATOM 615 C TYR A 60 1.087 -15.376 29.104 1.00 0.00 C ATOM 616 O TYR A 60 1.624 -15.507 28.003 1.00 0.00 O ATOM 617 CB TYR A 60 -0.483 -13.442 29.259 1.00 0.00 C ATOM 618 CG TYR A 60 -1.910 -13.028 29.494 1.00 0.00 C ATOM 619 CD1 TYR A 60 -2.347 -12.741 30.793 1.00 0.00 C ATOM 620 CD2 TYR A 60 -2.803 -12.936 28.419 1.00 0.00 C ATOM 621 CE1 TYR A 60 -3.676 -12.360 31.017 1.00 0.00 C ATOM 622 CE2 TYR A 60 -4.131 -12.556 28.642 1.00 0.00 C ATOM 623 CZ TYR A 60 -4.567 -12.267 29.941 1.00 0.00 C ATOM 624 OH TYR A 60 -5.875 -11.888 30.159 1.00 0.00 O ATOM 0 H TYR A 60 -1.376 -14.840 31.056 1.00 0.00 H new ATOM 0 HA TYR A 60 -0.920 -15.343 28.352 1.00 0.00 H new ATOM 0 HB2 TYR A 60 0.154 -13.047 30.051 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -0.123 -13.020 28.320 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -1.659 -12.813 31.622 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -2.466 -13.159 27.417 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -4.013 -12.138 32.019 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -4.819 -12.486 27.813 1.00 0.00 H new ATOM 0 HH TYR A 60 -6.358 -11.873 29.306 1.00 0.00 H new ATOM 634 N ALA A 61 1.728 -15.585 30.250 1.00 0.00 N ATOM 635 CA ALA A 61 3.130 -15.991 30.272 1.00 0.00 C ATOM 636 C ALA A 61 3.288 -17.403 29.717 1.00 0.00 C ATOM 637 O ALA A 61 4.374 -17.795 29.291 1.00 0.00 O ATOM 638 CB ALA A 61 3.670 -15.935 31.702 1.00 0.00 C ATOM 0 H ALA A 61 1.302 -15.481 31.171 1.00 0.00 H new ATOM 0 HA ALA A 61 3.698 -15.303 29.646 1.00 0.00 H new ATOM 0 HB1 ALA A 61 4.717 -16.240 31.708 1.00 0.00 H new ATOM 0 HB2 ALA A 61 3.586 -14.917 32.083 1.00 0.00 H new ATOM 0 HB3 ALA A 61 3.093 -16.608 32.336 1.00 0.00 H new ATOM 644 N LYS A 62 2.200 -18.164 29.728 1.00 0.00 N ATOM 645 CA LYS A 62 2.235 -19.531 29.223 1.00 0.00 C ATOM 646 C LYS A 62 1.864 -19.564 27.745 1.00 0.00 C ATOM 647 O LYS A 62 2.392 -20.373 26.982 1.00 0.00 O ATOM 648 CB LYS A 62 1.260 -20.414 30.029 1.00 0.00 C ATOM 649 CG LYS A 62 2.044 -21.348 30.957 1.00 0.00 C ATOM 650 CD LYS A 62 1.077 -22.131 31.848 1.00 0.00 C ATOM 651 CE LYS A 62 0.532 -21.225 32.954 1.00 0.00 C ATOM 652 NZ LYS A 62 -0.090 -22.061 34.014 1.00 0.00 N ATOM 0 H LYS A 62 1.291 -17.862 30.078 1.00 0.00 H new ATOM 0 HA LYS A 62 3.248 -19.918 29.336 1.00 0.00 H new ATOM 0 HB2 LYS A 62 0.587 -19.787 30.614 1.00 0.00 H new ATOM 0 HB3 LYS A 62 0.640 -20.999 29.350 1.00 0.00 H new ATOM 0 HG2 LYS A 62 2.648 -22.038 30.367 1.00 0.00 H new ATOM 0 HG3 LYS A 62 2.732 -20.769 31.573 1.00 0.00 H new ATOM 0 HD2 LYS A 62 0.255 -22.523 31.249 1.00 0.00 H new ATOM 0 HD3 LYS A 62 1.588 -22.988 32.287 1.00 0.00 H new ATOM 0 HE2 LYS A 62 1.337 -20.623 33.376 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -0.203 -20.533 32.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -0.742 -21.479 34.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -0.616 -22.844 33.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 0.652 -22.446 34.632 1.00 0.00 H new ATOM 666 N ILE A 63 0.941 -18.697 27.351 1.00 0.00 N ATOM 667 CA ILE A 63 0.498 -18.661 25.964 1.00 0.00 C ATOM 668 C ILE A 63 1.653 -18.287 25.045 1.00 0.00 C ATOM 669 O ILE A 63 1.867 -18.924 24.016 1.00 0.00 O ATOM 670 CB ILE A 63 -0.626 -17.634 25.812 1.00 0.00 C ATOM 671 CG1 ILE A 63 -1.846 -18.078 26.631 1.00 0.00 C ATOM 672 CG2 ILE A 63 -1.020 -17.515 24.338 1.00 0.00 C ATOM 673 CD1 ILE A 63 -2.325 -19.464 26.179 1.00 0.00 C ATOM 0 H ILE A 63 0.489 -18.017 27.963 1.00 0.00 H new ATOM 0 HA ILE A 63 0.134 -19.651 25.687 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.278 -16.667 26.174 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.590 -18.103 27.690 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -2.652 -17.353 26.515 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -1.821 -16.783 24.233 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.156 -17.194 23.755 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.364 -18.483 23.974 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.190 -19.761 26.771 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -2.602 -19.428 25.125 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -1.523 -20.189 26.319 1.00 0.00 H new ATOM 685 N ALA A 64 2.395 -17.258 25.425 1.00 0.00 N ATOM 686 CA ALA A 64 3.530 -16.817 24.622 1.00 0.00 C ATOM 687 C ALA A 64 4.631 -17.868 24.636 1.00 0.00 C ATOM 688 O ALA A 64 5.535 -17.844 23.802 1.00 0.00 O ATOM 689 CB ALA A 64 4.064 -15.491 25.169 1.00 0.00 C ATOM 0 H ALA A 64 2.236 -16.716 26.275 1.00 0.00 H new ATOM 0 HA ALA A 64 3.200 -16.675 23.593 1.00 0.00 H new ATOM 0 HB1 ALA A 64 4.912 -15.164 24.567 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.278 -14.737 25.128 1.00 0.00 H new ATOM 0 HB3 ALA A 64 4.383 -15.626 26.202 1.00 0.00 H new ATOM 695 N ARG A 65 4.552 -18.782 25.593 1.00 0.00 N ATOM 696 CA ARG A 65 5.551 -19.834 25.708 1.00 0.00 C ATOM 697 C ARG A 65 5.250 -20.969 24.736 1.00 0.00 C ATOM 698 O ARG A 65 6.138 -21.455 24.036 1.00 0.00 O ATOM 699 CB ARG A 65 5.583 -20.369 27.139 1.00 0.00 C ATOM 700 CG ARG A 65 6.696 -21.409 27.268 1.00 0.00 C ATOM 701 CD ARG A 65 6.714 -21.963 28.693 1.00 0.00 C ATOM 702 NE ARG A 65 7.126 -20.926 29.633 1.00 0.00 N ATOM 703 CZ ARG A 65 7.194 -21.168 30.938 1.00 0.00 C ATOM 704 NH1 ARG A 65 7.565 -20.225 31.759 1.00 0.00 N ATOM 705 NH2 ARG A 65 6.889 -22.351 31.398 1.00 0.00 N ATOM 0 H ARG A 65 3.813 -18.817 26.295 1.00 0.00 H new ATOM 0 HA ARG A 65 6.526 -19.414 25.460 1.00 0.00 H new ATOM 0 HB2 ARG A 65 5.751 -19.552 27.841 1.00 0.00 H new ATOM 0 HB3 ARG A 65 4.622 -20.816 27.394 1.00 0.00 H new ATOM 0 HG2 ARG A 65 6.537 -22.217 26.554 1.00 0.00 H new ATOM 0 HG3 ARG A 65 7.659 -20.958 27.030 1.00 0.00 H new ATOM 0 HD2 ARG A 65 5.724 -22.333 28.959 1.00 0.00 H new ATOM 0 HD3 ARG A 65 7.397 -22.810 28.753 1.00 0.00 H new ATOM 0 HE ARG A 65 7.366 -19.999 29.282 1.00 0.00 H new ATOM 0 HH11 ARG A 65 7.803 -19.301 31.400 1.00 0.00 H new ATOM 0 HH12 ARG A 65 7.617 -20.412 32.760 1.00 0.00 H new ATOM 0 HH21 ARG A 65 6.599 -23.089 30.756 1.00 0.00 H new ATOM 0 HH22 ARG A 65 6.941 -22.538 32.399 1.00 0.00 H new ATOM 719 N ILE A 66 3.989 -21.387 24.702 1.00 0.00 N ATOM 720 CA ILE A 66 3.573 -22.464 23.814 1.00 0.00 C ATOM 721 C ILE A 66 3.315 -21.932 22.410 1.00 0.00 C ATOM 722 O ILE A 66 3.308 -22.687 21.443 1.00 0.00 O ATOM 723 CB ILE A 66 2.308 -23.134 24.355 1.00 0.00 C ATOM 724 CG1 ILE A 66 2.630 -23.824 25.683 1.00 0.00 C ATOM 725 CG2 ILE A 66 1.809 -24.172 23.348 1.00 0.00 C ATOM 726 CD1 ILE A 66 1.329 -24.263 26.358 1.00 0.00 C ATOM 0 H ILE A 66 3.241 -20.998 25.276 1.00 0.00 H new ATOM 0 HA ILE A 66 4.376 -23.200 23.767 1.00 0.00 H new ATOM 0 HB ILE A 66 1.535 -22.382 24.512 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.272 -24.688 25.510 1.00 0.00 H new ATOM 0 HG13 ILE A 66 3.179 -23.144 26.335 1.00 0.00 H new ATOM 0 HG21 ILE A 66 0.908 -24.649 23.734 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.583 -23.681 22.401 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.580 -24.926 23.191 1.00 0.00 H new ATOM 0 HD11 ILE A 66 1.558 -24.754 27.304 1.00 0.00 H new ATOM 0 HD12 ILE A 66 0.703 -23.390 26.545 1.00 0.00 H new ATOM 0 HD13 ILE A 66 0.798 -24.958 25.707 1.00 0.00 H new ATOM 738 N GLY A 67 3.102 -20.626 22.304 1.00 0.00 N ATOM 739 CA GLY A 67 2.843 -20.007 21.008 1.00 0.00 C ATOM 740 C GLY A 67 4.137 -19.841 20.216 1.00 0.00 C ATOM 741 O GLY A 67 4.120 -19.607 19.013 1.00 0.00 O ATOM 0 H GLY A 67 3.103 -19.979 23.092 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.141 -20.619 20.442 1.00 0.00 H new ATOM 0 HA3 GLY A 67 2.373 -19.034 21.152 1.00 0.00 H new ATOM 745 N TYR A 68 5.265 -19.959 20.899 1.00 0.00 N ATOM 746 CA TYR A 68 6.562 -19.821 20.238 1.00 0.00 C ATOM 747 C TYR A 68 7.316 -21.146 20.264 1.00 0.00 C ATOM 748 O TYR A 68 8.372 -21.279 19.648 1.00 0.00 O ATOM 749 CB TYR A 68 7.388 -18.741 20.933 1.00 0.00 C ATOM 750 CG TYR A 68 8.809 -18.797 20.428 1.00 0.00 C ATOM 751 CD1 TYR A 68 9.091 -18.490 19.092 1.00 0.00 C ATOM 752 CD2 TYR A 68 9.847 -19.152 21.298 1.00 0.00 C ATOM 753 CE1 TYR A 68 10.410 -18.539 18.625 1.00 0.00 C ATOM 754 CE2 TYR A 68 11.166 -19.202 20.831 1.00 0.00 C ATOM 755 CZ TYR A 68 11.447 -18.895 19.495 1.00 0.00 C ATOM 756 OH TYR A 68 12.747 -18.943 19.035 1.00 0.00 O ATOM 0 H TYR A 68 5.314 -20.148 21.900 1.00 0.00 H new ATOM 0 HA TYR A 68 6.395 -19.533 19.200 1.00 0.00 H new ATOM 0 HB2 TYR A 68 6.959 -17.758 20.739 1.00 0.00 H new ATOM 0 HB3 TYR A 68 7.368 -18.890 22.013 1.00 0.00 H new ATOM 0 HD1 TYR A 68 8.291 -18.215 18.421 1.00 0.00 H new ATOM 0 HD2 TYR A 68 9.630 -19.387 22.330 1.00 0.00 H new ATOM 0 HE1 TYR A 68 10.627 -18.302 17.594 1.00 0.00 H new ATOM 0 HE2 TYR A 68 11.966 -19.477 21.502 1.00 0.00 H new ATOM 0 HH TYR A 68 13.343 -19.206 19.767 1.00 0.00 H new ATOM 766 N GLU A 69 6.767 -22.122 20.979 1.00 0.00 N ATOM 767 CA GLU A 69 7.398 -23.435 21.081 1.00 0.00 C ATOM 768 C GLU A 69 6.597 -24.479 20.312 1.00 0.00 C ATOM 769 O GLU A 69 6.930 -25.664 20.328 1.00 0.00 O ATOM 770 CB GLU A 69 7.504 -23.848 22.549 1.00 0.00 C ATOM 771 CG GLU A 69 8.506 -22.937 23.263 1.00 0.00 C ATOM 772 CD GLU A 69 8.557 -23.281 24.747 1.00 0.00 C ATOM 773 OE1 GLU A 69 7.853 -24.192 25.148 1.00 0.00 O ATOM 774 OE2 GLU A 69 9.301 -22.629 25.461 1.00 0.00 O ATOM 0 H GLU A 69 5.891 -22.031 21.494 1.00 0.00 H new ATOM 0 HA GLU A 69 8.396 -23.372 20.647 1.00 0.00 H new ATOM 0 HB2 GLU A 69 6.528 -23.780 23.029 1.00 0.00 H new ATOM 0 HB3 GLU A 69 7.824 -24.887 22.624 1.00 0.00 H new ATOM 0 HG2 GLU A 69 9.495 -23.053 22.820 1.00 0.00 H new ATOM 0 HG3 GLU A 69 8.219 -21.894 23.133 1.00 0.00 H new ATOM 781 N ASP A 70 5.541 -24.031 19.638 1.00 0.00 N ATOM 782 CA ASP A 70 4.699 -24.938 18.862 1.00 0.00 C ATOM 783 C ASP A 70 4.221 -24.261 17.581 1.00 0.00 C ATOM 784 O ASP A 70 4.270 -24.850 16.502 1.00 0.00 O ATOM 785 CB ASP A 70 3.489 -25.374 19.693 1.00 0.00 C ATOM 786 CG ASP A 70 3.925 -26.359 20.772 1.00 0.00 C ATOM 787 OD1 ASP A 70 5.011 -26.899 20.649 1.00 0.00 O ATOM 788 OD2 ASP A 70 3.165 -26.560 21.706 1.00 0.00 O ATOM 0 H ASP A 70 5.249 -23.054 19.613 1.00 0.00 H new ATOM 0 HA ASP A 70 5.291 -25.814 18.599 1.00 0.00 H new ATOM 0 HB2 ASP A 70 3.020 -24.504 20.152 1.00 0.00 H new ATOM 0 HB3 ASP A 70 2.742 -25.836 19.048 1.00 0.00 H new ATOM 793 N GLU A 71 3.755 -23.023 17.709 1.00 0.00 N ATOM 794 CA GLU A 71 3.267 -22.282 16.554 1.00 0.00 C ATOM 795 C GLU A 71 4.420 -21.584 15.841 1.00 0.00 C ATOM 796 O GLU A 71 4.319 -21.247 14.661 1.00 0.00 O ATOM 797 CB GLU A 71 2.233 -21.252 17.003 1.00 0.00 C ATOM 798 CG GLU A 71 1.044 -21.947 17.660 1.00 0.00 C ATOM 799 CD GLU A 71 0.295 -22.801 16.642 1.00 0.00 C ATOM 800 OE1 GLU A 71 0.605 -22.690 15.468 1.00 0.00 O ATOM 801 OE2 GLU A 71 -0.581 -23.547 17.049 1.00 0.00 O ATOM 0 H GLU A 71 3.705 -22.516 18.593 1.00 0.00 H new ATOM 0 HA GLU A 71 2.802 -22.982 15.859 1.00 0.00 H new ATOM 0 HB2 GLU A 71 2.687 -20.553 17.705 1.00 0.00 H new ATOM 0 HB3 GLU A 71 1.894 -20.669 16.146 1.00 0.00 H new ATOM 0 HG2 GLU A 71 1.390 -22.572 18.483 1.00 0.00 H new ATOM 0 HG3 GLU A 71 0.370 -21.203 18.086 1.00 0.00 H new ATOM 808 N GLY A 72 5.517 -21.379 16.561 1.00 0.00 N ATOM 809 CA GLY A 72 6.686 -20.729 15.983 1.00 0.00 C ATOM 810 C GLY A 72 6.333 -19.361 15.418 1.00 0.00 C ATOM 811 O GLY A 72 6.693 -19.033 14.288 1.00 0.00 O ATOM 0 H GLY A 72 5.621 -21.651 17.538 1.00 0.00 H new ATOM 0 HA2 GLY A 72 7.459 -20.622 16.744 1.00 0.00 H new ATOM 0 HA3 GLY A 72 7.100 -21.356 15.193 1.00 0.00 H new ATOM 893 N GLU A 78 5.566 -11.403 28.040 1.00 0.00 N ATOM 894 CA GLU A 78 4.391 -11.328 28.906 1.00 0.00 C ATOM 895 C GLU A 78 3.536 -10.121 28.543 1.00 0.00 C ATOM 896 O GLU A 78 2.371 -10.264 28.174 1.00 0.00 O ATOM 897 CB GLU A 78 4.828 -11.225 30.369 1.00 0.00 C ATOM 898 CG GLU A 78 5.478 -12.540 30.805 1.00 0.00 C ATOM 899 CD GLU A 78 6.002 -12.417 32.232 1.00 0.00 C ATOM 900 OE1 GLU A 78 6.584 -13.374 32.713 1.00 0.00 O ATOM 901 OE2 GLU A 78 5.812 -11.365 32.822 1.00 0.00 O ATOM 0 HA GLU A 78 3.800 -12.233 28.766 1.00 0.00 H new ATOM 0 HB2 GLU A 78 5.532 -10.402 30.492 1.00 0.00 H new ATOM 0 HB3 GLU A 78 3.968 -11.006 31.001 1.00 0.00 H new ATOM 0 HG2 GLU A 78 4.752 -13.351 30.744 1.00 0.00 H new ATOM 0 HG3 GLU A 78 6.295 -12.792 30.130 1.00 0.00 H new ATOM 908 N SER A 79 4.119 -8.932 28.643 1.00 0.00 N ATOM 909 CA SER A 79 3.392 -7.713 28.318 1.00 0.00 C ATOM 910 C SER A 79 2.817 -7.791 26.907 1.00 0.00 C ATOM 911 O SER A 79 1.629 -7.551 26.699 1.00 0.00 O ATOM 912 CB SER A 79 4.339 -6.518 28.406 1.00 0.00 C ATOM 913 OG SER A 79 3.627 -5.326 28.102 1.00 0.00 O ATOM 0 H SER A 79 5.083 -8.787 28.943 1.00 0.00 H new ATOM 0 HA SER A 79 2.573 -7.596 29.028 1.00 0.00 H new ATOM 0 HB2 SER A 79 4.768 -6.453 29.406 1.00 0.00 H new ATOM 0 HB3 SER A 79 5.169 -6.646 27.711 1.00 0.00 H new ATOM 0 HG SER A 79 4.234 -4.559 28.160 1.00 0.00 H new ATOM 919 N ALA A 80 3.663 -8.139 25.944 1.00 0.00 N ATOM 920 CA ALA A 80 3.219 -8.251 24.558 1.00 0.00 C ATOM 921 C ALA A 80 2.081 -9.261 24.442 1.00 0.00 C ATOM 922 O ALA A 80 1.241 -9.168 23.550 1.00 0.00 O ATOM 923 CB ALA A 80 4.394 -8.685 23.672 1.00 0.00 C ATOM 0 H ALA A 80 4.650 -8.347 26.094 1.00 0.00 H new ATOM 0 HA ALA A 80 2.856 -7.278 24.226 1.00 0.00 H new ATOM 0 HB1 ALA A 80 4.059 -8.768 22.638 1.00 0.00 H new ATOM 0 HB2 ALA A 80 5.191 -7.945 23.737 1.00 0.00 H new ATOM 0 HB3 ALA A 80 4.768 -9.651 24.011 1.00 0.00 H new ATOM 929 N CYS A 81 2.062 -10.226 25.348 1.00 0.00 N ATOM 930 CA CYS A 81 1.029 -11.248 25.335 1.00 0.00 C ATOM 931 C CYS A 81 -0.304 -10.668 25.790 1.00 0.00 C ATOM 932 O CYS A 81 -1.347 -11.312 25.673 1.00 0.00 O ATOM 933 CB CYS A 81 1.437 -12.375 26.270 1.00 0.00 C ATOM 934 SG CYS A 81 3.173 -12.767 26.011 1.00 0.00 S ATOM 0 H CYS A 81 2.747 -10.322 26.098 1.00 0.00 H new ATOM 0 HA CYS A 81 0.914 -11.625 24.319 1.00 0.00 H new ATOM 0 HB2 CYS A 81 1.270 -12.081 27.306 1.00 0.00 H new ATOM 0 HB3 CYS A 81 0.822 -13.256 26.085 1.00 0.00 H new ATOM 0 HG CYS A 81 3.400 -12.914 24.739 1.00 0.00 H new ATOM 940 N ARG A 82 -0.258 -9.447 26.315 1.00 0.00 N ATOM 941 CA ARG A 82 -1.465 -8.783 26.786 1.00 0.00 C ATOM 942 C ARG A 82 -1.895 -7.707 25.812 1.00 0.00 C ATOM 943 O ARG A 82 -3.060 -7.345 25.784 1.00 0.00 O ATOM 944 CB ARG A 82 -1.234 -8.156 28.157 1.00 0.00 C ATOM 945 CG ARG A 82 -1.089 -9.263 29.199 1.00 0.00 C ATOM 946 CD ARG A 82 -1.052 -8.645 30.597 1.00 0.00 C ATOM 947 NE ARG A 82 0.156 -7.849 30.773 1.00 0.00 N ATOM 948 CZ ARG A 82 1.288 -8.403 31.194 1.00 0.00 C ATOM 949 NH1 ARG A 82 2.358 -7.671 31.342 1.00 0.00 N ATOM 950 NH2 ARG A 82 1.329 -9.679 31.461 1.00 0.00 N ATOM 0 H ARG A 82 0.597 -8.902 26.424 1.00 0.00 H new ATOM 0 HA ARG A 82 -2.251 -9.534 26.863 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -0.337 -7.537 28.140 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -2.067 -7.503 28.416 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -1.922 -9.962 29.121 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -0.177 -9.832 29.017 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -1.932 -8.019 30.747 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -1.088 -9.432 31.350 1.00 0.00 H new ATOM 0 HE ARG A 82 0.132 -6.850 30.570 1.00 0.00 H new ATOM 0 HH11 ARG A 82 2.326 -6.673 31.134 1.00 0.00 H new ATOM 0 HH12 ARG A 82 3.227 -8.097 31.665 1.00 0.00 H new ATOM 0 HH21 ARG A 82 0.492 -10.251 31.347 1.00 0.00 H new ATOM 0 HH22 ARG A 82 2.198 -10.105 31.784 1.00 0.00 H new ATOM 964 N ASN A 83 -0.949 -7.203 25.022 1.00 0.00 N ATOM 965 CA ASN A 83 -1.247 -6.164 24.040 1.00 0.00 C ATOM 966 C ASN A 83 -1.743 -6.776 22.731 1.00 0.00 C ATOM 967 O ASN A 83 -2.729 -6.319 22.153 1.00 0.00 O ATOM 968 CB ASN A 83 0.006 -5.337 23.770 1.00 0.00 C ATOM 969 CG ASN A 83 0.526 -4.746 25.080 1.00 0.00 C ATOM 970 OD1 ASN A 83 1.759 -4.976 25.439 1.00 0.00 O flip ATOM 971 ND2 ASN A 83 -0.208 -4.064 25.795 1.00 0.00 N flip ATOM 0 H ASN A 83 0.028 -7.497 25.043 1.00 0.00 H new ATOM 0 HA ASN A 83 -2.032 -5.526 24.445 1.00 0.00 H new ATOM 0 HB2 ASN A 83 0.773 -5.961 23.312 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -0.219 -4.538 23.064 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -1.172 -3.885 25.513 1.00 0.00 H new ATOM 0 HD22 ASN A 83 0.148 -3.678 26.670 1.00 0.00 H new ATOM 978 N GLN A 84 -1.041 -7.806 22.266 1.00 0.00 N ATOM 979 CA GLN A 84 -1.408 -8.469 21.017 1.00 0.00 C ATOM 980 C GLN A 84 -2.832 -9.006 21.089 1.00 0.00 C ATOM 981 O GLN A 84 -3.694 -8.612 20.302 1.00 0.00 O ATOM 982 CB GLN A 84 -0.440 -9.629 20.747 1.00 0.00 C ATOM 983 CG GLN A 84 0.754 -9.124 19.943 1.00 0.00 C ATOM 984 CD GLN A 84 1.513 -8.069 20.742 1.00 0.00 C ATOM 985 OE1 GLN A 84 1.007 -6.967 20.956 1.00 0.00 O ATOM 986 NE2 GLN A 84 2.705 -8.342 21.195 1.00 0.00 N ATOM 0 H GLN A 84 -0.221 -8.197 22.730 1.00 0.00 H new ATOM 0 HA GLN A 84 -1.349 -7.740 20.208 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -0.101 -10.059 21.689 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -0.950 -10.422 20.200 1.00 0.00 H new ATOM 0 HG2 GLN A 84 1.417 -9.955 19.700 1.00 0.00 H new ATOM 0 HG3 GLN A 84 0.414 -8.701 18.998 1.00 0.00 H new ATOM 0 HE21 GLN A 84 3.122 -9.256 21.016 1.00 0.00 H new ATOM 0 HE22 GLN A 84 3.221 -7.642 21.728 1.00 0.00 H new ATOM 995 N ILE A 85 -3.072 -9.898 22.040 1.00 0.00 N ATOM 996 CA ILE A 85 -4.394 -10.483 22.206 1.00 0.00 C ATOM 997 C ILE A 85 -5.426 -9.386 22.399 1.00 0.00 C ATOM 998 O ILE A 85 -6.530 -9.466 21.866 1.00 0.00 O ATOM 999 CB ILE A 85 -4.407 -11.425 23.411 1.00 0.00 C ATOM 1000 CG1 ILE A 85 -3.550 -12.656 23.105 1.00 0.00 C ATOM 1001 CG2 ILE A 85 -5.843 -11.864 23.703 1.00 0.00 C ATOM 1002 CD1 ILE A 85 -3.337 -13.461 24.388 1.00 0.00 C ATOM 0 H ILE A 85 -2.373 -10.230 22.704 1.00 0.00 H new ATOM 0 HA ILE A 85 -4.641 -11.052 21.310 1.00 0.00 H new ATOM 0 HB ILE A 85 -4.003 -10.906 24.280 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -4.039 -13.274 22.352 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -2.589 -12.350 22.691 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -5.851 -12.535 24.562 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -6.454 -10.988 23.921 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -6.249 -12.382 22.834 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -2.727 -14.338 24.170 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -2.830 -12.840 25.127 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -4.302 -13.779 24.782 1.00 0.00 H new ATOM 1014 N ILE A 86 -5.068 -8.360 23.158 1.00 0.00 N ATOM 1015 CA ILE A 86 -5.993 -7.255 23.398 1.00 0.00 C ATOM 1016 C ILE A 86 -6.327 -6.550 22.087 1.00 0.00 C ATOM 1017 O ILE A 86 -7.474 -6.210 21.828 1.00 0.00 O ATOM 1018 CB ILE A 86 -5.361 -6.233 24.381 1.00 0.00 C ATOM 1019 CG1 ILE A 86 -5.879 -6.478 25.813 1.00 0.00 C ATOM 1020 CG2 ILE A 86 -5.678 -4.780 23.962 1.00 0.00 C ATOM 1021 CD1 ILE A 86 -5.449 -5.323 26.745 1.00 0.00 C ATOM 0 H ILE A 86 -4.160 -8.267 23.613 1.00 0.00 H new ATOM 0 HA ILE A 86 -6.907 -7.660 23.832 1.00 0.00 H new ATOM 0 HB ILE A 86 -4.280 -6.373 24.354 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -6.966 -6.562 25.804 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -5.490 -7.423 26.191 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -5.221 -4.089 24.671 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -5.279 -4.594 22.965 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -6.758 -4.631 23.954 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -5.822 -5.510 27.752 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -4.361 -5.259 26.767 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -5.860 -4.384 26.374 1.00 0.00 H new ATOM 1033 N SER A 87 -5.316 -6.300 21.280 1.00 0.00 N ATOM 1034 CA SER A 87 -5.535 -5.601 20.029 1.00 0.00 C ATOM 1035 C SER A 87 -6.525 -6.355 19.162 1.00 0.00 C ATOM 1036 O SER A 87 -7.429 -5.760 18.569 1.00 0.00 O ATOM 1037 CB SER A 87 -4.223 -5.459 19.291 1.00 0.00 C ATOM 1038 OG SER A 87 -4.493 -5.108 17.940 1.00 0.00 O ATOM 0 H SER A 87 -4.348 -6.565 21.463 1.00 0.00 H new ATOM 0 HA SER A 87 -5.943 -4.614 20.248 1.00 0.00 H new ATOM 0 HB2 SER A 87 -3.605 -4.695 19.763 1.00 0.00 H new ATOM 0 HB3 SER A 87 -3.663 -6.393 19.334 1.00 0.00 H new ATOM 0 HG SER A 87 -3.649 -5.012 17.452 1.00 0.00 H new ATOM 1044 N ILE A 88 -6.350 -7.668 19.098 1.00 0.00 N ATOM 1045 CA ILE A 88 -7.237 -8.500 18.308 1.00 0.00 C ATOM 1046 C ILE A 88 -8.679 -8.309 18.765 1.00 0.00 C ATOM 1047 O ILE A 88 -9.605 -8.479 17.995 1.00 0.00 O ATOM 1048 CB ILE A 88 -6.857 -9.971 18.453 1.00 0.00 C ATOM 1049 CG1 ILE A 88 -5.479 -10.202 17.834 1.00 0.00 C ATOM 1050 CG2 ILE A 88 -7.892 -10.842 17.733 1.00 0.00 C ATOM 1051 CD1 ILE A 88 -4.986 -11.603 18.199 1.00 0.00 C ATOM 0 H ILE A 88 -5.607 -8.174 19.581 1.00 0.00 H new ATOM 0 HA ILE A 88 -7.142 -8.205 17.263 1.00 0.00 H new ATOM 0 HB ILE A 88 -6.832 -10.237 19.510 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -5.532 -10.094 16.751 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -4.776 -9.452 18.195 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -7.619 -11.892 17.837 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -8.876 -10.677 18.173 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -7.918 -10.577 16.676 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -4.003 -11.769 17.758 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -4.917 -11.694 19.283 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -5.686 -12.346 17.816 1.00 0.00 H new ATOM 1063 N MET A 89 -8.873 -7.971 20.029 1.00 0.00 N ATOM 1064 CA MET A 89 -10.228 -7.771 20.542 1.00 0.00 C ATOM 1065 C MET A 89 -10.853 -6.502 19.959 1.00 0.00 C ATOM 1066 O MET A 89 -11.976 -6.526 19.449 1.00 0.00 O ATOM 1067 CB MET A 89 -10.187 -7.650 22.064 1.00 0.00 C ATOM 1068 CG MET A 89 -9.725 -8.973 22.668 1.00 0.00 C ATOM 1069 SD MET A 89 -10.947 -10.257 22.312 1.00 0.00 S ATOM 1070 CE MET A 89 -12.236 -9.656 23.429 1.00 0.00 C ATOM 0 H MET A 89 -8.128 -7.830 20.712 1.00 0.00 H new ATOM 0 HA MET A 89 -10.833 -8.629 20.248 1.00 0.00 H new ATOM 0 HB2 MET A 89 -9.510 -6.848 22.357 1.00 0.00 H new ATOM 0 HB3 MET A 89 -11.174 -7.389 22.445 1.00 0.00 H new ATOM 0 HG2 MET A 89 -8.756 -9.254 22.256 1.00 0.00 H new ATOM 0 HG3 MET A 89 -9.595 -8.868 23.745 1.00 0.00 H new ATOM 0 HE1 MET A 89 -12.873 -10.488 23.731 1.00 0.00 H new ATOM 0 HE2 MET A 89 -11.775 -9.213 24.312 1.00 0.00 H new ATOM 0 HE3 MET A 89 -12.839 -8.905 22.919 1.00 0.00 H new ATOM 1080 N ARG A 90 -10.120 -5.397 20.038 1.00 0.00 N ATOM 1081 CA ARG A 90 -10.614 -4.126 19.525 1.00 0.00 C ATOM 1082 C ARG A 90 -11.128 -4.298 18.104 1.00 0.00 C ATOM 1083 O ARG A 90 -12.171 -3.762 17.740 1.00 0.00 O ATOM 1084 CB ARG A 90 -9.492 -3.083 19.548 1.00 0.00 C ATOM 1085 CG ARG A 90 -10.044 -1.725 19.113 1.00 0.00 C ATOM 1086 CD ARG A 90 -8.927 -0.678 19.149 1.00 0.00 C ATOM 1087 NE ARG A 90 -7.911 -0.990 18.152 1.00 0.00 N ATOM 1088 CZ ARG A 90 -6.938 -0.130 17.872 1.00 0.00 C ATOM 1089 NH1 ARG A 90 -6.039 -0.431 16.974 1.00 0.00 N ATOM 1090 NH2 ARG A 90 -6.879 1.015 18.495 1.00 0.00 N ATOM 0 H ARG A 90 -9.188 -5.356 20.450 1.00 0.00 H new ATOM 0 HA ARG A 90 -11.433 -3.786 20.158 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -9.070 -3.011 20.550 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -8.684 -3.388 18.883 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -10.458 -1.795 18.107 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -10.858 -1.425 19.772 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -9.341 0.312 18.959 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -8.477 -0.650 20.141 1.00 0.00 H new ATOM 0 HE ARG A 90 -7.948 -1.883 17.661 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -6.084 -1.326 16.488 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -5.292 0.229 16.759 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -7.580 1.250 19.197 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -6.132 1.675 18.280 1.00 0.00 H new ATOM 1104 N VAL A 91 -10.396 -5.052 17.303 1.00 0.00 N ATOM 1105 CA VAL A 91 -10.792 -5.288 15.923 1.00 0.00 C ATOM 1106 C VAL A 91 -12.062 -6.146 15.850 1.00 0.00 C ATOM 1107 O VAL A 91 -12.937 -5.926 15.003 1.00 0.00 O ATOM 1108 CB VAL A 91 -9.632 -5.978 15.175 1.00 0.00 C ATOM 1109 CG1 VAL A 91 -8.289 -5.349 15.634 1.00 0.00 C ATOM 1110 CG2 VAL A 91 -9.634 -7.517 15.433 1.00 0.00 C ATOM 0 H VAL A 91 -9.528 -5.510 17.581 1.00 0.00 H new ATOM 0 HA VAL A 91 -11.014 -4.331 15.451 1.00 0.00 H new ATOM 0 HB VAL A 91 -9.759 -5.826 14.103 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -7.464 -5.831 15.110 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -8.290 -4.283 15.407 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -8.169 -5.491 16.708 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -8.806 -7.977 14.894 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -9.522 -7.707 16.500 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -10.575 -7.943 15.085 1.00 0.00 H new ATOM 1120 N TYR A 92 -12.138 -7.134 16.741 1.00 0.00 N ATOM 1121 CA TYR A 92 -13.258 -8.042 16.781 1.00 0.00 C ATOM 1122 C TYR A 92 -14.515 -7.285 17.119 1.00 0.00 C ATOM 1123 O TYR A 92 -15.554 -7.509 16.513 1.00 0.00 O ATOM 1124 CB TYR A 92 -13.011 -9.158 17.804 1.00 0.00 C ATOM 1125 CG TYR A 92 -14.256 -10.001 17.935 1.00 0.00 C ATOM 1126 CD1 TYR A 92 -14.584 -10.936 16.945 1.00 0.00 C ATOM 1127 CD2 TYR A 92 -15.087 -9.842 19.050 1.00 0.00 C ATOM 1128 CE1 TYR A 92 -15.744 -11.711 17.071 1.00 0.00 C ATOM 1129 CE2 TYR A 92 -16.246 -10.616 19.176 1.00 0.00 C ATOM 1130 CZ TYR A 92 -16.575 -11.550 18.186 1.00 0.00 C ATOM 1131 OH TYR A 92 -17.717 -12.315 18.309 1.00 0.00 O ATOM 0 H TYR A 92 -11.424 -7.318 17.446 1.00 0.00 H new ATOM 0 HA TYR A 92 -13.375 -8.502 15.800 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -12.171 -9.777 17.488 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -12.746 -8.729 18.770 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -13.943 -11.059 16.085 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -14.834 -9.122 19.814 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -15.997 -12.432 16.308 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -16.887 -10.493 20.037 1.00 0.00 H new ATOM 0 HH TYR A 92 -18.180 -12.080 19.140 1.00 0.00 H new ATOM 1141 N GLU A 93 -14.405 -6.381 18.083 1.00 0.00 N ATOM 1142 CA GLU A 93 -15.545 -5.577 18.497 1.00 0.00 C ATOM 1143 C GLU A 93 -15.897 -4.540 17.433 1.00 0.00 C ATOM 1144 O GLU A 93 -17.072 -4.251 17.199 1.00 0.00 O ATOM 1145 CB GLU A 93 -15.239 -4.877 19.821 1.00 0.00 C ATOM 1146 CG GLU A 93 -15.059 -5.928 20.920 1.00 0.00 C ATOM 1147 CD GLU A 93 -16.363 -6.690 21.135 1.00 0.00 C ATOM 1148 OE1 GLU A 93 -17.396 -6.183 20.731 1.00 0.00 O ATOM 1149 OE2 GLU A 93 -16.308 -7.770 21.701 1.00 0.00 O ATOM 0 H GLU A 93 -13.542 -6.187 18.591 1.00 0.00 H new ATOM 0 HA GLU A 93 -16.400 -6.241 18.628 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -14.336 -4.275 19.727 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -16.050 -4.197 20.082 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -14.265 -6.622 20.644 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -14.753 -5.446 21.848 1.00 0.00 H new ATOM 1156 N GLN A 94 -14.873 -3.982 16.794 1.00 0.00 N ATOM 1157 CA GLN A 94 -15.088 -2.976 15.758 1.00 0.00 C ATOM 1158 C GLN A 94 -15.816 -3.575 14.559 1.00 0.00 C ATOM 1159 O GLN A 94 -16.851 -3.064 14.130 1.00 0.00 O ATOM 1160 CB GLN A 94 -13.746 -2.397 15.305 1.00 0.00 C ATOM 1161 CG GLN A 94 -13.259 -1.365 16.325 1.00 0.00 C ATOM 1162 CD GLN A 94 -11.864 -0.878 15.946 1.00 0.00 C ATOM 1163 OE1 GLN A 94 -10.930 -1.675 15.855 1.00 0.00 O ATOM 1164 NE2 GLN A 94 -11.665 0.391 15.722 1.00 0.00 N ATOM 0 H GLN A 94 -13.894 -4.206 16.973 1.00 0.00 H new ATOM 0 HA GLN A 94 -15.705 -2.182 16.178 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -13.011 -3.195 15.201 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -13.852 -1.932 14.325 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -13.950 -0.523 16.361 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -13.241 -1.806 17.322 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -12.440 1.050 15.798 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -10.734 0.725 15.471 1.00 0.00 H new ATOM 1173 N ARG A 95 -15.270 -4.662 14.026 1.00 0.00 N ATOM 1174 CA ARG A 95 -15.876 -5.325 12.877 1.00 0.00 C ATOM 1175 C ARG A 95 -17.178 -6.010 13.281 1.00 0.00 C ATOM 1176 O ARG A 95 -17.956 -6.443 12.431 1.00 0.00 O ATOM 1177 CB ARG A 95 -14.903 -6.348 12.290 1.00 0.00 C ATOM 1178 CG ARG A 95 -15.394 -6.783 10.907 1.00 0.00 C ATOM 1179 CD ARG A 95 -14.379 -7.740 10.282 1.00 0.00 C ATOM 1180 NE ARG A 95 -13.143 -7.031 9.972 1.00 0.00 N ATOM 1181 CZ ARG A 95 -12.108 -7.661 9.425 1.00 0.00 C ATOM 1182 NH1 ARG A 95 -11.013 -7.005 9.154 1.00 0.00 N ATOM 1183 NH2 ARG A 95 -12.187 -8.936 9.158 1.00 0.00 N ATOM 0 H ARG A 95 -14.415 -5.101 14.368 1.00 0.00 H new ATOM 0 HA ARG A 95 -16.101 -4.574 12.120 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -13.905 -5.915 12.214 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -14.826 -7.213 12.949 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -16.365 -7.271 10.991 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -15.529 -5.911 10.267 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -14.173 -8.562 10.968 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -14.793 -8.178 9.374 1.00 0.00 H new ATOM 0 HE ARG A 95 -13.071 -6.035 10.178 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -10.951 -6.008 9.362 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -10.219 -7.489 8.734 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -13.043 -9.449 9.369 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -11.393 -9.419 8.738 1.00 0.00 H new ATOM 1197 N LEU A 96 -17.410 -6.098 14.586 1.00 0.00 N ATOM 1198 CA LEU A 96 -18.626 -6.721 15.098 1.00 0.00 C ATOM 1199 C LEU A 96 -19.810 -5.765 15.008 1.00 0.00 C ATOM 1200 O LEU A 96 -20.940 -6.185 14.756 1.00 0.00 O ATOM 1201 CB LEU A 96 -18.430 -7.166 16.547 1.00 0.00 C ATOM 1202 CG LEU A 96 -19.737 -7.710 17.113 1.00 0.00 C ATOM 1203 CD1 LEU A 96 -20.244 -8.839 16.216 1.00 0.00 C ATOM 1204 CD2 LEU A 96 -19.487 -8.251 18.521 1.00 0.00 C ATOM 0 H LEU A 96 -16.777 -5.748 15.305 1.00 0.00 H new ATOM 0 HA LEU A 96 -18.838 -7.595 14.482 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -17.656 -7.932 16.598 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -18.086 -6.325 17.150 1.00 0.00 H new ATOM 0 HG LEU A 96 -20.482 -6.915 17.153 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -21.179 -9.231 16.617 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -20.414 -8.456 15.210 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -19.502 -9.637 16.180 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -20.418 -8.642 18.931 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -18.746 -9.050 18.478 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -19.118 -7.448 19.159 1.00 0.00 H new ATOM 1216 N ALA A 97 -19.545 -4.483 15.230 1.00 0.00 N ATOM 1217 CA ALA A 97 -20.598 -3.478 15.189 1.00 0.00 C ATOM 1218 C ALA A 97 -20.864 -3.037 13.755 1.00 0.00 C ATOM 1219 O ALA A 97 -21.973 -2.623 13.419 1.00 0.00 O ATOM 1220 CB ALA A 97 -20.196 -2.265 16.028 1.00 0.00 C ATOM 0 H ALA A 97 -18.616 -4.117 15.439 1.00 0.00 H new ATOM 0 HA ALA A 97 -21.508 -3.918 15.597 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -20.989 -1.518 15.992 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -20.036 -2.574 17.061 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -19.276 -1.836 15.631 1.00 0.00 H new ATOM 1226 N HIS A 98 -19.838 -3.127 12.915 1.00 0.00 N ATOM 1227 CA HIS A 98 -19.972 -2.731 11.520 1.00 0.00 C ATOM 1228 C HIS A 98 -21.003 -3.603 10.814 1.00 0.00 C ATOM 1229 O HIS A 98 -20.936 -4.832 10.870 1.00 0.00 O ATOM 1230 CB HIS A 98 -18.624 -2.861 10.810 1.00 0.00 C ATOM 1231 CG HIS A 98 -17.651 -1.875 11.395 1.00 0.00 C ATOM 1232 ND1 HIS A 98 -16.299 -1.900 11.089 1.00 0.00 N ATOM 1233 CD2 HIS A 98 -17.819 -0.830 12.269 1.00 0.00 C ATOM 1234 CE1 HIS A 98 -15.711 -0.898 11.770 1.00 0.00 C ATOM 1235 NE2 HIS A 98 -16.593 -0.214 12.505 1.00 0.00 N ATOM 0 H HIS A 98 -18.912 -3.468 13.174 1.00 0.00 H new ATOM 0 HA HIS A 98 -20.304 -1.693 11.486 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -18.240 -3.875 10.919 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -18.745 -2.679 9.742 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -18.760 -0.531 12.707 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -14.655 -0.674 11.727 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -16.408 0.587 13.109 1.00 0.00 H new ATOM 1343 N THR A 105 -17.974 -13.152 2.601 1.00 0.00 N ATOM 1344 CA THR A 105 -17.567 -13.919 3.772 1.00 0.00 C ATOM 1345 C THR A 105 -16.315 -14.737 3.468 1.00 0.00 C ATOM 1346 O THR A 105 -15.936 -14.903 2.308 1.00 0.00 O ATOM 1347 CB THR A 105 -18.697 -14.856 4.202 1.00 0.00 C ATOM 1348 OG1 THR A 105 -18.940 -15.806 3.174 1.00 0.00 O ATOM 1349 CG2 THR A 105 -19.967 -14.041 4.456 1.00 0.00 C ATOM 0 HA THR A 105 -17.346 -13.222 4.580 1.00 0.00 H new ATOM 0 HB THR A 105 -18.411 -15.376 5.117 1.00 0.00 H new ATOM 0 HG1 THR A 105 -18.762 -15.397 2.302 1.00 0.00 H new ATOM 0 HG21 THR A 105 -20.772 -14.708 4.762 1.00 0.00 H new ATOM 0 HG22 THR A 105 -19.780 -13.312 5.245 1.00 0.00 H new ATOM 0 HG23 THR A 105 -20.255 -13.521 3.542 1.00 0.00 H new ATOM 1357 N THR A 106 -15.677 -15.247 4.518 1.00 0.00 N ATOM 1358 CA THR A 106 -14.470 -16.047 4.346 1.00 0.00 C ATOM 1359 C THR A 106 -14.334 -17.059 5.483 1.00 0.00 C ATOM 1360 O THR A 106 -14.830 -16.830 6.588 1.00 0.00 O ATOM 1361 CB THR A 106 -13.239 -15.135 4.323 1.00 0.00 C ATOM 1362 OG1 THR A 106 -13.439 -14.055 5.225 1.00 0.00 O ATOM 1363 CG2 THR A 106 -13.028 -14.593 2.910 1.00 0.00 C ATOM 0 H THR A 106 -15.972 -15.122 5.486 1.00 0.00 H new ATOM 0 HA THR A 106 -14.542 -16.585 3.401 1.00 0.00 H new ATOM 0 HB THR A 106 -12.358 -15.702 4.624 1.00 0.00 H new ATOM 0 HG1 THR A 106 -12.653 -13.470 5.214 1.00 0.00 H new ATOM 0 HG21 THR A 106 -12.152 -13.945 2.896 1.00 0.00 H new ATOM 0 HG22 THR A 106 -12.876 -15.424 2.221 1.00 0.00 H new ATOM 0 HG23 THR A 106 -13.906 -14.024 2.604 1.00 0.00 H new ATOM 1371 N PRO A 107 -13.673 -18.165 5.240 1.00 0.00 N ATOM 1372 CA PRO A 107 -13.478 -19.219 6.277 1.00 0.00 C ATOM 1373 C PRO A 107 -12.483 -18.787 7.354 1.00 0.00 C ATOM 1374 O PRO A 107 -12.657 -19.093 8.533 1.00 0.00 O ATOM 1375 CB PRO A 107 -12.942 -20.417 5.486 1.00 0.00 C ATOM 1376 CG PRO A 107 -12.309 -19.839 4.265 1.00 0.00 C ATOM 1377 CD PRO A 107 -13.041 -18.531 3.961 1.00 0.00 C ATOM 0 HA PRO A 107 -14.400 -19.439 6.814 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -12.218 -20.982 6.073 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -13.746 -21.105 5.223 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -11.247 -19.658 4.430 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -12.388 -20.530 3.425 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -12.351 -17.758 3.622 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -13.783 -18.664 3.174 1.00 0.00 H new ATOM 1385 N GLU A 108 -11.442 -18.072 6.937 1.00 0.00 N ATOM 1386 CA GLU A 108 -10.426 -17.607 7.874 1.00 0.00 C ATOM 1387 C GLU A 108 -11.002 -16.553 8.813 1.00 0.00 C ATOM 1388 O GLU A 108 -10.841 -16.637 10.031 1.00 0.00 O ATOM 1389 CB GLU A 108 -9.238 -17.014 7.111 1.00 0.00 C ATOM 1390 CG GLU A 108 -8.535 -18.113 6.305 1.00 0.00 C ATOM 1391 CD GLU A 108 -9.199 -18.271 4.941 1.00 0.00 C ATOM 1392 OE1 GLU A 108 -10.205 -17.618 4.714 1.00 0.00 O ATOM 1393 OE2 GLU A 108 -8.693 -19.043 4.143 1.00 0.00 O ATOM 0 H GLU A 108 -11.281 -17.804 5.966 1.00 0.00 H new ATOM 0 HA GLU A 108 -10.090 -18.460 8.464 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -9.581 -16.224 6.443 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -8.537 -16.558 7.810 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -7.481 -17.864 6.178 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -8.576 -19.056 6.849 1.00 0.00 H new ATOM 1400 N GLU A 109 -11.676 -15.564 8.239 1.00 0.00 N ATOM 1401 CA GLU A 109 -12.275 -14.499 9.033 1.00 0.00 C ATOM 1402 C GLU A 109 -13.355 -15.066 9.947 1.00 0.00 C ATOM 1403 O GLU A 109 -13.554 -14.585 11.062 1.00 0.00 O ATOM 1404 CB GLU A 109 -12.877 -13.435 8.114 1.00 0.00 C ATOM 1405 CG GLU A 109 -13.440 -12.290 8.958 1.00 0.00 C ATOM 1406 CD GLU A 109 -14.001 -11.200 8.050 1.00 0.00 C ATOM 1407 OE1 GLU A 109 -13.695 -11.225 6.870 1.00 0.00 O ATOM 1408 OE2 GLU A 109 -14.727 -10.357 8.550 1.00 0.00 O ATOM 0 H GLU A 109 -11.821 -15.477 7.233 1.00 0.00 H new ATOM 0 HA GLU A 109 -11.499 -14.042 9.646 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -12.116 -13.057 7.431 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -13.666 -13.872 7.502 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -14.223 -12.664 9.617 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -12.657 -11.877 9.595 1.00 0.00 H new ATOM 1415 N ASP A 110 -14.057 -16.085 9.463 1.00 0.00 N ATOM 1416 CA ASP A 110 -15.115 -16.709 10.248 1.00 0.00 C ATOM 1417 C ASP A 110 -14.542 -17.402 11.481 1.00 0.00 C ATOM 1418 O ASP A 110 -15.051 -17.239 12.588 1.00 0.00 O ATOM 1419 CB ASP A 110 -15.870 -17.731 9.386 1.00 0.00 C ATOM 1420 CG ASP A 110 -16.956 -17.035 8.566 1.00 0.00 C ATOM 1421 OD1 ASP A 110 -17.340 -15.939 8.940 1.00 0.00 O ATOM 1422 OD2 ASP A 110 -17.384 -17.607 7.578 1.00 0.00 O ATOM 0 H ASP A 110 -13.914 -16.493 8.539 1.00 0.00 H new ATOM 0 HA ASP A 110 -15.802 -15.929 10.577 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -15.173 -18.241 8.721 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -16.318 -18.493 10.023 1.00 0.00 H new ATOM 1427 N GLU A 111 -13.476 -18.171 11.281 1.00 0.00 N ATOM 1428 CA GLU A 111 -12.847 -18.886 12.386 1.00 0.00 C ATOM 1429 C GLU A 111 -12.377 -17.912 13.458 1.00 0.00 C ATOM 1430 O GLU A 111 -12.673 -18.085 14.641 1.00 0.00 O ATOM 1431 CB GLU A 111 -11.650 -19.685 11.872 1.00 0.00 C ATOM 1432 CG GLU A 111 -11.031 -20.476 13.025 1.00 0.00 C ATOM 1433 CD GLU A 111 -9.856 -21.306 12.518 1.00 0.00 C ATOM 1434 OE1 GLU A 111 -9.431 -21.073 11.398 1.00 0.00 O ATOM 1435 OE2 GLU A 111 -9.398 -22.162 13.256 1.00 0.00 O ATOM 0 H GLU A 111 -13.033 -18.314 10.373 1.00 0.00 H new ATOM 0 HA GLU A 111 -13.583 -19.562 12.820 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -11.966 -20.364 11.080 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -10.909 -19.013 11.439 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -10.695 -19.794 13.806 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -11.781 -21.128 13.473 1.00 0.00 H new ATOM 1442 N LEU A 112 -11.646 -16.886 13.041 1.00 0.00 N ATOM 1443 CA LEU A 112 -11.139 -15.898 13.982 1.00 0.00 C ATOM 1444 C LEU A 112 -12.282 -15.308 14.797 1.00 0.00 C ATOM 1445 O LEU A 112 -12.166 -15.138 16.011 1.00 0.00 O ATOM 1446 CB LEU A 112 -10.430 -14.772 13.220 1.00 0.00 C ATOM 1447 CG LEU A 112 -9.930 -13.712 14.206 1.00 0.00 C ATOM 1448 CD1 LEU A 112 -8.991 -14.361 15.225 1.00 0.00 C ATOM 1449 CD2 LEU A 112 -9.179 -12.618 13.443 1.00 0.00 C ATOM 0 H LEU A 112 -11.393 -16.718 12.067 1.00 0.00 H new ATOM 0 HA LEU A 112 -10.435 -16.388 14.655 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.593 -15.177 12.651 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -11.114 -14.320 12.502 1.00 0.00 H new ATOM 0 HG LEU A 112 -10.781 -13.273 14.727 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -8.636 -13.605 15.926 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.527 -15.138 15.770 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.140 -14.803 14.706 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.823 -11.864 14.145 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.329 -13.057 12.920 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -9.849 -12.153 12.720 1.00 0.00 H new ATOM 1461 N ASP A 113 -13.388 -15.007 14.130 1.00 0.00 N ATOM 1462 CA ASP A 113 -14.544 -14.434 14.811 1.00 0.00 C ATOM 1463 C ASP A 113 -15.048 -15.396 15.888 1.00 0.00 C ATOM 1464 O ASP A 113 -15.356 -14.981 17.004 1.00 0.00 O ATOM 1465 CB ASP A 113 -15.661 -14.163 13.797 1.00 0.00 C ATOM 1466 CG ASP A 113 -15.458 -12.798 13.140 1.00 0.00 C ATOM 1467 OD1 ASP A 113 -14.551 -12.094 13.553 1.00 0.00 O ATOM 1468 OD2 ASP A 113 -16.210 -12.480 12.234 1.00 0.00 O ATOM 0 H ASP A 113 -13.510 -15.148 13.127 1.00 0.00 H new ATOM 0 HA ASP A 113 -14.249 -13.496 15.282 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -15.668 -14.943 13.036 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -16.630 -14.194 14.295 1.00 0.00 H new ATOM 1473 N GLN A 114 -15.134 -16.675 15.543 1.00 0.00 N ATOM 1474 CA GLN A 114 -15.603 -17.679 16.492 1.00 0.00 C ATOM 1475 C GLN A 114 -14.669 -17.767 17.692 1.00 0.00 C ATOM 1476 O GLN A 114 -15.116 -17.805 18.839 1.00 0.00 O ATOM 1477 CB GLN A 114 -15.680 -19.044 15.809 1.00 0.00 C ATOM 1478 CG GLN A 114 -16.757 -19.016 14.723 1.00 0.00 C ATOM 1479 CD GLN A 114 -18.126 -18.789 15.352 1.00 0.00 C ATOM 1480 OE1 GLN A 114 -18.517 -19.514 16.267 1.00 0.00 O ATOM 1481 NE2 GLN A 114 -18.882 -17.819 14.915 1.00 0.00 N ATOM 0 H GLN A 114 -14.888 -17.040 14.623 1.00 0.00 H new ATOM 0 HA GLN A 114 -16.594 -17.385 16.839 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -14.715 -19.297 15.371 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -15.910 -19.816 16.543 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -16.541 -18.224 14.006 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -16.753 -19.956 14.171 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -18.555 -17.220 14.157 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -19.799 -17.660 15.332 1.00 0.00 H new ATOM 1490 N LEU A 115 -13.369 -17.798 17.423 1.00 0.00 N ATOM 1491 CA LEU A 115 -12.384 -17.887 18.492 1.00 0.00 C ATOM 1492 C LEU A 115 -12.507 -16.692 19.426 1.00 0.00 C ATOM 1493 O LEU A 115 -12.433 -16.836 20.646 1.00 0.00 O ATOM 1494 CB LEU A 115 -10.976 -17.923 17.895 1.00 0.00 C ATOM 1495 CG LEU A 115 -10.765 -19.236 17.135 1.00 0.00 C ATOM 1496 CD1 LEU A 115 -9.438 -19.179 16.372 1.00 0.00 C ATOM 1497 CD2 LEU A 115 -10.743 -20.412 18.121 1.00 0.00 C ATOM 0 H LEU A 115 -12.976 -17.763 16.482 1.00 0.00 H new ATOM 0 HA LEU A 115 -12.565 -18.800 19.059 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -10.835 -17.077 17.223 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -10.233 -17.828 18.687 1.00 0.00 H new ATOM 0 HG LEU A 115 -11.584 -19.377 16.429 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -9.289 -20.114 15.832 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -9.460 -18.350 15.664 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -8.619 -19.032 17.076 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.593 -21.343 17.574 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -9.930 -20.274 18.833 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -11.691 -20.455 18.657 1.00 0.00 H new ATOM 1509 N CYS A 116 -12.702 -15.513 18.850 1.00 0.00 N ATOM 1510 CA CYS A 116 -12.840 -14.301 19.647 1.00 0.00 C ATOM 1511 C CYS A 116 -14.085 -14.379 20.526 1.00 0.00 C ATOM 1512 O CYS A 116 -14.063 -13.975 21.688 1.00 0.00 O ATOM 1513 CB CYS A 116 -12.941 -13.083 18.729 1.00 0.00 C ATOM 1514 SG CYS A 116 -11.377 -12.863 17.845 1.00 0.00 S ATOM 0 H CYS A 116 -12.768 -15.370 17.842 1.00 0.00 H new ATOM 0 HA CYS A 116 -11.961 -14.205 20.285 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -13.757 -13.216 18.019 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -13.169 -12.192 19.313 1.00 0.00 H new ATOM 0 HG CYS A 116 -11.289 -13.744 16.893 1.00 0.00 H new ATOM 1520 N ASP A 117 -15.171 -14.905 19.964 1.00 0.00 N ATOM 1521 CA ASP A 117 -16.417 -15.031 20.709 1.00 0.00 C ATOM 1522 C ASP A 117 -16.229 -15.939 21.920 1.00 0.00 C ATOM 1523 O ASP A 117 -16.674 -15.621 23.022 1.00 0.00 O ATOM 1524 CB ASP A 117 -17.510 -15.605 19.805 1.00 0.00 C ATOM 1525 CG ASP A 117 -18.812 -15.752 20.587 1.00 0.00 C ATOM 1526 OD1 ASP A 117 -19.329 -14.742 21.031 1.00 0.00 O ATOM 1527 OD2 ASP A 117 -19.270 -16.874 20.729 1.00 0.00 O ATOM 0 H ASP A 117 -15.212 -15.247 19.004 1.00 0.00 H new ATOM 0 HA ASP A 117 -16.713 -14.040 21.054 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -17.664 -14.951 18.947 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -17.199 -16.574 19.415 1.00 0.00 H new ATOM 1532 N GLU A 118 -15.565 -17.071 21.707 1.00 0.00 N ATOM 1533 CA GLU A 118 -15.329 -18.017 22.789 1.00 0.00 C ATOM 1534 C GLU A 118 -14.464 -17.385 23.874 1.00 0.00 C ATOM 1535 O GLU A 118 -14.760 -17.497 25.063 1.00 0.00 O ATOM 1536 CB GLU A 118 -14.643 -19.271 22.241 1.00 0.00 C ATOM 1537 CG GLU A 118 -14.555 -20.329 23.341 1.00 0.00 C ATOM 1538 CD GLU A 118 -14.257 -21.692 22.727 1.00 0.00 C ATOM 1539 OE1 GLU A 118 -14.202 -22.656 23.474 1.00 0.00 O ATOM 1540 OE2 GLU A 118 -14.101 -21.755 21.519 1.00 0.00 O ATOM 0 H GLU A 118 -15.185 -17.353 20.804 1.00 0.00 H new ATOM 0 HA GLU A 118 -16.289 -18.292 23.227 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -15.202 -19.662 21.391 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -13.645 -19.023 21.880 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -13.774 -20.062 24.053 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -15.492 -20.368 23.896 1.00 0.00 H new ATOM 1547 N TRP A 119 -13.398 -16.712 23.454 1.00 0.00 N ATOM 1548 CA TRP A 119 -12.501 -16.055 24.397 1.00 0.00 C ATOM 1549 C TRP A 119 -13.226 -14.935 25.137 1.00 0.00 C ATOM 1550 O TRP A 119 -13.039 -14.746 26.339 1.00 0.00 O ATOM 1551 CB TRP A 119 -11.289 -15.485 23.658 1.00 0.00 C ATOM 1552 CG TRP A 119 -10.495 -14.627 24.589 1.00 0.00 C ATOM 1553 CD1 TRP A 119 -10.421 -13.278 24.530 1.00 0.00 C ATOM 1554 CD2 TRP A 119 -9.665 -15.034 25.715 1.00 0.00 C ATOM 1555 NE1 TRP A 119 -9.597 -12.831 25.547 1.00 0.00 N ATOM 1556 CE2 TRP A 119 -9.108 -13.875 26.305 1.00 0.00 C ATOM 1557 CE3 TRP A 119 -9.345 -16.284 26.275 1.00 0.00 C ATOM 1558 CZ2 TRP A 119 -8.262 -13.954 27.413 1.00 0.00 C ATOM 1559 CZ3 TRP A 119 -8.494 -16.366 27.390 1.00 0.00 C ATOM 1560 CH2 TRP A 119 -7.954 -15.203 27.957 1.00 0.00 C ATOM 0 H TRP A 119 -13.135 -16.608 22.474 1.00 0.00 H new ATOM 0 HA TRP A 119 -12.165 -16.794 25.124 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -10.669 -16.296 23.276 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -11.616 -14.901 22.798 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -10.923 -12.652 23.807 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -9.378 -11.849 25.716 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -9.756 -17.186 25.846 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -7.849 -13.055 27.846 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -8.254 -17.331 27.813 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -7.300 -15.273 28.814 1.00 0.00 H new ATOM 1571 N LYS A 120 -14.057 -14.197 24.408 1.00 0.00 N ATOM 1572 CA LYS A 120 -14.805 -13.096 25.002 1.00 0.00 C ATOM 1573 C LYS A 120 -15.745 -13.615 26.087 1.00 0.00 C ATOM 1574 O LYS A 120 -15.935 -12.968 27.117 1.00 0.00 O ATOM 1575 CB LYS A 120 -15.615 -12.370 23.923 1.00 0.00 C ATOM 1576 CG LYS A 120 -16.298 -11.145 24.533 1.00 0.00 C ATOM 1577 CD LYS A 120 -17.060 -10.388 23.442 1.00 0.00 C ATOM 1578 CE LYS A 120 -17.728 -9.153 24.048 1.00 0.00 C ATOM 1579 NZ LYS A 120 -18.456 -8.409 22.982 1.00 0.00 N ATOM 0 H LYS A 120 -14.228 -14.340 23.413 1.00 0.00 H new ATOM 0 HA LYS A 120 -14.097 -12.399 25.451 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -14.961 -12.065 23.106 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -16.361 -13.042 23.500 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -16.983 -11.453 25.323 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -15.555 -10.492 24.992 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -16.377 -10.091 22.646 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -17.811 -11.037 22.992 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -18.420 -9.450 24.836 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -16.978 -8.510 24.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -18.751 -7.481 23.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -17.830 -8.276 22.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -19.296 -8.950 22.692 1.00 0.00 H new ATOM 1593 N ALA A 121 -16.331 -14.785 25.846 1.00 0.00 N ATOM 1594 CA ALA A 121 -17.250 -15.381 26.810 1.00 0.00 C ATOM 1595 C ALA A 121 -16.522 -15.736 28.097 1.00 0.00 C ATOM 1596 O ALA A 121 -17.016 -15.479 29.193 1.00 0.00 O ATOM 1597 CB ALA A 121 -17.880 -16.640 26.219 1.00 0.00 C ATOM 0 H ALA A 121 -16.187 -15.335 24.999 1.00 0.00 H new ATOM 0 HA ALA A 121 -18.030 -14.653 27.036 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -18.565 -17.079 26.945 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -18.428 -16.382 25.313 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -17.098 -17.359 25.977 1.00 0.00 H new ATOM 1603 N ARG A 122 -15.343 -16.317 27.960 1.00 0.00 N ATOM 1604 CA ARG A 122 -14.564 -16.683 29.128 1.00 0.00 C ATOM 1605 C ARG A 122 -14.267 -15.445 29.966 1.00 0.00 C ATOM 1606 O ARG A 122 -14.369 -15.475 31.192 1.00 0.00 O ATOM 1607 CB ARG A 122 -13.247 -17.373 28.685 1.00 0.00 C ATOM 1608 CG ARG A 122 -12.021 -16.835 29.495 1.00 0.00 C ATOM 1609 CD ARG A 122 -11.010 -17.924 29.790 1.00 0.00 C ATOM 1610 NE ARG A 122 -10.300 -17.600 30.997 1.00 0.00 N ATOM 1611 CZ ARG A 122 -9.499 -16.542 31.064 1.00 0.00 C ATOM 1612 NH1 ARG A 122 -8.847 -16.286 32.165 1.00 0.00 N ATOM 1613 NH2 ARG A 122 -9.363 -15.760 30.028 1.00 0.00 N ATOM 0 H ARG A 122 -14.909 -16.543 27.065 1.00 0.00 H new ATOM 0 HA ARG A 122 -15.136 -17.382 29.738 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -13.334 -18.450 28.826 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -13.085 -17.203 27.621 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -11.538 -16.036 28.933 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -12.369 -16.400 30.432 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -11.514 -18.884 29.898 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -10.312 -18.022 28.959 1.00 0.00 H new ATOM 0 HE ARG A 122 -10.413 -18.194 31.818 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -8.952 -16.898 32.974 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -8.232 -15.474 32.216 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -9.872 -15.961 29.167 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -8.748 -14.948 30.079 1.00 0.00 H new ATOM 1627 N LEU A 123 -13.864 -14.377 29.304 1.00 0.00 N ATOM 1628 CA LEU A 123 -13.514 -13.159 30.006 1.00 0.00 C ATOM 1629 C LEU A 123 -14.708 -12.634 30.780 1.00 0.00 C ATOM 1630 O LEU A 123 -14.571 -12.170 31.911 1.00 0.00 O ATOM 1631 CB LEU A 123 -13.023 -12.101 29.015 1.00 0.00 C ATOM 1632 CG LEU A 123 -11.647 -12.499 28.463 1.00 0.00 C ATOM 1633 CD1 LEU A 123 -11.247 -11.531 27.339 1.00 0.00 C ATOM 1634 CD2 LEU A 123 -10.598 -12.452 29.589 1.00 0.00 C ATOM 0 H LEU A 123 -13.772 -14.328 28.289 1.00 0.00 H new ATOM 0 HA LEU A 123 -12.712 -13.382 30.710 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -13.736 -11.998 28.197 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -12.960 -11.131 29.507 1.00 0.00 H new ATOM 0 HG LEU A 123 -11.697 -13.513 28.067 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -10.270 -11.813 26.947 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -11.986 -11.577 26.539 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -11.201 -10.516 27.733 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -9.624 -12.736 29.191 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -10.544 -11.442 29.994 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -10.882 -13.146 30.380 1.00 0.00 H new ATOM 1646 N SER A 124 -15.876 -12.722 30.166 1.00 0.00 N ATOM 1647 CA SER A 124 -17.100 -12.266 30.805 1.00 0.00 C ATOM 1648 C SER A 124 -17.447 -13.147 32.003 1.00 0.00 C ATOM 1649 O SER A 124 -17.885 -12.652 33.042 1.00 0.00 O ATOM 1650 CB SER A 124 -18.250 -12.284 29.801 1.00 0.00 C ATOM 1651 OG SER A 124 -19.299 -11.454 30.280 1.00 0.00 O ATOM 0 H SER A 124 -16.003 -13.104 29.229 1.00 0.00 H new ATOM 0 HA SER A 124 -16.943 -11.247 31.158 1.00 0.00 H new ATOM 0 HB2 SER A 124 -17.906 -11.931 28.829 1.00 0.00 H new ATOM 0 HB3 SER A 124 -18.611 -13.303 29.661 1.00 0.00 H new ATOM 0 HG SER A 124 -20.040 -11.460 29.639 1.00 0.00 H new ATOM 1657 N GLU A 125 -17.256 -14.454 31.849 1.00 0.00 N ATOM 1658 CA GLU A 125 -17.562 -15.393 32.922 1.00 0.00 C ATOM 1659 C GLU A 125 -16.735 -15.074 34.163 1.00 0.00 C ATOM 1660 O GLU A 125 -17.240 -15.110 35.285 1.00 0.00 O ATOM 1661 CB GLU A 125 -17.268 -16.823 32.460 1.00 0.00 C ATOM 1662 CG GLU A 125 -17.635 -17.805 33.573 1.00 0.00 C ATOM 1663 CD GLU A 125 -17.363 -19.235 33.120 1.00 0.00 C ATOM 1664 OE1 GLU A 125 -16.289 -19.473 32.590 1.00 0.00 O ATOM 1665 OE2 GLU A 125 -18.231 -20.071 33.308 1.00 0.00 O ATOM 0 H GLU A 125 -16.893 -14.884 30.998 1.00 0.00 H new ATOM 0 HA GLU A 125 -18.619 -15.303 33.172 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -17.837 -17.049 31.559 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -16.213 -16.924 32.205 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -17.057 -17.583 34.470 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -18.687 -17.692 33.836 1.00 0.00 H new ATOM 1672 N LEU A 126 -15.464 -14.756 33.950 1.00 0.00 N ATOM 1673 CA LEU A 126 -14.571 -14.422 35.054 1.00 0.00 C ATOM 1674 C LEU A 126 -14.993 -13.108 35.702 1.00 0.00 C ATOM 1675 O LEU A 126 -14.883 -12.942 36.917 1.00 0.00 O ATOM 1676 CB LEU A 126 -13.130 -14.318 34.554 1.00 0.00 C ATOM 1677 CG LEU A 126 -12.660 -15.697 34.083 1.00 0.00 C ATOM 1678 CD1 LEU A 126 -11.280 -15.574 33.442 1.00 0.00 C ATOM 1679 CD2 LEU A 126 -12.584 -16.664 35.275 1.00 0.00 C ATOM 0 H LEU A 126 -15.029 -14.722 33.028 1.00 0.00 H new ATOM 0 HA LEU A 126 -14.632 -15.215 35.799 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -13.067 -13.600 33.736 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -12.482 -13.952 35.350 1.00 0.00 H new ATOM 0 HG LEU A 126 -13.371 -16.084 33.353 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -10.946 -16.556 33.107 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -11.334 -14.898 32.588 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -10.573 -15.180 34.172 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -12.249 -17.642 34.929 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -11.879 -16.278 36.012 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -13.570 -16.758 35.730 1.00 0.00 H new ATOM 1691 N GLN A 127 -15.471 -12.177 34.883 1.00 0.00 N ATOM 1692 CA GLN A 127 -15.905 -10.878 35.386 1.00 0.00 C ATOM 1693 C GLN A 127 -17.124 -11.025 36.293 1.00 0.00 C ATOM 1694 O GLN A 127 -17.209 -10.386 37.342 1.00 0.00 O ATOM 1695 CB GLN A 127 -16.246 -9.952 34.217 1.00 0.00 C ATOM 1696 CG GLN A 127 -14.957 -9.492 33.535 1.00 0.00 C ATOM 1697 CD GLN A 127 -15.289 -8.677 32.289 1.00 0.00 C ATOM 1698 OE1 GLN A 127 -15.885 -9.199 31.347 1.00 0.00 O ATOM 1699 NE2 GLN A 127 -14.937 -7.422 32.228 1.00 0.00 N ATOM 0 H GLN A 127 -15.567 -12.296 33.875 1.00 0.00 H new ATOM 0 HA GLN A 127 -15.089 -10.448 35.966 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -16.882 -10.472 33.501 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -16.808 -9.089 34.575 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -14.365 -8.891 34.225 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -14.351 -10.356 33.264 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -14.443 -6.992 33.010 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -15.156 -6.871 31.398 1.00 0.00 H new ATOM 1708 N GLN A 128 -18.061 -11.871 35.883 1.00 0.00 N ATOM 1709 CA GLN A 128 -19.270 -12.094 36.667 1.00 0.00 C ATOM 1710 C GLN A 128 -18.913 -12.567 38.071 1.00 0.00 C ATOM 1711 O GLN A 128 -19.555 -12.186 39.048 1.00 0.00 O ATOM 1712 CB GLN A 128 -20.156 -13.135 35.978 1.00 0.00 C ATOM 1713 CG GLN A 128 -20.724 -12.546 34.685 1.00 0.00 C ATOM 1714 CD GLN A 128 -21.572 -13.589 33.966 1.00 0.00 C ATOM 1715 OE1 GLN A 128 -22.417 -14.237 34.586 1.00 0.00 O ATOM 1716 NE2 GLN A 128 -21.398 -13.792 32.689 1.00 0.00 N ATOM 0 H GLN A 128 -18.009 -12.410 35.019 1.00 0.00 H new ATOM 0 HA GLN A 128 -19.815 -11.153 36.742 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -19.577 -14.032 35.758 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -20.968 -13.434 36.641 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -21.328 -11.667 34.910 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -19.911 -12.217 34.038 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -20.698 -13.254 32.178 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -21.962 -14.488 32.202 1.00 0.00 H new ATOM 1725 N TYR A 129 -17.877 -13.395 38.163 1.00 0.00 N ATOM 1726 CA TYR A 129 -17.437 -13.909 39.454 1.00 0.00 C ATOM 1727 C TYR A 129 -16.938 -12.774 40.343 1.00 0.00 C ATOM 1728 O TYR A 129 -17.174 -12.770 41.551 1.00 0.00 O ATOM 1729 CB TYR A 129 -16.321 -14.940 39.258 1.00 0.00 C ATOM 1730 CG TYR A 129 -16.925 -16.295 38.978 1.00 0.00 C ATOM 1731 CD1 TYR A 129 -16.783 -16.883 37.716 1.00 0.00 C ATOM 1732 CD2 TYR A 129 -17.628 -16.965 39.986 1.00 0.00 C ATOM 1733 CE1 TYR A 129 -17.344 -18.140 37.461 1.00 0.00 C ATOM 1734 CE2 TYR A 129 -18.189 -18.222 39.732 1.00 0.00 C ATOM 1735 CZ TYR A 129 -18.048 -18.809 38.470 1.00 0.00 C ATOM 1736 OH TYR A 129 -18.602 -20.048 38.219 1.00 0.00 O ATOM 0 H TYR A 129 -17.331 -13.722 37.366 1.00 0.00 H new ATOM 0 HA TYR A 129 -18.287 -14.387 39.940 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -15.677 -14.640 38.431 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -15.695 -14.987 40.149 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -16.240 -16.367 36.938 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -17.738 -16.512 40.960 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -17.234 -18.593 36.487 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -18.731 -18.739 40.510 1.00 0.00 H new ATOM 0 HH TYR A 129 -19.055 -20.373 39.025 1.00 0.00 H new ATOM 1746 N ARG A 130 -16.247 -11.816 39.736 1.00 0.00 N ATOM 1747 CA ARG A 130 -15.715 -10.681 40.481 1.00 0.00 C ATOM 1748 C ARG A 130 -16.843 -9.906 41.153 1.00 0.00 C ATOM 1749 O ARG A 130 -16.724 -9.493 42.307 1.00 0.00 O ATOM 1750 CB ARG A 130 -14.946 -9.752 39.541 1.00 0.00 C ATOM 1751 CG ARG A 130 -14.319 -8.614 40.348 1.00 0.00 C ATOM 1752 CD ARG A 130 -13.546 -7.687 39.410 1.00 0.00 C ATOM 1753 NE ARG A 130 -14.460 -7.031 38.480 1.00 0.00 N ATOM 1754 CZ ARG A 130 -14.073 -6.698 37.253 1.00 0.00 C ATOM 1755 NH1 ARG A 130 -14.910 -6.112 36.441 1.00 0.00 N ATOM 1756 NH2 ARG A 130 -12.855 -6.955 36.860 1.00 0.00 N ATOM 0 H ARG A 130 -16.043 -11.802 38.737 1.00 0.00 H new ATOM 0 HA ARG A 130 -15.040 -11.059 41.249 1.00 0.00 H new ATOM 0 HB2 ARG A 130 -14.171 -10.310 39.016 1.00 0.00 H new ATOM 0 HB3 ARG A 130 -15.617 -9.348 38.783 1.00 0.00 H new ATOM 0 HG2 ARG A 130 -15.095 -8.055 40.871 1.00 0.00 H new ATOM 0 HG3 ARG A 130 -13.651 -9.019 41.108 1.00 0.00 H new ATOM 0 HD2 ARG A 130 -13.007 -6.938 39.990 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -12.801 -8.258 38.856 1.00 0.00 H new ATOM 0 HE ARG A 130 -15.414 -6.824 38.777 1.00 0.00 H new ATOM 0 HH11 ARG A 130 -15.861 -5.909 36.748 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -14.613 -5.856 35.499 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -12.200 -7.412 37.495 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -12.558 -6.699 35.918 1.00 0.00 H new ATOM 1770 N GLU A 131 -17.935 -9.709 40.423 1.00 0.00 N ATOM 1771 CA GLU A 131 -19.079 -8.982 40.959 1.00 0.00 C ATOM 1772 C GLU A 131 -19.687 -9.733 42.141 1.00 0.00 C ATOM 1773 O GLU A 131 -20.149 -9.120 43.105 1.00 0.00 O ATOM 1774 CB GLU A 131 -20.139 -8.800 39.872 1.00 0.00 C ATOM 1775 CG GLU A 131 -19.608 -7.854 38.794 1.00 0.00 C ATOM 1776 CD GLU A 131 -20.620 -7.733 37.660 1.00 0.00 C ATOM 1777 OE1 GLU A 131 -21.668 -8.350 37.760 1.00 0.00 O ATOM 1778 OE2 GLU A 131 -20.333 -7.027 36.708 1.00 0.00 O ATOM 0 H GLU A 131 -18.052 -10.040 39.465 1.00 0.00 H new ATOM 0 HA GLU A 131 -18.735 -8.005 41.300 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -20.393 -9.764 39.432 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -21.054 -8.397 40.306 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -19.413 -6.872 39.225 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -18.659 -8.226 38.407 1.00 0.00 H new