USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 760 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 217 LYS NZ :NH3+ -177:sc= 1.25 (180deg=0.99) USER MOD Set 1.2: A 247 ASN : amide:sc= 0.0446 K(o=1.4,f=-4.1!) USER MOD Set 1.3: A 248 ASN : amide:sc= 0.098 K(o=1.4,f=-1.9!) USER MOD Set 2.1: A 203 ASN : amide:sc= 1.07 K(o=0.73,f=-0.63) USER MOD Set 2.2: A 206 ASN : amide:sc= -0.334 K(o=0.73,f=-1.3!) USER MOD Set 3.1: A 185 THR OG1 : rot 180:sc= 1.03 USER MOD Set 3.2: A 192 THR OG1 : rot -65:sc= 1.27 USER MOD Set 4.1: A 183 ASN :FLIP amide:sc=-0.00331 X(o=-0.44,f=-0.15) USER MOD Set 4.2: A 194 GLN :FLIP amide:sc= -0.142 F(o=-0.93,f=-0.15) USER MOD Single : A 168 TYR OH : rot 180:sc= 0 USER MOD Single : A 175 MET CE :methyl 166:sc= -0.0128 (180deg=-0.26) USER MOD Single : A 179 TYR OH : rot 180:sc= 0 USER MOD Single : A 180 LYS NZ :NH3+ 146:sc= 1.25 (180deg=0.282) USER MOD Single : A 181 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 HIS : no HD1:sc= -0.886 X(o=-0.89,f=-1.4) USER MOD Single : A 188 THR OG1 : rot 180:sc= 0 USER MOD Single : A 190 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 199 SER OG : rot 92:sc= 1.29 USER MOD Single : A 201 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 202 LYS NZ :NH3+ -124:sc= 0.48 (180deg=-0.000819) USER MOD Single : A 205 SER OG : rot 180:sc= 0 USER MOD Single : A 209 TYR OH : rot 180:sc= 0 USER MOD Single : A 210 THR OG1 : rot 180:sc= 0 USER MOD Single : A 211 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 216 THR OG1 : rot 180:sc= -0.341 USER MOD Single : A 219 THR OG1 : rot 90:sc= 0.127 USER MOD Single : A 224 ASN : amide:sc= -0.412 K(o=-0.41,f=-14!) USER MOD Single : A 226 SER OG : rot 180:sc= 0 USER MOD Single : A 232 THR OG1 : rot -117:sc= -0.319 USER MOD Single : A 234 SER OG : rot 180:sc= 0 USER MOD Single : A 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 242 TYR OH : rot 180:sc= 0 USER MOD Single : A 244 GLN : amide:sc= -1.82 X(o=-1.8,f=-1.9!) USER MOD Single : A 246 THR OG1 : rot 180:sc= -0.315 USER MOD Single : A 251 ASN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 254 CYS SG : rot 180:sc= -0.041 USER MOD Single : A 256 ASN : amide:sc= -0.811! X(o=-0.81!,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 168 -15.518 -11.805 6.571 1.00 0.00 N ATOM 2 CA TYR A 168 -16.786 -12.326 6.021 1.00 0.00 C ATOM 3 C TYR A 168 -16.558 -12.953 4.662 1.00 0.00 C ATOM 4 O TYR A 168 -17.510 -13.246 3.933 1.00 0.00 O ATOM 5 CB TYR A 168 -17.818 -11.211 5.914 1.00 0.00 C ATOM 6 CG TYR A 168 -18.049 -10.460 7.206 1.00 0.00 C ATOM 7 CD1 TYR A 168 -18.896 -10.961 8.185 1.00 0.00 C ATOM 8 CD2 TYR A 168 -17.418 -9.247 7.442 1.00 0.00 C ATOM 9 CE1 TYR A 168 -19.106 -10.272 9.365 1.00 0.00 C ATOM 10 CE2 TYR A 168 -17.623 -8.552 8.613 1.00 0.00 C ATOM 11 CZ TYR A 168 -18.467 -9.067 9.571 1.00 0.00 C ATOM 12 OH TYR A 168 -18.677 -8.369 10.736 1.00 0.00 O ATOM 0 HA TYR A 168 -17.164 -13.090 6.700 1.00 0.00 H new ATOM 0 HB2 TYR A 168 -17.497 -10.505 5.148 1.00 0.00 H new ATOM 0 HB3 TYR A 168 -18.764 -11.636 5.579 1.00 0.00 H new ATOM 0 HD1 TYR A 168 -19.398 -11.903 8.022 1.00 0.00 H new ATOM 0 HD2 TYR A 168 -16.754 -8.840 6.694 1.00 0.00 H new ATOM 0 HE1 TYR A 168 -19.765 -10.674 10.120 1.00 0.00 H new ATOM 0 HE2 TYR A 168 -17.125 -7.608 8.779 1.00 0.00 H new ATOM 0 HH TYR A 168 -18.151 -7.542 10.721 1.00 0.00 H new ATOM 22 N GLU A 169 -15.282 -13.129 4.326 1.00 0.00 N ATOM 23 CA GLU A 169 -14.839 -13.733 3.068 1.00 0.00 C ATOM 24 C GLU A 169 -15.109 -12.828 1.848 1.00 0.00 C ATOM 25 O GLU A 169 -14.564 -13.049 0.760 1.00 0.00 O ATOM 26 CB GLU A 169 -15.467 -15.118 2.863 1.00 0.00 C ATOM 27 CG GLU A 169 -14.852 -15.904 1.718 1.00 0.00 C ATOM 28 CD GLU A 169 -15.501 -17.246 1.513 1.00 0.00 C ATOM 29 OE1 GLU A 169 -15.138 -18.204 2.224 1.00 0.00 O ATOM 30 OE2 GLU A 169 -16.373 -17.358 0.631 1.00 0.00 O ATOM 0 H GLU A 169 -14.510 -12.851 4.932 1.00 0.00 H new ATOM 0 HA GLU A 169 -13.758 -13.851 3.147 1.00 0.00 H new ATOM 0 HB2 GLU A 169 -15.365 -15.693 3.783 1.00 0.00 H new ATOM 0 HB3 GLU A 169 -16.535 -14.999 2.678 1.00 0.00 H new ATOM 0 HG2 GLU A 169 -14.934 -15.323 0.800 1.00 0.00 H new ATOM 0 HG3 GLU A 169 -13.789 -16.046 1.911 1.00 0.00 H new ATOM 37 N ARG A 170 -15.922 -11.807 2.035 1.00 0.00 N ATOM 38 CA ARG A 170 -16.270 -10.906 0.956 1.00 0.00 C ATOM 39 C ARG A 170 -15.170 -9.886 0.721 1.00 0.00 C ATOM 40 O ARG A 170 -15.129 -8.835 1.363 1.00 0.00 O ATOM 41 CB ARG A 170 -17.593 -10.197 1.257 1.00 0.00 C ATOM 42 CG ARG A 170 -18.772 -11.138 1.439 1.00 0.00 C ATOM 43 CD ARG A 170 -19.155 -11.828 0.138 1.00 0.00 C ATOM 44 NE ARG A 170 -20.322 -12.696 0.310 1.00 0.00 N ATOM 45 CZ ARG A 170 -20.942 -13.343 -0.681 1.00 0.00 C ATOM 46 NH1 ARG A 170 -20.562 -13.164 -1.943 1.00 0.00 N ATOM 47 NH2 ARG A 170 -21.955 -14.156 -0.406 1.00 0.00 N ATOM 0 H ARG A 170 -16.356 -11.581 2.930 1.00 0.00 H new ATOM 0 HA ARG A 170 -16.386 -11.498 0.048 1.00 0.00 H new ATOM 0 HB2 ARG A 170 -17.475 -9.600 2.161 1.00 0.00 H new ATOM 0 HB3 ARG A 170 -17.816 -9.505 0.444 1.00 0.00 H new ATOM 0 HG2 ARG A 170 -18.524 -11.889 2.189 1.00 0.00 H new ATOM 0 HG3 ARG A 170 -19.627 -10.579 1.819 1.00 0.00 H new ATOM 0 HD2 ARG A 170 -19.368 -11.078 -0.623 1.00 0.00 H new ATOM 0 HD3 ARG A 170 -18.313 -12.418 -0.223 1.00 0.00 H new ATOM 0 HE ARG A 170 -20.688 -12.815 1.255 1.00 0.00 H new ATOM 0 HH11 ARG A 170 -19.793 -12.530 -2.159 1.00 0.00 H new ATOM 0 HH12 ARG A 170 -21.040 -13.661 -2.695 1.00 0.00 H new ATOM 0 HH21 ARG A 170 -22.258 -14.285 0.559 1.00 0.00 H new ATOM 0 HH22 ARG A 170 -22.431 -14.651 -1.160 1.00 0.00 H new ATOM 61 N PHE A 171 -14.257 -10.225 -0.164 1.00 0.00 N ATOM 62 CA PHE A 171 -13.188 -9.334 -0.541 1.00 0.00 C ATOM 63 C PHE A 171 -13.239 -9.062 -2.031 1.00 0.00 C ATOM 64 O PHE A 171 -13.062 -9.976 -2.842 1.00 0.00 O ATOM 65 CB PHE A 171 -11.829 -9.924 -0.156 1.00 0.00 C ATOM 66 CG PHE A 171 -11.656 -10.120 1.320 1.00 0.00 C ATOM 67 CD1 PHE A 171 -11.370 -9.045 2.137 1.00 0.00 C ATOM 68 CD2 PHE A 171 -11.786 -11.374 1.892 1.00 0.00 C ATOM 69 CE1 PHE A 171 -11.213 -9.210 3.497 1.00 0.00 C ATOM 70 CE2 PHE A 171 -11.630 -11.548 3.254 1.00 0.00 C ATOM 71 CZ PHE A 171 -11.343 -10.464 4.058 1.00 0.00 C ATOM 0 H PHE A 171 -14.238 -11.127 -0.641 1.00 0.00 H new ATOM 0 HA PHE A 171 -13.317 -8.394 -0.005 1.00 0.00 H new ATOM 0 HB2 PHE A 171 -11.703 -10.883 -0.659 1.00 0.00 H new ATOM 0 HB3 PHE A 171 -11.040 -9.267 -0.522 1.00 0.00 H new ATOM 0 HD1 PHE A 171 -11.268 -8.060 1.705 1.00 0.00 H new ATOM 0 HD2 PHE A 171 -12.012 -12.225 1.267 1.00 0.00 H new ATOM 0 HE1 PHE A 171 -10.989 -8.359 4.122 1.00 0.00 H new ATOM 0 HE2 PHE A 171 -11.733 -12.531 3.689 1.00 0.00 H new ATOM 0 HZ PHE A 171 -11.221 -10.597 5.123 1.00 0.00 H new ATOM 81 N ILE A 172 -13.475 -7.815 -2.390 1.00 0.00 N ATOM 82 CA ILE A 172 -13.543 -7.428 -3.785 1.00 0.00 C ATOM 83 C ILE A 172 -12.133 -7.241 -4.350 1.00 0.00 C ATOM 84 O ILE A 172 -11.453 -6.248 -4.084 1.00 0.00 O ATOM 85 CB ILE A 172 -14.423 -6.156 -3.987 1.00 0.00 C ATOM 86 CG1 ILE A 172 -14.409 -5.697 -5.449 1.00 0.00 C ATOM 87 CG2 ILE A 172 -13.997 -5.030 -3.054 1.00 0.00 C ATOM 88 CD1 ILE A 172 -15.441 -4.630 -5.762 1.00 0.00 C ATOM 0 H ILE A 172 -13.623 -7.050 -1.732 1.00 0.00 H new ATOM 0 HA ILE A 172 -14.027 -8.231 -4.341 1.00 0.00 H new ATOM 0 HB ILE A 172 -15.448 -6.424 -3.732 1.00 0.00 H new ATOM 0 HG12 ILE A 172 -13.418 -5.314 -5.691 1.00 0.00 H new ATOM 0 HG13 ILE A 172 -14.583 -6.559 -6.093 1.00 0.00 H new ATOM 0 HG21 ILE A 172 -14.631 -4.159 -3.221 1.00 0.00 H new ATOM 0 HG22 ILE A 172 -14.096 -5.358 -2.019 1.00 0.00 H new ATOM 0 HG23 ILE A 172 -12.958 -4.766 -3.253 1.00 0.00 H new ATOM 0 HD11 ILE A 172 -15.372 -4.355 -6.814 1.00 0.00 H new ATOM 0 HD12 ILE A 172 -16.439 -5.016 -5.553 1.00 0.00 H new ATOM 0 HD13 ILE A 172 -15.255 -3.751 -5.144 1.00 0.00 H new ATOM 100 N ARG A 173 -11.706 -8.218 -5.123 1.00 0.00 N ATOM 101 CA ARG A 173 -10.358 -8.260 -5.652 1.00 0.00 C ATOM 102 C ARG A 173 -10.373 -8.642 -7.130 1.00 0.00 C ATOM 103 O ARG A 173 -11.373 -9.164 -7.624 1.00 0.00 O ATOM 104 CB ARG A 173 -9.537 -9.267 -4.836 1.00 0.00 C ATOM 105 CG ARG A 173 -10.080 -10.685 -4.875 1.00 0.00 C ATOM 106 CD ARG A 173 -9.285 -11.601 -3.962 1.00 0.00 C ATOM 107 NE ARG A 173 -9.772 -12.979 -4.003 1.00 0.00 N ATOM 108 CZ ARG A 173 -10.802 -13.443 -3.289 1.00 0.00 C ATOM 109 NH1 ARG A 173 -11.513 -12.621 -2.524 1.00 0.00 N ATOM 110 NH2 ARG A 173 -11.136 -14.725 -3.361 1.00 0.00 N ATOM 0 H ARG A 173 -12.286 -9.009 -5.403 1.00 0.00 H new ATOM 0 HA ARG A 173 -9.902 -7.273 -5.572 1.00 0.00 H new ATOM 0 HB2 ARG A 173 -8.513 -9.271 -5.208 1.00 0.00 H new ATOM 0 HB3 ARG A 173 -9.498 -8.933 -3.799 1.00 0.00 H new ATOM 0 HG2 ARG A 173 -11.127 -10.685 -4.573 1.00 0.00 H new ATOM 0 HG3 ARG A 173 -10.043 -11.064 -5.896 1.00 0.00 H new ATOM 0 HD2 ARG A 173 -8.235 -11.580 -4.253 1.00 0.00 H new ATOM 0 HD3 ARG A 173 -9.340 -11.228 -2.939 1.00 0.00 H new ATOM 0 HE ARG A 173 -9.291 -13.633 -4.621 1.00 0.00 H new ATOM 0 HH11 ARG A 173 -11.274 -11.630 -2.480 1.00 0.00 H new ATOM 0 HH12 ARG A 173 -12.298 -12.981 -1.981 1.00 0.00 H new ATOM 0 HH21 ARG A 173 -10.607 -15.357 -3.962 1.00 0.00 H new ATOM 0 HH22 ARG A 173 -11.922 -15.079 -2.816 1.00 0.00 H new ATOM 124 N PRO A 174 -9.273 -8.367 -7.861 1.00 0.00 N ATOM 125 CA PRO A 174 -9.166 -8.686 -9.267 1.00 0.00 C ATOM 126 C PRO A 174 -8.681 -10.125 -9.466 1.00 0.00 C ATOM 127 O PRO A 174 -9.177 -11.050 -8.830 1.00 0.00 O ATOM 128 CB PRO A 174 -8.119 -7.676 -9.733 1.00 0.00 C ATOM 129 CG PRO A 174 -7.171 -7.629 -8.596 1.00 0.00 C ATOM 130 CD PRO A 174 -8.029 -7.726 -7.367 1.00 0.00 C ATOM 0 HA PRO A 174 -10.108 -8.627 -9.813 1.00 0.00 H new ATOM 0 HB2 PRO A 174 -7.630 -7.997 -10.653 1.00 0.00 H new ATOM 0 HB3 PRO A 174 -8.561 -6.699 -9.931 1.00 0.00 H new ATOM 0 HG2 PRO A 174 -6.457 -8.451 -8.644 1.00 0.00 H new ATOM 0 HG3 PRO A 174 -6.594 -6.704 -8.602 1.00 0.00 H new ATOM 0 HD2 PRO A 174 -7.551 -8.323 -6.590 1.00 0.00 H new ATOM 0 HD3 PRO A 174 -8.227 -6.744 -6.937 1.00 0.00 H new ATOM 138 N MET A 175 -7.693 -10.295 -10.315 1.00 0.00 N ATOM 139 CA MET A 175 -7.179 -11.621 -10.650 1.00 0.00 C ATOM 140 C MET A 175 -6.030 -12.007 -9.701 1.00 0.00 C ATOM 141 O MET A 175 -4.991 -12.513 -10.121 1.00 0.00 O ATOM 142 CB MET A 175 -6.717 -11.636 -12.121 1.00 0.00 C ATOM 143 CG MET A 175 -6.335 -13.015 -12.657 1.00 0.00 C ATOM 144 SD MET A 175 -5.870 -12.979 -14.403 1.00 0.00 S ATOM 145 CE MET A 175 -4.321 -12.080 -14.323 1.00 0.00 C ATOM 0 H MET A 175 -7.220 -9.529 -10.795 1.00 0.00 H new ATOM 0 HA MET A 175 -7.971 -12.359 -10.526 1.00 0.00 H new ATOM 0 HB2 MET A 175 -7.514 -11.228 -12.742 1.00 0.00 H new ATOM 0 HB3 MET A 175 -5.860 -10.971 -12.225 1.00 0.00 H new ATOM 0 HG2 MET A 175 -5.505 -13.411 -12.072 1.00 0.00 H new ATOM 0 HG3 MET A 175 -7.174 -13.698 -12.522 1.00 0.00 H new ATOM 0 HE1 MET A 175 -3.788 -12.188 -15.268 1.00 0.00 H new ATOM 0 HE2 MET A 175 -4.522 -11.025 -14.138 1.00 0.00 H new ATOM 0 HE3 MET A 175 -3.709 -12.480 -13.514 1.00 0.00 H new ATOM 155 N GLY A 176 -6.234 -11.745 -8.417 1.00 0.00 N ATOM 156 CA GLY A 176 -5.245 -12.096 -7.408 1.00 0.00 C ATOM 157 C GLY A 176 -4.100 -11.105 -7.320 1.00 0.00 C ATOM 158 O GLY A 176 -3.198 -11.280 -6.503 1.00 0.00 O ATOM 0 H GLY A 176 -7.072 -11.293 -8.051 1.00 0.00 H new ATOM 0 HA2 GLY A 176 -5.735 -12.162 -6.437 1.00 0.00 H new ATOM 0 HA3 GLY A 176 -4.844 -13.085 -7.631 1.00 0.00 H new ATOM 162 N LEU A 177 -4.162 -10.043 -8.150 1.00 0.00 N ATOM 163 CA LEU A 177 -3.105 -9.012 -8.236 1.00 0.00 C ATOM 164 C LEU A 177 -1.700 -9.643 -8.222 1.00 0.00 C ATOM 165 O LEU A 177 -1.515 -10.759 -8.725 1.00 0.00 O ATOM 166 CB LEU A 177 -3.257 -7.899 -7.152 1.00 0.00 C ATOM 167 CG LEU A 177 -3.242 -8.321 -5.675 1.00 0.00 C ATOM 168 CD1 LEU A 177 -2.657 -7.204 -4.826 1.00 0.00 C ATOM 169 CD2 LEU A 177 -4.653 -8.643 -5.191 1.00 0.00 C ATOM 0 H LEU A 177 -4.946 -9.875 -8.780 1.00 0.00 H new ATOM 0 HA LEU A 177 -3.231 -8.515 -9.198 1.00 0.00 H new ATOM 0 HB2 LEU A 177 -2.454 -7.177 -7.301 1.00 0.00 H new ATOM 0 HB3 LEU A 177 -4.195 -7.376 -7.340 1.00 0.00 H new ATOM 0 HG LEU A 177 -2.626 -9.215 -5.579 1.00 0.00 H new ATOM 0 HD11 LEU A 177 -2.649 -7.509 -3.779 1.00 0.00 H new ATOM 0 HD12 LEU A 177 -1.638 -6.995 -5.151 1.00 0.00 H new ATOM 0 HD13 LEU A 177 -3.264 -6.306 -4.938 1.00 0.00 H new ATOM 0 HD21 LEU A 177 -4.619 -8.940 -4.143 1.00 0.00 H new ATOM 0 HD22 LEU A 177 -5.285 -7.761 -5.299 1.00 0.00 H new ATOM 0 HD23 LEU A 177 -5.064 -9.459 -5.786 1.00 0.00 H new ATOM 181 N ARG A 178 -0.708 -8.930 -7.702 1.00 0.00 N ATOM 182 CA ARG A 178 0.637 -9.489 -7.640 1.00 0.00 C ATOM 183 C ARG A 178 0.724 -10.592 -6.587 1.00 0.00 C ATOM 184 O ARG A 178 1.246 -11.674 -6.852 1.00 0.00 O ATOM 185 CB ARG A 178 1.694 -8.405 -7.349 1.00 0.00 C ATOM 186 CG ARG A 178 1.489 -7.657 -6.034 1.00 0.00 C ATOM 187 CD ARG A 178 2.625 -6.685 -5.759 1.00 0.00 C ATOM 188 NE ARG A 178 3.877 -7.379 -5.439 1.00 0.00 N ATOM 189 CZ ARG A 178 4.970 -7.378 -6.211 1.00 0.00 C ATOM 190 NH1 ARG A 178 4.966 -6.761 -7.388 1.00 0.00 N ATOM 191 NH2 ARG A 178 6.063 -8.015 -5.813 1.00 0.00 N ATOM 0 H ARG A 178 -0.804 -7.987 -7.326 1.00 0.00 H new ATOM 0 HA ARG A 178 0.848 -9.916 -8.620 1.00 0.00 H new ATOM 0 HB2 ARG A 178 2.680 -8.870 -7.338 1.00 0.00 H new ATOM 0 HB3 ARG A 178 1.691 -7.684 -8.167 1.00 0.00 H new ATOM 0 HG2 ARG A 178 0.545 -7.114 -6.067 1.00 0.00 H new ATOM 0 HG3 ARG A 178 1.416 -8.373 -5.215 1.00 0.00 H new ATOM 0 HD2 ARG A 178 2.776 -6.048 -6.631 1.00 0.00 H new ATOM 0 HD3 ARG A 178 2.351 -6.032 -4.931 1.00 0.00 H new ATOM 0 HE ARG A 178 3.917 -7.901 -4.564 1.00 0.00 H new ATOM 0 HH11 ARG A 178 4.125 -6.283 -7.710 1.00 0.00 H new ATOM 0 HH12 ARG A 178 5.804 -6.766 -7.969 1.00 0.00 H new ATOM 0 HH21 ARG A 178 6.070 -8.505 -4.919 1.00 0.00 H new ATOM 0 HH22 ARG A 178 6.896 -8.014 -6.401 1.00 0.00 H new ATOM 205 N TYR A 179 0.195 -10.303 -5.406 1.00 0.00 N ATOM 206 CA TYR A 179 0.231 -11.210 -4.277 1.00 0.00 C ATOM 207 C TYR A 179 -0.506 -10.544 -3.119 1.00 0.00 C ATOM 208 O TYR A 179 -0.862 -9.369 -3.214 1.00 0.00 O ATOM 209 CB TYR A 179 1.702 -11.503 -3.890 1.00 0.00 C ATOM 210 CG TYR A 179 1.896 -12.634 -2.896 1.00 0.00 C ATOM 211 CD1 TYR A 179 1.769 -13.959 -3.291 1.00 0.00 C ATOM 212 CD2 TYR A 179 2.221 -12.374 -1.570 1.00 0.00 C ATOM 213 CE1 TYR A 179 1.959 -14.993 -2.395 1.00 0.00 C ATOM 214 CE2 TYR A 179 2.409 -13.401 -0.668 1.00 0.00 C ATOM 215 CZ TYR A 179 2.277 -14.709 -1.083 1.00 0.00 C ATOM 216 OH TYR A 179 2.468 -15.739 -0.184 1.00 0.00 O ATOM 0 H TYR A 179 -0.276 -9.420 -5.207 1.00 0.00 H new ATOM 0 HA TYR A 179 -0.248 -12.157 -4.526 1.00 0.00 H new ATOM 0 HB2 TYR A 179 2.260 -11.738 -4.797 1.00 0.00 H new ATOM 0 HB3 TYR A 179 2.139 -10.596 -3.473 1.00 0.00 H new ATOM 0 HD1 TYR A 179 1.517 -14.185 -4.317 1.00 0.00 H new ATOM 0 HD2 TYR A 179 2.328 -11.351 -1.240 1.00 0.00 H new ATOM 0 HE1 TYR A 179 1.859 -16.018 -2.720 1.00 0.00 H new ATOM 0 HE2 TYR A 179 2.659 -13.181 0.359 1.00 0.00 H new ATOM 0 HH TYR A 179 2.687 -15.368 0.696 1.00 0.00 H new ATOM 226 N LYS A 180 -0.733 -11.272 -2.042 1.00 0.00 N ATOM 227 CA LYS A 180 -1.362 -10.719 -0.843 1.00 0.00 C ATOM 228 C LYS A 180 -0.377 -9.824 -0.065 1.00 0.00 C ATOM 229 O LYS A 180 -0.374 -9.816 1.169 1.00 0.00 O ATOM 230 CB LYS A 180 -1.822 -11.873 0.045 1.00 0.00 C ATOM 231 CG LYS A 180 -3.182 -12.440 -0.331 1.00 0.00 C ATOM 232 CD LYS A 180 -4.311 -11.617 0.259 1.00 0.00 C ATOM 233 CE LYS A 180 -4.339 -11.765 1.769 1.00 0.00 C ATOM 234 NZ LYS A 180 -5.495 -11.071 2.384 1.00 0.00 N ATOM 0 H LYS A 180 -0.490 -12.260 -1.967 1.00 0.00 H new ATOM 0 HA LYS A 180 -2.213 -10.106 -1.138 1.00 0.00 H new ATOM 0 HB2 LYS A 180 -1.081 -12.671 -0.002 1.00 0.00 H new ATOM 0 HB3 LYS A 180 -1.856 -11.531 1.079 1.00 0.00 H new ATOM 0 HG2 LYS A 180 -3.279 -12.466 -1.416 1.00 0.00 H new ATOM 0 HG3 LYS A 180 -3.258 -13.469 0.021 1.00 0.00 H new ATOM 0 HD2 LYS A 180 -4.183 -10.568 -0.008 1.00 0.00 H new ATOM 0 HD3 LYS A 180 -5.263 -11.939 -0.162 1.00 0.00 H new ATOM 0 HE2 LYS A 180 -4.375 -12.823 2.027 1.00 0.00 H new ATOM 0 HE3 LYS A 180 -3.415 -11.366 2.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 180 -5.821 -11.607 3.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 180 -5.209 -10.116 2.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 180 -6.268 -11.002 1.691 1.00 0.00 H new ATOM 248 N LYS A 181 0.426 -9.056 -0.791 1.00 0.00 N ATOM 249 CA LYS A 181 1.438 -8.204 -0.192 1.00 0.00 C ATOM 250 C LYS A 181 1.741 -7.012 -1.125 1.00 0.00 C ATOM 251 O LYS A 181 1.789 -7.175 -2.347 1.00 0.00 O ATOM 252 CB LYS A 181 2.704 -9.032 0.059 1.00 0.00 C ATOM 253 CG LYS A 181 3.737 -8.348 0.923 1.00 0.00 C ATOM 254 CD LYS A 181 4.997 -9.197 1.070 1.00 0.00 C ATOM 255 CE LYS A 181 4.728 -10.486 1.831 1.00 0.00 C ATOM 256 NZ LYS A 181 5.967 -11.288 2.016 1.00 0.00 N ATOM 0 H LYS A 181 0.392 -9.008 -1.809 1.00 0.00 H new ATOM 0 HA LYS A 181 1.076 -7.809 0.758 1.00 0.00 H new ATOM 0 HB2 LYS A 181 2.420 -9.973 0.530 1.00 0.00 H new ATOM 0 HB3 LYS A 181 3.157 -9.280 -0.901 1.00 0.00 H new ATOM 0 HG2 LYS A 181 3.996 -7.383 0.487 1.00 0.00 H new ATOM 0 HG3 LYS A 181 3.315 -8.149 1.908 1.00 0.00 H new ATOM 0 HD2 LYS A 181 5.392 -9.435 0.082 1.00 0.00 H new ATOM 0 HD3 LYS A 181 5.763 -8.622 1.590 1.00 0.00 H new ATOM 0 HE2 LYS A 181 4.299 -10.250 2.805 1.00 0.00 H new ATOM 0 HE3 LYS A 181 3.989 -11.079 1.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 181 5.742 -12.159 2.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 181 6.363 -11.535 1.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 181 6.663 -10.732 2.552 1.00 0.00 H new ATOM 270 N ALA A 182 1.937 -5.826 -0.546 1.00 0.00 N ATOM 271 CA ALA A 182 2.206 -4.612 -1.337 1.00 0.00 C ATOM 272 C ALA A 182 3.295 -3.762 -0.701 1.00 0.00 C ATOM 273 O ALA A 182 3.547 -3.858 0.505 1.00 0.00 O ATOM 274 CB ALA A 182 0.936 -3.790 -1.495 1.00 0.00 C ATOM 0 H ALA A 182 1.916 -5.675 0.463 1.00 0.00 H new ATOM 0 HA ALA A 182 2.554 -4.930 -2.320 1.00 0.00 H new ATOM 0 HB1 ALA A 182 1.151 -2.897 -2.081 1.00 0.00 H new ATOM 0 HB2 ALA A 182 0.179 -4.385 -2.005 1.00 0.00 H new ATOM 0 HB3 ALA A 182 0.567 -3.498 -0.512 1.00 0.00 H new ATOM 280 N ASN A 183 3.948 -2.930 -1.514 1.00 0.00 N ATOM 281 CA ASN A 183 5.003 -2.054 -1.021 1.00 0.00 C ATOM 282 C ASN A 183 4.403 -0.760 -0.516 1.00 0.00 C ATOM 283 O ASN A 183 4.076 0.123 -1.289 1.00 0.00 O ATOM 284 CB ASN A 183 6.034 -1.764 -2.119 1.00 0.00 C ATOM 285 CG ASN A 183 6.793 -3.000 -2.561 1.00 0.00 C ATOM 286 OD1 ASN A 183 7.912 -3.270 -1.917 1.00 0.00 O flip ATOM 287 ND2 ASN A 183 6.381 -3.707 -3.482 1.00 0.00 N flip ATOM 0 H ASN A 183 3.763 -2.847 -2.514 1.00 0.00 H new ATOM 0 HA ASN A 183 5.514 -2.559 -0.201 1.00 0.00 H new ATOM 0 HB2 ASN A 183 5.527 -1.329 -2.980 1.00 0.00 H new ATOM 0 HB3 ASN A 183 6.743 -1.019 -1.757 1.00 0.00 H new ATOM 0 HD21 ASN A 183 5.511 -3.468 -3.958 1.00 0.00 H new ATOM 0 HD22 ASN A 183 6.910 -4.531 -3.768 1.00 0.00 H new ATOM 294 N VAL A 184 4.281 -0.653 0.781 1.00 0.00 N ATOM 295 CA VAL A 184 3.647 0.481 1.416 1.00 0.00 C ATOM 296 C VAL A 184 4.668 1.568 1.730 1.00 0.00 C ATOM 297 O VAL A 184 5.682 1.318 2.382 1.00 0.00 O ATOM 298 CB VAL A 184 2.943 0.056 2.727 1.00 0.00 C ATOM 299 CG1 VAL A 184 2.256 1.243 3.389 1.00 0.00 C ATOM 300 CG2 VAL A 184 1.949 -1.066 2.462 1.00 0.00 C ATOM 0 H VAL A 184 4.621 -1.356 1.437 1.00 0.00 H new ATOM 0 HA VAL A 184 2.906 0.873 0.720 1.00 0.00 H new ATOM 0 HB VAL A 184 3.703 -0.315 3.414 1.00 0.00 H new ATOM 0 HG11 VAL A 184 1.769 0.916 4.308 1.00 0.00 H new ATOM 0 HG12 VAL A 184 2.996 2.008 3.623 1.00 0.00 H new ATOM 0 HG13 VAL A 184 1.510 1.656 2.711 1.00 0.00 H new ATOM 0 HG21 VAL A 184 1.464 -1.351 3.396 1.00 0.00 H new ATOM 0 HG22 VAL A 184 1.196 -0.725 1.752 1.00 0.00 H new ATOM 0 HG23 VAL A 184 2.474 -1.927 2.048 1.00 0.00 H new ATOM 310 N THR A 185 4.399 2.761 1.265 1.00 0.00 N ATOM 311 CA THR A 185 5.270 3.879 1.509 1.00 0.00 C ATOM 312 C THR A 185 4.636 4.822 2.523 1.00 0.00 C ATOM 313 O THR A 185 3.500 5.279 2.351 1.00 0.00 O ATOM 314 CB THR A 185 5.558 4.636 0.197 1.00 0.00 C ATOM 315 OG1 THR A 185 6.154 3.732 -0.746 1.00 0.00 O ATOM 316 CG2 THR A 185 6.505 5.806 0.439 1.00 0.00 C ATOM 0 H THR A 185 3.573 2.983 0.709 1.00 0.00 H new ATOM 0 HA THR A 185 6.212 3.504 1.909 1.00 0.00 H new ATOM 0 HB THR A 185 4.618 5.027 -0.193 1.00 0.00 H new ATOM 0 HG1 THR A 185 6.338 4.207 -1.583 1.00 0.00 H new ATOM 0 HG21 THR A 185 6.692 6.323 -0.502 1.00 0.00 H new ATOM 0 HG22 THR A 185 6.054 6.498 1.150 1.00 0.00 H new ATOM 0 HG23 THR A 185 7.447 5.434 0.842 1.00 0.00 H new ATOM 324 N HIS A 186 5.360 5.079 3.592 1.00 0.00 N ATOM 325 CA HIS A 186 4.900 5.979 4.633 1.00 0.00 C ATOM 326 C HIS A 186 5.627 7.296 4.529 1.00 0.00 C ATOM 327 O HIS A 186 6.833 7.340 4.724 1.00 0.00 O ATOM 328 CB HIS A 186 5.132 5.379 6.032 1.00 0.00 C ATOM 329 CG HIS A 186 4.334 4.146 6.327 1.00 0.00 C ATOM 330 ND1 HIS A 186 3.211 4.155 7.128 1.00 0.00 N ATOM 331 CD2 HIS A 186 4.500 2.861 5.931 1.00 0.00 C ATOM 332 CE1 HIS A 186 2.721 2.937 7.210 1.00 0.00 C ATOM 333 NE2 HIS A 186 3.484 2.133 6.494 1.00 0.00 N ATOM 0 H HIS A 186 6.280 4.673 3.765 1.00 0.00 H new ATOM 0 HA HIS A 186 3.830 6.133 4.495 1.00 0.00 H new ATOM 0 HB2 HIS A 186 6.191 5.144 6.140 1.00 0.00 H new ATOM 0 HB3 HIS A 186 4.895 6.136 6.780 1.00 0.00 H new ATOM 0 HD2 HIS A 186 5.284 2.482 5.293 1.00 0.00 H new ATOM 0 HE1 HIS A 186 1.844 2.645 7.768 1.00 0.00 H new ATOM 0 HE2 HIS A 186 3.341 1.130 6.378 1.00 0.00 H new ATOM 341 N PRO A 187 4.908 8.396 4.240 1.00 0.00 N ATOM 342 CA PRO A 187 5.515 9.737 4.134 1.00 0.00 C ATOM 343 C PRO A 187 6.098 10.187 5.469 1.00 0.00 C ATOM 344 O PRO A 187 6.922 11.088 5.532 1.00 0.00 O ATOM 345 CB PRO A 187 4.338 10.635 3.726 1.00 0.00 C ATOM 346 CG PRO A 187 3.125 9.886 4.155 1.00 0.00 C ATOM 347 CD PRO A 187 3.455 8.434 3.979 1.00 0.00 C ATOM 0 HA PRO A 187 6.342 9.767 3.425 1.00 0.00 H new ATOM 0 HB2 PRO A 187 4.395 11.608 4.213 1.00 0.00 H new ATOM 0 HB3 PRO A 187 4.332 10.816 2.651 1.00 0.00 H new ATOM 0 HG2 PRO A 187 2.876 10.107 5.193 1.00 0.00 H new ATOM 0 HG3 PRO A 187 2.260 10.166 3.553 1.00 0.00 H new ATOM 0 HD2 PRO A 187 2.902 7.806 4.677 1.00 0.00 H new ATOM 0 HD3 PRO A 187 3.215 8.083 2.975 1.00 0.00 H new ATOM 355 N THR A 188 5.645 9.543 6.528 1.00 0.00 N ATOM 356 CA THR A 188 6.113 9.808 7.867 1.00 0.00 C ATOM 357 C THR A 188 7.602 9.452 7.989 1.00 0.00 C ATOM 358 O THR A 188 8.376 10.160 8.627 1.00 0.00 O ATOM 359 CB THR A 188 5.309 8.962 8.875 1.00 0.00 C ATOM 360 OG1 THR A 188 3.908 9.244 8.732 1.00 0.00 O ATOM 361 CG2 THR A 188 5.735 9.260 10.308 1.00 0.00 C ATOM 0 H THR A 188 4.934 8.814 6.478 1.00 0.00 H new ATOM 0 HA THR A 188 5.977 10.868 8.081 1.00 0.00 H new ATOM 0 HB THR A 188 5.504 7.910 8.666 1.00 0.00 H new ATOM 0 HG1 THR A 188 3.399 8.704 9.372 1.00 0.00 H new ATOM 0 HG21 THR A 188 5.151 8.649 10.996 1.00 0.00 H new ATOM 0 HG22 THR A 188 6.794 9.030 10.428 1.00 0.00 H new ATOM 0 HG23 THR A 188 5.565 10.314 10.526 1.00 0.00 H new ATOM 369 N LEU A 189 7.983 8.338 7.375 1.00 0.00 N ATOM 370 CA LEU A 189 9.357 7.844 7.457 1.00 0.00 C ATOM 371 C LEU A 189 10.065 8.059 6.139 1.00 0.00 C ATOM 372 O LEU A 189 11.291 7.995 6.060 1.00 0.00 O ATOM 373 CB LEU A 189 9.328 6.358 7.741 1.00 0.00 C ATOM 374 CG LEU A 189 8.400 5.937 8.856 1.00 0.00 C ATOM 375 CD1 LEU A 189 8.407 4.425 9.022 1.00 0.00 C ATOM 376 CD2 LEU A 189 8.758 6.625 10.165 1.00 0.00 C ATOM 0 H LEU A 189 7.360 7.757 6.813 1.00 0.00 H new ATOM 0 HA LEU A 189 9.881 8.380 8.248 1.00 0.00 H new ATOM 0 HB2 LEU A 189 9.037 5.835 6.830 1.00 0.00 H new ATOM 0 HB3 LEU A 189 10.338 6.031 7.987 1.00 0.00 H new ATOM 0 HG LEU A 189 7.392 6.248 8.583 1.00 0.00 H new ATOM 0 HD11 LEU A 189 7.732 4.145 9.830 1.00 0.00 H new ATOM 0 HD12 LEU A 189 8.078 3.956 8.095 1.00 0.00 H new ATOM 0 HD13 LEU A 189 9.417 4.090 9.260 1.00 0.00 H new ATOM 0 HD21 LEU A 189 8.071 6.300 10.947 1.00 0.00 H new ATOM 0 HD22 LEU A 189 9.778 6.363 10.447 1.00 0.00 H new ATOM 0 HD23 LEU A 189 8.682 7.705 10.041 1.00 0.00 H new ATOM 388 N ASN A 190 9.270 8.308 5.110 1.00 0.00 N ATOM 389 CA ASN A 190 9.770 8.461 3.730 1.00 0.00 C ATOM 390 C ASN A 190 10.470 7.185 3.286 1.00 0.00 C ATOM 391 O ASN A 190 11.512 7.222 2.624 1.00 0.00 O ATOM 392 CB ASN A 190 10.735 9.653 3.607 1.00 0.00 C ATOM 393 CG ASN A 190 10.074 10.986 3.864 1.00 0.00 C ATOM 394 OD1 ASN A 190 8.897 11.176 3.568 1.00 0.00 O ATOM 395 ND2 ASN A 190 10.828 11.922 4.410 1.00 0.00 N ATOM 0 H ASN A 190 8.259 8.412 5.196 1.00 0.00 H new ATOM 0 HA ASN A 190 8.913 8.653 3.085 1.00 0.00 H new ATOM 0 HB2 ASN A 190 11.556 9.521 4.311 1.00 0.00 H new ATOM 0 HB3 ASN A 190 11.170 9.658 2.608 1.00 0.00 H new ATOM 0 HD21 ASN A 190 10.437 12.845 4.601 1.00 0.00 H new ATOM 0 HD22 ASN A 190 11.801 11.723 4.641 1.00 0.00 H new ATOM 402 N VAL A 191 9.878 6.051 3.637 1.00 0.00 N ATOM 403 CA VAL A 191 10.463 4.771 3.328 1.00 0.00 C ATOM 404 C VAL A 191 9.393 3.835 2.780 1.00 0.00 C ATOM 405 O VAL A 191 8.205 3.952 3.138 1.00 0.00 O ATOM 406 CB VAL A 191 11.125 4.129 4.587 1.00 0.00 C ATOM 407 CG1 VAL A 191 10.082 3.587 5.556 1.00 0.00 C ATOM 408 CG2 VAL A 191 12.120 3.048 4.192 1.00 0.00 C ATOM 0 H VAL A 191 8.990 6.001 4.137 1.00 0.00 H new ATOM 0 HA VAL A 191 11.239 4.927 2.578 1.00 0.00 H new ATOM 0 HB VAL A 191 11.672 4.917 5.105 1.00 0.00 H new ATOM 0 HG11 VAL A 191 10.581 3.148 6.420 1.00 0.00 H new ATOM 0 HG12 VAL A 191 9.434 4.400 5.885 1.00 0.00 H new ATOM 0 HG13 VAL A 191 9.483 2.825 5.057 1.00 0.00 H new ATOM 0 HG21 VAL A 191 12.566 2.618 5.089 1.00 0.00 H new ATOM 0 HG22 VAL A 191 11.605 2.267 3.633 1.00 0.00 H new ATOM 0 HG23 VAL A 191 12.903 3.483 3.571 1.00 0.00 H new ATOM 418 N THR A 192 9.795 2.942 1.907 1.00 0.00 N ATOM 419 CA THR A 192 8.889 1.977 1.353 1.00 0.00 C ATOM 420 C THR A 192 9.155 0.611 1.975 1.00 0.00 C ATOM 421 O THR A 192 10.264 0.078 1.886 1.00 0.00 O ATOM 422 CB THR A 192 9.050 1.884 -0.179 1.00 0.00 C ATOM 423 OG1 THR A 192 8.811 3.172 -0.771 1.00 0.00 O ATOM 424 CG2 THR A 192 8.071 0.877 -0.764 1.00 0.00 C ATOM 0 H THR A 192 10.753 2.868 1.566 1.00 0.00 H new ATOM 0 HA THR A 192 7.870 2.295 1.575 1.00 0.00 H new ATOM 0 HB THR A 192 10.066 1.557 -0.397 1.00 0.00 H new ATOM 0 HG1 THR A 192 7.875 3.428 -0.631 1.00 0.00 H new ATOM 0 HG21 THR A 192 8.202 0.828 -1.845 1.00 0.00 H new ATOM 0 HG22 THR A 192 8.257 -0.106 -0.331 1.00 0.00 H new ATOM 0 HG23 THR A 192 7.051 1.186 -0.536 1.00 0.00 H new ATOM 432 N VAL A 193 8.147 0.060 2.607 1.00 0.00 N ATOM 433 CA VAL A 193 8.246 -1.239 3.239 1.00 0.00 C ATOM 434 C VAL A 193 7.128 -2.137 2.750 1.00 0.00 C ATOM 435 O VAL A 193 6.000 -1.708 2.628 1.00 0.00 O ATOM 436 CB VAL A 193 8.199 -1.121 4.784 1.00 0.00 C ATOM 437 CG1 VAL A 193 9.503 -0.542 5.314 1.00 0.00 C ATOM 438 CG2 VAL A 193 7.032 -0.236 5.217 1.00 0.00 C ATOM 0 H VAL A 193 7.231 0.499 2.699 1.00 0.00 H new ATOM 0 HA VAL A 193 9.207 -1.676 2.966 1.00 0.00 H new ATOM 0 HB VAL A 193 8.060 -2.120 5.197 1.00 0.00 H new ATOM 0 HG11 VAL A 193 9.453 -0.466 6.400 1.00 0.00 H new ATOM 0 HG12 VAL A 193 10.331 -1.193 5.034 1.00 0.00 H new ATOM 0 HG13 VAL A 193 9.661 0.449 4.888 1.00 0.00 H new ATOM 0 HG21 VAL A 193 7.014 -0.164 6.304 1.00 0.00 H new ATOM 0 HG22 VAL A 193 7.152 0.759 4.789 1.00 0.00 H new ATOM 0 HG23 VAL A 193 6.096 -0.671 4.867 1.00 0.00 H new ATOM 448 N GLN A 194 7.438 -3.377 2.488 1.00 0.00 N ATOM 449 CA GLN A 194 6.458 -4.283 1.925 1.00 0.00 C ATOM 450 C GLN A 194 5.752 -5.083 3.021 1.00 0.00 C ATOM 451 O GLN A 194 6.391 -5.821 3.771 1.00 0.00 O ATOM 452 CB GLN A 194 7.142 -5.203 0.918 1.00 0.00 C ATOM 453 CG GLN A 194 6.197 -6.047 0.100 1.00 0.00 C ATOM 454 CD GLN A 194 6.907 -6.829 -0.985 1.00 0.00 C ATOM 455 OE1 GLN A 194 6.972 -6.266 -2.176 1.00 0.00 O flip ATOM 456 NE2 GLN A 194 7.386 -7.936 -0.757 1.00 0.00 N flip ATOM 0 H GLN A 194 8.357 -3.788 2.652 1.00 0.00 H new ATOM 0 HA GLN A 194 5.691 -3.704 1.410 1.00 0.00 H new ATOM 0 HB2 GLN A 194 7.745 -4.597 0.242 1.00 0.00 H new ATOM 0 HB3 GLN A 194 7.827 -5.861 1.453 1.00 0.00 H new ATOM 0 HG2 GLN A 194 5.672 -6.740 0.758 1.00 0.00 H new ATOM 0 HG3 GLN A 194 5.442 -5.405 -0.354 1.00 0.00 H new ATOM 0 HE21 GLN A 194 7.316 -8.339 0.177 1.00 0.00 H new ATOM 0 HE22 GLN A 194 7.854 -8.452 -1.502 1.00 0.00 H new ATOM 465 N LEU A 195 4.431 -4.925 3.105 1.00 0.00 N ATOM 466 CA LEU A 195 3.626 -5.617 4.114 1.00 0.00 C ATOM 467 C LEU A 195 2.438 -6.335 3.476 1.00 0.00 C ATOM 468 O LEU A 195 1.973 -5.945 2.398 1.00 0.00 O ATOM 469 CB LEU A 195 3.101 -4.650 5.210 1.00 0.00 C ATOM 470 CG LEU A 195 4.131 -4.016 6.159 1.00 0.00 C ATOM 471 CD1 LEU A 195 5.063 -5.065 6.744 1.00 0.00 C ATOM 472 CD2 LEU A 195 4.907 -2.911 5.476 1.00 0.00 C ATOM 0 H LEU A 195 3.893 -4.321 2.484 1.00 0.00 H new ATOM 0 HA LEU A 195 4.287 -6.347 4.582 1.00 0.00 H new ATOM 0 HB2 LEU A 195 2.561 -3.843 4.714 1.00 0.00 H new ATOM 0 HB3 LEU A 195 2.376 -5.193 5.817 1.00 0.00 H new ATOM 0 HG LEU A 195 3.580 -3.566 6.985 1.00 0.00 H new ATOM 0 HD11 LEU A 195 5.779 -4.584 7.411 1.00 0.00 H new ATOM 0 HD12 LEU A 195 4.481 -5.797 7.304 1.00 0.00 H new ATOM 0 HD13 LEU A 195 5.598 -5.567 5.938 1.00 0.00 H new ATOM 0 HD21 LEU A 195 5.626 -2.485 6.176 1.00 0.00 H new ATOM 0 HD22 LEU A 195 5.436 -3.317 4.614 1.00 0.00 H new ATOM 0 HD23 LEU A 195 4.218 -2.133 5.145 1.00 0.00 H new ATOM 484 N PRO A 196 1.952 -7.417 4.125 1.00 0.00 N ATOM 485 CA PRO A 196 0.782 -8.182 3.659 1.00 0.00 C ATOM 486 C PRO A 196 -0.494 -7.336 3.609 1.00 0.00 C ATOM 487 O PRO A 196 -0.698 -6.442 4.442 1.00 0.00 O ATOM 488 CB PRO A 196 0.635 -9.286 4.716 1.00 0.00 C ATOM 489 CG PRO A 196 1.979 -9.389 5.336 1.00 0.00 C ATOM 490 CD PRO A 196 2.511 -7.994 5.362 1.00 0.00 C ATOM 0 HA PRO A 196 0.923 -8.550 2.643 1.00 0.00 H new ATOM 0 HB2 PRO A 196 -0.124 -9.029 5.455 1.00 0.00 H new ATOM 0 HB3 PRO A 196 0.333 -10.231 4.264 1.00 0.00 H new ATOM 0 HG2 PRO A 196 1.917 -9.805 6.342 1.00 0.00 H new ATOM 0 HG3 PRO A 196 2.629 -10.047 4.759 1.00 0.00 H new ATOM 0 HD2 PRO A 196 2.182 -7.451 6.248 1.00 0.00 H new ATOM 0 HD3 PRO A 196 3.601 -7.975 5.362 1.00 0.00 H new ATOM 498 N ILE A 197 -1.349 -7.632 2.643 1.00 0.00 N ATOM 499 CA ILE A 197 -2.610 -6.925 2.489 1.00 0.00 C ATOM 500 C ILE A 197 -3.719 -7.690 3.208 1.00 0.00 C ATOM 501 O ILE A 197 -4.020 -8.830 2.860 1.00 0.00 O ATOM 502 CB ILE A 197 -2.996 -6.792 1.001 1.00 0.00 C ATOM 503 CG1 ILE A 197 -1.896 -6.072 0.220 1.00 0.00 C ATOM 504 CG2 ILE A 197 -4.314 -6.044 0.866 1.00 0.00 C ATOM 505 CD1 ILE A 197 -2.119 -6.077 -1.278 1.00 0.00 C ATOM 0 H ILE A 197 -1.191 -8.363 1.949 1.00 0.00 H new ATOM 0 HA ILE A 197 -2.490 -5.930 2.917 1.00 0.00 H new ATOM 0 HB ILE A 197 -3.114 -7.792 0.584 1.00 0.00 H new ATOM 0 HG12 ILE A 197 -1.830 -5.041 0.566 1.00 0.00 H new ATOM 0 HG13 ILE A 197 -0.938 -6.543 0.439 1.00 0.00 H new ATOM 0 HG21 ILE A 197 -4.576 -5.956 -0.188 1.00 0.00 H new ATOM 0 HG22 ILE A 197 -5.098 -6.590 1.391 1.00 0.00 H new ATOM 0 HG23 ILE A 197 -4.214 -5.049 1.299 1.00 0.00 H new ATOM 0 HD11 ILE A 197 -1.301 -5.549 -1.769 1.00 0.00 H new ATOM 0 HD12 ILE A 197 -2.155 -7.106 -1.637 1.00 0.00 H new ATOM 0 HD13 ILE A 197 -3.061 -5.580 -1.507 1.00 0.00 H new ATOM 517 N LEU A 198 -4.324 -7.058 4.190 1.00 0.00 N ATOM 518 CA LEU A 198 -5.368 -7.691 4.992 1.00 0.00 C ATOM 519 C LEU A 198 -6.714 -7.672 4.284 1.00 0.00 C ATOM 520 O LEU A 198 -7.405 -8.689 4.214 1.00 0.00 O ATOM 521 CB LEU A 198 -5.486 -7.005 6.358 1.00 0.00 C ATOM 522 CG LEU A 198 -4.595 -7.565 7.480 1.00 0.00 C ATOM 523 CD1 LEU A 198 -5.016 -8.979 7.845 1.00 0.00 C ATOM 524 CD2 LEU A 198 -3.129 -7.536 7.076 1.00 0.00 C ATOM 0 H LEU A 198 -4.114 -6.097 4.460 1.00 0.00 H new ATOM 0 HA LEU A 198 -5.080 -8.732 5.136 1.00 0.00 H new ATOM 0 HB2 LEU A 198 -5.253 -5.948 6.231 1.00 0.00 H new ATOM 0 HB3 LEU A 198 -6.525 -7.066 6.683 1.00 0.00 H new ATOM 0 HG LEU A 198 -4.720 -6.929 8.357 1.00 0.00 H new ATOM 0 HD11 LEU A 198 -4.373 -9.356 8.640 1.00 0.00 H new ATOM 0 HD12 LEU A 198 -6.051 -8.974 8.187 1.00 0.00 H new ATOM 0 HD13 LEU A 198 -4.926 -9.623 6.970 1.00 0.00 H new ATOM 0 HD21 LEU A 198 -2.520 -7.937 7.886 1.00 0.00 H new ATOM 0 HD22 LEU A 198 -2.986 -8.141 6.181 1.00 0.00 H new ATOM 0 HD23 LEU A 198 -2.828 -6.509 6.871 1.00 0.00 H new ATOM 536 N SER A 199 -7.072 -6.526 3.743 1.00 0.00 N ATOM 537 CA SER A 199 -8.354 -6.367 3.082 1.00 0.00 C ATOM 538 C SER A 199 -8.199 -5.514 1.839 1.00 0.00 C ATOM 539 O SER A 199 -7.320 -4.654 1.782 1.00 0.00 O ATOM 540 CB SER A 199 -9.355 -5.706 4.036 1.00 0.00 C ATOM 541 OG SER A 199 -9.474 -6.438 5.245 1.00 0.00 O ATOM 0 H SER A 199 -6.492 -5.687 3.747 1.00 0.00 H new ATOM 0 HA SER A 199 -8.724 -7.351 2.795 1.00 0.00 H new ATOM 0 HB2 SER A 199 -9.034 -4.688 4.255 1.00 0.00 H new ATOM 0 HB3 SER A 199 -10.330 -5.636 3.553 1.00 0.00 H new ATOM 0 HG SER A 199 -8.845 -6.082 5.906 1.00 0.00 H new ATOM 547 N VAL A 200 -9.039 -5.754 0.847 1.00 0.00 N ATOM 548 CA VAL A 200 -9.001 -4.983 -0.383 1.00 0.00 C ATOM 549 C VAL A 200 -10.384 -4.441 -0.716 1.00 0.00 C ATOM 550 O VAL A 200 -11.395 -5.098 -0.456 1.00 0.00 O ATOM 551 CB VAL A 200 -8.477 -5.829 -1.576 1.00 0.00 C ATOM 552 CG1 VAL A 200 -7.024 -6.218 -1.371 1.00 0.00 C ATOM 553 CG2 VAL A 200 -9.326 -7.075 -1.764 1.00 0.00 C ATOM 0 H VAL A 200 -9.757 -6.478 0.870 1.00 0.00 H new ATOM 0 HA VAL A 200 -8.312 -4.154 -0.222 1.00 0.00 H new ATOM 0 HB VAL A 200 -8.547 -5.216 -2.474 1.00 0.00 H new ATOM 0 HG11 VAL A 200 -6.682 -6.809 -2.220 1.00 0.00 H new ATOM 0 HG12 VAL A 200 -6.415 -5.318 -1.287 1.00 0.00 H new ATOM 0 HG13 VAL A 200 -6.930 -6.806 -0.458 1.00 0.00 H new ATOM 0 HG21 VAL A 200 -8.942 -7.653 -2.604 1.00 0.00 H new ATOM 0 HG22 VAL A 200 -9.288 -7.681 -0.859 1.00 0.00 H new ATOM 0 HG23 VAL A 200 -10.358 -6.786 -1.964 1.00 0.00 H new ATOM 563 N LYS A 201 -10.426 -3.238 -1.271 1.00 0.00 N ATOM 564 CA LYS A 201 -11.678 -2.607 -1.660 1.00 0.00 C ATOM 565 C LYS A 201 -11.537 -1.869 -2.988 1.00 0.00 C ATOM 566 O LYS A 201 -10.972 -0.765 -3.035 1.00 0.00 O ATOM 567 CB LYS A 201 -12.146 -1.613 -0.579 1.00 0.00 C ATOM 568 CG LYS A 201 -12.524 -2.236 0.760 1.00 0.00 C ATOM 569 CD LYS A 201 -13.807 -3.045 0.652 1.00 0.00 C ATOM 570 CE LYS A 201 -14.235 -3.594 2.004 1.00 0.00 C ATOM 571 NZ LYS A 201 -15.512 -4.345 1.918 1.00 0.00 N ATOM 0 H LYS A 201 -9.598 -2.675 -1.463 1.00 0.00 H new ATOM 0 HA LYS A 201 -12.418 -3.399 -1.772 1.00 0.00 H new ATOM 0 HB2 LYS A 201 -11.353 -0.885 -0.411 1.00 0.00 H new ATOM 0 HB3 LYS A 201 -13.007 -1.064 -0.962 1.00 0.00 H new ATOM 0 HG2 LYS A 201 -11.714 -2.879 1.106 1.00 0.00 H new ATOM 0 HG3 LYS A 201 -12.648 -1.451 1.506 1.00 0.00 H new ATOM 0 HD2 LYS A 201 -14.600 -2.418 0.245 1.00 0.00 H new ATOM 0 HD3 LYS A 201 -13.661 -3.869 -0.047 1.00 0.00 H new ATOM 0 HE2 LYS A 201 -13.455 -4.248 2.394 1.00 0.00 H new ATOM 0 HE3 LYS A 201 -14.344 -2.772 2.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 201 -15.769 -4.703 2.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 201 -16.263 -3.715 1.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 201 -15.401 -5.145 1.263 1.00 0.00 H new ATOM 585 N LYS A 202 -12.038 -2.470 -4.066 1.00 0.00 N ATOM 586 CA LYS A 202 -12.049 -1.798 -5.354 1.00 0.00 C ATOM 587 C LYS A 202 -13.069 -0.679 -5.311 1.00 0.00 C ATOM 588 O LYS A 202 -14.099 -0.800 -4.644 1.00 0.00 O ATOM 589 CB LYS A 202 -12.380 -2.759 -6.507 1.00 0.00 C ATOM 590 CG LYS A 202 -11.305 -3.800 -6.797 1.00 0.00 C ATOM 591 CD LYS A 202 -11.729 -4.737 -7.932 1.00 0.00 C ATOM 592 CE LYS A 202 -11.840 -3.996 -9.268 1.00 0.00 C ATOM 593 NZ LYS A 202 -12.248 -4.896 -10.384 1.00 0.00 N ATOM 0 H LYS A 202 -12.436 -3.409 -4.070 1.00 0.00 H new ATOM 0 HA LYS A 202 -11.051 -1.403 -5.541 1.00 0.00 H new ATOM 0 HB2 LYS A 202 -13.312 -3.274 -6.276 1.00 0.00 H new ATOM 0 HB3 LYS A 202 -12.554 -2.175 -7.411 1.00 0.00 H new ATOM 0 HG2 LYS A 202 -10.374 -3.300 -7.064 1.00 0.00 H new ATOM 0 HG3 LYS A 202 -11.107 -4.382 -5.897 1.00 0.00 H new ATOM 0 HD2 LYS A 202 -11.006 -5.547 -8.024 1.00 0.00 H new ATOM 0 HD3 LYS A 202 -12.689 -5.193 -7.688 1.00 0.00 H new ATOM 0 HE2 LYS A 202 -12.565 -3.188 -9.173 1.00 0.00 H new ATOM 0 HE3 LYS A 202 -10.881 -3.537 -9.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 202 -11.543 -4.845 -11.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 202 -12.311 -5.874 -10.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 202 -13.175 -4.598 -10.749 1.00 0.00 H new ATOM 607 N ASN A 203 -12.792 0.402 -6.001 1.00 0.00 N ATOM 608 CA ASN A 203 -13.684 1.547 -5.979 1.00 0.00 C ATOM 609 C ASN A 203 -14.781 1.401 -7.008 1.00 0.00 C ATOM 610 O ASN A 203 -14.508 1.358 -8.204 1.00 0.00 O ATOM 611 CB ASN A 203 -12.919 2.833 -6.280 1.00 0.00 C ATOM 612 CG ASN A 203 -11.810 3.123 -5.303 1.00 0.00 C ATOM 613 OD1 ASN A 203 -11.879 2.765 -4.130 1.00 0.00 O ATOM 614 ND2 ASN A 203 -10.781 3.780 -5.781 1.00 0.00 N ATOM 0 H ASN A 203 -11.962 0.517 -6.583 1.00 0.00 H new ATOM 0 HA ASN A 203 -14.119 1.595 -4.981 1.00 0.00 H new ATOM 0 HB2 ASN A 203 -12.499 2.768 -7.284 1.00 0.00 H new ATOM 0 HB3 ASN A 203 -13.618 3.669 -6.280 1.00 0.00 H new ATOM 0 HD21 ASN A 203 -9.997 4.013 -5.172 1.00 0.00 H new ATOM 0 HD22 ASN A 203 -10.765 4.058 -6.762 1.00 0.00 H new ATOM 621 N PRO A 204 -16.044 1.329 -6.566 1.00 0.00 N ATOM 622 CA PRO A 204 -17.182 1.290 -7.478 1.00 0.00 C ATOM 623 C PRO A 204 -17.391 2.658 -8.121 1.00 0.00 C ATOM 624 O PRO A 204 -18.009 2.785 -9.180 1.00 0.00 O ATOM 625 CB PRO A 204 -18.356 0.932 -6.563 1.00 0.00 C ATOM 626 CG PRO A 204 -17.955 1.443 -5.222 1.00 0.00 C ATOM 627 CD PRO A 204 -16.464 1.273 -5.147 1.00 0.00 C ATOM 0 HA PRO A 204 -17.055 0.584 -8.299 1.00 0.00 H new ATOM 0 HB2 PRO A 204 -19.281 1.397 -6.904 1.00 0.00 H new ATOM 0 HB3 PRO A 204 -18.529 -0.144 -6.542 1.00 0.00 H new ATOM 0 HG2 PRO A 204 -18.236 2.489 -5.103 1.00 0.00 H new ATOM 0 HG3 PRO A 204 -18.452 0.887 -4.427 1.00 0.00 H new ATOM 0 HD2 PRO A 204 -15.998 2.063 -4.558 1.00 0.00 H new ATOM 0 HD3 PRO A 204 -16.190 0.325 -4.683 1.00 0.00 H new ATOM 635 N SER A 205 -16.879 3.682 -7.444 1.00 0.00 N ATOM 636 CA SER A 205 -16.958 5.050 -7.905 1.00 0.00 C ATOM 637 C SER A 205 -16.127 5.250 -9.171 1.00 0.00 C ATOM 638 O SER A 205 -16.546 5.944 -10.097 1.00 0.00 O ATOM 639 CB SER A 205 -16.462 5.984 -6.812 1.00 0.00 C ATOM 640 OG SER A 205 -17.257 5.863 -5.638 1.00 0.00 O ATOM 0 H SER A 205 -16.395 3.576 -6.553 1.00 0.00 H new ATOM 0 HA SER A 205 -17.998 5.276 -8.140 1.00 0.00 H new ATOM 0 HB2 SER A 205 -15.423 5.755 -6.577 1.00 0.00 H new ATOM 0 HB3 SER A 205 -16.488 7.014 -7.169 1.00 0.00 H new ATOM 0 HG SER A 205 -16.918 6.472 -4.949 1.00 0.00 H new ATOM 646 N ASN A 206 -14.953 4.628 -9.205 1.00 0.00 N ATOM 647 CA ASN A 206 -14.050 4.774 -10.333 1.00 0.00 C ATOM 648 C ASN A 206 -14.617 4.098 -11.565 1.00 0.00 C ATOM 649 O ASN A 206 -15.013 2.933 -11.524 1.00 0.00 O ATOM 650 CB ASN A 206 -12.650 4.218 -10.009 1.00 0.00 C ATOM 651 CG ASN A 206 -11.939 4.992 -8.902 1.00 0.00 C ATOM 652 OD1 ASN A 206 -12.569 5.519 -7.982 1.00 0.00 O ATOM 653 ND2 ASN A 206 -10.624 5.063 -8.983 1.00 0.00 N ATOM 0 H ASN A 206 -14.608 4.019 -8.463 1.00 0.00 H new ATOM 0 HA ASN A 206 -13.947 5.840 -10.537 1.00 0.00 H new ATOM 0 HB2 ASN A 206 -12.740 3.173 -9.713 1.00 0.00 H new ATOM 0 HB3 ASN A 206 -12.039 4.242 -10.911 1.00 0.00 H new ATOM 0 HD21 ASN A 206 -10.096 5.566 -8.270 1.00 0.00 H new ATOM 0 HD22 ASN A 206 -10.136 4.615 -9.758 1.00 0.00 H new ATOM 660 N PRO A 207 -14.680 4.833 -12.673 1.00 0.00 N ATOM 661 CA PRO A 207 -15.222 4.330 -13.927 1.00 0.00 C ATOM 662 C PRO A 207 -14.272 3.378 -14.654 1.00 0.00 C ATOM 663 O PRO A 207 -13.527 3.787 -15.551 1.00 0.00 O ATOM 664 CB PRO A 207 -15.448 5.599 -14.749 1.00 0.00 C ATOM 665 CG PRO A 207 -14.418 6.551 -14.247 1.00 0.00 C ATOM 666 CD PRO A 207 -14.243 6.239 -12.785 1.00 0.00 C ATOM 0 HA PRO A 207 -16.124 3.740 -13.765 1.00 0.00 H new ATOM 0 HB2 PRO A 207 -15.328 5.409 -15.816 1.00 0.00 H new ATOM 0 HB3 PRO A 207 -16.455 5.991 -14.607 1.00 0.00 H new ATOM 0 HG2 PRO A 207 -13.479 6.430 -14.787 1.00 0.00 H new ATOM 0 HG3 PRO A 207 -14.738 7.583 -14.390 1.00 0.00 H new ATOM 0 HD2 PRO A 207 -13.207 6.363 -12.470 1.00 0.00 H new ATOM 0 HD3 PRO A 207 -14.847 6.897 -12.160 1.00 0.00 H new ATOM 674 N LEU A 208 -14.257 2.127 -14.227 1.00 0.00 N ATOM 675 CA LEU A 208 -13.485 1.109 -14.911 1.00 0.00 C ATOM 676 C LEU A 208 -14.120 0.788 -16.238 1.00 0.00 C ATOM 677 O LEU A 208 -15.351 0.777 -16.362 1.00 0.00 O ATOM 678 CB LEU A 208 -13.357 -0.161 -14.068 1.00 0.00 C ATOM 679 CG LEU A 208 -12.393 -0.080 -12.892 1.00 0.00 C ATOM 680 CD1 LEU A 208 -12.574 -1.272 -11.969 1.00 0.00 C ATOM 681 CD2 LEU A 208 -10.968 -0.029 -13.398 1.00 0.00 C ATOM 0 H LEU A 208 -14.770 1.794 -13.411 1.00 0.00 H new ATOM 0 HA LEU A 208 -12.482 1.502 -15.074 1.00 0.00 H new ATOM 0 HB2 LEU A 208 -14.344 -0.423 -13.687 1.00 0.00 H new ATOM 0 HB3 LEU A 208 -13.040 -0.976 -14.718 1.00 0.00 H new ATOM 0 HG LEU A 208 -12.607 0.828 -12.329 1.00 0.00 H new ATOM 0 HD11 LEU A 208 -11.876 -1.196 -11.135 1.00 0.00 H new ATOM 0 HD12 LEU A 208 -13.595 -1.285 -11.588 1.00 0.00 H new ATOM 0 HD13 LEU A 208 -12.381 -2.192 -12.521 1.00 0.00 H new ATOM 0 HD21 LEU A 208 -10.283 0.029 -12.552 1.00 0.00 H new ATOM 0 HD22 LEU A 208 -10.755 -0.928 -13.976 1.00 0.00 H new ATOM 0 HD23 LEU A 208 -10.838 0.849 -14.031 1.00 0.00 H new ATOM 693 N TYR A 209 -13.292 0.542 -17.227 1.00 0.00 N ATOM 694 CA TYR A 209 -13.779 0.227 -18.566 1.00 0.00 C ATOM 695 C TYR A 209 -14.625 -1.036 -18.517 1.00 0.00 C ATOM 696 O TYR A 209 -15.714 -1.099 -19.082 1.00 0.00 O ATOM 697 CB TYR A 209 -12.616 0.067 -19.549 1.00 0.00 C ATOM 698 CG TYR A 209 -13.056 -0.204 -20.969 1.00 0.00 C ATOM 699 CD1 TYR A 209 -13.589 0.813 -21.746 1.00 0.00 C ATOM 700 CD2 TYR A 209 -12.933 -1.467 -21.538 1.00 0.00 C ATOM 701 CE1 TYR A 209 -13.988 0.586 -23.044 1.00 0.00 C ATOM 702 CE2 TYR A 209 -13.333 -1.702 -22.840 1.00 0.00 C ATOM 703 CZ TYR A 209 -13.860 -0.669 -23.587 1.00 0.00 C ATOM 704 OH TYR A 209 -14.254 -0.891 -24.886 1.00 0.00 O ATOM 0 H TYR A 209 -12.276 0.552 -17.138 1.00 0.00 H new ATOM 0 HA TYR A 209 -14.396 1.053 -18.920 1.00 0.00 H new ATOM 0 HB2 TYR A 209 -12.010 0.973 -19.532 1.00 0.00 H new ATOM 0 HB3 TYR A 209 -11.977 -0.750 -19.213 1.00 0.00 H new ATOM 0 HD1 TYR A 209 -13.693 1.802 -21.325 1.00 0.00 H new ATOM 0 HD2 TYR A 209 -12.519 -2.276 -20.954 1.00 0.00 H new ATOM 0 HE1 TYR A 209 -14.400 1.392 -23.633 1.00 0.00 H new ATOM 0 HE2 TYR A 209 -13.234 -2.688 -23.270 1.00 0.00 H new ATOM 0 HH TYR A 209 -14.097 -1.830 -25.120 1.00 0.00 H new ATOM 714 N THR A 210 -14.112 -2.030 -17.839 1.00 0.00 N ATOM 715 CA THR A 210 -14.813 -3.266 -17.642 1.00 0.00 C ATOM 716 C THR A 210 -15.174 -3.375 -16.164 1.00 0.00 C ATOM 717 O THR A 210 -14.332 -3.128 -15.300 1.00 0.00 O ATOM 718 CB THR A 210 -13.931 -4.464 -18.044 1.00 0.00 C ATOM 719 OG1 THR A 210 -13.497 -4.300 -19.398 1.00 0.00 O ATOM 720 CG2 THR A 210 -14.698 -5.774 -17.922 1.00 0.00 C ATOM 0 H THR A 210 -13.189 -2.001 -17.406 1.00 0.00 H new ATOM 0 HA THR A 210 -15.709 -3.280 -18.262 1.00 0.00 H new ATOM 0 HB THR A 210 -13.073 -4.499 -17.372 1.00 0.00 H new ATOM 0 HG1 THR A 210 -12.934 -5.060 -19.656 1.00 0.00 H new ATOM 0 HG21 THR A 210 -14.052 -6.602 -18.212 1.00 0.00 H new ATOM 0 HG22 THR A 210 -15.023 -5.911 -16.891 1.00 0.00 H new ATOM 0 HG23 THR A 210 -15.569 -5.748 -18.576 1.00 0.00 H new ATOM 728 N GLN A 211 -16.418 -3.720 -15.875 1.00 0.00 N ATOM 729 CA GLN A 211 -16.882 -3.817 -14.490 1.00 0.00 C ATOM 730 C GLN A 211 -16.062 -4.855 -13.724 1.00 0.00 C ATOM 731 O GLN A 211 -15.692 -4.648 -12.572 1.00 0.00 O ATOM 732 CB GLN A 211 -18.368 -4.178 -14.451 1.00 0.00 C ATOM 733 CG GLN A 211 -18.962 -4.183 -13.053 1.00 0.00 C ATOM 734 CD GLN A 211 -20.440 -4.503 -13.049 1.00 0.00 C ATOM 735 OE1 GLN A 211 -21.159 -4.202 -14.007 1.00 0.00 O ATOM 736 NE2 GLN A 211 -20.905 -5.105 -11.978 1.00 0.00 N ATOM 0 H GLN A 211 -17.127 -3.938 -16.575 1.00 0.00 H new ATOM 0 HA GLN A 211 -16.747 -2.847 -14.011 1.00 0.00 H new ATOM 0 HB2 GLN A 211 -18.921 -3.469 -15.068 1.00 0.00 H new ATOM 0 HB3 GLN A 211 -18.505 -5.163 -14.897 1.00 0.00 H new ATOM 0 HG2 GLN A 211 -18.434 -4.914 -12.441 1.00 0.00 H new ATOM 0 HG3 GLN A 211 -18.804 -3.208 -12.592 1.00 0.00 H new ATOM 0 HE21 GLN A 211 -20.276 -5.336 -11.209 1.00 0.00 H new ATOM 0 HE22 GLN A 211 -21.895 -5.342 -11.915 1.00 0.00 H new ATOM 745 N LEU A 212 -15.767 -5.953 -14.385 1.00 0.00 N ATOM 746 CA LEU A 212 -14.957 -7.010 -13.803 1.00 0.00 C ATOM 747 C LEU A 212 -13.508 -6.855 -14.254 1.00 0.00 C ATOM 748 O LEU A 212 -12.717 -7.794 -14.182 1.00 0.00 O ATOM 749 CB LEU A 212 -15.490 -8.380 -14.228 1.00 0.00 C ATOM 750 CG LEU A 212 -16.942 -8.678 -13.850 1.00 0.00 C ATOM 751 CD1 LEU A 212 -17.349 -10.045 -14.366 1.00 0.00 C ATOM 752 CD2 LEU A 212 -17.140 -8.595 -12.344 1.00 0.00 C ATOM 0 H LEU A 212 -16.079 -6.141 -15.338 1.00 0.00 H new ATOM 0 HA LEU A 212 -15.006 -6.936 -12.717 1.00 0.00 H new ATOM 0 HB2 LEU A 212 -15.391 -8.467 -15.310 1.00 0.00 H new ATOM 0 HB3 LEU A 212 -14.855 -9.148 -13.787 1.00 0.00 H new ATOM 0 HG LEU A 212 -17.578 -7.925 -14.315 1.00 0.00 H new ATOM 0 HD11 LEU A 212 -18.384 -10.245 -14.090 1.00 0.00 H new ATOM 0 HD12 LEU A 212 -17.252 -10.068 -15.451 1.00 0.00 H new ATOM 0 HD13 LEU A 212 -16.704 -10.806 -13.928 1.00 0.00 H new ATOM 0 HD21 LEU A 212 -18.180 -8.811 -12.101 1.00 0.00 H new ATOM 0 HD22 LEU A 212 -16.494 -9.322 -11.852 1.00 0.00 H new ATOM 0 HD23 LEU A 212 -16.887 -7.593 -11.999 1.00 0.00 H new ATOM 764 N GLY A 213 -13.168 -5.648 -14.693 1.00 0.00 N ATOM 765 CA GLY A 213 -11.851 -5.374 -15.231 1.00 0.00 C ATOM 766 C GLY A 213 -10.752 -5.418 -14.194 1.00 0.00 C ATOM 767 O GLY A 213 -11.018 -5.503 -12.982 1.00 0.00 O ATOM 0 H GLY A 213 -13.794 -4.843 -14.684 1.00 0.00 H new ATOM 0 HA2 GLY A 213 -11.629 -6.099 -16.014 1.00 0.00 H new ATOM 0 HA3 GLY A 213 -11.857 -4.390 -15.700 1.00 0.00 H new ATOM 771 N VAL A 214 -9.515 -5.345 -14.671 1.00 0.00 N ATOM 772 CA VAL A 214 -8.343 -5.434 -13.819 1.00 0.00 C ATOM 773 C VAL A 214 -8.260 -4.277 -12.831 1.00 0.00 C ATOM 774 O VAL A 214 -8.975 -3.272 -12.953 1.00 0.00 O ATOM 775 CB VAL A 214 -7.031 -5.513 -14.642 1.00 0.00 C ATOM 776 CG1 VAL A 214 -7.037 -6.738 -15.541 1.00 0.00 C ATOM 777 CG2 VAL A 214 -6.819 -4.248 -15.463 1.00 0.00 C ATOM 0 H VAL A 214 -9.300 -5.222 -15.660 1.00 0.00 H new ATOM 0 HA VAL A 214 -8.455 -6.360 -13.255 1.00 0.00 H new ATOM 0 HB VAL A 214 -6.201 -5.601 -13.941 1.00 0.00 H new ATOM 0 HG11 VAL A 214 -6.108 -6.776 -16.110 1.00 0.00 H new ATOM 0 HG12 VAL A 214 -7.126 -7.637 -14.931 1.00 0.00 H new ATOM 0 HG13 VAL A 214 -7.882 -6.681 -16.228 1.00 0.00 H new ATOM 0 HG21 VAL A 214 -5.891 -4.333 -16.029 1.00 0.00 H new ATOM 0 HG22 VAL A 214 -7.654 -4.117 -16.152 1.00 0.00 H new ATOM 0 HG23 VAL A 214 -6.760 -3.387 -14.797 1.00 0.00 H new ATOM 787 N LEU A 215 -7.383 -4.425 -11.865 1.00 0.00 N ATOM 788 CA LEU A 215 -7.227 -3.461 -10.799 1.00 0.00 C ATOM 789 C LEU A 215 -6.490 -2.207 -11.274 1.00 0.00 C ATOM 790 O LEU A 215 -5.426 -2.296 -11.896 1.00 0.00 O ATOM 791 CB LEU A 215 -6.459 -4.109 -9.649 1.00 0.00 C ATOM 792 CG LEU A 215 -6.295 -3.268 -8.391 1.00 0.00 C ATOM 793 CD1 LEU A 215 -7.650 -2.984 -7.774 1.00 0.00 C ATOM 794 CD2 LEU A 215 -5.387 -3.971 -7.393 1.00 0.00 C ATOM 0 H LEU A 215 -6.753 -5.224 -11.796 1.00 0.00 H new ATOM 0 HA LEU A 215 -8.218 -3.154 -10.466 1.00 0.00 H new ATOM 0 HB2 LEU A 215 -6.966 -5.035 -9.378 1.00 0.00 H new ATOM 0 HB3 LEU A 215 -5.467 -4.382 -10.010 1.00 0.00 H new ATOM 0 HG LEU A 215 -5.831 -2.320 -8.662 1.00 0.00 H new ATOM 0 HD11 LEU A 215 -7.521 -2.382 -6.875 1.00 0.00 H new ATOM 0 HD12 LEU A 215 -8.269 -2.441 -8.489 1.00 0.00 H new ATOM 0 HD13 LEU A 215 -8.136 -3.925 -7.514 1.00 0.00 H new ATOM 0 HD21 LEU A 215 -5.282 -3.355 -6.500 1.00 0.00 H new ATOM 0 HD22 LEU A 215 -5.821 -4.933 -7.121 1.00 0.00 H new ATOM 0 HD23 LEU A 215 -4.407 -4.130 -7.842 1.00 0.00 H new ATOM 806 N THR A 216 -7.073 -1.050 -11.007 1.00 0.00 N ATOM 807 CA THR A 216 -6.428 0.208 -11.306 1.00 0.00 C ATOM 808 C THR A 216 -5.973 0.898 -10.024 1.00 0.00 C ATOM 809 O THR A 216 -6.420 0.549 -8.920 1.00 0.00 O ATOM 810 CB THR A 216 -7.349 1.146 -12.108 1.00 0.00 C ATOM 811 OG1 THR A 216 -8.608 1.291 -11.436 1.00 0.00 O ATOM 812 CG2 THR A 216 -7.567 0.615 -13.517 1.00 0.00 C ATOM 0 H THR A 216 -7.996 -0.961 -10.582 1.00 0.00 H new ATOM 0 HA THR A 216 -5.556 -0.015 -11.921 1.00 0.00 H new ATOM 0 HB THR A 216 -6.868 2.121 -12.180 1.00 0.00 H new ATOM 0 HG1 THR A 216 -9.187 1.890 -11.952 1.00 0.00 H new ATOM 0 HG21 THR A 216 -8.221 1.294 -14.065 1.00 0.00 H new ATOM 0 HG22 THR A 216 -6.608 0.541 -14.030 1.00 0.00 H new ATOM 0 HG23 THR A 216 -8.028 -0.371 -13.467 1.00 0.00 H new ATOM 820 N LYS A 217 -5.068 1.853 -10.164 1.00 0.00 N ATOM 821 CA LYS A 217 -4.564 2.597 -9.024 1.00 0.00 C ATOM 822 C LYS A 217 -5.650 3.466 -8.396 1.00 0.00 C ATOM 823 O LYS A 217 -6.581 3.913 -9.073 1.00 0.00 O ATOM 824 CB LYS A 217 -3.337 3.436 -9.399 1.00 0.00 C ATOM 825 CG LYS A 217 -3.478 4.229 -10.687 1.00 0.00 C ATOM 826 CD LYS A 217 -2.315 5.199 -10.871 1.00 0.00 C ATOM 827 CE LYS A 217 -0.957 4.503 -10.772 1.00 0.00 C ATOM 828 NZ LYS A 217 -0.748 3.496 -11.843 1.00 0.00 N ATOM 0 H LYS A 217 -4.667 2.131 -11.060 1.00 0.00 H new ATOM 0 HA LYS A 217 -4.252 1.867 -8.277 1.00 0.00 H new ATOM 0 HB2 LYS A 217 -3.124 4.128 -8.584 1.00 0.00 H new ATOM 0 HB3 LYS A 217 -2.475 2.774 -9.488 1.00 0.00 H new ATOM 0 HG2 LYS A 217 -3.522 3.545 -11.535 1.00 0.00 H new ATOM 0 HG3 LYS A 217 -4.417 4.782 -10.675 1.00 0.00 H new ATOM 0 HD2 LYS A 217 -2.401 5.686 -11.842 1.00 0.00 H new ATOM 0 HD3 LYS A 217 -2.375 5.982 -10.115 1.00 0.00 H new ATOM 0 HE2 LYS A 217 -0.166 5.251 -10.823 1.00 0.00 H new ATOM 0 HE3 LYS A 217 -0.873 4.016 -9.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 217 0.165 3.020 -11.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 217 -1.514 2.793 -11.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 217 -0.749 3.969 -12.769 1.00 0.00 H new ATOM 842 N GLY A 218 -5.513 3.704 -7.107 1.00 0.00 N ATOM 843 CA GLY A 218 -6.497 4.457 -6.369 1.00 0.00 C ATOM 844 C GLY A 218 -7.340 3.553 -5.502 1.00 0.00 C ATOM 845 O GLY A 218 -8.267 4.004 -4.835 1.00 0.00 O ATOM 0 H GLY A 218 -4.722 3.382 -6.549 1.00 0.00 H new ATOM 0 HA2 GLY A 218 -5.998 5.200 -5.747 1.00 0.00 H new ATOM 0 HA3 GLY A 218 -7.138 5.001 -7.063 1.00 0.00 H new ATOM 849 N THR A 219 -6.993 2.280 -5.491 1.00 0.00 N ATOM 850 CA THR A 219 -7.735 1.278 -4.730 1.00 0.00 C ATOM 851 C THR A 219 -7.346 1.305 -3.249 1.00 0.00 C ATOM 852 O THR A 219 -6.176 1.372 -2.918 1.00 0.00 O ATOM 853 CB THR A 219 -7.508 -0.125 -5.323 1.00 0.00 C ATOM 854 OG1 THR A 219 -8.010 -0.152 -6.668 1.00 0.00 O ATOM 855 CG2 THR A 219 -8.203 -1.199 -4.496 1.00 0.00 C ATOM 0 H THR A 219 -6.194 1.907 -6.004 1.00 0.00 H new ATOM 0 HA THR A 219 -8.795 1.520 -4.801 1.00 0.00 H new ATOM 0 HB THR A 219 -6.438 -0.335 -5.313 1.00 0.00 H new ATOM 0 HG1 THR A 219 -7.298 0.110 -7.288 1.00 0.00 H new ATOM 0 HG21 THR A 219 -8.022 -2.176 -4.943 1.00 0.00 H new ATOM 0 HG22 THR A 219 -7.810 -1.186 -3.479 1.00 0.00 H new ATOM 0 HG23 THR A 219 -9.275 -1.004 -4.473 1.00 0.00 H new ATOM 863 N ILE A 220 -8.335 1.256 -2.367 1.00 0.00 N ATOM 864 CA ILE A 220 -8.077 1.333 -0.931 1.00 0.00 C ATOM 865 C ILE A 220 -7.954 -0.064 -0.324 1.00 0.00 C ATOM 866 O ILE A 220 -8.831 -0.911 -0.504 1.00 0.00 O ATOM 867 CB ILE A 220 -9.196 2.119 -0.196 1.00 0.00 C ATOM 868 CG1 ILE A 220 -9.361 3.526 -0.802 1.00 0.00 C ATOM 869 CG2 ILE A 220 -8.902 2.211 1.300 1.00 0.00 C ATOM 870 CD1 ILE A 220 -8.111 4.385 -0.731 1.00 0.00 C ATOM 0 H ILE A 220 -9.320 1.164 -2.616 1.00 0.00 H new ATOM 0 HA ILE A 220 -7.134 1.865 -0.801 1.00 0.00 H new ATOM 0 HB ILE A 220 -10.132 1.577 -0.327 1.00 0.00 H new ATOM 0 HG12 ILE A 220 -9.661 3.427 -1.845 1.00 0.00 H new ATOM 0 HG13 ILE A 220 -10.171 4.040 -0.284 1.00 0.00 H new ATOM 0 HG21 ILE A 220 -9.700 2.766 1.794 1.00 0.00 H new ATOM 0 HG22 ILE A 220 -8.843 1.208 1.722 1.00 0.00 H new ATOM 0 HG23 ILE A 220 -7.953 2.725 1.453 1.00 0.00 H new ATOM 0 HD11 ILE A 220 -8.312 5.358 -1.179 1.00 0.00 H new ATOM 0 HD12 ILE A 220 -7.820 4.518 0.311 1.00 0.00 H new ATOM 0 HD13 ILE A 220 -7.302 3.896 -1.274 1.00 0.00 H new ATOM 882 N ILE A 221 -6.853 -0.305 0.372 1.00 0.00 N ATOM 883 CA ILE A 221 -6.607 -1.594 1.007 1.00 0.00 C ATOM 884 C ILE A 221 -6.194 -1.426 2.457 1.00 0.00 C ATOM 885 O ILE A 221 -5.839 -0.339 2.889 1.00 0.00 O ATOM 886 CB ILE A 221 -5.507 -2.399 0.288 1.00 0.00 C ATOM 887 CG1 ILE A 221 -4.183 -1.618 0.290 1.00 0.00 C ATOM 888 CG2 ILE A 221 -5.936 -2.739 -1.126 1.00 0.00 C ATOM 889 CD1 ILE A 221 -2.998 -2.412 -0.212 1.00 0.00 C ATOM 0 H ILE A 221 -6.110 0.380 0.513 1.00 0.00 H new ATOM 0 HA ILE A 221 -7.549 -2.139 0.945 1.00 0.00 H new ATOM 0 HB ILE A 221 -5.350 -3.334 0.827 1.00 0.00 H new ATOM 0 HG12 ILE A 221 -4.298 -0.727 -0.328 1.00 0.00 H new ATOM 0 HG13 ILE A 221 -3.976 -1.278 1.305 1.00 0.00 H new ATOM 0 HG21 ILE A 221 -5.147 -3.307 -1.619 1.00 0.00 H new ATOM 0 HG22 ILE A 221 -6.848 -3.335 -1.096 1.00 0.00 H new ATOM 0 HG23 ILE A 221 -6.121 -1.819 -1.681 1.00 0.00 H new ATOM 0 HD11 ILE A 221 -2.103 -1.790 -0.179 1.00 0.00 H new ATOM 0 HD12 ILE A 221 -2.854 -3.289 0.419 1.00 0.00 H new ATOM 0 HD13 ILE A 221 -3.181 -2.730 -1.238 1.00 0.00 H new ATOM 901 N GLU A 222 -6.245 -2.512 3.189 1.00 0.00 N ATOM 902 CA GLU A 222 -5.838 -2.536 4.575 1.00 0.00 C ATOM 903 C GLU A 222 -4.533 -3.307 4.693 1.00 0.00 C ATOM 904 O GLU A 222 -4.422 -4.415 4.179 1.00 0.00 O ATOM 905 CB GLU A 222 -6.923 -3.206 5.415 1.00 0.00 C ATOM 906 CG GLU A 222 -6.588 -3.343 6.888 1.00 0.00 C ATOM 907 CD GLU A 222 -7.700 -4.011 7.661 1.00 0.00 C ATOM 908 OE1 GLU A 222 -8.289 -4.989 7.143 1.00 0.00 O ATOM 909 OE2 GLU A 222 -7.991 -3.574 8.784 1.00 0.00 O ATOM 0 H GLU A 222 -6.573 -3.412 2.838 1.00 0.00 H new ATOM 0 HA GLU A 222 -5.691 -1.519 4.938 1.00 0.00 H new ATOM 0 HB2 GLU A 222 -7.845 -2.633 5.318 1.00 0.00 H new ATOM 0 HB3 GLU A 222 -7.119 -4.197 5.007 1.00 0.00 H new ATOM 0 HG2 GLU A 222 -5.671 -3.922 6.999 1.00 0.00 H new ATOM 0 HG3 GLU A 222 -6.395 -2.356 7.309 1.00 0.00 H new ATOM 916 N VAL A 223 -3.550 -2.727 5.352 1.00 0.00 N ATOM 917 CA VAL A 223 -2.259 -3.376 5.505 1.00 0.00 C ATOM 918 C VAL A 223 -1.846 -3.439 6.967 1.00 0.00 C ATOM 919 O VAL A 223 -2.268 -2.613 7.787 1.00 0.00 O ATOM 920 CB VAL A 223 -1.147 -2.663 4.687 1.00 0.00 C ATOM 921 CG1 VAL A 223 -1.449 -2.727 3.198 1.00 0.00 C ATOM 922 CG2 VAL A 223 -0.984 -1.215 5.137 1.00 0.00 C ATOM 0 H VAL A 223 -3.618 -1.809 5.790 1.00 0.00 H new ATOM 0 HA VAL A 223 -2.375 -4.389 5.119 1.00 0.00 H new ATOM 0 HB VAL A 223 -0.208 -3.185 4.870 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -0.658 -2.222 2.644 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -1.504 -3.769 2.882 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -2.402 -2.236 2.999 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -0.200 -0.737 4.549 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -1.923 -0.681 4.991 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -0.713 -1.190 6.192 1.00 0.00 H new ATOM 932 N ASN A 224 -1.030 -4.420 7.289 1.00 0.00 N ATOM 933 CA ASN A 224 -0.562 -4.604 8.650 1.00 0.00 C ATOM 934 C ASN A 224 0.818 -3.987 8.820 1.00 0.00 C ATOM 935 O ASN A 224 1.808 -4.518 8.333 1.00 0.00 O ATOM 936 CB ASN A 224 -0.532 -6.105 9.003 1.00 0.00 C ATOM 937 CG ASN A 224 -0.154 -6.390 10.454 1.00 0.00 C ATOM 938 OD1 ASN A 224 0.592 -5.650 11.074 1.00 0.00 O ATOM 939 ND2 ASN A 224 -0.676 -7.472 10.999 1.00 0.00 N ATOM 0 H ASN A 224 -0.674 -5.107 6.624 1.00 0.00 H new ATOM 0 HA ASN A 224 -1.250 -4.102 9.330 1.00 0.00 H new ATOM 0 HB2 ASN A 224 -1.513 -6.536 8.802 1.00 0.00 H new ATOM 0 HB3 ASN A 224 0.178 -6.609 8.347 1.00 0.00 H new ATOM 0 HD21 ASN A 224 -0.459 -7.711 11.967 1.00 0.00 H new ATOM 0 HD22 ASN A 224 -1.296 -8.070 10.453 1.00 0.00 H new ATOM 946 N VAL A 225 0.874 -2.866 9.517 1.00 0.00 N ATOM 947 CA VAL A 225 2.136 -2.192 9.767 1.00 0.00 C ATOM 948 C VAL A 225 2.572 -2.407 11.212 1.00 0.00 C ATOM 949 O VAL A 225 3.304 -1.613 11.794 1.00 0.00 O ATOM 950 CB VAL A 225 2.085 -0.676 9.419 1.00 0.00 C ATOM 951 CG1 VAL A 225 1.777 -0.486 7.944 1.00 0.00 C ATOM 952 CG2 VAL A 225 1.071 0.063 10.272 1.00 0.00 C ATOM 0 H VAL A 225 0.060 -2.403 9.920 1.00 0.00 H new ATOM 0 HA VAL A 225 2.877 -2.636 9.103 1.00 0.00 H new ATOM 0 HB VAL A 225 3.066 -0.253 9.636 1.00 0.00 H new ATOM 0 HG11 VAL A 225 1.744 0.579 7.713 1.00 0.00 H new ATOM 0 HG12 VAL A 225 2.553 -0.963 7.346 1.00 0.00 H new ATOM 0 HG13 VAL A 225 0.812 -0.937 7.713 1.00 0.00 H new ATOM 0 HG21 VAL A 225 1.066 1.118 9.999 1.00 0.00 H new ATOM 0 HG22 VAL A 225 0.080 -0.360 10.107 1.00 0.00 H new ATOM 0 HG23 VAL A 225 1.338 -0.038 11.324 1.00 0.00 H new ATOM 962 N SER A 226 2.084 -3.480 11.792 1.00 0.00 N ATOM 963 CA SER A 226 2.477 -3.874 13.118 1.00 0.00 C ATOM 964 C SER A 226 3.746 -4.725 13.040 1.00 0.00 C ATOM 965 O SER A 226 4.516 -4.801 14.000 1.00 0.00 O ATOM 966 CB SER A 226 1.342 -4.638 13.814 1.00 0.00 C ATOM 967 OG SER A 226 1.655 -4.910 15.169 1.00 0.00 O ATOM 0 H SER A 226 1.404 -4.101 11.355 1.00 0.00 H new ATOM 0 HA SER A 226 2.686 -2.984 13.711 1.00 0.00 H new ATOM 0 HB2 SER A 226 0.423 -4.054 13.762 1.00 0.00 H new ATOM 0 HB3 SER A 226 1.155 -5.574 13.287 1.00 0.00 H new ATOM 0 HG SER A 226 0.913 -5.396 15.585 1.00 0.00 H new ATOM 973 N ASP A 227 3.962 -5.341 11.870 1.00 0.00 N ATOM 974 CA ASP A 227 5.119 -6.222 11.641 1.00 0.00 C ATOM 975 C ASP A 227 6.445 -5.489 11.812 1.00 0.00 C ATOM 976 O ASP A 227 7.392 -6.036 12.376 1.00 0.00 O ATOM 977 CB ASP A 227 5.071 -6.848 10.235 1.00 0.00 C ATOM 978 CG ASP A 227 3.978 -7.890 10.060 1.00 0.00 C ATOM 979 OD1 ASP A 227 3.641 -8.582 11.037 1.00 0.00 O ATOM 980 OD2 ASP A 227 3.464 -8.030 8.933 1.00 0.00 O ATOM 0 H ASP A 227 3.347 -5.245 11.062 1.00 0.00 H new ATOM 0 HA ASP A 227 5.058 -7.007 12.394 1.00 0.00 H new ATOM 0 HB2 ASP A 227 4.925 -6.056 9.500 1.00 0.00 H new ATOM 0 HB3 ASP A 227 6.035 -7.308 10.020 1.00 0.00 H new ATOM 985 N LEU A 228 6.514 -4.255 11.328 1.00 0.00 N ATOM 986 CA LEU A 228 7.753 -3.481 11.420 1.00 0.00 C ATOM 987 C LEU A 228 7.736 -2.526 12.593 1.00 0.00 C ATOM 988 O LEU A 228 8.713 -1.819 12.844 1.00 0.00 O ATOM 989 CB LEU A 228 8.050 -2.701 10.136 1.00 0.00 C ATOM 990 CG LEU A 228 7.113 -1.523 9.809 1.00 0.00 C ATOM 991 CD1 LEU A 228 7.789 -0.570 8.840 1.00 0.00 C ATOM 992 CD2 LEU A 228 5.798 -2.012 9.221 1.00 0.00 C ATOM 0 H LEU A 228 5.740 -3.771 10.873 1.00 0.00 H new ATOM 0 HA LEU A 228 8.547 -4.213 11.570 1.00 0.00 H new ATOM 0 HB2 LEU A 228 9.069 -2.318 10.199 1.00 0.00 H new ATOM 0 HB3 LEU A 228 8.023 -3.400 9.300 1.00 0.00 H new ATOM 0 HG LEU A 228 6.896 -0.998 10.739 1.00 0.00 H new ATOM 0 HD11 LEU A 228 7.117 0.259 8.616 1.00 0.00 H new ATOM 0 HD12 LEU A 228 8.704 -0.184 9.288 1.00 0.00 H new ATOM 0 HD13 LEU A 228 8.032 -1.099 7.919 1.00 0.00 H new ATOM 0 HD21 LEU A 228 5.158 -1.158 9.001 1.00 0.00 H new ATOM 0 HD22 LEU A 228 5.994 -2.565 8.303 1.00 0.00 H new ATOM 0 HD23 LEU A 228 5.299 -2.664 9.938 1.00 0.00 H new ATOM 1004 N GLY A 229 6.646 -2.505 13.319 1.00 0.00 N ATOM 1005 CA GLY A 229 6.548 -1.618 14.449 1.00 0.00 C ATOM 1006 C GLY A 229 7.160 -2.221 15.686 1.00 0.00 C ATOM 1007 O GLY A 229 6.576 -2.170 16.763 1.00 0.00 O ATOM 0 H GLY A 229 5.824 -3.085 13.150 1.00 0.00 H new ATOM 0 HA2 GLY A 229 7.048 -0.677 14.217 1.00 0.00 H new ATOM 0 HA3 GLY A 229 5.500 -1.384 14.638 1.00 0.00 H new ATOM 1011 N ILE A 230 8.342 -2.795 15.525 1.00 0.00 N ATOM 1012 CA ILE A 230 9.033 -3.446 16.626 1.00 0.00 C ATOM 1013 C ILE A 230 9.791 -2.429 17.468 1.00 0.00 C ATOM 1014 O ILE A 230 9.374 -2.078 18.567 1.00 0.00 O ATOM 1015 CB ILE A 230 10.029 -4.507 16.102 1.00 0.00 C ATOM 1016 CG1 ILE A 230 9.292 -5.546 15.261 1.00 0.00 C ATOM 1017 CG2 ILE A 230 10.758 -5.183 17.265 1.00 0.00 C ATOM 1018 CD1 ILE A 230 10.205 -6.523 14.555 1.00 0.00 C ATOM 0 H ILE A 230 8.844 -2.823 14.638 1.00 0.00 H new ATOM 0 HA ILE A 230 8.277 -3.933 17.242 1.00 0.00 H new ATOM 0 HB ILE A 230 10.771 -4.009 15.477 1.00 0.00 H new ATOM 0 HG12 ILE A 230 8.609 -6.102 15.904 1.00 0.00 H new ATOM 0 HG13 ILE A 230 8.683 -5.032 14.518 1.00 0.00 H new ATOM 0 HG21 ILE A 230 11.454 -5.926 16.876 1.00 0.00 H new ATOM 0 HG22 ILE A 230 11.308 -4.434 17.834 1.00 0.00 H new ATOM 0 HG23 ILE A 230 10.032 -5.672 17.915 1.00 0.00 H new ATOM 0 HD11 ILE A 230 9.607 -7.229 13.979 1.00 0.00 H new ATOM 0 HD12 ILE A 230 10.871 -5.980 13.885 1.00 0.00 H new ATOM 0 HD13 ILE A 230 10.796 -7.066 15.292 1.00 0.00 H new ATOM 1030 N VAL A 231 10.890 -1.944 16.932 1.00 0.00 N ATOM 1031 CA VAL A 231 11.718 -0.977 17.638 1.00 0.00 C ATOM 1032 C VAL A 231 12.211 0.111 16.672 1.00 0.00 C ATOM 1033 O VAL A 231 13.047 0.939 17.015 1.00 0.00 O ATOM 1034 CB VAL A 231 12.925 -1.687 18.327 1.00 0.00 C ATOM 1035 CG1 VAL A 231 13.931 -2.193 17.302 1.00 0.00 C ATOM 1036 CG2 VAL A 231 13.591 -0.782 19.361 1.00 0.00 C ATOM 0 H VAL A 231 11.236 -2.201 16.007 1.00 0.00 H new ATOM 0 HA VAL A 231 11.113 -0.504 18.412 1.00 0.00 H new ATOM 0 HB VAL A 231 12.533 -2.555 18.858 1.00 0.00 H new ATOM 0 HG11 VAL A 231 14.759 -2.682 17.815 1.00 0.00 H new ATOM 0 HG12 VAL A 231 13.445 -2.906 16.636 1.00 0.00 H new ATOM 0 HG13 VAL A 231 14.311 -1.353 16.720 1.00 0.00 H new ATOM 0 HG21 VAL A 231 14.427 -1.309 19.821 1.00 0.00 H new ATOM 0 HG22 VAL A 231 13.956 0.122 18.873 1.00 0.00 H new ATOM 0 HG23 VAL A 231 12.866 -0.512 20.129 1.00 0.00 H new ATOM 1046 N THR A 232 11.636 0.121 15.479 1.00 0.00 N ATOM 1047 CA THR A 232 12.025 1.066 14.441 1.00 0.00 C ATOM 1048 C THR A 232 11.720 2.510 14.854 1.00 0.00 C ATOM 1049 O THR A 232 12.495 3.427 14.584 1.00 0.00 O ATOM 1050 CB THR A 232 11.283 0.745 13.139 1.00 0.00 C ATOM 1051 OG1 THR A 232 9.878 0.676 13.408 1.00 0.00 O ATOM 1052 CG2 THR A 232 11.745 -0.580 12.566 1.00 0.00 C ATOM 0 H THR A 232 10.892 -0.520 15.203 1.00 0.00 H new ATOM 0 HA THR A 232 13.100 0.971 14.291 1.00 0.00 H new ATOM 0 HB THR A 232 11.494 1.530 12.413 1.00 0.00 H new ATOM 0 HG1 THR A 232 9.552 -0.228 13.217 1.00 0.00 H new ATOM 0 HG21 THR A 232 11.204 -0.786 11.642 1.00 0.00 H new ATOM 0 HG22 THR A 232 12.814 -0.533 12.358 1.00 0.00 H new ATOM 0 HG23 THR A 232 11.550 -1.375 13.285 1.00 0.00 H new ATOM 1060 N ALA A 233 10.593 2.689 15.515 1.00 0.00 N ATOM 1061 CA ALA A 233 10.184 3.985 16.016 1.00 0.00 C ATOM 1062 C ALA A 233 9.496 3.810 17.355 1.00 0.00 C ATOM 1063 O ALA A 233 8.317 4.123 17.508 1.00 0.00 O ATOM 1064 CB ALA A 233 9.264 4.679 15.020 1.00 0.00 C ATOM 0 H ALA A 233 9.934 1.938 15.720 1.00 0.00 H new ATOM 0 HA ALA A 233 11.064 4.614 16.148 1.00 0.00 H new ATOM 0 HB1 ALA A 233 8.968 5.651 15.415 1.00 0.00 H new ATOM 0 HB2 ALA A 233 9.789 4.816 14.074 1.00 0.00 H new ATOM 0 HB3 ALA A 233 8.376 4.068 14.857 1.00 0.00 H new ATOM 1070 N SER A 234 10.230 3.232 18.305 1.00 0.00 N ATOM 1071 CA SER A 234 9.728 2.964 19.662 1.00 0.00 C ATOM 1072 C SER A 234 8.515 2.013 19.642 1.00 0.00 C ATOM 1073 O SER A 234 7.841 1.824 20.652 1.00 0.00 O ATOM 1074 CB SER A 234 9.366 4.278 20.366 1.00 0.00 C ATOM 1075 OG SER A 234 10.475 5.172 20.379 1.00 0.00 O ATOM 0 H SER A 234 11.194 2.933 18.159 1.00 0.00 H new ATOM 0 HA SER A 234 10.525 2.471 20.219 1.00 0.00 H new ATOM 0 HB2 SER A 234 8.523 4.746 19.859 1.00 0.00 H new ATOM 0 HB3 SER A 234 9.048 4.072 21.388 1.00 0.00 H new ATOM 0 HG SER A 234 10.220 6.003 20.831 1.00 0.00 H new ATOM 1081 N GLY A 235 8.251 1.422 18.481 1.00 0.00 N ATOM 1082 CA GLY A 235 7.151 0.487 18.346 1.00 0.00 C ATOM 1083 C GLY A 235 5.799 1.171 18.196 1.00 0.00 C ATOM 1084 O GLY A 235 4.770 0.505 18.100 1.00 0.00 O ATOM 0 H GLY A 235 8.785 1.576 17.625 1.00 0.00 H new ATOM 0 HA2 GLY A 235 7.328 -0.149 17.479 1.00 0.00 H new ATOM 0 HA3 GLY A 235 7.127 -0.164 19.220 1.00 0.00 H new ATOM 1088 N LYS A 236 5.796 2.500 18.164 1.00 0.00 N ATOM 1089 CA LYS A 236 4.547 3.260 18.094 1.00 0.00 C ATOM 1090 C LYS A 236 3.873 3.151 16.737 1.00 0.00 C ATOM 1091 O LYS A 236 2.669 3.384 16.610 1.00 0.00 O ATOM 1092 CB LYS A 236 4.769 4.730 18.468 1.00 0.00 C ATOM 1093 CG LYS A 236 5.643 5.496 17.490 1.00 0.00 C ATOM 1094 CD LYS A 236 5.772 6.960 17.876 1.00 0.00 C ATOM 1095 CE LYS A 236 6.468 7.129 19.218 1.00 0.00 C ATOM 1096 NZ LYS A 236 6.663 8.554 19.560 1.00 0.00 N ATOM 0 H LYS A 236 6.639 3.073 18.185 1.00 0.00 H new ATOM 0 HA LYS A 236 3.873 2.813 18.825 1.00 0.00 H new ATOM 0 HB2 LYS A 236 3.801 5.226 18.538 1.00 0.00 H new ATOM 0 HB3 LYS A 236 5.223 4.777 19.458 1.00 0.00 H new ATOM 0 HG2 LYS A 236 6.633 5.041 17.454 1.00 0.00 H new ATOM 0 HG3 LYS A 236 5.220 5.420 16.488 1.00 0.00 H new ATOM 0 HD2 LYS A 236 6.332 7.491 17.106 1.00 0.00 H new ATOM 0 HD3 LYS A 236 4.782 7.413 17.920 1.00 0.00 H new ATOM 0 HE2 LYS A 236 5.878 6.646 19.997 1.00 0.00 H new ATOM 0 HE3 LYS A 236 7.435 6.626 19.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 236 7.140 8.628 20.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 236 7.247 9.009 18.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 236 5.739 9.029 19.610 1.00 0.00 H new ATOM 1110 N ILE A 237 4.637 2.792 15.731 1.00 0.00 N ATOM 1111 CA ILE A 237 4.100 2.694 14.390 1.00 0.00 C ATOM 1112 C ILE A 237 3.374 1.372 14.155 1.00 0.00 C ATOM 1113 O ILE A 237 2.777 1.168 13.100 1.00 0.00 O ATOM 1114 CB ILE A 237 5.185 2.870 13.314 1.00 0.00 C ATOM 1115 CG1 ILE A 237 6.277 1.815 13.484 1.00 0.00 C ATOM 1116 CG2 ILE A 237 5.772 4.275 13.374 1.00 0.00 C ATOM 1117 CD1 ILE A 237 7.178 1.678 12.279 1.00 0.00 C ATOM 0 H ILE A 237 5.628 2.564 15.813 1.00 0.00 H new ATOM 0 HA ILE A 237 3.383 3.510 14.303 1.00 0.00 H new ATOM 0 HB ILE A 237 4.730 2.735 12.333 1.00 0.00 H new ATOM 0 HG12 ILE A 237 6.883 2.068 14.354 1.00 0.00 H new ATOM 0 HG13 ILE A 237 5.811 0.852 13.690 1.00 0.00 H new ATOM 0 HG21 ILE A 237 6.538 4.382 12.606 1.00 0.00 H new ATOM 0 HG22 ILE A 237 4.982 5.007 13.204 1.00 0.00 H new ATOM 0 HG23 ILE A 237 6.216 4.442 14.355 1.00 0.00 H new ATOM 0 HD11 ILE A 237 7.929 0.912 12.471 1.00 0.00 H new ATOM 0 HD12 ILE A 237 6.584 1.394 11.411 1.00 0.00 H new ATOM 0 HD13 ILE A 237 7.673 2.630 12.084 1.00 0.00 H new ATOM 1129 N ALA A 238 3.412 0.488 15.140 1.00 0.00 N ATOM 1130 CA ALA A 238 2.782 -0.818 15.008 1.00 0.00 C ATOM 1131 C ALA A 238 1.271 -0.699 15.086 1.00 0.00 C ATOM 1132 O ALA A 238 0.715 -0.451 16.164 1.00 0.00 O ATOM 1133 CB ALA A 238 3.285 -1.767 16.086 1.00 0.00 C ATOM 0 H ALA A 238 3.870 0.649 16.037 1.00 0.00 H new ATOM 0 HA ALA A 238 3.049 -1.222 14.031 1.00 0.00 H new ATOM 0 HB1 ALA A 238 2.802 -2.738 15.970 1.00 0.00 H new ATOM 0 HB2 ALA A 238 4.365 -1.885 15.992 1.00 0.00 H new ATOM 0 HB3 ALA A 238 3.049 -1.359 17.069 1.00 0.00 H new ATOM 1139 N TRP A 239 0.601 -0.890 13.954 1.00 0.00 N ATOM 1140 CA TRP A 239 -0.859 -0.761 13.908 1.00 0.00 C ATOM 1141 C TRP A 239 -1.395 -1.286 12.568 1.00 0.00 C ATOM 1142 O TRP A 239 -0.646 -1.845 11.769 1.00 0.00 O ATOM 1143 CB TRP A 239 -1.246 0.728 14.098 1.00 0.00 C ATOM 1144 CG TRP A 239 -2.647 0.956 14.597 1.00 0.00 C ATOM 1145 CD1 TRP A 239 -3.733 1.343 13.863 1.00 0.00 C ATOM 1146 CD2 TRP A 239 -3.105 0.828 15.948 1.00 0.00 C ATOM 1147 NE1 TRP A 239 -4.835 1.447 14.670 1.00 0.00 N ATOM 1148 CE2 TRP A 239 -4.477 1.140 15.954 1.00 0.00 C ATOM 1149 CE3 TRP A 239 -2.488 0.474 17.151 1.00 0.00 C ATOM 1150 CZ2 TRP A 239 -5.242 1.111 17.118 1.00 0.00 C ATOM 1151 CZ3 TRP A 239 -3.248 0.446 18.304 1.00 0.00 C ATOM 1152 CH2 TRP A 239 -4.612 0.762 18.279 1.00 0.00 C ATOM 0 H TRP A 239 1.036 -1.132 13.064 1.00 0.00 H new ATOM 0 HA TRP A 239 -1.302 -1.353 14.709 1.00 0.00 H new ATOM 0 HB2 TRP A 239 -0.547 1.184 14.799 1.00 0.00 H new ATOM 0 HB3 TRP A 239 -1.126 1.245 13.146 1.00 0.00 H new ATOM 0 HD1 TRP A 239 -3.724 1.538 12.801 1.00 0.00 H new ATOM 0 HE1 TRP A 239 -5.771 1.711 14.363 1.00 0.00 H new ATOM 0 HE3 TRP A 239 -1.437 0.227 17.179 1.00 0.00 H new ATOM 0 HZ2 TRP A 239 -6.294 1.355 17.103 1.00 0.00 H new ATOM 0 HZ3 TRP A 239 -2.783 0.176 19.240 1.00 0.00 H new ATOM 0 HH2 TRP A 239 -5.179 0.729 19.198 1.00 0.00 H new ATOM 1163 N GLY A 240 -2.690 -1.141 12.352 1.00 0.00 N ATOM 1164 CA GLY A 240 -3.281 -1.492 11.079 1.00 0.00 C ATOM 1165 C GLY A 240 -3.680 -0.237 10.339 1.00 0.00 C ATOM 1166 O GLY A 240 -4.394 0.604 10.886 1.00 0.00 O ATOM 0 H GLY A 240 -3.350 -0.783 13.043 1.00 0.00 H new ATOM 0 HA2 GLY A 240 -2.571 -2.066 10.484 1.00 0.00 H new ATOM 0 HA3 GLY A 240 -4.153 -2.127 11.235 1.00 0.00 H new ATOM 1170 N ARG A 241 -3.229 -0.092 9.113 1.00 0.00 N ATOM 1171 CA ARG A 241 -3.483 1.131 8.362 1.00 0.00 C ATOM 1172 C ARG A 241 -4.067 0.840 6.999 1.00 0.00 C ATOM 1173 O ARG A 241 -3.906 -0.254 6.464 1.00 0.00 O ATOM 1174 CB ARG A 241 -2.193 1.945 8.202 1.00 0.00 C ATOM 1175 CG ARG A 241 -1.547 2.370 9.512 1.00 0.00 C ATOM 1176 CD ARG A 241 -2.454 3.289 10.311 1.00 0.00 C ATOM 1177 NE ARG A 241 -1.809 3.753 11.537 1.00 0.00 N ATOM 1178 CZ ARG A 241 -2.422 4.457 12.488 1.00 0.00 C ATOM 1179 NH1 ARG A 241 -3.710 4.751 12.372 1.00 0.00 N ATOM 1180 NH2 ARG A 241 -1.748 4.853 13.561 1.00 0.00 N ATOM 0 H ARG A 241 -2.688 -0.797 8.612 1.00 0.00 H new ATOM 0 HA ARG A 241 -4.211 1.711 8.930 1.00 0.00 H new ATOM 0 HB2 ARG A 241 -1.475 1.355 7.632 1.00 0.00 H new ATOM 0 HB3 ARG A 241 -2.412 2.836 7.614 1.00 0.00 H new ATOM 0 HG2 ARG A 241 -1.310 1.487 10.105 1.00 0.00 H new ATOM 0 HG3 ARG A 241 -0.605 2.877 9.306 1.00 0.00 H new ATOM 0 HD2 ARG A 241 -2.733 4.147 9.699 1.00 0.00 H new ATOM 0 HD3 ARG A 241 -3.375 2.763 10.561 1.00 0.00 H new ATOM 0 HE ARG A 241 -0.825 3.523 11.674 1.00 0.00 H new ATOM 0 HH11 ARG A 241 -4.233 4.438 11.554 1.00 0.00 H new ATOM 0 HH12 ARG A 241 -4.178 5.290 13.101 1.00 0.00 H new ATOM 0 HH21 ARG A 241 -0.760 4.618 13.658 1.00 0.00 H new ATOM 0 HH22 ARG A 241 -2.218 5.392 14.288 1.00 0.00 H new ATOM 1194 N TYR A 242 -4.749 1.820 6.449 1.00 0.00 N ATOM 1195 CA TYR A 242 -5.308 1.709 5.124 1.00 0.00 C ATOM 1196 C TYR A 242 -4.448 2.473 4.139 1.00 0.00 C ATOM 1197 O TYR A 242 -4.057 3.612 4.392 1.00 0.00 O ATOM 1198 CB TYR A 242 -6.751 2.217 5.094 1.00 0.00 C ATOM 1199 CG TYR A 242 -7.727 1.305 5.804 1.00 0.00 C ATOM 1200 CD1 TYR A 242 -7.908 1.375 7.179 1.00 0.00 C ATOM 1201 CD2 TYR A 242 -8.470 0.371 5.092 1.00 0.00 C ATOM 1202 CE1 TYR A 242 -8.800 0.538 7.824 1.00 0.00 C ATOM 1203 CE2 TYR A 242 -9.363 -0.466 5.729 1.00 0.00 C ATOM 1204 CZ TYR A 242 -9.523 -0.380 7.093 1.00 0.00 C ATOM 1205 OH TYR A 242 -10.414 -1.213 7.729 1.00 0.00 O ATOM 0 H TYR A 242 -4.930 2.713 6.908 1.00 0.00 H new ATOM 0 HA TYR A 242 -5.322 0.657 4.838 1.00 0.00 H new ATOM 0 HB2 TYR A 242 -6.790 3.205 5.553 1.00 0.00 H new ATOM 0 HB3 TYR A 242 -7.065 2.335 4.057 1.00 0.00 H new ATOM 0 HD1 TYR A 242 -7.343 2.094 7.754 1.00 0.00 H new ATOM 0 HD2 TYR A 242 -8.346 0.299 4.022 1.00 0.00 H new ATOM 0 HE1 TYR A 242 -8.929 0.603 8.894 1.00 0.00 H new ATOM 0 HE2 TYR A 242 -9.934 -1.185 5.160 1.00 0.00 H new ATOM 0 HH TYR A 242 -10.842 -1.799 7.070 1.00 0.00 H new ATOM 1215 N ALA A 243 -4.162 1.853 3.025 1.00 0.00 N ATOM 1216 CA ALA A 243 -3.298 2.436 2.032 1.00 0.00 C ATOM 1217 C ALA A 243 -3.938 2.384 0.660 1.00 0.00 C ATOM 1218 O ALA A 243 -4.802 1.551 0.395 1.00 0.00 O ATOM 1219 CB ALA A 243 -1.949 1.728 2.024 1.00 0.00 C ATOM 0 H ALA A 243 -4.521 0.930 2.780 1.00 0.00 H new ATOM 0 HA ALA A 243 -3.139 3.483 2.288 1.00 0.00 H new ATOM 0 HB1 ALA A 243 -1.306 2.179 1.268 1.00 0.00 H new ATOM 0 HB2 ALA A 243 -1.481 1.825 3.004 1.00 0.00 H new ATOM 0 HB3 ALA A 243 -2.093 0.672 1.794 1.00 0.00 H new ATOM 1225 N GLN A 244 -3.526 3.288 -0.192 1.00 0.00 N ATOM 1226 CA GLN A 244 -4.038 3.364 -1.537 1.00 0.00 C ATOM 1227 C GLN A 244 -3.056 2.723 -2.508 1.00 0.00 C ATOM 1228 O GLN A 244 -1.882 3.093 -2.548 1.00 0.00 O ATOM 1229 CB GLN A 244 -4.285 4.827 -1.914 1.00 0.00 C ATOM 1230 CG GLN A 244 -4.755 5.029 -3.344 1.00 0.00 C ATOM 1231 CD GLN A 244 -4.953 6.493 -3.698 1.00 0.00 C ATOM 1232 OE1 GLN A 244 -4.753 6.895 -4.841 1.00 0.00 O ATOM 1233 NE2 GLN A 244 -5.357 7.293 -2.729 1.00 0.00 N ATOM 0 H GLN A 244 -2.824 3.994 0.028 1.00 0.00 H new ATOM 0 HA GLN A 244 -4.982 2.822 -1.592 1.00 0.00 H new ATOM 0 HB2 GLN A 244 -5.029 5.245 -1.236 1.00 0.00 H new ATOM 0 HB3 GLN A 244 -3.364 5.390 -1.763 1.00 0.00 H new ATOM 0 HG2 GLN A 244 -4.027 4.590 -4.026 1.00 0.00 H new ATOM 0 HG3 GLN A 244 -5.693 4.494 -3.492 1.00 0.00 H new ATOM 0 HE21 GLN A 244 -5.512 6.921 -1.792 1.00 0.00 H new ATOM 0 HE22 GLN A 244 -5.514 8.283 -2.917 1.00 0.00 H new ATOM 1242 N ILE A 245 -3.534 1.763 -3.276 1.00 0.00 N ATOM 1243 CA ILE A 245 -2.707 1.083 -4.248 1.00 0.00 C ATOM 1244 C ILE A 245 -2.494 1.940 -5.466 1.00 0.00 C ATOM 1245 O ILE A 245 -3.455 2.413 -6.087 1.00 0.00 O ATOM 1246 CB ILE A 245 -3.313 -0.270 -4.715 1.00 0.00 C ATOM 1247 CG1 ILE A 245 -3.406 -1.261 -3.567 1.00 0.00 C ATOM 1248 CG2 ILE A 245 -2.499 -0.864 -5.864 1.00 0.00 C ATOM 1249 CD1 ILE A 245 -4.119 -2.543 -3.946 1.00 0.00 C ATOM 0 H ILE A 245 -4.500 1.436 -3.243 1.00 0.00 H new ATOM 0 HA ILE A 245 -1.761 0.888 -3.743 1.00 0.00 H new ATOM 0 HB ILE A 245 -4.323 -0.070 -5.072 1.00 0.00 H new ATOM 0 HG12 ILE A 245 -2.401 -1.500 -3.219 1.00 0.00 H new ATOM 0 HG13 ILE A 245 -3.930 -0.794 -2.733 1.00 0.00 H new ATOM 0 HG21 ILE A 245 -2.943 -1.810 -6.173 1.00 0.00 H new ATOM 0 HG22 ILE A 245 -2.498 -0.171 -6.706 1.00 0.00 H new ATOM 0 HG23 ILE A 245 -1.474 -1.035 -5.534 1.00 0.00 H new ATOM 0 HD11 ILE A 245 -4.153 -3.209 -3.084 1.00 0.00 H new ATOM 0 HD12 ILE A 245 -5.135 -2.313 -4.267 1.00 0.00 H new ATOM 0 HD13 ILE A 245 -3.583 -3.030 -4.760 1.00 0.00 H new ATOM 1261 N THR A 246 -1.243 2.132 -5.791 1.00 0.00 N ATOM 1262 CA THR A 246 -0.829 2.813 -6.970 1.00 0.00 C ATOM 1263 C THR A 246 0.256 1.963 -7.654 1.00 0.00 C ATOM 1264 O THR A 246 1.438 1.999 -7.299 1.00 0.00 O ATOM 1265 CB THR A 246 -0.328 4.262 -6.666 1.00 0.00 C ATOM 1266 OG1 THR A 246 0.197 4.869 -7.848 1.00 0.00 O ATOM 1267 CG2 THR A 246 0.725 4.281 -5.557 1.00 0.00 C ATOM 0 H THR A 246 -0.465 1.805 -5.218 1.00 0.00 H new ATOM 0 HA THR A 246 -1.680 2.933 -7.640 1.00 0.00 H new ATOM 0 HB THR A 246 -1.188 4.835 -6.319 1.00 0.00 H new ATOM 0 HG1 THR A 246 0.505 5.776 -7.641 1.00 0.00 H new ATOM 0 HG21 THR A 246 1.046 5.307 -5.378 1.00 0.00 H new ATOM 0 HG22 THR A 246 0.298 3.869 -4.643 1.00 0.00 H new ATOM 0 HG23 THR A 246 1.583 3.680 -5.859 1.00 0.00 H new ATOM 1275 N ASN A 247 -0.173 1.149 -8.594 1.00 0.00 N ATOM 1276 CA ASN A 247 0.721 0.239 -9.276 1.00 0.00 C ATOM 1277 C ASN A 247 1.488 0.933 -10.381 1.00 0.00 C ATOM 1278 O ASN A 247 0.909 1.426 -11.345 1.00 0.00 O ATOM 1279 CB ASN A 247 -0.049 -0.978 -9.836 1.00 0.00 C ATOM 1280 CG ASN A 247 -1.150 -0.610 -10.831 1.00 0.00 C ATOM 1281 OD1 ASN A 247 -1.768 0.460 -10.739 1.00 0.00 O ATOM 1282 ND2 ASN A 247 -1.399 -1.491 -11.781 1.00 0.00 N ATOM 0 H ASN A 247 -1.143 1.099 -8.905 1.00 0.00 H new ATOM 0 HA ASN A 247 1.443 -0.116 -8.541 1.00 0.00 H new ATOM 0 HB2 ASN A 247 0.658 -1.650 -10.323 1.00 0.00 H new ATOM 0 HB3 ASN A 247 -0.492 -1.529 -9.006 1.00 0.00 H new ATOM 0 HD21 ASN A 247 -2.123 -1.302 -12.474 1.00 0.00 H new ATOM 0 HD22 ASN A 247 -0.868 -2.361 -11.822 1.00 0.00 H new ATOM 1289 N ASN A 248 2.794 0.972 -10.234 1.00 0.00 N ATOM 1290 CA ASN A 248 3.654 1.566 -11.238 1.00 0.00 C ATOM 1291 C ASN A 248 4.801 0.636 -11.573 1.00 0.00 C ATOM 1292 O ASN A 248 5.943 0.888 -11.195 1.00 0.00 O ATOM 1293 CB ASN A 248 4.200 2.927 -10.776 1.00 0.00 C ATOM 1294 CG ASN A 248 3.121 3.978 -10.607 1.00 0.00 C ATOM 1295 OD1 ASN A 248 2.137 3.997 -11.344 1.00 0.00 O ATOM 1296 ND2 ASN A 248 3.294 4.850 -9.638 1.00 0.00 N ATOM 0 H ASN A 248 3.288 0.597 -9.424 1.00 0.00 H new ATOM 0 HA ASN A 248 3.052 1.727 -12.133 1.00 0.00 H new ATOM 0 HB2 ASN A 248 4.724 2.798 -9.829 1.00 0.00 H new ATOM 0 HB3 ASN A 248 4.933 3.282 -11.500 1.00 0.00 H new ATOM 0 HD21 ASN A 248 2.597 5.577 -9.476 1.00 0.00 H new ATOM 0 HD22 ASN A 248 4.125 4.799 -9.049 1.00 0.00 H new ATOM 1303 N PRO A 249 4.523 -0.470 -12.276 1.00 0.00 N ATOM 1304 CA PRO A 249 5.551 -1.438 -12.631 1.00 0.00 C ATOM 1305 C PRO A 249 6.499 -0.914 -13.707 1.00 0.00 C ATOM 1306 O PRO A 249 7.601 -1.422 -13.877 1.00 0.00 O ATOM 1307 CB PRO A 249 4.754 -2.638 -13.132 1.00 0.00 C ATOM 1308 CG PRO A 249 3.492 -2.052 -13.662 1.00 0.00 C ATOM 1309 CD PRO A 249 3.190 -0.865 -12.789 1.00 0.00 C ATOM 0 HA PRO A 249 6.200 -1.674 -11.788 1.00 0.00 H new ATOM 0 HB2 PRO A 249 5.297 -3.179 -13.907 1.00 0.00 H new ATOM 0 HB3 PRO A 249 4.556 -3.347 -12.328 1.00 0.00 H new ATOM 0 HG2 PRO A 249 3.608 -1.752 -14.703 1.00 0.00 H new ATOM 0 HG3 PRO A 249 2.680 -2.778 -13.628 1.00 0.00 H new ATOM 0 HD2 PRO A 249 2.722 -0.059 -13.354 1.00 0.00 H new ATOM 0 HD3 PRO A 249 2.508 -1.125 -11.979 1.00 0.00 H new ATOM 1317 N GLU A 250 6.066 0.096 -14.428 1.00 0.00 N ATOM 1318 CA GLU A 250 6.885 0.682 -15.465 1.00 0.00 C ATOM 1319 C GLU A 250 7.796 1.762 -14.895 1.00 0.00 C ATOM 1320 O GLU A 250 8.853 2.046 -15.449 1.00 0.00 O ATOM 1321 CB GLU A 250 6.007 1.240 -16.577 1.00 0.00 C ATOM 1322 CG GLU A 250 5.166 0.177 -17.260 1.00 0.00 C ATOM 1323 CD GLU A 250 4.235 0.749 -18.294 1.00 0.00 C ATOM 1324 OE1 GLU A 250 4.717 1.329 -19.284 1.00 0.00 O ATOM 1325 OE2 GLU A 250 3.006 0.619 -18.118 1.00 0.00 O ATOM 0 H GLU A 250 5.150 0.529 -14.315 1.00 0.00 H new ATOM 0 HA GLU A 250 7.520 -0.098 -15.886 1.00 0.00 H new ATOM 0 HB2 GLU A 250 5.350 2.005 -16.164 1.00 0.00 H new ATOM 0 HB3 GLU A 250 6.638 1.729 -17.320 1.00 0.00 H new ATOM 0 HG2 GLU A 250 5.824 -0.552 -17.733 1.00 0.00 H new ATOM 0 HG3 GLU A 250 4.584 -0.358 -16.509 1.00 0.00 H new ATOM 1332 N ASN A 251 7.395 2.347 -13.773 1.00 0.00 N ATOM 1333 CA ASN A 251 8.183 3.408 -13.160 1.00 0.00 C ATOM 1334 C ASN A 251 8.979 2.878 -11.974 1.00 0.00 C ATOM 1335 O ASN A 251 10.209 2.966 -11.946 1.00 0.00 O ATOM 1336 CB ASN A 251 7.261 4.541 -12.712 1.00 0.00 C ATOM 1337 CG ASN A 251 8.015 5.767 -12.245 1.00 0.00 C ATOM 1338 OD1 ASN A 251 9.105 6.069 -12.727 1.00 0.00 O ATOM 1339 ND2 ASN A 251 7.434 6.481 -11.310 1.00 0.00 N ATOM 0 H ASN A 251 6.538 2.108 -13.274 1.00 0.00 H new ATOM 0 HA ASN A 251 8.889 3.788 -13.899 1.00 0.00 H new ATOM 0 HB2 ASN A 251 6.606 4.817 -13.538 1.00 0.00 H new ATOM 0 HB3 ASN A 251 6.622 4.184 -11.904 1.00 0.00 H new ATOM 0 HD21 ASN A 251 7.888 7.323 -10.955 1.00 0.00 H new ATOM 0 HD22 ASN A 251 6.529 6.194 -10.938 1.00 0.00 H new ATOM 1346 N ASP A 252 8.278 2.320 -11.003 1.00 0.00 N ATOM 1347 CA ASP A 252 8.909 1.745 -9.834 1.00 0.00 C ATOM 1348 C ASP A 252 9.339 0.320 -10.110 1.00 0.00 C ATOM 1349 O ASP A 252 10.407 -0.120 -9.689 1.00 0.00 O ATOM 1350 CB ASP A 252 7.949 1.768 -8.665 1.00 0.00 C ATOM 1351 CG ASP A 252 8.532 1.127 -7.437 1.00 0.00 C ATOM 1352 OD1 ASP A 252 9.388 1.754 -6.782 1.00 0.00 O ATOM 1353 OD2 ASP A 252 8.136 -0.005 -7.123 1.00 0.00 O ATOM 0 H ASP A 252 7.260 2.254 -11.005 1.00 0.00 H new ATOM 0 HA ASP A 252 9.791 2.338 -9.591 1.00 0.00 H new ATOM 0 HB2 ASP A 252 7.678 2.800 -8.440 1.00 0.00 H new ATOM 0 HB3 ASP A 252 7.031 1.250 -8.941 1.00 0.00 H new ATOM 1358 N GLY A 253 8.495 -0.388 -10.831 1.00 0.00 N ATOM 1359 CA GLY A 253 8.760 -1.774 -11.152 1.00 0.00 C ATOM 1360 C GLY A 253 7.931 -2.724 -10.312 1.00 0.00 C ATOM 1361 O GLY A 253 7.890 -3.925 -10.580 1.00 0.00 O ATOM 0 H GLY A 253 7.618 -0.026 -11.206 1.00 0.00 H new ATOM 0 HA2 GLY A 253 8.550 -1.947 -12.207 1.00 0.00 H new ATOM 0 HA3 GLY A 253 9.818 -1.985 -10.999 1.00 0.00 H new ATOM 1365 N CYS A 254 7.260 -2.184 -9.314 1.00 0.00 N ATOM 1366 CA CYS A 254 6.435 -2.979 -8.416 1.00 0.00 C ATOM 1367 C CYS A 254 5.090 -2.293 -8.157 1.00 0.00 C ATOM 1368 O CYS A 254 4.882 -1.138 -8.550 1.00 0.00 O ATOM 1369 CB CYS A 254 7.166 -3.205 -7.090 1.00 0.00 C ATOM 1370 SG CYS A 254 8.767 -4.037 -7.250 1.00 0.00 S ATOM 0 H CYS A 254 7.269 -1.187 -9.100 1.00 0.00 H new ATOM 0 HA CYS A 254 6.246 -3.941 -8.892 1.00 0.00 H new ATOM 0 HB2 CYS A 254 7.318 -2.241 -6.604 1.00 0.00 H new ATOM 0 HB3 CYS A 254 6.527 -3.796 -6.433 1.00 0.00 H new ATOM 0 HG CYS A 254 9.302 -4.178 -6.074 1.00 0.00 H new ATOM 1376 N VAL A 255 4.168 -3.023 -7.534 1.00 0.00 N ATOM 1377 CA VAL A 255 2.891 -2.453 -7.124 1.00 0.00 C ATOM 1378 C VAL A 255 3.066 -1.836 -5.750 1.00 0.00 C ATOM 1379 O VAL A 255 3.405 -2.532 -4.787 1.00 0.00 O ATOM 1380 CB VAL A 255 1.770 -3.520 -7.059 1.00 0.00 C ATOM 1381 CG1 VAL A 255 0.467 -2.907 -6.566 1.00 0.00 C ATOM 1382 CG2 VAL A 255 1.570 -4.177 -8.415 1.00 0.00 C ATOM 0 H VAL A 255 4.283 -4.010 -7.303 1.00 0.00 H new ATOM 0 HA VAL A 255 2.594 -1.708 -7.862 1.00 0.00 H new ATOM 0 HB VAL A 255 2.077 -4.288 -6.349 1.00 0.00 H new ATOM 0 HG11 VAL A 255 -0.305 -3.675 -6.529 1.00 0.00 H new ATOM 0 HG12 VAL A 255 0.614 -2.492 -5.569 1.00 0.00 H new ATOM 0 HG13 VAL A 255 0.157 -2.114 -7.247 1.00 0.00 H new ATOM 0 HG21 VAL A 255 0.778 -4.923 -8.345 1.00 0.00 H new ATOM 0 HG22 VAL A 255 1.292 -3.420 -9.149 1.00 0.00 H new ATOM 0 HG23 VAL A 255 2.496 -4.660 -8.725 1.00 0.00 H new ATOM 1392 N ASN A 256 2.829 -0.552 -5.650 1.00 0.00 N ATOM 1393 CA ASN A 256 3.083 0.153 -4.415 1.00 0.00 C ATOM 1394 C ASN A 256 1.799 0.686 -3.820 1.00 0.00 C ATOM 1395 O ASN A 256 0.848 0.958 -4.529 1.00 0.00 O ATOM 1396 CB ASN A 256 4.057 1.307 -4.662 1.00 0.00 C ATOM 1397 CG ASN A 256 5.386 0.845 -5.240 1.00 0.00 C ATOM 1398 OD1 ASN A 256 6.282 0.424 -4.512 1.00 0.00 O ATOM 1399 ND2 ASN A 256 5.516 0.932 -6.558 1.00 0.00 N ATOM 0 H ASN A 256 2.462 0.027 -6.405 1.00 0.00 H new ATOM 0 HA ASN A 256 3.524 -0.549 -3.708 1.00 0.00 H new ATOM 0 HB2 ASN A 256 3.599 2.023 -5.344 1.00 0.00 H new ATOM 0 HB3 ASN A 256 4.237 1.831 -3.723 1.00 0.00 H new ATOM 0 HD21 ASN A 256 6.386 0.643 -7.005 1.00 0.00 H new ATOM 0 HD22 ASN A 256 4.746 1.288 -7.124 1.00 0.00 H new ATOM 1406 N ALA A 257 1.775 0.796 -2.523 1.00 0.00 N ATOM 1407 CA ALA A 257 0.655 1.365 -1.815 1.00 0.00 C ATOM 1408 C ALA A 257 1.129 2.560 -0.997 1.00 0.00 C ATOM 1409 O ALA A 257 2.220 2.535 -0.427 1.00 0.00 O ATOM 1410 CB ALA A 257 0.008 0.320 -0.919 1.00 0.00 C ATOM 0 H ALA A 257 2.537 0.492 -1.918 1.00 0.00 H new ATOM 0 HA ALA A 257 -0.094 1.701 -2.533 1.00 0.00 H new ATOM 0 HB1 ALA A 257 -0.836 0.765 -0.391 1.00 0.00 H new ATOM 0 HB2 ALA A 257 -0.343 -0.514 -1.527 1.00 0.00 H new ATOM 0 HB3 ALA A 257 0.739 -0.041 -0.195 1.00 0.00 H new ATOM 1416 N VAL A 258 0.330 3.600 -0.949 1.00 0.00 N ATOM 1417 CA VAL A 258 0.691 4.793 -0.207 1.00 0.00 C ATOM 1418 C VAL A 258 -0.326 5.061 0.900 1.00 0.00 C ATOM 1419 O VAL A 258 -1.533 4.914 0.695 1.00 0.00 O ATOM 1420 CB VAL A 258 0.815 6.033 -1.143 1.00 0.00 C ATOM 1421 CG1 VAL A 258 -0.501 6.332 -1.851 1.00 0.00 C ATOM 1422 CG2 VAL A 258 1.305 7.252 -0.372 1.00 0.00 C ATOM 0 H VAL A 258 -0.576 3.648 -1.414 1.00 0.00 H new ATOM 0 HA VAL A 258 1.667 4.619 0.245 1.00 0.00 H new ATOM 0 HB VAL A 258 1.555 5.794 -1.907 1.00 0.00 H new ATOM 0 HG11 VAL A 258 -0.378 7.203 -2.495 1.00 0.00 H new ATOM 0 HG12 VAL A 258 -0.793 5.472 -2.454 1.00 0.00 H new ATOM 0 HG13 VAL A 258 -1.275 6.535 -1.110 1.00 0.00 H new ATOM 0 HG21 VAL A 258 1.383 8.103 -1.048 1.00 0.00 H new ATOM 0 HG22 VAL A 258 0.600 7.486 0.426 1.00 0.00 H new ATOM 0 HG23 VAL A 258 2.284 7.041 0.059 1.00 0.00 H new ATOM 1432 N LEU A 259 0.164 5.428 2.072 1.00 0.00 N ATOM 1433 CA LEU A 259 -0.703 5.677 3.211 1.00 0.00 C ATOM 1434 C LEU A 259 -1.424 6.999 3.060 1.00 0.00 C ATOM 1435 O LEU A 259 -0.791 8.043 2.876 1.00 0.00 O ATOM 1436 CB LEU A 259 0.105 5.694 4.520 1.00 0.00 C ATOM 1437 CG LEU A 259 -0.710 5.908 5.802 1.00 0.00 C ATOM 1438 CD1 LEU A 259 -1.694 4.775 6.016 1.00 0.00 C ATOM 1439 CD2 LEU A 259 0.208 6.057 7.004 1.00 0.00 C ATOM 0 H LEU A 259 1.158 5.560 2.260 1.00 0.00 H new ATOM 0 HA LEU A 259 -1.434 4.869 3.248 1.00 0.00 H new ATOM 0 HB2 LEU A 259 0.642 4.749 4.606 1.00 0.00 H new ATOM 0 HB3 LEU A 259 0.855 6.482 4.452 1.00 0.00 H new ATOM 0 HG LEU A 259 -1.279 6.831 5.689 1.00 0.00 H new ATOM 0 HD11 LEU A 259 -2.259 4.952 6.931 1.00 0.00 H new ATOM 0 HD12 LEU A 259 -2.380 4.724 5.170 1.00 0.00 H new ATOM 0 HD13 LEU A 259 -1.152 3.833 6.100 1.00 0.00 H new ATOM 0 HD21 LEU A 259 -0.390 6.208 7.902 1.00 0.00 H new ATOM 0 HD22 LEU A 259 0.810 5.155 7.116 1.00 0.00 H new ATOM 0 HD23 LEU A 259 0.864 6.915 6.857 1.00 0.00 H new ATOM 1451 N LEU A 260 -2.738 6.958 3.126 1.00 0.00 N ATOM 1452 CA LEU A 260 -3.515 8.170 3.113 1.00 0.00 C ATOM 1453 C LEU A 260 -3.634 8.671 4.535 1.00 0.00 C ATOM 1454 O LEU A 260 -4.530 8.281 5.279 1.00 0.00 O ATOM 1455 CB LEU A 260 -4.907 7.957 2.489 1.00 0.00 C ATOM 1456 CG LEU A 260 -5.692 6.729 2.968 1.00 0.00 C ATOM 1457 CD1 LEU A 260 -7.179 7.028 2.987 1.00 0.00 C ATOM 1458 CD2 LEU A 260 -5.416 5.537 2.064 1.00 0.00 C ATOM 0 H LEU A 260 -3.285 6.099 3.189 1.00 0.00 H new ATOM 0 HA LEU A 260 -3.010 8.910 2.492 1.00 0.00 H new ATOM 0 HB2 LEU A 260 -5.508 8.844 2.686 1.00 0.00 H new ATOM 0 HB3 LEU A 260 -4.789 7.886 1.408 1.00 0.00 H new ATOM 0 HG LEU A 260 -5.367 6.487 3.980 1.00 0.00 H new ATOM 0 HD11 LEU A 260 -7.723 6.147 3.329 1.00 0.00 H new ATOM 0 HD12 LEU A 260 -7.374 7.860 3.663 1.00 0.00 H new ATOM 0 HD13 LEU A 260 -7.510 7.291 1.982 1.00 0.00 H new ATOM 0 HD21 LEU A 260 -5.980 4.674 2.417 1.00 0.00 H new ATOM 0 HD22 LEU A 260 -5.719 5.776 1.044 1.00 0.00 H new ATOM 0 HD23 LEU A 260 -4.351 5.306 2.082 1.00 0.00 H new ATOM 1470 N VAL A 261 -2.707 9.509 4.916 1.00 0.00 N ATOM 1471 CA VAL A 261 -2.636 9.992 6.281 1.00 0.00 C ATOM 1472 C VAL A 261 -3.708 11.039 6.536 1.00 0.00 C ATOM 1473 O VAL A 261 -3.647 12.118 5.873 1.00 0.00 O ATOM 1474 CB VAL A 261 -1.241 10.580 6.610 1.00 0.00 C ATOM 1475 CG1 VAL A 261 -0.938 10.432 8.086 1.00 0.00 C ATOM 1476 CG2 VAL A 261 -0.153 9.915 5.775 1.00 0.00 C ATOM 0 H VAL A 261 -1.983 9.877 4.299 1.00 0.00 H new ATOM 0 HA VAL A 261 -2.806 9.136 6.934 1.00 0.00 H new ATOM 0 HB VAL A 261 -1.257 11.641 6.361 1.00 0.00 H new ATOM 0 HG11 VAL A 261 0.046 10.850 8.299 1.00 0.00 H new ATOM 0 HG12 VAL A 261 -1.692 10.963 8.667 1.00 0.00 H new ATOM 0 HG13 VAL A 261 -0.949 9.376 8.356 1.00 0.00 H new ATOM 0 HG21 VAL A 261 0.815 10.348 6.027 1.00 0.00 H new ATOM 0 HG22 VAL A 261 -0.137 8.845 5.983 1.00 0.00 H new ATOM 0 HG23 VAL A 261 -0.357 10.076 4.716 1.00 0.00 H new TER 1486 VAL A 261