USER MOD reduce.3.24.130724 H: found=0, std=0, add=928, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 928 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 109 SER OG : rot -67:sc= -0.54 USER MOD Set 1.2: A 114 GLN : amide:sc= -0.7 K(o=-1.2,f=-1.8!) USER MOD Set 2.1: A 68 MET CE :methyl 156:sc= -3.69! (180deg=-2.73!) USER MOD Set 2.2: A 144 MET CE :methyl -137:sc= -0.46 (180deg=-0.462) USER MOD Single : A 12 HIS : no HD1:sc= -8.87! C(o=-8.9!,f=-9.5!) USER MOD Single : A 13 GLN :FLIP amide:sc= -0.154 F(o=-0.73,f=-0.15) USER MOD Single : A 16 SER OG : rot 180:sc= 0.18 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc= -3.11! C(o=-3.1!,f=-10!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 180:sc= -0.0142 USER MOD Single : A 39 MET CE :methyl 141:sc= -4.34! (180deg=-8.24!) USER MOD Single : A 41 SER OG : rot -52:sc= 0.142 USER MOD Single : A 44 SER OG : rot -170:sc= 0.539 USER MOD Single : A 48 THR OG1 : rot -123:sc= 0.88 USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=-0.03) USER MOD Single : A 53 ASN : amide:sc= -0.518 X(o=-0.52,f=-0.11) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 MET CE :methyl 180:sc= -2.6 (180deg=-2.6) USER MOD Single : A 57 ASN : amide:sc= -0.312 K(o=-0.31,f=-3.1!) USER MOD Single : A 58 THR OG1 : rot 89:sc= -0.0821 USER MOD Single : A 62 HIS :FLIP no HE2:sc= 0.1 F(o=-2.3,f=0.1) USER MOD Single : A 63 GLN : amide:sc= 0 K(o=0,f=-0.95) USER MOD Single : A 66 MET CE :methyl -145:sc= -0.864 (180deg=-3.04!) USER MOD Single : A 67 GLN : amide:sc= -0.22 K(o=-0.22,f=-1.9!) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc=-0.00636 X(o=-0.0064,f=-0.48) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 GLN : amide:sc= -0.0118 X(o=-0.012,f=-0.0071) USER MOD Single : A 118 MET CE :methyl -137:sc= -0.844 (180deg=-2.06) USER MOD Single : A 119 THR OG1 : rot 95:sc= 1.22 USER MOD Single : A 120 HIS : no HD1:sc= -0.305 X(o=-0.31,f=-0.6) USER MOD Single : A 121 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= -0.165 X(o=-0.16,f=0) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 0.816 0.444 -0.262 1.00 0.00 N ATOM 2 CA PRO A 1 1.454 0.380 -1.566 1.00 0.00 C ATOM 3 C PRO A 1 1.392 -1.038 -2.139 1.00 0.00 C ATOM 4 O PRO A 1 1.775 -1.997 -1.472 1.00 0.00 O ATOM 5 CB PRO A 1 2.876 0.865 -1.332 1.00 0.00 C ATOM 6 CG PRO A 1 3.119 0.739 0.163 1.00 0.00 C ATOM 7 CD PRO A 1 1.773 0.529 0.837 1.00 0.00 C ATOM 0 H2 PRO A 1 0.232 -0.382 -0.134 1.00 0.00 H new ATOM 0 H3 PRO A 1 0.198 1.255 -0.231 1.00 0.00 H new ATOM 0 HA PRO A 1 0.953 0.999 -2.310 1.00 0.00 H new ATOM 0 HB2 PRO A 1 3.591 0.265 -1.896 1.00 0.00 H new ATOM 0 HB3 PRO A 1 2.996 1.897 -1.661 1.00 0.00 H new ATOM 0 HG2 PRO A 1 3.786 -0.098 0.372 1.00 0.00 H new ATOM 0 HG3 PRO A 1 3.603 1.636 0.548 1.00 0.00 H new ATOM 0 HD2 PRO A 1 1.769 -0.381 1.437 1.00 0.00 H new ATOM 0 HD3 PRO A 1 1.533 1.354 1.508 1.00 0.00 H new ATOM 15 N ILE A 2 0.906 -1.124 -3.368 1.00 0.00 N ATOM 16 CA ILE A 2 0.790 -2.408 -4.038 1.00 0.00 C ATOM 17 C ILE A 2 1.726 -2.435 -5.247 1.00 0.00 C ATOM 18 O ILE A 2 2.002 -1.397 -5.846 1.00 0.00 O ATOM 19 CB ILE A 2 -0.672 -2.699 -4.386 1.00 0.00 C ATOM 20 CG1 ILE A 2 -1.487 -2.994 -3.125 1.00 0.00 C ATOM 21 CG2 ILE A 2 -0.776 -3.829 -5.413 1.00 0.00 C ATOM 22 CD1 ILE A 2 -2.983 -3.061 -3.442 1.00 0.00 C ATOM 0 H ILE A 2 0.588 -0.326 -3.917 1.00 0.00 H new ATOM 0 HA ILE A 2 1.104 -3.214 -3.374 1.00 0.00 H new ATOM 0 HB ILE A 2 -1.099 -1.807 -4.844 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -1.161 -3.939 -2.690 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -1.304 -2.220 -2.380 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -1.825 -4.016 -5.643 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -0.250 -3.542 -6.324 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -0.327 -4.734 -5.005 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -3.539 -3.272 -2.529 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -3.311 -2.107 -3.854 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -3.166 -3.852 -4.169 1.00 0.00 H new ATOM 158 N VAL A 11 0.017 -7.908 -6.042 1.00 0.00 N ATOM 159 CA VAL A 11 0.287 -8.214 -4.648 1.00 0.00 C ATOM 160 C VAL A 11 0.666 -6.927 -3.911 1.00 0.00 C ATOM 161 O VAL A 11 1.168 -5.984 -4.520 1.00 0.00 O ATOM 162 CB VAL A 11 1.362 -9.297 -4.549 1.00 0.00 C ATOM 163 CG1 VAL A 11 0.865 -10.619 -5.137 1.00 0.00 C ATOM 164 CG2 VAL A 11 2.658 -8.848 -5.227 1.00 0.00 C ATOM 0 HA VAL A 11 -0.605 -8.614 -4.166 1.00 0.00 H new ATOM 0 HB VAL A 11 1.576 -9.460 -3.493 1.00 0.00 H new ATOM 0 HG11 VAL A 11 1.649 -11.372 -5.054 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -0.017 -10.952 -4.590 1.00 0.00 H new ATOM 0 HG13 VAL A 11 0.609 -10.477 -6.187 1.00 0.00 H new ATOM 0 HG21 VAL A 11 3.405 -9.637 -5.142 1.00 0.00 H new ATOM 0 HG22 VAL A 11 2.466 -8.643 -6.280 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.028 -7.944 -4.743 1.00 0.00 H new ATOM 174 N HIS A 12 0.408 -6.929 -2.612 1.00 0.00 N ATOM 175 CA HIS A 12 0.715 -5.774 -1.787 1.00 0.00 C ATOM 176 C HIS A 12 2.104 -5.939 -1.168 1.00 0.00 C ATOM 177 O HIS A 12 2.578 -7.060 -0.987 1.00 0.00 O ATOM 178 CB HIS A 12 -0.377 -5.548 -0.738 1.00 0.00 C ATOM 179 CG HIS A 12 -0.598 -6.726 0.181 1.00 0.00 C ATOM 180 ND1 HIS A 12 0.279 -7.056 1.200 1.00 0.00 N ATOM 181 CD2 HIS A 12 -1.603 -7.647 0.225 1.00 0.00 C ATOM 182 CE1 HIS A 12 -0.187 -8.129 1.822 1.00 0.00 C ATOM 183 NE2 HIS A 12 -1.354 -8.494 1.216 1.00 0.00 N ATOM 0 H HIS A 12 -0.010 -7.712 -2.110 1.00 0.00 H new ATOM 0 HA HIS A 12 0.735 -4.877 -2.406 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -0.116 -4.676 -0.138 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -1.313 -5.316 -1.247 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -2.457 -7.681 -0.435 1.00 0.00 H new ATOM 0 HE1 HIS A 12 0.275 -8.627 2.661 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -1.938 -9.287 1.481 1.00 0.00 H new ATOM 192 N GLN A 13 2.719 -4.807 -0.862 1.00 0.00 N ATOM 193 CA GLN A 13 4.046 -4.812 -0.268 1.00 0.00 C ATOM 194 C GLN A 13 4.011 -4.157 1.114 1.00 0.00 C ATOM 195 O GLN A 13 4.911 -3.396 1.467 1.00 0.00 O ATOM 196 CB GLN A 13 5.058 -4.114 -1.180 1.00 0.00 C ATOM 197 CG GLN A 13 6.477 -4.613 -0.905 1.00 0.00 C ATOM 198 CD GLN A 13 7.133 -5.136 -2.186 1.00 0.00 C ATOM 199 OE1 GLN A 13 6.888 -4.393 -3.260 1.00 0.00 O flip ATOM 200 NE2 GLN A 13 7.816 -6.146 -2.195 1.00 0.00 N flip ATOM 0 H GLN A 13 2.323 -3.879 -1.014 1.00 0.00 H new ATOM 0 HA GLN A 13 4.366 -5.847 -0.150 1.00 0.00 H new ATOM 0 HB2 GLN A 13 4.800 -4.297 -2.223 1.00 0.00 H new ATOM 0 HB3 GLN A 13 5.011 -3.036 -1.024 1.00 0.00 H new ATOM 0 HG2 GLN A 13 7.077 -3.803 -0.490 1.00 0.00 H new ATOM 0 HG3 GLN A 13 6.449 -5.405 -0.157 1.00 0.00 H new ATOM 0 HE21 GLN A 13 7.963 -6.670 -1.332 1.00 0.00 H new ATOM 0 HE22 GLN A 13 8.240 -6.467 -3.065 1.00 0.00 H new ATOM 209 N ALA A 14 2.962 -4.476 1.858 1.00 0.00 N ATOM 210 CA ALA A 14 2.798 -3.927 3.195 1.00 0.00 C ATOM 211 C ALA A 14 3.057 -2.420 3.158 1.00 0.00 C ATOM 212 O ALA A 14 3.247 -1.845 2.087 1.00 0.00 O ATOM 213 CB ALA A 14 3.732 -4.656 4.163 1.00 0.00 C ATOM 0 H ALA A 14 2.217 -5.107 1.561 1.00 0.00 H new ATOM 0 HA ALA A 14 1.778 -4.077 3.550 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.610 -4.245 5.165 1.00 0.00 H new ATOM 0 HB2 ALA A 14 3.488 -5.718 4.174 1.00 0.00 H new ATOM 0 HB3 ALA A 14 4.765 -4.525 3.840 1.00 0.00 H new ATOM 219 N ILE A 15 3.055 -1.822 4.340 1.00 0.00 N ATOM 220 CA ILE A 15 3.286 -0.393 4.457 1.00 0.00 C ATOM 221 C ILE A 15 4.779 -0.138 4.668 1.00 0.00 C ATOM 222 O ILE A 15 5.582 -1.070 4.643 1.00 0.00 O ATOM 223 CB ILE A 15 2.399 0.206 5.550 1.00 0.00 C ATOM 224 CG1 ILE A 15 2.008 1.647 5.212 1.00 0.00 C ATOM 225 CG2 ILE A 15 3.071 0.102 6.920 1.00 0.00 C ATOM 226 CD1 ILE A 15 0.569 1.940 5.639 1.00 0.00 C ATOM 0 H ILE A 15 2.897 -2.302 5.226 1.00 0.00 H new ATOM 0 HA ILE A 15 3.003 0.115 3.535 1.00 0.00 H new ATOM 0 HB ILE A 15 1.478 -0.375 5.598 1.00 0.00 H new ATOM 0 HG12 ILE A 15 2.687 2.338 5.711 1.00 0.00 H new ATOM 0 HG13 ILE A 15 2.114 1.814 4.140 1.00 0.00 H new ATOM 0 HG21 ILE A 15 2.419 0.535 7.679 1.00 0.00 H new ATOM 0 HG22 ILE A 15 3.256 -0.946 7.156 1.00 0.00 H new ATOM 0 HG23 ILE A 15 4.017 0.643 6.903 1.00 0.00 H new ATOM 0 HD11 ILE A 15 0.317 2.970 5.387 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -0.110 1.263 5.120 1.00 0.00 H new ATOM 0 HD13 ILE A 15 0.472 1.796 6.715 1.00 0.00 H new ATOM 238 N SER A 16 5.108 1.129 4.873 1.00 0.00 N ATOM 239 CA SER A 16 6.492 1.518 5.090 1.00 0.00 C ATOM 240 C SER A 16 6.617 2.297 6.401 1.00 0.00 C ATOM 241 O SER A 16 5.704 3.026 6.784 1.00 0.00 O ATOM 242 CB SER A 16 7.016 2.356 3.922 1.00 0.00 C ATOM 243 OG SER A 16 8.003 3.296 4.342 1.00 0.00 O ATOM 0 H SER A 16 4.440 1.900 4.893 1.00 0.00 H new ATOM 0 HA SER A 16 7.097 0.613 5.154 1.00 0.00 H new ATOM 0 HB2 SER A 16 7.441 1.697 3.165 1.00 0.00 H new ATOM 0 HB3 SER A 16 6.186 2.886 3.454 1.00 0.00 H new ATOM 0 HG SER A 16 8.314 3.811 3.569 1.00 0.00 H new ATOM 249 N PRO A 17 7.786 2.109 7.070 1.00 0.00 N ATOM 250 CA PRO A 17 8.043 2.784 8.331 1.00 0.00 C ATOM 251 C PRO A 17 8.370 4.262 8.104 1.00 0.00 C ATOM 252 O PRO A 17 7.997 5.114 8.909 1.00 0.00 O ATOM 253 CB PRO A 17 9.190 2.014 8.964 1.00 0.00 C ATOM 254 CG PRO A 17 9.837 1.228 7.835 1.00 0.00 C ATOM 255 CD PRO A 17 8.890 1.252 6.648 1.00 0.00 C ATOM 0 HA PRO A 17 7.174 2.790 8.989 1.00 0.00 H new ATOM 0 HB2 PRO A 17 9.906 2.692 9.429 1.00 0.00 H new ATOM 0 HB3 PRO A 17 8.828 1.347 9.747 1.00 0.00 H new ATOM 0 HG2 PRO A 17 10.798 1.667 7.566 1.00 0.00 H new ATOM 0 HG3 PRO A 17 10.032 0.202 8.147 1.00 0.00 H new ATOM 0 HD2 PRO A 17 9.380 1.648 5.759 1.00 0.00 H new ATOM 0 HD3 PRO A 17 8.541 0.250 6.400 1.00 0.00 H new ATOM 263 N ARG A 18 9.062 4.520 7.005 1.00 0.00 N ATOM 264 CA ARG A 18 9.442 5.880 6.662 1.00 0.00 C ATOM 265 C ARG A 18 8.207 6.698 6.281 1.00 0.00 C ATOM 266 O ARG A 18 8.145 7.897 6.544 1.00 0.00 O ATOM 267 CB ARG A 18 10.436 5.897 5.499 1.00 0.00 C ATOM 268 CG ARG A 18 11.863 6.129 5.999 1.00 0.00 C ATOM 269 CD ARG A 18 12.847 6.216 4.830 1.00 0.00 C ATOM 270 NE ARG A 18 14.003 5.326 5.076 1.00 0.00 N ATOM 271 CZ ARG A 18 15.115 5.315 4.326 1.00 0.00 C ATOM 272 NH1 ARG A 18 15.226 6.146 3.281 1.00 0.00 N ATOM 273 NH2 ARG A 18 16.115 4.473 4.623 1.00 0.00 N ATOM 0 H ARG A 18 9.370 3.810 6.340 1.00 0.00 H new ATOM 0 HA ARG A 18 9.917 6.322 7.538 1.00 0.00 H new ATOM 0 HB2 ARG A 18 10.385 4.951 4.959 1.00 0.00 H new ATOM 0 HB3 ARG A 18 10.162 6.682 4.794 1.00 0.00 H new ATOM 0 HG2 ARG A 18 11.903 7.049 6.582 1.00 0.00 H new ATOM 0 HG3 ARG A 18 12.155 5.317 6.665 1.00 0.00 H new ATOM 0 HD2 ARG A 18 12.349 5.932 3.903 1.00 0.00 H new ATOM 0 HD3 ARG A 18 13.188 7.244 4.707 1.00 0.00 H new ATOM 0 HE ARG A 18 13.951 4.681 5.865 1.00 0.00 H new ATOM 0 HH11 ARG A 18 14.465 6.787 3.056 1.00 0.00 H new ATOM 0 HH12 ARG A 18 16.072 6.138 2.711 1.00 0.00 H new ATOM 0 HH21 ARG A 18 16.030 3.841 5.419 1.00 0.00 H new ATOM 0 HH22 ARG A 18 16.961 4.464 4.053 1.00 0.00 H new ATOM 287 N THR A 19 7.251 6.015 5.666 1.00 0.00 N ATOM 288 CA THR A 19 6.020 6.662 5.246 1.00 0.00 C ATOM 289 C THR A 19 5.131 6.953 6.457 1.00 0.00 C ATOM 290 O THR A 19 4.664 8.077 6.633 1.00 0.00 O ATOM 291 CB THR A 19 5.350 5.770 4.200 1.00 0.00 C ATOM 292 OG1 THR A 19 5.415 6.535 2.998 1.00 0.00 O ATOM 293 CG2 THR A 19 3.851 5.598 4.451 1.00 0.00 C ATOM 0 H THR A 19 7.305 5.020 5.449 1.00 0.00 H new ATOM 0 HA THR A 19 6.218 7.631 4.788 1.00 0.00 H new ATOM 0 HB THR A 19 5.832 4.792 4.195 1.00 0.00 H new ATOM 0 HG1 THR A 19 5.004 6.030 2.266 1.00 0.00 H new ATOM 0 HG21 THR A 19 3.424 4.956 3.680 1.00 0.00 H new ATOM 0 HG22 THR A 19 3.696 5.143 5.429 1.00 0.00 H new ATOM 0 HG23 THR A 19 3.363 6.572 4.423 1.00 0.00 H new ATOM 301 N LEU A 20 4.922 5.919 7.258 1.00 0.00 N ATOM 302 CA LEU A 20 4.096 6.049 8.447 1.00 0.00 C ATOM 303 C LEU A 20 4.760 7.025 9.420 1.00 0.00 C ATOM 304 O LEU A 20 4.086 7.851 10.034 1.00 0.00 O ATOM 305 CB LEU A 20 3.810 4.674 9.054 1.00 0.00 C ATOM 306 CG LEU A 20 2.665 3.885 8.417 1.00 0.00 C ATOM 307 CD1 LEU A 20 2.677 2.428 8.883 1.00 0.00 C ATOM 308 CD2 LEU A 20 1.318 4.560 8.683 1.00 0.00 C ATOM 0 H LEU A 20 5.310 4.988 7.108 1.00 0.00 H new ATOM 0 HA LEU A 20 3.123 6.467 8.191 1.00 0.00 H new ATOM 0 HB2 LEU A 20 4.718 4.074 8.990 1.00 0.00 H new ATOM 0 HB3 LEU A 20 3.589 4.805 10.113 1.00 0.00 H new ATOM 0 HG LEU A 20 2.815 3.879 7.337 1.00 0.00 H new ATOM 0 HD11 LEU A 20 1.853 1.890 8.415 1.00 0.00 H new ATOM 0 HD12 LEU A 20 3.621 1.963 8.600 1.00 0.00 H new ATOM 0 HD13 LEU A 20 2.565 2.392 9.967 1.00 0.00 H new ATOM 0 HD21 LEU A 20 0.522 3.978 8.219 1.00 0.00 H new ATOM 0 HD22 LEU A 20 1.146 4.618 9.758 1.00 0.00 H new ATOM 0 HD23 LEU A 20 1.325 5.565 8.262 1.00 0.00 H new ATOM 320 N ASN A 21 6.074 6.897 9.531 1.00 0.00 N ATOM 321 CA ASN A 21 6.838 7.758 10.419 1.00 0.00 C ATOM 322 C ASN A 21 6.623 9.218 10.017 1.00 0.00 C ATOM 323 O ASN A 21 6.144 10.022 10.816 1.00 0.00 O ATOM 324 CB ASN A 21 8.335 7.457 10.324 1.00 0.00 C ATOM 325 CG ASN A 21 9.137 8.366 11.258 1.00 0.00 C ATOM 326 OD1 ASN A 21 8.783 9.506 11.512 1.00 0.00 O ATOM 327 ND2 ASN A 21 10.235 7.801 11.753 1.00 0.00 N ATOM 0 H ASN A 21 6.629 6.210 9.021 1.00 0.00 H new ATOM 0 HA ASN A 21 6.498 7.578 11.439 1.00 0.00 H new ATOM 0 HB2 ASN A 21 8.517 6.414 10.581 1.00 0.00 H new ATOM 0 HB3 ASN A 21 8.673 7.596 9.297 1.00 0.00 H new ATOM 0 HD21 ASN A 21 10.838 8.327 12.386 1.00 0.00 H new ATOM 0 HD22 ASN A 21 10.474 6.842 11.500 1.00 0.00 H new ATOM 334 N ALA A 22 6.986 9.518 8.779 1.00 0.00 N ATOM 335 CA ALA A 22 6.840 10.867 8.261 1.00 0.00 C ATOM 336 C ALA A 22 5.404 11.343 8.490 1.00 0.00 C ATOM 337 O ALA A 22 5.182 12.473 8.923 1.00 0.00 O ATOM 338 CB ALA A 22 7.233 10.892 6.782 1.00 0.00 C ATOM 0 H ALA A 22 7.382 8.849 8.119 1.00 0.00 H new ATOM 0 HA ALA A 22 7.504 11.554 8.786 1.00 0.00 H new ATOM 0 HB1 ALA A 22 7.123 11.904 6.393 1.00 0.00 H new ATOM 0 HB2 ALA A 22 8.270 10.573 6.676 1.00 0.00 H new ATOM 0 HB3 ALA A 22 6.586 10.217 6.222 1.00 0.00 H new ATOM 344 N TRP A 23 4.465 10.457 8.190 1.00 0.00 N ATOM 345 CA TRP A 23 3.057 10.772 8.358 1.00 0.00 C ATOM 346 C TRP A 23 2.849 11.254 9.796 1.00 0.00 C ATOM 347 O TRP A 23 2.397 12.376 10.019 1.00 0.00 O ATOM 348 CB TRP A 23 2.179 9.573 7.998 1.00 0.00 C ATOM 349 CG TRP A 23 0.736 9.686 8.493 1.00 0.00 C ATOM 350 CD1 TRP A 23 0.114 8.923 9.402 1.00 0.00 C ATOM 351 CD2 TRP A 23 -0.246 10.654 8.068 1.00 0.00 C ATOM 352 NE1 TRP A 23 -1.192 9.326 9.594 1.00 0.00 N ATOM 353 CE2 TRP A 23 -1.417 10.412 8.756 1.00 0.00 C ATOM 354 CE3 TRP A 23 -0.148 11.699 7.133 1.00 0.00 C ATOM 355 CZ2 TRP A 23 -2.579 11.174 8.582 1.00 0.00 C ATOM 356 CZ3 TRP A 23 -1.318 12.450 6.970 1.00 0.00 C ATOM 357 CH2 TRP A 23 -2.505 12.220 7.655 1.00 0.00 C ATOM 0 H TRP A 23 4.652 9.521 7.831 1.00 0.00 H new ATOM 0 HA TRP A 23 2.756 11.567 7.676 1.00 0.00 H new ATOM 0 HB2 TRP A 23 2.172 9.453 6.915 1.00 0.00 H new ATOM 0 HB3 TRP A 23 2.626 8.671 8.415 1.00 0.00 H new ATOM 0 HD1 TRP A 23 0.577 8.096 9.920 1.00 0.00 H new ATOM 0 HE1 TRP A 23 -1.867 8.905 10.232 1.00 0.00 H new ATOM 0 HE3 TRP A 23 0.759 11.906 6.584 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 -3.484 10.966 9.134 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 -1.297 13.265 6.262 1.00 0.00 H new ATOM 0 HH2 TRP A 23 -3.366 12.845 7.473 1.00 0.00 H new ATOM 368 N VAL A 24 3.189 10.383 10.734 1.00 0.00 N ATOM 369 CA VAL A 24 3.046 10.706 12.143 1.00 0.00 C ATOM 370 C VAL A 24 3.570 12.121 12.394 1.00 0.00 C ATOM 371 O VAL A 24 2.953 12.895 13.124 1.00 0.00 O ATOM 372 CB VAL A 24 3.749 9.648 12.997 1.00 0.00 C ATOM 373 CG1 VAL A 24 3.840 10.093 14.457 1.00 0.00 C ATOM 374 CG2 VAL A 24 3.048 8.293 12.878 1.00 0.00 C ATOM 0 H VAL A 24 3.563 9.453 10.546 1.00 0.00 H new ATOM 0 HA VAL A 24 1.995 10.693 12.432 1.00 0.00 H new ATOM 0 HB VAL A 24 4.765 9.533 12.619 1.00 0.00 H new ATOM 0 HG11 VAL A 24 4.344 9.323 15.041 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.405 11.023 14.519 1.00 0.00 H new ATOM 0 HG13 VAL A 24 2.837 10.250 14.853 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.567 7.559 13.494 1.00 0.00 H new ATOM 0 HG22 VAL A 24 2.016 8.386 13.217 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.060 7.967 11.838 1.00 0.00 H new ATOM 384 N LYS A 25 4.703 12.417 11.773 1.00 0.00 N ATOM 385 CA LYS A 25 5.316 13.725 11.920 1.00 0.00 C ATOM 386 C LYS A 25 4.423 14.780 11.262 1.00 0.00 C ATOM 387 O LYS A 25 4.287 15.890 11.773 1.00 0.00 O ATOM 388 CB LYS A 25 6.748 13.710 11.381 1.00 0.00 C ATOM 389 CG LYS A 25 7.756 13.486 12.510 1.00 0.00 C ATOM 390 CD LYS A 25 8.204 12.025 12.565 1.00 0.00 C ATOM 391 CE LYS A 25 7.636 11.324 13.801 1.00 0.00 C ATOM 392 NZ LYS A 25 8.729 10.915 14.713 1.00 0.00 N ATOM 0 H LYS A 25 5.212 11.773 11.167 1.00 0.00 H new ATOM 0 HA LYS A 25 5.399 13.989 12.974 1.00 0.00 H new ATOM 0 HB2 LYS A 25 6.851 12.922 10.635 1.00 0.00 H new ATOM 0 HB3 LYS A 25 6.962 14.654 10.880 1.00 0.00 H new ATOM 0 HG2 LYS A 25 8.623 14.130 12.361 1.00 0.00 H new ATOM 0 HG3 LYS A 25 7.309 13.769 13.463 1.00 0.00 H new ATOM 0 HD2 LYS A 25 7.875 11.506 11.665 1.00 0.00 H new ATOM 0 HD3 LYS A 25 9.293 11.975 12.582 1.00 0.00 H new ATOM 0 HE2 LYS A 25 6.950 11.992 14.322 1.00 0.00 H new ATOM 0 HE3 LYS A 25 7.061 10.449 13.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 8.326 10.441 15.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 9.368 10.261 14.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 9.261 11.756 15.016 1.00 0.00 H new ATOM 406 N VAL A 26 3.838 14.393 10.138 1.00 0.00 N ATOM 407 CA VAL A 26 2.962 15.291 9.404 1.00 0.00 C ATOM 408 C VAL A 26 1.750 15.639 10.273 1.00 0.00 C ATOM 409 O VAL A 26 1.351 16.799 10.352 1.00 0.00 O ATOM 410 CB VAL A 26 2.574 14.665 8.063 1.00 0.00 C ATOM 411 CG1 VAL A 26 1.231 15.209 7.571 1.00 0.00 C ATOM 412 CG2 VAL A 26 3.670 14.885 7.019 1.00 0.00 C ATOM 0 H VAL A 26 3.953 13.471 9.718 1.00 0.00 H new ATOM 0 HA VAL A 26 3.478 16.224 9.175 1.00 0.00 H new ATOM 0 HB VAL A 26 2.465 13.591 8.214 1.00 0.00 H new ATOM 0 HG11 VAL A 26 0.979 14.747 6.616 1.00 0.00 H new ATOM 0 HG12 VAL A 26 0.455 14.978 8.301 1.00 0.00 H new ATOM 0 HG13 VAL A 26 1.300 16.289 7.445 1.00 0.00 H new ATOM 0 HG21 VAL A 26 3.370 14.431 6.075 1.00 0.00 H new ATOM 0 HG22 VAL A 26 3.825 15.954 6.874 1.00 0.00 H new ATOM 0 HG23 VAL A 26 4.597 14.427 7.363 1.00 0.00 H new ATOM 422 N VAL A 27 1.201 14.611 10.904 1.00 0.00 N ATOM 423 CA VAL A 27 0.044 14.793 11.764 1.00 0.00 C ATOM 424 C VAL A 27 0.456 15.591 13.003 1.00 0.00 C ATOM 425 O VAL A 27 -0.279 16.470 13.452 1.00 0.00 O ATOM 426 CB VAL A 27 -0.572 13.435 12.105 1.00 0.00 C ATOM 427 CG1 VAL A 27 -1.891 13.606 12.862 1.00 0.00 C ATOM 428 CG2 VAL A 27 -0.770 12.590 10.846 1.00 0.00 C ATOM 0 H VAL A 27 1.536 13.650 10.837 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.728 15.366 11.250 1.00 0.00 H new ATOM 0 HB VAL A 27 0.124 12.907 12.757 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.308 12.626 13.092 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -1.711 14.150 13.789 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.595 14.164 12.245 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.209 11.630 11.117 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -1.435 13.112 10.158 1.00 0.00 H new ATOM 0 HG23 VAL A 27 0.193 12.425 10.364 1.00 0.00 H new ATOM 438 N GLU A 28 1.629 15.257 13.520 1.00 0.00 N ATOM 439 CA GLU A 28 2.147 15.931 14.698 1.00 0.00 C ATOM 440 C GLU A 28 2.355 17.420 14.409 1.00 0.00 C ATOM 441 O GLU A 28 2.224 18.253 15.304 1.00 0.00 O ATOM 442 CB GLU A 28 3.446 15.279 15.177 1.00 0.00 C ATOM 443 CG GLU A 28 3.426 15.068 16.692 1.00 0.00 C ATOM 444 CD GLU A 28 3.721 13.609 17.047 1.00 0.00 C ATOM 445 OE1 GLU A 28 3.008 12.738 16.502 1.00 0.00 O ATOM 446 OE2 GLU A 28 4.650 13.398 17.855 1.00 0.00 O ATOM 0 H GLU A 28 2.236 14.528 13.144 1.00 0.00 H new ATOM 0 HA GLU A 28 1.414 15.835 15.499 1.00 0.00 H new ATOM 0 HB2 GLU A 28 3.584 14.322 14.674 1.00 0.00 H new ATOM 0 HB3 GLU A 28 4.294 15.907 14.905 1.00 0.00 H new ATOM 0 HG2 GLU A 28 4.164 15.717 17.163 1.00 0.00 H new ATOM 0 HG3 GLU A 28 2.452 15.353 17.090 1.00 0.00 H new ATOM 453 N GLU A 29 2.675 17.707 13.156 1.00 0.00 N ATOM 454 CA GLU A 29 2.902 19.080 12.738 1.00 0.00 C ATOM 455 C GLU A 29 1.577 19.747 12.364 1.00 0.00 C ATOM 456 O GLU A 29 1.382 20.934 12.619 1.00 0.00 O ATOM 457 CB GLU A 29 3.895 19.142 11.577 1.00 0.00 C ATOM 458 CG GLU A 29 4.808 20.364 11.699 1.00 0.00 C ATOM 459 CD GLU A 29 4.898 21.118 10.371 1.00 0.00 C ATOM 460 OE1 GLU A 29 3.825 21.329 9.765 1.00 0.00 O ATOM 461 OE2 GLU A 29 6.037 21.464 9.991 1.00 0.00 O ATOM 0 H GLU A 29 2.782 17.013 12.417 1.00 0.00 H new ATOM 0 HA GLU A 29 3.337 19.627 13.574 1.00 0.00 H new ATOM 0 HB2 GLU A 29 4.498 18.234 11.561 1.00 0.00 H new ATOM 0 HB3 GLU A 29 3.353 19.182 10.632 1.00 0.00 H new ATOM 0 HG2 GLU A 29 4.428 21.030 12.474 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.804 20.048 12.010 1.00 0.00 H new ATOM 468 N LYS A 30 0.701 18.954 11.766 1.00 0.00 N ATOM 469 CA LYS A 30 -0.601 19.453 11.353 1.00 0.00 C ATOM 470 C LYS A 30 -1.675 18.896 12.289 1.00 0.00 C ATOM 471 O LYS A 30 -2.175 19.608 13.159 1.00 0.00 O ATOM 472 CB LYS A 30 -0.851 19.142 9.877 1.00 0.00 C ATOM 473 CG LYS A 30 -0.658 20.391 9.014 1.00 0.00 C ATOM 474 CD LYS A 30 0.741 20.420 8.395 1.00 0.00 C ATOM 475 CE LYS A 30 0.782 21.343 7.175 1.00 0.00 C ATOM 476 NZ LYS A 30 1.306 20.619 5.996 1.00 0.00 N ATOM 0 H LYS A 30 0.866 17.969 11.557 1.00 0.00 H new ATOM 0 HA LYS A 30 -0.636 20.539 11.436 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -0.170 18.358 9.546 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -1.864 18.760 9.749 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -1.409 20.411 8.224 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -0.809 21.284 9.621 1.00 0.00 H new ATOM 0 HD2 LYS A 30 1.464 20.760 9.137 1.00 0.00 H new ATOM 0 HD3 LYS A 30 1.034 19.412 8.103 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -0.219 21.720 6.963 1.00 0.00 H new ATOM 0 HE3 LYS A 30 1.410 22.208 7.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 1.327 21.259 5.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 2.269 20.281 6.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 0.691 19.808 5.785 1.00 0.00 H new ATOM 490 N ALA A 31 -1.998 17.629 12.080 1.00 0.00 N ATOM 491 CA ALA A 31 -3.005 16.969 12.894 1.00 0.00 C ATOM 492 C ALA A 31 -4.384 17.188 12.269 1.00 0.00 C ATOM 493 O ALA A 31 -5.181 17.977 12.776 1.00 0.00 O ATOM 494 CB ALA A 31 -2.924 17.492 14.329 1.00 0.00 C ATOM 0 H ALA A 31 -1.580 17.041 11.359 1.00 0.00 H new ATOM 0 HA ALA A 31 -2.827 15.894 12.929 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -3.679 16.997 14.940 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -1.935 17.284 14.737 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -3.100 18.568 14.335 1.00 0.00 H new ATOM 500 N PHE A 32 -4.624 16.477 11.178 1.00 0.00 N ATOM 501 CA PHE A 32 -5.894 16.584 10.479 1.00 0.00 C ATOM 502 C PHE A 32 -6.153 18.024 10.031 1.00 0.00 C ATOM 503 O PHE A 32 -7.119 18.649 10.468 1.00 0.00 O ATOM 504 CB PHE A 32 -6.985 16.165 11.467 1.00 0.00 C ATOM 505 CG PHE A 32 -7.373 14.687 11.377 1.00 0.00 C ATOM 506 CD1 PHE A 32 -6.496 13.729 11.778 1.00 0.00 C ATOM 507 CD2 PHE A 32 -8.594 14.334 10.895 1.00 0.00 C ATOM 508 CE1 PHE A 32 -6.856 12.358 11.694 1.00 0.00 C ATOM 509 CE2 PHE A 32 -8.954 12.962 10.810 1.00 0.00 C ATOM 510 CZ PHE A 32 -8.077 12.004 11.212 1.00 0.00 C ATOM 0 H PHE A 32 -3.961 15.824 10.760 1.00 0.00 H new ATOM 0 HA PHE A 32 -5.885 15.952 9.591 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -6.645 16.380 12.480 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -7.872 16.774 11.293 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.526 14.010 12.160 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -9.290 15.096 10.577 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -6.160 11.596 12.013 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -9.924 12.680 10.426 1.00 0.00 H new ATOM 0 HZ PHE A 32 -8.350 10.961 11.148 1.00 0.00 H new ATOM 520 N SER A 33 -5.275 18.507 9.166 1.00 0.00 N ATOM 521 CA SER A 33 -5.396 19.862 8.654 1.00 0.00 C ATOM 522 C SER A 33 -6.077 19.844 7.284 1.00 0.00 C ATOM 523 O SER A 33 -6.314 18.778 6.718 1.00 0.00 O ATOM 524 CB SER A 33 -4.028 20.539 8.557 1.00 0.00 C ATOM 525 OG SER A 33 -3.902 21.621 9.476 1.00 0.00 O ATOM 0 H SER A 33 -4.476 17.985 8.806 1.00 0.00 H new ATOM 0 HA SER A 33 -6.007 20.437 9.350 1.00 0.00 H new ATOM 0 HB2 SER A 33 -3.246 19.805 8.751 1.00 0.00 H new ATOM 0 HB3 SER A 33 -3.876 20.906 7.542 1.00 0.00 H new ATOM 0 HG SER A 33 -3.014 22.026 9.385 1.00 0.00 H new ATOM 531 N PRO A 34 -6.382 21.069 6.777 1.00 0.00 N ATOM 532 CA PRO A 34 -7.031 21.205 5.485 1.00 0.00 C ATOM 533 C PRO A 34 -6.045 20.940 4.345 1.00 0.00 C ATOM 534 O PRO A 34 -6.418 20.979 3.174 1.00 0.00 O ATOM 535 CB PRO A 34 -7.590 22.618 5.471 1.00 0.00 C ATOM 536 CG PRO A 34 -6.838 23.374 6.555 1.00 0.00 C ATOM 537 CD PRO A 34 -6.118 22.353 7.419 1.00 0.00 C ATOM 0 HA PRO A 34 -7.827 20.475 5.336 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -7.446 23.086 4.497 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -8.662 22.616 5.668 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -6.125 24.069 6.111 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -7.528 23.965 7.157 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -5.049 22.559 7.467 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -6.491 22.368 8.443 1.00 0.00 H new ATOM 545 N GLU A 35 -4.804 20.678 4.728 1.00 0.00 N ATOM 546 CA GLU A 35 -3.761 20.407 3.754 1.00 0.00 C ATOM 547 C GLU A 35 -3.157 19.021 3.992 1.00 0.00 C ATOM 548 O GLU A 35 -2.034 18.749 3.572 1.00 0.00 O ATOM 549 CB GLU A 35 -2.680 21.490 3.793 1.00 0.00 C ATOM 550 CG GLU A 35 -2.238 21.873 2.379 1.00 0.00 C ATOM 551 CD GLU A 35 -2.289 23.391 2.182 1.00 0.00 C ATOM 552 OE1 GLU A 35 -1.617 24.089 2.972 1.00 0.00 O ATOM 553 OE2 GLU A 35 -2.998 23.817 1.245 1.00 0.00 O ATOM 0 H GLU A 35 -4.497 20.648 5.700 1.00 0.00 H new ATOM 0 HA GLU A 35 -4.208 20.420 2.760 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -3.061 22.371 4.310 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -1.822 21.132 4.362 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -1.225 21.513 2.201 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -2.883 21.386 1.648 1.00 0.00 H new ATOM 560 N VAL A 36 -3.930 18.183 4.667 1.00 0.00 N ATOM 561 CA VAL A 36 -3.485 16.833 4.968 1.00 0.00 C ATOM 562 C VAL A 36 -4.300 15.837 4.139 1.00 0.00 C ATOM 563 O VAL A 36 -3.960 14.656 4.071 1.00 0.00 O ATOM 564 CB VAL A 36 -3.577 16.574 6.472 1.00 0.00 C ATOM 565 CG1 VAL A 36 -3.818 15.091 6.761 1.00 0.00 C ATOM 566 CG2 VAL A 36 -2.323 17.075 7.193 1.00 0.00 C ATOM 0 H VAL A 36 -4.861 18.413 5.014 1.00 0.00 H new ATOM 0 HA VAL A 36 -2.438 16.706 4.694 1.00 0.00 H new ATOM 0 HB VAL A 36 -4.431 17.133 6.855 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.879 14.935 7.838 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -4.752 14.777 6.295 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -2.995 14.503 6.356 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -2.415 16.878 8.261 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -1.447 16.557 6.802 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -2.213 18.147 7.029 1.00 0.00 H new ATOM 576 N ILE A 37 -5.359 16.349 3.529 1.00 0.00 N ATOM 577 CA ILE A 37 -6.224 15.520 2.708 1.00 0.00 C ATOM 578 C ILE A 37 -5.466 15.088 1.451 1.00 0.00 C ATOM 579 O ILE A 37 -5.552 13.934 1.036 1.00 0.00 O ATOM 580 CB ILE A 37 -7.539 16.244 2.415 1.00 0.00 C ATOM 581 CG1 ILE A 37 -8.137 16.834 3.694 1.00 0.00 C ATOM 582 CG2 ILE A 37 -8.523 15.321 1.694 1.00 0.00 C ATOM 583 CD1 ILE A 37 -8.649 15.729 4.620 1.00 0.00 C ATOM 0 H ILE A 37 -5.637 17.329 3.587 1.00 0.00 H new ATOM 0 HA ILE A 37 -6.500 14.611 3.242 1.00 0.00 H new ATOM 0 HB ILE A 37 -7.329 17.077 1.745 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -7.384 17.427 4.212 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -8.955 17.508 3.440 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -9.450 15.860 1.497 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -8.088 14.991 0.751 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -8.733 14.454 2.320 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -9.069 16.175 5.521 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -9.419 15.153 4.108 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -7.824 15.071 4.892 1.00 0.00 H new ATOM 595 N PRO A 38 -4.721 16.064 0.866 1.00 0.00 N ATOM 596 CA PRO A 38 -3.948 15.796 -0.335 1.00 0.00 C ATOM 597 C PRO A 38 -2.693 14.986 -0.011 1.00 0.00 C ATOM 598 O PRO A 38 -2.263 14.153 -0.808 1.00 0.00 O ATOM 599 CB PRO A 38 -3.637 17.167 -0.916 1.00 0.00 C ATOM 600 CG PRO A 38 -3.843 18.157 0.219 1.00 0.00 C ATOM 601 CD PRO A 38 -4.596 17.442 1.329 1.00 0.00 C ATOM 0 HA PRO A 38 -4.491 15.185 -1.057 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -2.614 17.210 -1.291 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -4.294 17.393 -1.756 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -2.884 18.525 0.584 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -4.406 19.024 -0.128 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -4.053 17.495 2.273 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -5.574 17.893 1.498 1.00 0.00 H new ATOM 609 N MET A 39 -2.140 15.256 1.163 1.00 0.00 N ATOM 610 CA MET A 39 -0.942 14.561 1.604 1.00 0.00 C ATOM 611 C MET A 39 -1.232 13.084 1.874 1.00 0.00 C ATOM 612 O MET A 39 -0.403 12.222 1.587 1.00 0.00 O ATOM 613 CB MET A 39 -0.410 15.219 2.879 1.00 0.00 C ATOM 614 CG MET A 39 0.935 15.900 2.624 1.00 0.00 C ATOM 615 SD MET A 39 1.994 15.715 4.049 1.00 0.00 S ATOM 616 CE MET A 39 2.002 13.936 4.199 1.00 0.00 C ATOM 0 H MET A 39 -2.499 15.946 1.822 1.00 0.00 H new ATOM 0 HA MET A 39 -0.195 14.626 0.812 1.00 0.00 H new ATOM 0 HB2 MET A 39 -1.130 15.953 3.242 1.00 0.00 H new ATOM 0 HB3 MET A 39 -0.299 14.468 3.661 1.00 0.00 H new ATOM 0 HG2 MET A 39 1.412 15.463 1.747 1.00 0.00 H new ATOM 0 HG3 MET A 39 0.781 16.958 2.410 1.00 0.00 H new ATOM 0 HE1 MET A 39 3.001 13.599 4.477 1.00 0.00 H new ATOM 0 HE2 MET A 39 1.290 13.632 4.966 1.00 0.00 H new ATOM 0 HE3 MET A 39 1.721 13.489 3.245 1.00 0.00 H new ATOM 626 N PHE A 40 -2.413 12.837 2.422 1.00 0.00 N ATOM 627 CA PHE A 40 -2.823 11.478 2.734 1.00 0.00 C ATOM 628 C PHE A 40 -3.191 10.710 1.462 1.00 0.00 C ATOM 629 O PHE A 40 -2.781 9.564 1.284 1.00 0.00 O ATOM 630 CB PHE A 40 -4.060 11.578 3.630 1.00 0.00 C ATOM 631 CG PHE A 40 -4.222 10.408 4.601 1.00 0.00 C ATOM 632 CD1 PHE A 40 -3.295 10.198 5.574 1.00 0.00 C ATOM 633 CD2 PHE A 40 -5.292 9.576 4.492 1.00 0.00 C ATOM 634 CE1 PHE A 40 -3.444 9.112 6.476 1.00 0.00 C ATOM 635 CE2 PHE A 40 -5.442 8.490 5.394 1.00 0.00 C ATOM 636 CZ PHE A 40 -4.515 8.280 6.367 1.00 0.00 C ATOM 0 H PHE A 40 -3.099 13.554 2.658 1.00 0.00 H new ATOM 0 HA PHE A 40 -2.007 10.947 3.224 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -4.009 12.505 4.200 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -4.948 11.640 3.000 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -2.445 10.858 5.660 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -6.028 9.741 3.719 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -2.708 8.946 7.248 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -6.293 7.830 5.308 1.00 0.00 H new ATOM 0 HZ PHE A 40 -4.629 7.453 7.053 1.00 0.00 H new ATOM 646 N SER A 41 -3.960 11.373 0.611 1.00 0.00 N ATOM 647 CA SER A 41 -4.387 10.768 -0.640 1.00 0.00 C ATOM 648 C SER A 41 -3.168 10.432 -1.502 1.00 0.00 C ATOM 649 O SER A 41 -3.154 9.414 -2.192 1.00 0.00 O ATOM 650 CB SER A 41 -5.338 11.692 -1.402 1.00 0.00 C ATOM 651 OG SER A 41 -4.636 12.625 -2.220 1.00 0.00 O ATOM 0 H SER A 41 -4.299 12.323 0.763 1.00 0.00 H new ATOM 0 HA SER A 41 -4.925 9.848 -0.409 1.00 0.00 H new ATOM 0 HB2 SER A 41 -6.004 11.094 -2.024 1.00 0.00 H new ATOM 0 HB3 SER A 41 -5.965 12.232 -0.692 1.00 0.00 H new ATOM 0 HG SER A 41 -3.965 13.093 -1.680 1.00 0.00 H new ATOM 657 N ALA A 42 -2.175 11.307 -1.433 1.00 0.00 N ATOM 658 CA ALA A 42 -0.956 11.115 -2.199 1.00 0.00 C ATOM 659 C ALA A 42 -0.106 10.032 -1.533 1.00 0.00 C ATOM 660 O ALA A 42 0.561 9.255 -2.214 1.00 0.00 O ATOM 661 CB ALA A 42 -0.213 12.448 -2.318 1.00 0.00 C ATOM 0 H ALA A 42 -2.190 12.150 -0.859 1.00 0.00 H new ATOM 0 HA ALA A 42 -1.187 10.778 -3.210 1.00 0.00 H new ATOM 0 HB1 ALA A 42 0.702 12.305 -2.893 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -0.849 13.175 -2.823 1.00 0.00 H new ATOM 0 HB3 ALA A 42 0.038 12.815 -1.323 1.00 0.00 H new ATOM 667 N LEU A 43 -0.156 10.016 -0.208 1.00 0.00 N ATOM 668 CA LEU A 43 0.602 9.040 0.558 1.00 0.00 C ATOM 669 C LEU A 43 0.185 7.631 0.135 1.00 0.00 C ATOM 670 O LEU A 43 1.032 6.760 -0.060 1.00 0.00 O ATOM 671 CB LEU A 43 0.450 9.303 2.057 1.00 0.00 C ATOM 672 CG LEU A 43 1.645 9.966 2.746 1.00 0.00 C ATOM 673 CD1 LEU A 43 1.197 10.770 3.968 1.00 0.00 C ATOM 674 CD2 LEU A 43 2.715 8.933 3.102 1.00 0.00 C ATOM 0 H LEU A 43 -0.709 10.663 0.354 1.00 0.00 H new ATOM 0 HA LEU A 43 1.667 9.133 0.347 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -0.427 9.933 2.208 1.00 0.00 H new ATOM 0 HB3 LEU A 43 0.250 8.354 2.554 1.00 0.00 H new ATOM 0 HG LEU A 43 2.096 10.669 2.045 1.00 0.00 H new ATOM 0 HD11 LEU A 43 2.065 11.231 4.439 1.00 0.00 H new ATOM 0 HD12 LEU A 43 0.499 11.547 3.656 1.00 0.00 H new ATOM 0 HD13 LEU A 43 0.707 10.106 4.681 1.00 0.00 H new ATOM 0 HD21 LEU A 43 3.553 9.431 3.590 1.00 0.00 H new ATOM 0 HD22 LEU A 43 2.292 8.189 3.776 1.00 0.00 H new ATOM 0 HD23 LEU A 43 3.064 8.443 2.193 1.00 0.00 H new ATOM 686 N SER A 44 -1.121 7.448 0.004 1.00 0.00 N ATOM 687 CA SER A 44 -1.661 6.159 -0.393 1.00 0.00 C ATOM 688 C SER A 44 -1.473 5.953 -1.897 1.00 0.00 C ATOM 689 O SER A 44 -0.564 5.241 -2.321 1.00 0.00 O ATOM 690 CB SER A 44 -3.141 6.044 -0.022 1.00 0.00 C ATOM 691 OG SER A 44 -3.722 4.839 -0.513 1.00 0.00 O ATOM 0 H SER A 44 -1.821 8.172 0.166 1.00 0.00 H new ATOM 0 HA SER A 44 -1.118 5.381 0.144 1.00 0.00 H new ATOM 0 HB2 SER A 44 -3.247 6.082 1.062 1.00 0.00 H new ATOM 0 HB3 SER A 44 -3.684 6.899 -0.426 1.00 0.00 H new ATOM 0 HG SER A 44 -4.694 4.873 -0.396 1.00 0.00 H new ATOM 697 N GLU A 45 -2.347 6.589 -2.662 1.00 0.00 N ATOM 698 CA GLU A 45 -2.289 6.485 -4.111 1.00 0.00 C ATOM 699 C GLU A 45 -2.962 5.193 -4.577 1.00 0.00 C ATOM 700 O GLU A 45 -3.310 5.058 -5.749 1.00 0.00 O ATOM 701 CB GLU A 45 -0.844 6.561 -4.608 1.00 0.00 C ATOM 702 CG GLU A 45 -0.701 7.606 -5.717 1.00 0.00 C ATOM 703 CD GLU A 45 -0.834 6.961 -7.098 1.00 0.00 C ATOM 704 OE1 GLU A 45 -0.182 5.914 -7.301 1.00 0.00 O ATOM 705 OE2 GLU A 45 -1.585 7.530 -7.920 1.00 0.00 O ATOM 0 H GLU A 45 -3.100 7.178 -2.306 1.00 0.00 H new ATOM 0 HA GLU A 45 -2.831 7.329 -4.539 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -0.183 6.813 -3.779 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -0.532 5.585 -4.980 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -1.463 8.376 -5.596 1.00 0.00 H new ATOM 0 HG3 GLU A 45 0.267 8.100 -5.634 1.00 0.00 H new ATOM 712 N GLY A 46 -3.122 4.274 -3.636 1.00 0.00 N ATOM 713 CA GLY A 46 -3.748 2.997 -3.936 1.00 0.00 C ATOM 714 C GLY A 46 -3.329 1.930 -2.921 1.00 0.00 C ATOM 715 O GLY A 46 -3.130 0.771 -3.281 1.00 0.00 O ATOM 0 H GLY A 46 -2.829 4.388 -2.666 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -4.832 3.108 -3.926 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -3.469 2.678 -4.940 1.00 0.00 H new ATOM 719 N ALA A 47 -3.208 2.361 -1.675 1.00 0.00 N ATOM 720 CA ALA A 47 -2.816 1.457 -0.606 1.00 0.00 C ATOM 721 C ALA A 47 -3.956 0.474 -0.332 1.00 0.00 C ATOM 722 O ALA A 47 -5.091 0.702 -0.749 1.00 0.00 O ATOM 723 CB ALA A 47 -2.435 2.268 0.635 1.00 0.00 C ATOM 0 H ALA A 47 -3.374 3.323 -1.381 1.00 0.00 H new ATOM 0 HA ALA A 47 -1.941 0.875 -0.897 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.141 1.590 1.436 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -1.602 2.930 0.396 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -3.290 2.862 0.958 1.00 0.00 H new ATOM 729 N THR A 48 -3.615 -0.599 0.366 1.00 0.00 N ATOM 730 CA THR A 48 -4.595 -1.618 0.700 1.00 0.00 C ATOM 731 C THR A 48 -5.391 -1.205 1.940 1.00 0.00 C ATOM 732 O THR A 48 -5.247 -0.087 2.431 1.00 0.00 O ATOM 733 CB THR A 48 -3.857 -2.948 0.867 1.00 0.00 C ATOM 734 OG1 THR A 48 -3.542 -2.998 2.255 1.00 0.00 O ATOM 735 CG2 THR A 48 -2.492 -2.950 0.174 1.00 0.00 C ATOM 0 H THR A 48 -2.673 -0.785 0.710 1.00 0.00 H new ATOM 0 HA THR A 48 -5.330 -1.736 -0.096 1.00 0.00 H new ATOM 0 HB THR A 48 -4.469 -3.756 0.466 1.00 0.00 H new ATOM 0 HG1 THR A 48 -2.573 -3.095 2.367 1.00 0.00 H new ATOM 0 HG21 THR A 48 -2.010 -3.916 0.323 1.00 0.00 H new ATOM 0 HG22 THR A 48 -2.625 -2.771 -0.893 1.00 0.00 H new ATOM 0 HG23 THR A 48 -1.867 -2.164 0.598 1.00 0.00 H new ATOM 743 N PRO A 49 -6.237 -2.156 2.421 1.00 0.00 N ATOM 744 CA PRO A 49 -7.057 -1.903 3.594 1.00 0.00 C ATOM 745 C PRO A 49 -6.216 -1.953 4.871 1.00 0.00 C ATOM 746 O PRO A 49 -6.496 -1.237 5.832 1.00 0.00 O ATOM 747 CB PRO A 49 -8.141 -2.967 3.554 1.00 0.00 C ATOM 748 CG PRO A 49 -7.623 -4.055 2.627 1.00 0.00 C ATOM 749 CD PRO A 49 -6.434 -3.490 1.865 1.00 0.00 C ATOM 0 HA PRO A 49 -7.497 -0.906 3.593 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -8.336 -3.363 4.550 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -9.080 -2.554 3.185 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -7.327 -4.935 3.199 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -8.404 -4.372 1.936 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -5.547 -4.110 1.999 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -6.634 -3.447 0.794 1.00 0.00 H new ATOM 757 N GLN A 50 -5.204 -2.807 4.843 1.00 0.00 N ATOM 758 CA GLN A 50 -4.321 -2.961 5.986 1.00 0.00 C ATOM 759 C GLN A 50 -3.350 -1.781 6.069 1.00 0.00 C ATOM 760 O GLN A 50 -3.021 -1.319 7.160 1.00 0.00 O ATOM 761 CB GLN A 50 -3.566 -4.289 5.921 1.00 0.00 C ATOM 762 CG GLN A 50 -2.782 -4.538 7.212 1.00 0.00 C ATOM 763 CD GLN A 50 -3.624 -5.319 8.222 1.00 0.00 C ATOM 764 OE1 GLN A 50 -4.475 -4.779 8.910 1.00 0.00 O ATOM 765 NE2 GLN A 50 -3.341 -6.618 8.274 1.00 0.00 N ATOM 0 H GLN A 50 -4.976 -3.400 4.045 1.00 0.00 H new ATOM 0 HA GLN A 50 -4.928 -2.971 6.891 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -4.270 -5.104 5.756 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -2.883 -4.282 5.072 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -1.871 -5.092 6.987 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -2.477 -3.586 7.646 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -2.616 -7.007 7.670 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -3.849 -7.225 8.917 1.00 0.00 H new ATOM 774 N ASP A 51 -2.918 -1.329 4.901 1.00 0.00 N ATOM 775 CA ASP A 51 -1.991 -0.212 4.828 1.00 0.00 C ATOM 776 C ASP A 51 -2.699 1.064 5.288 1.00 0.00 C ATOM 777 O ASP A 51 -2.246 1.729 6.217 1.00 0.00 O ATOM 778 CB ASP A 51 -1.505 0.007 3.394 1.00 0.00 C ATOM 779 CG ASP A 51 -0.943 -1.237 2.704 1.00 0.00 C ATOM 780 OD1 ASP A 51 -1.168 -2.339 3.250 1.00 0.00 O ATOM 781 OD2 ASP A 51 -0.302 -1.060 1.646 1.00 0.00 O ATOM 0 H ASP A 51 -3.192 -1.716 3.998 1.00 0.00 H new ATOM 0 HA ASP A 51 -1.138 -0.439 5.467 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -2.335 0.390 2.800 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -0.735 0.779 3.401 1.00 0.00 H new ATOM 786 N LEU A 52 -3.798 1.368 4.614 1.00 0.00 N ATOM 787 CA LEU A 52 -4.574 2.552 4.941 1.00 0.00 C ATOM 788 C LEU A 52 -5.061 2.454 6.389 1.00 0.00 C ATOM 789 O LEU A 52 -5.066 3.446 7.115 1.00 0.00 O ATOM 790 CB LEU A 52 -5.700 2.754 3.926 1.00 0.00 C ATOM 791 CG LEU A 52 -5.458 3.822 2.858 1.00 0.00 C ATOM 792 CD1 LEU A 52 -6.343 3.585 1.633 1.00 0.00 C ATOM 793 CD2 LEU A 52 -5.644 5.227 3.437 1.00 0.00 C ATOM 0 H LEU A 52 -4.170 0.814 3.842 1.00 0.00 H new ATOM 0 HA LEU A 52 -3.952 3.445 4.873 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -5.886 1.804 3.425 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -6.610 3.011 4.469 1.00 0.00 H new ATOM 0 HG LEU A 52 -4.423 3.744 2.526 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -6.150 4.359 0.890 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -6.119 2.608 1.206 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -7.391 3.620 1.929 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -5.466 5.968 2.658 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -6.661 5.333 3.814 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -4.937 5.381 4.252 1.00 0.00 H new ATOM 805 N ASN A 53 -5.459 1.247 6.765 1.00 0.00 N ATOM 806 CA ASN A 53 -5.946 1.006 8.112 1.00 0.00 C ATOM 807 C ASN A 53 -4.864 1.398 9.120 1.00 0.00 C ATOM 808 O ASN A 53 -5.152 2.038 10.128 1.00 0.00 O ATOM 809 CB ASN A 53 -6.274 -0.474 8.322 1.00 0.00 C ATOM 810 CG ASN A 53 -6.387 -0.804 9.812 1.00 0.00 C ATOM 811 OD1 ASN A 53 -7.435 -0.679 10.425 1.00 0.00 O ATOM 812 ND2 ASN A 53 -5.252 -1.232 10.358 1.00 0.00 N ATOM 0 H ASN A 53 -5.454 0.426 6.160 1.00 0.00 H new ATOM 0 HA ASN A 53 -6.849 1.600 8.255 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -7.210 -0.718 7.820 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -5.499 -1.090 7.867 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -5.223 -1.479 11.347 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -4.410 -1.313 9.787 1.00 0.00 H new ATOM 819 N THR A 54 -3.640 0.997 8.811 1.00 0.00 N ATOM 820 CA THR A 54 -2.513 1.297 9.676 1.00 0.00 C ATOM 821 C THR A 54 -2.214 2.797 9.660 1.00 0.00 C ATOM 822 O THR A 54 -1.780 3.359 10.665 1.00 0.00 O ATOM 823 CB THR A 54 -1.328 0.437 9.227 1.00 0.00 C ATOM 824 OG1 THR A 54 -0.700 0.050 10.446 1.00 0.00 O ATOM 825 CG2 THR A 54 -0.258 1.250 8.498 1.00 0.00 C ATOM 0 H THR A 54 -3.404 0.466 7.972 1.00 0.00 H new ATOM 0 HA THR A 54 -2.736 1.052 10.714 1.00 0.00 H new ATOM 0 HB THR A 54 -1.684 -0.361 8.575 1.00 0.00 H new ATOM 0 HG1 THR A 54 0.078 -0.512 10.249 1.00 0.00 H new ATOM 0 HG21 THR A 54 0.559 0.593 8.201 1.00 0.00 H new ATOM 0 HG22 THR A 54 -0.693 1.711 7.611 1.00 0.00 H new ATOM 0 HG23 THR A 54 0.123 2.027 9.161 1.00 0.00 H new ATOM 833 N MET A 55 -2.456 3.405 8.508 1.00 0.00 N ATOM 834 CA MET A 55 -2.219 4.829 8.348 1.00 0.00 C ATOM 835 C MET A 55 -3.167 5.645 9.228 1.00 0.00 C ATOM 836 O MET A 55 -2.757 6.629 9.843 1.00 0.00 O ATOM 837 CB MET A 55 -2.420 5.219 6.882 1.00 0.00 C ATOM 838 CG MET A 55 -1.400 6.275 6.451 1.00 0.00 C ATOM 839 SD MET A 55 -1.050 6.111 4.709 1.00 0.00 S ATOM 840 CE MET A 55 -1.729 7.649 4.109 1.00 0.00 C ATOM 0 H MET A 55 -2.814 2.937 7.676 1.00 0.00 H new ATOM 0 HA MET A 55 -1.195 5.044 8.653 1.00 0.00 H new ATOM 0 HB2 MET A 55 -2.323 4.336 6.250 1.00 0.00 H new ATOM 0 HB3 MET A 55 -3.430 5.604 6.739 1.00 0.00 H new ATOM 0 HG2 MET A 55 -1.787 7.272 6.660 1.00 0.00 H new ATOM 0 HG3 MET A 55 -0.482 6.162 7.027 1.00 0.00 H new ATOM 0 HE1 MET A 55 -1.594 7.710 3.029 1.00 0.00 H new ATOM 0 HE2 MET A 55 -2.792 7.694 4.344 1.00 0.00 H new ATOM 0 HE3 MET A 55 -1.216 8.484 4.587 1.00 0.00 H new ATOM 850 N LEU A 56 -4.417 5.208 9.260 1.00 0.00 N ATOM 851 CA LEU A 56 -5.427 5.886 10.055 1.00 0.00 C ATOM 852 C LEU A 56 -5.217 5.550 11.533 1.00 0.00 C ATOM 853 O LEU A 56 -5.258 6.436 12.386 1.00 0.00 O ATOM 854 CB LEU A 56 -6.828 5.549 9.541 1.00 0.00 C ATOM 855 CG LEU A 56 -7.061 5.754 8.043 1.00 0.00 C ATOM 856 CD1 LEU A 56 -7.559 4.466 7.384 1.00 0.00 C ATOM 857 CD2 LEU A 56 -8.007 6.930 7.791 1.00 0.00 C ATOM 0 H LEU A 56 -4.754 4.393 8.748 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.327 6.967 9.956 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -7.041 4.508 9.782 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -7.550 6.157 10.087 1.00 0.00 H new ATOM 0 HG LEU A 56 -6.106 6.004 7.580 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -7.717 4.639 6.319 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -6.817 3.679 7.517 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -8.499 4.161 7.845 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -8.156 7.054 6.718 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -8.966 6.734 8.270 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -7.574 7.841 8.205 1.00 0.00 H new ATOM 869 N ASN A 57 -4.997 4.270 11.790 1.00 0.00 N ATOM 870 CA ASN A 57 -4.781 3.807 13.150 1.00 0.00 C ATOM 871 C ASN A 57 -3.507 4.448 13.707 1.00 0.00 C ATOM 872 O ASN A 57 -3.371 4.617 14.917 1.00 0.00 O ATOM 873 CB ASN A 57 -4.603 2.287 13.193 1.00 0.00 C ATOM 874 CG ASN A 57 -5.841 1.607 13.779 1.00 0.00 C ATOM 875 OD1 ASN A 57 -6.744 2.242 14.297 1.00 0.00 O ATOM 876 ND2 ASN A 57 -5.833 0.281 13.669 1.00 0.00 N ATOM 0 H ASN A 57 -4.964 3.539 11.080 1.00 0.00 H new ATOM 0 HA ASN A 57 -5.652 4.085 13.743 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -4.419 1.910 12.187 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -3.728 2.036 13.793 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -6.615 -0.265 14.030 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -5.045 -0.189 13.224 1.00 0.00 H new ATOM 883 N THR A 58 -2.607 4.786 12.795 1.00 0.00 N ATOM 884 CA THR A 58 -1.349 5.403 13.179 1.00 0.00 C ATOM 885 C THR A 58 -1.605 6.723 13.910 1.00 0.00 C ATOM 886 O THR A 58 -0.908 7.051 14.869 1.00 0.00 O ATOM 887 CB THR A 58 -0.497 5.562 11.918 1.00 0.00 C ATOM 888 OG1 THR A 58 0.435 4.486 11.991 1.00 0.00 O ATOM 889 CG2 THR A 58 0.380 6.816 11.959 1.00 0.00 C ATOM 0 H THR A 58 -2.724 4.644 11.792 1.00 0.00 H new ATOM 0 HA THR A 58 -0.800 4.778 13.883 1.00 0.00 H new ATOM 0 HB THR A 58 -1.146 5.600 11.043 1.00 0.00 H new ATOM 0 HG1 THR A 58 0.054 3.693 11.559 1.00 0.00 H new ATOM 0 HG21 THR A 58 0.964 6.882 11.041 1.00 0.00 H new ATOM 0 HG22 THR A 58 -0.252 7.699 12.051 1.00 0.00 H new ATOM 0 HG23 THR A 58 1.053 6.761 12.814 1.00 0.00 H new ATOM 897 N VAL A 59 -2.606 7.445 13.428 1.00 0.00 N ATOM 898 CA VAL A 59 -2.963 8.721 14.024 1.00 0.00 C ATOM 899 C VAL A 59 -3.008 8.575 15.546 1.00 0.00 C ATOM 900 O VAL A 59 -2.928 7.464 16.068 1.00 0.00 O ATOM 901 CB VAL A 59 -4.281 9.224 13.433 1.00 0.00 C ATOM 902 CG1 VAL A 59 -5.387 9.234 14.490 1.00 0.00 C ATOM 903 CG2 VAL A 59 -4.108 10.610 12.807 1.00 0.00 C ATOM 0 H VAL A 59 -3.181 7.170 12.631 1.00 0.00 H new ATOM 0 HA VAL A 59 -2.210 9.474 13.792 1.00 0.00 H new ATOM 0 HB VAL A 59 -4.579 8.535 12.643 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -6.313 9.596 14.044 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -5.537 8.223 14.869 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -5.099 9.890 15.311 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -5.060 10.944 12.394 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -3.776 11.315 13.569 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -3.365 10.560 12.011 1.00 0.00 H new ATOM 913 N GLY A 60 -3.135 9.710 16.215 1.00 0.00 N ATOM 914 CA GLY A 60 -3.191 9.723 17.667 1.00 0.00 C ATOM 915 C GLY A 60 -4.353 8.866 18.177 1.00 0.00 C ATOM 916 O GLY A 60 -4.143 7.752 18.654 1.00 0.00 O ATOM 0 H GLY A 60 -3.201 10.629 15.778 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -2.252 9.349 18.074 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -3.307 10.747 18.021 1.00 0.00 H new ATOM 920 N GLY A 61 -5.550 9.419 18.060 1.00 0.00 N ATOM 921 CA GLY A 61 -6.744 8.721 18.504 1.00 0.00 C ATOM 922 C GLY A 61 -7.968 9.636 18.448 1.00 0.00 C ATOM 923 O GLY A 61 -8.657 9.821 19.450 1.00 0.00 O ATOM 0 H GLY A 61 -5.719 10.344 17.664 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -6.912 7.845 17.877 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -6.601 8.361 19.523 1.00 0.00 H new ATOM 927 N HIS A 62 -8.203 10.186 17.265 1.00 0.00 N ATOM 928 CA HIS A 62 -9.332 11.078 17.065 1.00 0.00 C ATOM 929 C HIS A 62 -10.607 10.255 16.865 1.00 0.00 C ATOM 930 O HIS A 62 -10.866 9.763 15.769 1.00 0.00 O ATOM 931 CB HIS A 62 -9.063 12.044 15.910 1.00 0.00 C ATOM 932 CG HIS A 62 -7.621 12.479 15.795 1.00 0.00 C ATOM 933 ND1 HIS A 62 -6.689 12.230 14.832 1.00 0.00 N flip ATOM 934 CD2 HIS A 62 -6.996 13.262 16.750 1.00 0.00 C flip ATOM 935 CE1 HIS A 62 -5.557 12.830 15.177 1.00 0.00 C flip ATOM 936 NE2 HIS A 62 -5.745 13.470 16.367 1.00 0.00 N flip ATOM 0 H HIS A 62 -7.630 10.031 16.435 1.00 0.00 H new ATOM 0 HA HIS A 62 -9.474 11.695 17.952 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -9.364 11.570 14.976 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -9.689 12.927 16.035 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -6.837 11.676 13.988 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -7.451 13.639 17.654 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -4.638 12.814 14.609 1.00 0.00 H new ATOM 945 N GLN A 63 -11.369 10.134 17.942 1.00 0.00 N ATOM 946 CA GLN A 63 -12.610 9.379 17.898 1.00 0.00 C ATOM 947 C GLN A 63 -13.646 10.109 17.041 1.00 0.00 C ATOM 948 O GLN A 63 -14.338 9.490 16.235 1.00 0.00 O ATOM 949 CB GLN A 63 -13.147 9.125 19.309 1.00 0.00 C ATOM 950 CG GLN A 63 -13.621 7.679 19.462 1.00 0.00 C ATOM 951 CD GLN A 63 -14.166 7.427 20.870 1.00 0.00 C ATOM 952 OE1 GLN A 63 -14.024 8.236 21.772 1.00 0.00 O ATOM 953 NE2 GLN A 63 -14.794 6.263 21.007 1.00 0.00 N ATOM 0 H GLN A 63 -11.151 10.546 18.850 1.00 0.00 H new ATOM 0 HA GLN A 63 -12.407 8.410 17.441 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -12.368 9.336 20.042 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -13.972 9.806 19.516 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -14.395 7.466 18.725 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -12.794 6.998 19.261 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -14.877 5.632 20.210 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -15.192 6.001 21.909 1.00 0.00 H new ATOM 962 N ALA A 64 -13.718 11.417 17.243 1.00 0.00 N ATOM 963 CA ALA A 64 -14.657 12.238 16.498 1.00 0.00 C ATOM 964 C ALA A 64 -14.313 12.175 15.009 1.00 0.00 C ATOM 965 O ALA A 64 -15.184 11.927 14.176 1.00 0.00 O ATOM 966 CB ALA A 64 -14.629 13.668 17.043 1.00 0.00 C ATOM 0 H ALA A 64 -13.142 11.928 17.912 1.00 0.00 H new ATOM 0 HA ALA A 64 -15.674 11.863 16.618 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -15.333 14.284 16.484 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -14.909 13.661 18.096 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -13.625 14.078 16.937 1.00 0.00 H new ATOM 972 N ALA A 65 -13.041 12.405 14.718 1.00 0.00 N ATOM 973 CA ALA A 65 -12.571 12.378 13.343 1.00 0.00 C ATOM 974 C ALA A 65 -12.848 10.999 12.741 1.00 0.00 C ATOM 975 O ALA A 65 -13.420 10.893 11.658 1.00 0.00 O ATOM 976 CB ALA A 65 -11.085 12.744 13.303 1.00 0.00 C ATOM 0 H ALA A 65 -12.321 12.611 15.411 1.00 0.00 H new ATOM 0 HA ALA A 65 -13.104 13.114 12.741 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -10.733 12.724 12.272 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -10.945 13.744 13.714 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -10.517 12.026 13.894 1.00 0.00 H new ATOM 982 N MET A 66 -12.428 9.974 13.471 1.00 0.00 N ATOM 983 CA MET A 66 -12.623 8.606 13.023 1.00 0.00 C ATOM 984 C MET A 66 -14.108 8.307 12.807 1.00 0.00 C ATOM 985 O MET A 66 -14.471 7.588 11.878 1.00 0.00 O ATOM 986 CB MET A 66 -12.053 7.642 14.065 1.00 0.00 C ATOM 987 CG MET A 66 -10.547 7.451 13.869 1.00 0.00 C ATOM 988 SD MET A 66 -10.226 6.728 12.270 1.00 0.00 S ATOM 989 CE MET A 66 -8.831 7.717 11.757 1.00 0.00 C ATOM 0 H MET A 66 -11.954 10.065 14.369 1.00 0.00 H new ATOM 0 HA MET A 66 -12.104 8.476 12.073 1.00 0.00 H new ATOM 0 HB2 MET A 66 -12.247 8.027 15.066 1.00 0.00 H new ATOM 0 HB3 MET A 66 -12.558 6.679 13.990 1.00 0.00 H new ATOM 0 HG2 MET A 66 -10.037 8.411 13.952 1.00 0.00 H new ATOM 0 HG3 MET A 66 -10.148 6.809 14.654 1.00 0.00 H new ATOM 0 HE1 MET A 66 -8.876 7.878 10.680 1.00 0.00 H new ATOM 0 HE2 MET A 66 -8.859 8.679 12.269 1.00 0.00 H new ATOM 0 HE3 MET A 66 -7.906 7.199 12.008 1.00 0.00 H new ATOM 999 N GLN A 67 -14.925 8.873 13.682 1.00 0.00 N ATOM 1000 CA GLN A 67 -16.363 8.675 13.599 1.00 0.00 C ATOM 1001 C GLN A 67 -16.893 9.189 12.259 1.00 0.00 C ATOM 1002 O GLN A 67 -17.547 8.452 11.522 1.00 0.00 O ATOM 1003 CB GLN A 67 -17.078 9.355 14.769 1.00 0.00 C ATOM 1004 CG GLN A 67 -18.407 8.662 15.075 1.00 0.00 C ATOM 1005 CD GLN A 67 -18.261 7.689 16.247 1.00 0.00 C ATOM 1006 OE1 GLN A 67 -17.415 7.842 17.113 1.00 0.00 O ATOM 1007 NE2 GLN A 67 -19.129 6.681 16.225 1.00 0.00 N ATOM 0 H GLN A 67 -14.620 9.468 14.452 1.00 0.00 H new ATOM 0 HA GLN A 67 -16.568 7.606 13.662 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -16.440 9.333 15.653 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -17.257 10.404 14.531 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -19.165 9.409 15.310 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -18.753 8.124 14.192 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -19.812 6.612 15.470 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -19.112 5.977 16.963 1.00 0.00 H new ATOM 1016 N MET A 68 -16.592 10.450 11.984 1.00 0.00 N ATOM 1017 CA MET A 68 -17.030 11.071 10.746 1.00 0.00 C ATOM 1018 C MET A 68 -16.475 10.323 9.531 1.00 0.00 C ATOM 1019 O MET A 68 -17.137 10.230 8.499 1.00 0.00 O ATOM 1020 CB MET A 68 -16.557 12.525 10.709 1.00 0.00 C ATOM 1021 CG MET A 68 -17.743 13.483 10.574 1.00 0.00 C ATOM 1022 SD MET A 68 -17.505 14.901 11.633 1.00 0.00 S ATOM 1023 CE MET A 68 -16.018 15.578 10.916 1.00 0.00 C ATOM 0 H MET A 68 -16.050 11.058 12.598 1.00 0.00 H new ATOM 0 HA MET A 68 -18.119 11.032 10.707 1.00 0.00 H new ATOM 0 HB2 MET A 68 -16.001 12.754 11.618 1.00 0.00 H new ATOM 0 HB3 MET A 68 -15.872 12.668 9.873 1.00 0.00 H new ATOM 0 HG2 MET A 68 -17.845 13.805 9.538 1.00 0.00 H new ATOM 0 HG3 MET A 68 -18.667 12.971 10.841 1.00 0.00 H new ATOM 0 HE1 MET A 68 -15.957 16.642 11.142 1.00 0.00 H new ATOM 0 HE2 MET A 68 -15.149 15.068 11.332 1.00 0.00 H new ATOM 0 HE3 MET A 68 -16.039 15.437 9.835 1.00 0.00 H new ATOM 1033 N LEU A 69 -15.265 9.809 9.695 1.00 0.00 N ATOM 1034 CA LEU A 69 -14.614 9.072 8.625 1.00 0.00 C ATOM 1035 C LEU A 69 -15.381 7.774 8.365 1.00 0.00 C ATOM 1036 O LEU A 69 -15.493 7.332 7.223 1.00 0.00 O ATOM 1037 CB LEU A 69 -13.133 8.859 8.945 1.00 0.00 C ATOM 1038 CG LEU A 69 -12.262 8.361 7.790 1.00 0.00 C ATOM 1039 CD1 LEU A 69 -11.075 9.297 7.555 1.00 0.00 C ATOM 1040 CD2 LEU A 69 -11.815 6.917 8.024 1.00 0.00 C ATOM 0 H LEU A 69 -14.718 9.888 10.552 1.00 0.00 H new ATOM 0 HA LEU A 69 -14.636 9.646 7.699 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -12.720 9.801 9.305 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -13.058 8.144 9.765 1.00 0.00 H new ATOM 0 HG LEU A 69 -12.863 8.369 6.881 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -10.472 8.920 6.729 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -11.441 10.294 7.312 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -10.465 9.344 8.457 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -11.197 6.587 7.189 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -11.238 6.860 8.947 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -12.691 6.273 8.104 1.00 0.00 H new ATOM 1052 N LYS A 70 -15.887 7.198 9.446 1.00 0.00 N ATOM 1053 CA LYS A 70 -16.639 5.958 9.350 1.00 0.00 C ATOM 1054 C LYS A 70 -17.955 6.221 8.615 1.00 0.00 C ATOM 1055 O LYS A 70 -18.319 5.482 7.701 1.00 0.00 O ATOM 1056 CB LYS A 70 -16.822 5.333 10.735 1.00 0.00 C ATOM 1057 CG LYS A 70 -16.345 3.880 10.749 1.00 0.00 C ATOM 1058 CD LYS A 70 -17.505 2.918 10.486 1.00 0.00 C ATOM 1059 CE LYS A 70 -17.242 2.067 9.243 1.00 0.00 C ATOM 1060 NZ LYS A 70 -16.646 0.766 9.623 1.00 0.00 N ATOM 0 H LYS A 70 -15.791 7.567 10.392 1.00 0.00 H new ATOM 0 HA LYS A 70 -16.088 5.222 8.765 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -16.265 5.909 11.474 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -17.873 5.377 11.022 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -15.573 3.740 9.992 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -15.891 3.652 11.713 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -17.648 2.270 11.351 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -18.428 3.483 10.355 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -18.175 1.903 8.703 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -16.572 2.597 8.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -16.474 0.200 8.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -15.746 0.928 10.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -17.299 0.255 10.250 1.00 0.00 H new ATOM 1074 N GLU A 71 -18.633 7.276 9.042 1.00 0.00 N ATOM 1075 CA GLU A 71 -19.901 7.646 8.436 1.00 0.00 C ATOM 1076 C GLU A 71 -19.729 7.855 6.930 1.00 0.00 C ATOM 1077 O GLU A 71 -20.523 7.357 6.135 1.00 0.00 O ATOM 1078 CB GLU A 71 -20.483 8.894 9.100 1.00 0.00 C ATOM 1079 CG GLU A 71 -21.975 8.717 9.392 1.00 0.00 C ATOM 1080 CD GLU A 71 -22.190 7.921 10.682 1.00 0.00 C ATOM 1081 OE1 GLU A 71 -22.100 6.677 10.604 1.00 0.00 O ATOM 1082 OE2 GLU A 71 -22.440 8.577 11.717 1.00 0.00 O ATOM 0 H GLU A 71 -18.328 7.886 9.800 1.00 0.00 H new ATOM 0 HA GLU A 71 -20.607 6.830 8.591 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -19.949 9.098 10.028 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -20.336 9.757 8.451 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -22.451 9.694 9.479 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -22.454 8.203 8.559 1.00 0.00 H new ATOM 1089 N THR A 72 -18.685 8.595 6.584 1.00 0.00 N ATOM 1090 CA THR A 72 -18.397 8.877 5.187 1.00 0.00 C ATOM 1091 C THR A 72 -18.179 7.575 4.415 1.00 0.00 C ATOM 1092 O THR A 72 -18.910 7.279 3.471 1.00 0.00 O ATOM 1093 CB THR A 72 -17.197 9.824 5.134 1.00 0.00 C ATOM 1094 OG1 THR A 72 -17.779 11.110 4.934 1.00 0.00 O ATOM 1095 CG2 THR A 72 -16.335 9.608 3.889 1.00 0.00 C ATOM 0 H THR A 72 -18.028 9.008 7.247 1.00 0.00 H new ATOM 0 HA THR A 72 -19.239 9.369 4.700 1.00 0.00 H new ATOM 0 HB THR A 72 -16.586 9.686 6.026 1.00 0.00 H new ATOM 0 HG1 THR A 72 -17.071 11.786 4.889 1.00 0.00 H new ATOM 0 HG21 THR A 72 -15.497 10.305 3.901 1.00 0.00 H new ATOM 0 HG22 THR A 72 -15.956 8.586 3.882 1.00 0.00 H new ATOM 0 HG23 THR A 72 -16.936 9.779 2.996 1.00 0.00 H new ATOM 1103 N ILE A 73 -17.168 6.832 4.844 1.00 0.00 N ATOM 1104 CA ILE A 73 -16.844 5.569 4.204 1.00 0.00 C ATOM 1105 C ILE A 73 -18.123 4.747 4.030 1.00 0.00 C ATOM 1106 O ILE A 73 -18.396 4.238 2.943 1.00 0.00 O ATOM 1107 CB ILE A 73 -15.746 4.840 4.981 1.00 0.00 C ATOM 1108 CG1 ILE A 73 -14.383 5.493 4.745 1.00 0.00 C ATOM 1109 CG2 ILE A 73 -15.733 3.348 4.644 1.00 0.00 C ATOM 1110 CD1 ILE A 73 -13.247 4.501 5.004 1.00 0.00 C ATOM 0 H ILE A 73 -16.563 7.081 5.627 1.00 0.00 H new ATOM 0 HA ILE A 73 -16.437 5.741 3.208 1.00 0.00 H new ATOM 0 HB ILE A 73 -15.965 4.927 6.045 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -14.324 5.859 3.720 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -14.272 6.358 5.399 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -14.943 2.854 5.210 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -16.696 2.908 4.904 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -15.551 3.218 3.577 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -12.289 4.991 4.829 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -13.294 4.155 6.037 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -13.347 3.649 4.331 1.00 0.00 H new ATOM 1122 N ASN A 74 -18.873 4.641 5.117 1.00 0.00 N ATOM 1123 CA ASN A 74 -20.117 3.890 5.099 1.00 0.00 C ATOM 1124 C ASN A 74 -21.034 4.455 4.012 1.00 0.00 C ATOM 1125 O ASN A 74 -21.778 3.712 3.376 1.00 0.00 O ATOM 1126 CB ASN A 74 -20.847 4.001 6.439 1.00 0.00 C ATOM 1127 CG ASN A 74 -21.981 2.979 6.531 1.00 0.00 C ATOM 1128 OD1 ASN A 74 -21.846 1.826 6.153 1.00 0.00 O ATOM 1129 ND2 ASN A 74 -23.105 3.463 7.053 1.00 0.00 N ATOM 0 H ASN A 74 -18.643 5.063 6.017 1.00 0.00 H new ATOM 0 HA ASN A 74 -19.877 2.845 4.905 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -20.142 3.842 7.255 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -21.249 5.007 6.556 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -23.920 2.859 7.157 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -23.151 4.438 7.349 1.00 0.00 H new ATOM 1136 N GLU A 75 -20.948 5.765 3.833 1.00 0.00 N ATOM 1137 CA GLU A 75 -21.760 6.438 2.834 1.00 0.00 C ATOM 1138 C GLU A 75 -21.386 5.955 1.431 1.00 0.00 C ATOM 1139 O GLU A 75 -22.206 5.355 0.738 1.00 0.00 O ATOM 1140 CB GLU A 75 -21.619 7.958 2.947 1.00 0.00 C ATOM 1141 CG GLU A 75 -22.977 8.618 3.192 1.00 0.00 C ATOM 1142 CD GLU A 75 -22.815 10.106 3.506 1.00 0.00 C ATOM 1143 OE1 GLU A 75 -22.133 10.784 2.708 1.00 0.00 O ATOM 1144 OE2 GLU A 75 -23.377 10.534 4.538 1.00 0.00 O ATOM 0 H GLU A 75 -20.328 6.378 4.363 1.00 0.00 H new ATOM 0 HA GLU A 75 -22.805 6.188 3.015 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -20.939 8.204 3.762 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -21.177 8.355 2.033 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -23.609 8.495 2.312 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -23.483 8.121 4.020 1.00 0.00 H new ATOM 1151 N GLU A 76 -20.147 6.234 1.055 1.00 0.00 N ATOM 1152 CA GLU A 76 -19.654 5.835 -0.251 1.00 0.00 C ATOM 1153 C GLU A 76 -19.992 4.368 -0.522 1.00 0.00 C ATOM 1154 O GLU A 76 -20.292 3.994 -1.655 1.00 0.00 O ATOM 1155 CB GLU A 76 -18.148 6.081 -0.368 1.00 0.00 C ATOM 1156 CG GLU A 76 -17.861 7.470 -0.940 1.00 0.00 C ATOM 1157 CD GLU A 76 -17.490 7.387 -2.422 1.00 0.00 C ATOM 1158 OE1 GLU A 76 -18.378 6.989 -3.208 1.00 0.00 O ATOM 1159 OE2 GLU A 76 -16.328 7.725 -2.736 1.00 0.00 O ATOM 0 H GLU A 76 -19.470 6.732 1.633 1.00 0.00 H new ATOM 0 HA GLU A 76 -20.149 6.447 -1.006 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -17.683 5.985 0.613 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -17.701 5.321 -1.008 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -18.737 8.106 -0.816 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -17.048 7.935 -0.383 1.00 0.00 H new ATOM 1166 N ALA A 77 -19.935 3.575 0.538 1.00 0.00 N ATOM 1167 CA ALA A 77 -20.232 2.157 0.430 1.00 0.00 C ATOM 1168 C ALA A 77 -21.692 1.978 0.008 1.00 0.00 C ATOM 1169 O ALA A 77 -21.984 1.237 -0.930 1.00 0.00 O ATOM 1170 CB ALA A 77 -19.919 1.466 1.759 1.00 0.00 C ATOM 0 H ALA A 77 -19.687 3.888 1.477 1.00 0.00 H new ATOM 0 HA ALA A 77 -19.609 1.691 -0.333 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -20.142 0.402 1.677 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -18.864 1.598 1.998 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -20.528 1.905 2.549 1.00 0.00 H new ATOM 1176 N ALA A 78 -22.570 2.667 0.721 1.00 0.00 N ATOM 1177 CA ALA A 78 -23.991 2.593 0.433 1.00 0.00 C ATOM 1178 C ALA A 78 -24.225 2.908 -1.046 1.00 0.00 C ATOM 1179 O ALA A 78 -24.929 2.173 -1.738 1.00 0.00 O ATOM 1180 CB ALA A 78 -24.751 3.545 1.358 1.00 0.00 C ATOM 0 H ALA A 78 -22.324 3.280 1.498 1.00 0.00 H new ATOM 0 HA ALA A 78 -24.367 1.587 0.620 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -25.818 3.489 1.141 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -24.576 3.261 2.396 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -24.401 4.565 1.197 1.00 0.00 H new ATOM 1186 N GLU A 79 -23.619 4.000 -1.489 1.00 0.00 N ATOM 1187 CA GLU A 79 -23.752 4.420 -2.873 1.00 0.00 C ATOM 1188 C GLU A 79 -23.224 3.333 -3.812 1.00 0.00 C ATOM 1189 O GLU A 79 -23.777 3.115 -4.888 1.00 0.00 O ATOM 1190 CB GLU A 79 -23.032 5.749 -3.114 1.00 0.00 C ATOM 1191 CG GLU A 79 -23.973 6.775 -3.749 1.00 0.00 C ATOM 1192 CD GLU A 79 -23.200 8.011 -4.217 1.00 0.00 C ATOM 1193 OE1 GLU A 79 -22.201 8.343 -3.545 1.00 0.00 O ATOM 1194 OE2 GLU A 79 -23.629 8.594 -5.237 1.00 0.00 O ATOM 0 H GLU A 79 -23.035 4.606 -0.913 1.00 0.00 H new ATOM 0 HA GLU A 79 -24.810 4.573 -3.085 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -22.650 6.136 -2.169 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -22.172 5.588 -3.764 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -24.491 6.324 -4.595 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -24.736 7.070 -3.028 1.00 0.00 H new ATOM 1201 N TRP A 80 -22.161 2.679 -3.368 1.00 0.00 N ATOM 1202 CA TRP A 80 -21.552 1.620 -4.155 1.00 0.00 C ATOM 1203 C TRP A 80 -22.616 0.549 -4.409 1.00 0.00 C ATOM 1204 O TRP A 80 -22.797 0.107 -5.542 1.00 0.00 O ATOM 1205 CB TRP A 80 -20.304 1.070 -3.462 1.00 0.00 C ATOM 1206 CG TRP A 80 -19.121 0.837 -4.404 1.00 0.00 C ATOM 1207 CD1 TRP A 80 -18.650 -0.330 -4.863 1.00 0.00 C ATOM 1208 CD2 TRP A 80 -18.274 1.850 -4.986 1.00 0.00 C ATOM 1209 NE1 TRP A 80 -17.564 -0.145 -5.695 1.00 0.00 N ATOM 1210 CE2 TRP A 80 -17.329 1.223 -5.773 1.00 0.00 C ATOM 1211 CE3 TRP A 80 -18.304 3.249 -4.853 1.00 0.00 C ATOM 1212 CZ2 TRP A 80 -16.344 1.915 -6.488 1.00 0.00 C ATOM 1213 CZ3 TRP A 80 -17.313 3.926 -5.574 1.00 0.00 C ATOM 1214 CH2 TRP A 80 -16.355 3.311 -6.369 1.00 0.00 C ATOM 0 H TRP A 80 -21.706 2.862 -2.474 1.00 0.00 H new ATOM 0 HA TRP A 80 -21.206 2.003 -5.115 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -20.000 1.764 -2.679 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -20.557 0.129 -2.973 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -19.067 -1.294 -4.614 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -17.032 -0.877 -6.166 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -19.034 3.761 -4.243 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.616 1.401 -7.098 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -17.292 5.004 -5.507 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -15.622 3.906 -6.893 1.00 0.00 H new ATOM 1225 N ASP A 81 -23.289 0.163 -3.335 1.00 0.00 N ATOM 1226 CA ASP A 81 -24.329 -0.847 -3.427 1.00 0.00 C ATOM 1227 C ASP A 81 -25.395 -0.385 -4.424 1.00 0.00 C ATOM 1228 O ASP A 81 -25.802 -1.148 -5.299 1.00 0.00 O ATOM 1229 CB ASP A 81 -25.009 -1.062 -2.074 1.00 0.00 C ATOM 1230 CG ASP A 81 -25.883 -2.315 -1.981 1.00 0.00 C ATOM 1231 OD1 ASP A 81 -26.488 -2.662 -3.019 1.00 0.00 O ATOM 1232 OD2 ASP A 81 -25.927 -2.897 -0.876 1.00 0.00 O ATOM 0 H ASP A 81 -23.134 0.532 -2.397 1.00 0.00 H new ATOM 0 HA ASP A 81 -23.866 -1.780 -3.750 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -24.241 -1.115 -1.303 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -25.625 -0.191 -1.851 1.00 0.00 H new ATOM 1237 N ARG A 82 -25.817 0.859 -4.257 1.00 0.00 N ATOM 1238 CA ARG A 82 -26.827 1.430 -5.130 1.00 0.00 C ATOM 1239 C ARG A 82 -26.349 1.405 -6.583 1.00 0.00 C ATOM 1240 O ARG A 82 -27.135 1.150 -7.494 1.00 0.00 O ATOM 1241 CB ARG A 82 -27.149 2.873 -4.731 1.00 0.00 C ATOM 1242 CG ARG A 82 -28.645 3.046 -4.463 1.00 0.00 C ATOM 1243 CD ARG A 82 -28.962 4.481 -4.036 1.00 0.00 C ATOM 1244 NE ARG A 82 -30.420 4.723 -4.117 1.00 0.00 N ATOM 1245 CZ ARG A 82 -31.023 5.833 -3.671 1.00 0.00 C ATOM 1246 NH1 ARG A 82 -30.298 6.809 -3.107 1.00 0.00 N ATOM 1247 NH2 ARG A 82 -32.351 5.966 -3.787 1.00 0.00 N ATOM 0 H ARG A 82 -25.477 1.488 -3.529 1.00 0.00 H new ATOM 0 HA ARG A 82 -27.730 0.827 -5.030 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -26.583 3.143 -3.840 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -26.837 3.552 -5.525 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -29.210 2.796 -5.361 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -28.961 2.352 -3.684 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -28.613 4.652 -3.018 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -28.432 5.185 -4.677 1.00 0.00 H new ATOM 0 HE ARG A 82 -31.002 3.999 -4.539 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -29.287 6.707 -3.017 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -30.757 7.654 -2.767 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -32.903 5.222 -4.215 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -32.811 6.811 -3.448 1.00 0.00 H new ATOM 1545 N SER A 102 -18.735 -2.079 0.709 1.00 0.00 N ATOM 1546 CA SER A 102 -18.645 -2.541 2.083 1.00 0.00 C ATOM 1547 C SER A 102 -17.486 -3.530 2.227 1.00 0.00 C ATOM 1548 O SER A 102 -16.762 -3.502 3.220 1.00 0.00 O ATOM 1549 CB SER A 102 -19.955 -3.190 2.533 1.00 0.00 C ATOM 1550 OG SER A 102 -20.042 -3.288 3.953 1.00 0.00 O ATOM 0 HA SER A 102 -18.460 -1.678 2.723 1.00 0.00 H new ATOM 0 HB2 SER A 102 -20.796 -2.607 2.158 1.00 0.00 H new ATOM 0 HB3 SER A 102 -20.036 -4.185 2.095 1.00 0.00 H new ATOM 0 HG SER A 102 -20.893 -3.706 4.201 1.00 0.00 H new ATOM 1556 N ASP A 103 -17.348 -4.381 1.221 1.00 0.00 N ATOM 1557 CA ASP A 103 -16.289 -5.377 1.223 1.00 0.00 C ATOM 1558 C ASP A 103 -14.938 -4.680 1.051 1.00 0.00 C ATOM 1559 O ASP A 103 -13.949 -5.079 1.662 1.00 0.00 O ATOM 1560 CB ASP A 103 -16.461 -6.365 0.068 1.00 0.00 C ATOM 1561 CG ASP A 103 -17.834 -7.039 -0.008 1.00 0.00 C ATOM 1562 OD1 ASP A 103 -18.011 -8.046 0.711 1.00 0.00 O ATOM 1563 OD2 ASP A 103 -18.673 -6.532 -0.783 1.00 0.00 O ATOM 0 H ASP A 103 -17.952 -4.402 0.399 1.00 0.00 H new ATOM 0 HA ASP A 103 -16.335 -5.916 2.169 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -16.278 -5.840 -0.870 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -15.698 -7.138 0.154 1.00 0.00 H new ATOM 1568 N ILE A 104 -14.942 -3.651 0.217 1.00 0.00 N ATOM 1569 CA ILE A 104 -13.729 -2.894 -0.043 1.00 0.00 C ATOM 1570 C ILE A 104 -13.181 -2.347 1.276 1.00 0.00 C ATOM 1571 O ILE A 104 -12.015 -1.964 1.358 1.00 0.00 O ATOM 1572 CB ILE A 104 -13.985 -1.816 -1.097 1.00 0.00 C ATOM 1573 CG1 ILE A 104 -14.474 -2.434 -2.408 1.00 0.00 C ATOM 1574 CG2 ILE A 104 -12.745 -0.943 -1.302 1.00 0.00 C ATOM 1575 CD1 ILE A 104 -15.037 -1.363 -3.345 1.00 0.00 C ATOM 0 H ILE A 104 -15.766 -3.323 -0.288 1.00 0.00 H new ATOM 0 HA ILE A 104 -12.960 -3.541 -0.464 1.00 0.00 H new ATOM 0 HB ILE A 104 -14.780 -1.165 -0.732 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -13.651 -2.954 -2.898 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -15.242 -3.179 -2.199 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -12.955 -0.185 -2.057 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -12.483 -0.457 -0.362 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -11.913 -1.565 -1.633 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -15.377 -1.830 -4.269 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -15.876 -0.861 -2.862 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -14.260 -0.633 -3.572 1.00 0.00 H new ATOM 1587 N ALA A 105 -14.049 -2.328 2.278 1.00 0.00 N ATOM 1588 CA ALA A 105 -13.667 -1.834 3.589 1.00 0.00 C ATOM 1589 C ALA A 105 -13.025 -2.968 4.390 1.00 0.00 C ATOM 1590 O ALA A 105 -12.257 -2.721 5.319 1.00 0.00 O ATOM 1591 CB ALA A 105 -14.894 -1.247 4.292 1.00 0.00 C ATOM 0 H ALA A 105 -15.015 -2.647 2.207 1.00 0.00 H new ATOM 0 HA ALA A 105 -12.930 -1.036 3.498 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -14.607 -0.876 5.276 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -15.296 -0.426 3.698 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -15.654 -2.020 4.403 1.00 0.00 H new ATOM 1597 N GLY A 106 -13.362 -4.190 4.001 1.00 0.00 N ATOM 1598 CA GLY A 106 -12.828 -5.363 4.669 1.00 0.00 C ATOM 1599 C GLY A 106 -13.684 -5.742 5.879 1.00 0.00 C ATOM 1600 O GLY A 106 -13.238 -6.486 6.752 1.00 0.00 O ATOM 0 H GLY A 106 -13.999 -4.392 3.230 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -12.790 -6.198 3.970 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -11.804 -5.169 4.990 1.00 0.00 H new ATOM 1604 N THR A 107 -14.899 -5.214 5.892 1.00 0.00 N ATOM 1605 CA THR A 107 -15.822 -5.488 6.980 1.00 0.00 C ATOM 1606 C THR A 107 -16.219 -6.965 6.985 1.00 0.00 C ATOM 1607 O THR A 107 -16.341 -7.575 8.045 1.00 0.00 O ATOM 1608 CB THR A 107 -17.016 -4.540 6.838 1.00 0.00 C ATOM 1609 OG1 THR A 107 -16.460 -3.247 7.067 1.00 0.00 O ATOM 1610 CG2 THR A 107 -18.038 -4.711 7.964 1.00 0.00 C ATOM 0 H THR A 107 -15.266 -4.598 5.166 1.00 0.00 H new ATOM 0 HA THR A 107 -15.355 -5.306 7.948 1.00 0.00 H new ATOM 0 HB THR A 107 -17.503 -4.711 5.878 1.00 0.00 H new ATOM 0 HG1 THR A 107 -17.165 -2.570 6.992 1.00 0.00 H new ATOM 0 HG21 THR A 107 -18.864 -4.015 7.815 1.00 0.00 H new ATOM 0 HG22 THR A 107 -18.419 -5.732 7.958 1.00 0.00 H new ATOM 0 HG23 THR A 107 -17.561 -4.507 8.923 1.00 0.00 H new ATOM 1618 N THR A 108 -16.408 -7.498 5.787 1.00 0.00 N ATOM 1619 CA THR A 108 -16.787 -8.893 5.639 1.00 0.00 C ATOM 1620 C THR A 108 -15.701 -9.664 4.886 1.00 0.00 C ATOM 1621 O THR A 108 -15.694 -10.894 4.888 1.00 0.00 O ATOM 1622 CB THR A 108 -18.154 -8.941 4.952 1.00 0.00 C ATOM 1623 OG1 THR A 108 -19.050 -8.414 5.927 1.00 0.00 O ATOM 1624 CG2 THR A 108 -18.646 -10.372 4.728 1.00 0.00 C ATOM 0 H THR A 108 -16.306 -6.989 4.909 1.00 0.00 H new ATOM 0 HA THR A 108 -16.877 -9.384 6.608 1.00 0.00 H new ATOM 0 HB THR A 108 -18.098 -8.423 3.995 1.00 0.00 H new ATOM 0 HG1 THR A 108 -19.960 -8.407 5.565 1.00 0.00 H new ATOM 0 HG21 THR A 108 -19.619 -10.350 4.238 1.00 0.00 H new ATOM 0 HG22 THR A 108 -17.935 -10.907 4.098 1.00 0.00 H new ATOM 0 HG23 THR A 108 -18.735 -10.881 5.688 1.00 0.00 H new ATOM 1632 N SER A 109 -14.810 -8.909 4.261 1.00 0.00 N ATOM 1633 CA SER A 109 -13.723 -9.507 3.505 1.00 0.00 C ATOM 1634 C SER A 109 -12.380 -9.145 4.145 1.00 0.00 C ATOM 1635 O SER A 109 -12.294 -8.192 4.918 1.00 0.00 O ATOM 1636 CB SER A 109 -13.753 -9.054 2.044 1.00 0.00 C ATOM 1637 OG SER A 109 -14.033 -7.662 1.922 1.00 0.00 O ATOM 0 H SER A 109 -14.818 -7.889 4.263 1.00 0.00 H new ATOM 0 HA SER A 109 -13.848 -10.590 3.524 1.00 0.00 H new ATOM 0 HB2 SER A 109 -12.793 -9.273 1.577 1.00 0.00 H new ATOM 0 HB3 SER A 109 -14.508 -9.624 1.503 1.00 0.00 H new ATOM 0 HG SER A 109 -14.951 -7.486 2.216 1.00 0.00 H new ATOM 1643 N THR A 110 -11.367 -9.926 3.800 1.00 0.00 N ATOM 1644 CA THR A 110 -10.034 -9.700 4.331 1.00 0.00 C ATOM 1645 C THR A 110 -9.126 -9.099 3.256 1.00 0.00 C ATOM 1646 O THR A 110 -9.558 -8.879 2.125 1.00 0.00 O ATOM 1647 CB THR A 110 -9.517 -11.026 4.891 1.00 0.00 C ATOM 1648 OG1 THR A 110 -9.409 -11.867 3.745 1.00 0.00 O ATOM 1649 CG2 THR A 110 -10.547 -11.730 5.775 1.00 0.00 C ATOM 0 H THR A 110 -11.443 -10.716 3.159 1.00 0.00 H new ATOM 0 HA THR A 110 -10.050 -8.972 5.142 1.00 0.00 H new ATOM 0 HB THR A 110 -8.608 -10.848 5.466 1.00 0.00 H new ATOM 0 HG1 THR A 110 -9.078 -12.749 4.016 1.00 0.00 H new ATOM 0 HG21 THR A 110 -10.129 -12.666 6.146 1.00 0.00 H new ATOM 0 HG22 THR A 110 -10.803 -11.088 6.617 1.00 0.00 H new ATOM 0 HG23 THR A 110 -11.444 -11.939 5.192 1.00 0.00 H new ATOM 1657 N LEU A 111 -7.885 -8.848 3.646 1.00 0.00 N ATOM 1658 CA LEU A 111 -6.913 -8.277 2.730 1.00 0.00 C ATOM 1659 C LEU A 111 -6.806 -9.163 1.488 1.00 0.00 C ATOM 1660 O LEU A 111 -6.754 -8.662 0.366 1.00 0.00 O ATOM 1661 CB LEU A 111 -5.577 -8.049 3.439 1.00 0.00 C ATOM 1662 CG LEU A 111 -4.360 -7.852 2.532 1.00 0.00 C ATOM 1663 CD1 LEU A 111 -4.462 -6.536 1.758 1.00 0.00 C ATOM 1664 CD2 LEU A 111 -3.059 -7.947 3.331 1.00 0.00 C ATOM 0 H LEU A 111 -7.530 -9.030 4.585 1.00 0.00 H new ATOM 0 HA LEU A 111 -7.241 -7.293 2.393 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -5.673 -7.172 4.079 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -5.385 -8.901 4.091 1.00 0.00 H new ATOM 0 HG LEU A 111 -4.346 -8.658 1.798 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -3.585 -6.420 1.121 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -5.360 -6.546 1.141 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -4.513 -5.704 2.460 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -2.210 -7.803 2.662 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -3.048 -7.176 4.102 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -2.990 -8.929 3.799 1.00 0.00 H new ATOM 1676 N GLN A 112 -6.778 -10.465 1.730 1.00 0.00 N ATOM 1677 CA GLN A 112 -6.679 -11.426 0.644 1.00 0.00 C ATOM 1678 C GLN A 112 -7.819 -11.217 -0.356 1.00 0.00 C ATOM 1679 O GLN A 112 -7.593 -11.203 -1.565 1.00 0.00 O ATOM 1680 CB GLN A 112 -6.678 -12.859 1.180 1.00 0.00 C ATOM 1681 CG GLN A 112 -5.566 -13.687 0.528 1.00 0.00 C ATOM 1682 CD GLN A 112 -5.949 -15.166 0.466 1.00 0.00 C ATOM 1683 OE1 GLN A 112 -6.866 -15.568 -0.232 1.00 0.00 O ATOM 1684 NE2 GLN A 112 -5.198 -15.953 1.232 1.00 0.00 N ATOM 0 H GLN A 112 -6.822 -10.877 2.662 1.00 0.00 H new ATOM 0 HA GLN A 112 -5.733 -11.264 0.127 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -6.541 -12.847 2.261 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -7.644 -13.324 0.986 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -5.373 -13.315 -0.478 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -4.642 -13.570 1.094 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -4.446 -15.552 1.792 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -5.374 -16.957 1.259 1.00 0.00 H new ATOM 1693 N GLU A 113 -9.017 -11.058 0.186 1.00 0.00 N ATOM 1694 CA GLU A 113 -10.191 -10.849 -0.644 1.00 0.00 C ATOM 1695 C GLU A 113 -10.026 -9.586 -1.491 1.00 0.00 C ATOM 1696 O GLU A 113 -10.312 -9.594 -2.688 1.00 0.00 O ATOM 1697 CB GLU A 113 -11.460 -10.775 0.209 1.00 0.00 C ATOM 1698 CG GLU A 113 -12.230 -12.095 0.162 1.00 0.00 C ATOM 1699 CD GLU A 113 -11.522 -13.173 0.986 1.00 0.00 C ATOM 1700 OE1 GLU A 113 -10.601 -13.805 0.422 1.00 0.00 O ATOM 1701 OE2 GLU A 113 -11.916 -13.340 2.161 1.00 0.00 O ATOM 0 H GLU A 113 -9.200 -11.070 1.189 1.00 0.00 H new ATOM 0 HA GLU A 113 -10.293 -11.702 -1.315 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -11.196 -10.540 1.240 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -12.096 -9.966 -0.149 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -13.240 -11.945 0.544 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -12.326 -12.427 -0.872 1.00 0.00 H new ATOM 1708 N GLN A 114 -9.563 -8.530 -0.837 1.00 0.00 N ATOM 1709 CA GLN A 114 -9.355 -7.262 -1.515 1.00 0.00 C ATOM 1710 C GLN A 114 -8.393 -7.440 -2.692 1.00 0.00 C ATOM 1711 O GLN A 114 -8.665 -6.972 -3.797 1.00 0.00 O ATOM 1712 CB GLN A 114 -8.841 -6.199 -0.543 1.00 0.00 C ATOM 1713 CG GLN A 114 -10.001 -5.410 0.071 1.00 0.00 C ATOM 1714 CD GLN A 114 -10.590 -6.150 1.274 1.00 0.00 C ATOM 1715 OE1 GLN A 114 -10.024 -6.181 2.354 1.00 0.00 O ATOM 1716 NE2 GLN A 114 -11.755 -6.743 1.027 1.00 0.00 N ATOM 0 H GLN A 114 -9.326 -8.527 0.155 1.00 0.00 H new ATOM 0 HA GLN A 114 -10.314 -6.919 -1.904 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -8.261 -6.674 0.248 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -8.169 -5.518 -1.065 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -9.652 -4.425 0.380 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -10.776 -5.253 -0.679 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -12.174 -6.677 0.099 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -12.229 -7.263 1.765 1.00 0.00 H new ATOM 1725 N ILE A 115 -7.289 -8.118 -2.414 1.00 0.00 N ATOM 1726 CA ILE A 115 -6.285 -8.364 -3.436 1.00 0.00 C ATOM 1727 C ILE A 115 -6.925 -9.123 -4.600 1.00 0.00 C ATOM 1728 O ILE A 115 -6.611 -8.865 -5.761 1.00 0.00 O ATOM 1729 CB ILE A 115 -5.070 -9.071 -2.834 1.00 0.00 C ATOM 1730 CG1 ILE A 115 -3.932 -8.082 -2.574 1.00 0.00 C ATOM 1731 CG2 ILE A 115 -4.624 -10.241 -3.713 1.00 0.00 C ATOM 1732 CD1 ILE A 115 -4.393 -6.943 -1.663 1.00 0.00 C ATOM 0 H ILE A 115 -7.068 -8.505 -1.496 1.00 0.00 H new ATOM 0 HA ILE A 115 -5.910 -7.422 -3.837 1.00 0.00 H new ATOM 0 HB ILE A 115 -5.361 -9.487 -1.869 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -3.091 -8.602 -2.115 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -3.576 -7.674 -3.520 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -3.758 -10.726 -3.262 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -5.438 -10.961 -3.802 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -4.357 -9.871 -4.703 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -3.565 -6.254 -1.494 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -5.218 -6.410 -2.136 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -4.725 -7.352 -0.709 1.00 0.00 H new ATOM 1744 N GLY A 116 -7.809 -10.045 -4.249 1.00 0.00 N ATOM 1745 CA GLY A 116 -8.495 -10.844 -5.251 1.00 0.00 C ATOM 1746 C GLY A 116 -9.360 -9.964 -6.156 1.00 0.00 C ATOM 1747 O GLY A 116 -9.264 -10.042 -7.379 1.00 0.00 O ATOM 0 H GLY A 116 -8.066 -10.257 -3.285 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -7.764 -11.384 -5.853 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -9.119 -11.591 -4.761 1.00 0.00 H new ATOM 1751 N TRP A 117 -10.185 -9.147 -5.518 1.00 0.00 N ATOM 1752 CA TRP A 117 -11.067 -8.253 -6.250 1.00 0.00 C ATOM 1753 C TRP A 117 -10.203 -7.380 -7.162 1.00 0.00 C ATOM 1754 O TRP A 117 -10.623 -7.018 -8.261 1.00 0.00 O ATOM 1755 CB TRP A 117 -11.939 -7.438 -5.293 1.00 0.00 C ATOM 1756 CG TRP A 117 -13.260 -8.117 -4.924 1.00 0.00 C ATOM 1757 CD1 TRP A 117 -14.222 -8.553 -5.749 1.00 0.00 C ATOM 1758 CD2 TRP A 117 -13.728 -8.421 -3.594 1.00 0.00 C ATOM 1759 NE1 TRP A 117 -15.271 -9.114 -5.050 1.00 0.00 N ATOM 1760 CE2 TRP A 117 -14.961 -9.032 -3.697 1.00 0.00 C ATOM 1761 CE3 TRP A 117 -13.129 -8.189 -2.343 1.00 0.00 C ATOM 1762 CZ2 TRP A 117 -15.701 -9.459 -2.588 1.00 0.00 C ATOM 1763 CZ3 TRP A 117 -13.881 -8.622 -1.244 1.00 0.00 C ATOM 1764 CH2 TRP A 117 -15.124 -9.238 -1.332 1.00 0.00 C ATOM 0 H TRP A 117 -10.262 -9.085 -4.503 1.00 0.00 H new ATOM 0 HA TRP A 117 -11.764 -8.819 -6.868 1.00 0.00 H new ATOM 0 HB2 TRP A 117 -11.375 -7.243 -4.381 1.00 0.00 H new ATOM 0 HB3 TRP A 117 -12.154 -6.471 -5.748 1.00 0.00 H new ATOM 0 HD1 TRP A 117 -14.181 -8.475 -6.825 1.00 0.00 H new ATOM 0 HE1 TRP A 117 -16.118 -9.515 -5.452 1.00 0.00 H new ATOM 0 HE3 TRP A 117 -12.165 -7.714 -2.238 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 -16.665 -9.933 -2.696 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 -13.466 -8.466 -0.259 1.00 0.00 H new ATOM 0 HH2 TRP A 117 -15.642 -9.545 -0.435 1.00 0.00 H new ATOM 1775 N MET A 118 -9.013 -7.066 -6.674 1.00 0.00 N ATOM 1776 CA MET A 118 -8.087 -6.241 -7.431 1.00 0.00 C ATOM 1777 C MET A 118 -7.283 -7.087 -8.421 1.00 0.00 C ATOM 1778 O MET A 118 -6.684 -6.556 -9.355 1.00 0.00 O ATOM 1779 CB MET A 118 -7.129 -5.533 -6.470 1.00 0.00 C ATOM 1780 CG MET A 118 -6.280 -4.496 -7.207 1.00 0.00 C ATOM 1781 SD MET A 118 -6.689 -2.854 -6.639 1.00 0.00 S ATOM 1782 CE MET A 118 -5.787 -2.827 -5.098 1.00 0.00 C ATOM 0 H MET A 118 -8.668 -7.368 -5.763 1.00 0.00 H new ATOM 0 HA MET A 118 -8.662 -5.505 -7.993 1.00 0.00 H new ATOM 0 HB2 MET A 118 -7.697 -5.046 -5.678 1.00 0.00 H new ATOM 0 HB3 MET A 118 -6.480 -6.267 -5.992 1.00 0.00 H new ATOM 0 HG2 MET A 118 -5.222 -4.695 -7.038 1.00 0.00 H new ATOM 0 HG3 MET A 118 -6.451 -4.571 -8.281 1.00 0.00 H new ATOM 0 HE1 MET A 118 -6.406 -2.377 -4.322 1.00 0.00 H new ATOM 0 HE2 MET A 118 -5.528 -3.846 -4.810 1.00 0.00 H new ATOM 0 HE3 MET A 118 -4.876 -2.242 -5.220 1.00 0.00 H new ATOM 1792 N THR A 119 -7.295 -8.391 -8.183 1.00 0.00 N ATOM 1793 CA THR A 119 -6.574 -9.315 -9.041 1.00 0.00 C ATOM 1794 C THR A 119 -7.556 -10.170 -9.846 1.00 0.00 C ATOM 1795 O THR A 119 -7.196 -11.241 -10.333 1.00 0.00 O ATOM 1796 CB THR A 119 -5.631 -10.138 -8.162 1.00 0.00 C ATOM 1797 OG1 THR A 119 -4.771 -9.167 -7.572 1.00 0.00 O ATOM 1798 CG2 THR A 119 -4.688 -11.020 -8.983 1.00 0.00 C ATOM 0 H THR A 119 -7.793 -8.829 -7.408 1.00 0.00 H new ATOM 0 HA THR A 119 -5.973 -8.784 -9.779 1.00 0.00 H new ATOM 0 HB THR A 119 -6.216 -10.762 -7.486 1.00 0.00 H new ATOM 0 HG1 THR A 119 -5.118 -8.915 -6.691 1.00 0.00 H new ATOM 0 HG21 THR A 119 -4.040 -11.583 -8.312 1.00 0.00 H new ATOM 0 HG22 THR A 119 -5.273 -11.712 -9.589 1.00 0.00 H new ATOM 0 HG23 THR A 119 -4.079 -10.393 -9.634 1.00 0.00 H new ATOM 1806 N HIS A 120 -8.776 -9.666 -9.959 1.00 0.00 N ATOM 1807 CA HIS A 120 -9.811 -10.369 -10.697 1.00 0.00 C ATOM 1808 C HIS A 120 -10.163 -9.586 -11.963 1.00 0.00 C ATOM 1809 O HIS A 120 -9.788 -8.423 -12.101 1.00 0.00 O ATOM 1810 CB HIS A 120 -11.027 -10.635 -9.807 1.00 0.00 C ATOM 1811 CG HIS A 120 -11.305 -12.100 -9.566 1.00 0.00 C ATOM 1812 ND1 HIS A 120 -10.305 -13.057 -9.533 1.00 0.00 N ATOM 1813 CD2 HIS A 120 -12.477 -12.760 -9.347 1.00 0.00 C ATOM 1814 CE1 HIS A 120 -10.863 -14.236 -9.305 1.00 0.00 C ATOM 1815 NE2 HIS A 120 -12.209 -14.051 -9.190 1.00 0.00 N ATOM 0 H HIS A 120 -9.071 -8.779 -9.552 1.00 0.00 H new ATOM 0 HA HIS A 120 -9.440 -11.346 -11.008 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -10.876 -10.142 -8.847 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -11.905 -10.180 -10.264 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -13.458 -12.309 -9.308 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -10.343 -15.179 -9.224 1.00 0.00 H new ATOM 0 HE2 HIS A 120 -12.896 -14.783 -9.013 1.00 0.00 H new ATOM 1824 N ASN A 121 -10.878 -10.256 -12.854 1.00 0.00 N ATOM 1825 CA ASN A 121 -11.285 -9.636 -14.105 1.00 0.00 C ATOM 1826 C ASN A 121 -12.808 -9.492 -14.126 1.00 0.00 C ATOM 1827 O ASN A 121 -13.530 -10.485 -14.052 1.00 0.00 O ATOM 1828 CB ASN A 121 -10.874 -10.493 -15.303 1.00 0.00 C ATOM 1829 CG ASN A 121 -9.456 -10.150 -15.764 1.00 0.00 C ATOM 1830 OD1 ASN A 121 -8.541 -9.991 -14.973 1.00 0.00 O ATOM 1831 ND2 ASN A 121 -9.327 -10.044 -17.083 1.00 0.00 N ATOM 0 H ASN A 121 -11.186 -11.221 -12.736 1.00 0.00 H new ATOM 0 HA ASN A 121 -10.798 -8.663 -14.174 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -10.927 -11.548 -15.035 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -11.574 -10.337 -16.123 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -8.420 -9.817 -17.490 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -10.135 -10.190 -17.688 1.00 0.00 H new ATOM 1838 N PRO A 122 -13.263 -8.215 -14.230 1.00 0.00 N ATOM 1839 CA PRO A 122 -12.341 -7.095 -14.312 1.00 0.00 C ATOM 1840 C PRO A 122 -11.715 -6.799 -12.947 1.00 0.00 C ATOM 1841 O PRO A 122 -12.228 -7.236 -11.917 1.00 0.00 O ATOM 1842 CB PRO A 122 -13.169 -5.941 -14.849 1.00 0.00 C ATOM 1843 CG PRO A 122 -14.621 -6.323 -14.609 1.00 0.00 C ATOM 1844 CD PRO A 122 -14.664 -7.804 -14.271 1.00 0.00 C ATOM 0 HA PRO A 122 -11.493 -7.296 -14.966 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -12.920 -5.011 -14.338 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -12.977 -5.783 -15.910 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -15.041 -5.733 -13.794 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -15.221 -6.116 -15.495 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -15.156 -7.978 -13.314 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -15.220 -8.366 -15.022 1.00 0.00 H new ATOM 1852 N PRO A 123 -10.588 -6.038 -12.984 1.00 0.00 N ATOM 1853 CA PRO A 123 -9.889 -5.678 -11.763 1.00 0.00 C ATOM 1854 C PRO A 123 -10.642 -4.586 -11.000 1.00 0.00 C ATOM 1855 O PRO A 123 -10.829 -3.482 -11.511 1.00 0.00 O ATOM 1856 CB PRO A 123 -8.507 -5.238 -12.217 1.00 0.00 C ATOM 1857 CG PRO A 123 -8.634 -4.926 -13.699 1.00 0.00 C ATOM 1858 CD PRO A 123 -9.954 -5.502 -14.184 1.00 0.00 C ATOM 0 HA PRO A 123 -9.819 -6.507 -11.059 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -8.174 -4.362 -11.661 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -7.771 -6.023 -12.045 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -8.602 -3.849 -13.867 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -7.802 -5.359 -14.253 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -10.573 -4.735 -14.650 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -9.796 -6.281 -14.930 1.00 0.00 H new ATOM 1866 N ILE A 124 -11.057 -4.933 -9.790 1.00 0.00 N ATOM 1867 CA ILE A 124 -11.785 -3.996 -8.952 1.00 0.00 C ATOM 1868 C ILE A 124 -10.793 -3.076 -8.240 1.00 0.00 C ATOM 1869 O ILE A 124 -9.874 -3.547 -7.571 1.00 0.00 O ATOM 1870 CB ILE A 124 -12.722 -4.745 -8.002 1.00 0.00 C ATOM 1871 CG1 ILE A 124 -13.838 -5.451 -8.774 1.00 0.00 C ATOM 1872 CG2 ILE A 124 -13.274 -3.809 -6.925 1.00 0.00 C ATOM 1873 CD1 ILE A 124 -13.624 -6.966 -8.785 1.00 0.00 C ATOM 0 H ILE A 124 -10.903 -5.850 -9.371 1.00 0.00 H new ATOM 0 HA ILE A 124 -12.427 -3.360 -9.561 1.00 0.00 H new ATOM 0 HB ILE A 124 -12.145 -5.517 -7.493 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -14.802 -5.220 -8.320 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -13.870 -5.077 -9.797 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -13.937 -4.367 -6.263 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -12.449 -3.394 -6.346 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -13.830 -2.999 -7.397 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -14.431 -7.443 -9.340 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -12.671 -7.195 -9.261 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -13.617 -7.340 -7.761 1.00 0.00 H new ATOM 1885 N PRO A 125 -11.018 -1.745 -8.410 1.00 0.00 N ATOM 1886 CA PRO A 125 -10.153 -0.755 -7.791 1.00 0.00 C ATOM 1887 C PRO A 125 -10.433 -0.645 -6.291 1.00 0.00 C ATOM 1888 O PRO A 125 -10.641 0.452 -5.773 1.00 0.00 O ATOM 1889 CB PRO A 125 -10.432 0.536 -8.544 1.00 0.00 C ATOM 1890 CG PRO A 125 -11.769 0.332 -9.239 1.00 0.00 C ATOM 1891 CD PRO A 125 -12.096 -1.151 -9.195 1.00 0.00 C ATOM 0 HA PRO A 125 -9.097 -1.018 -7.856 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -10.472 1.385 -7.862 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -9.644 0.745 -9.267 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -12.549 0.910 -8.743 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -11.720 0.682 -10.270 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -13.067 -1.329 -8.733 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -12.137 -1.577 -10.197 1.00 0.00 H new ATOM 1899 N VAL A 126 -10.429 -1.795 -5.634 1.00 0.00 N ATOM 1900 CA VAL A 126 -10.679 -1.842 -4.204 1.00 0.00 C ATOM 1901 C VAL A 126 -9.739 -0.866 -3.494 1.00 0.00 C ATOM 1902 O VAL A 126 -10.110 -0.259 -2.490 1.00 0.00 O ATOM 1903 CB VAL A 126 -10.545 -3.279 -3.695 1.00 0.00 C ATOM 1904 CG1 VAL A 126 -9.296 -3.949 -4.271 1.00 0.00 C ATOM 1905 CG2 VAL A 126 -10.534 -3.320 -2.166 1.00 0.00 C ATOM 0 H VAL A 126 -10.256 -2.703 -6.066 1.00 0.00 H new ATOM 0 HA VAL A 126 -11.700 -1.528 -3.985 1.00 0.00 H new ATOM 0 HB VAL A 126 -11.415 -3.839 -4.038 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -9.224 -4.969 -3.894 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -9.362 -3.968 -5.359 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -8.411 -3.388 -3.971 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -10.438 -4.353 -1.830 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -9.692 -2.737 -1.792 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -11.464 -2.899 -1.784 1.00 0.00 H new ATOM 1915 N GLY A 127 -8.539 -0.746 -4.043 1.00 0.00 N ATOM 1916 CA GLY A 127 -7.543 0.147 -3.474 1.00 0.00 C ATOM 1917 C GLY A 127 -7.937 1.610 -3.679 1.00 0.00 C ATOM 1918 O GLY A 127 -8.300 2.299 -2.726 1.00 0.00 O ATOM 0 H GLY A 127 -8.234 -1.251 -4.875 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -7.432 -0.058 -2.409 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -6.574 -0.041 -3.937 1.00 0.00 H new ATOM 1922 N GLU A 128 -7.851 2.044 -4.928 1.00 0.00 N ATOM 1923 CA GLU A 128 -8.195 3.414 -5.270 1.00 0.00 C ATOM 1924 C GLU A 128 -9.547 3.791 -4.661 1.00 0.00 C ATOM 1925 O GLU A 128 -9.772 4.947 -4.308 1.00 0.00 O ATOM 1926 CB GLU A 128 -8.201 3.615 -6.787 1.00 0.00 C ATOM 1927 CG GLU A 128 -6.777 3.775 -7.325 1.00 0.00 C ATOM 1928 CD GLU A 128 -6.790 4.337 -8.748 1.00 0.00 C ATOM 1929 OE1 GLU A 128 -7.442 3.702 -9.604 1.00 0.00 O ATOM 1930 OE2 GLU A 128 -6.146 5.389 -8.948 1.00 0.00 O ATOM 0 H GLU A 128 -7.548 1.471 -5.716 1.00 0.00 H new ATOM 0 HA GLU A 128 -7.435 4.074 -4.852 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -8.682 2.763 -7.268 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -8.790 4.497 -7.038 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -6.210 4.439 -6.673 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -6.270 2.810 -7.316 1.00 0.00 H new ATOM 1937 N ILE A 129 -10.411 2.791 -4.557 1.00 0.00 N ATOM 1938 CA ILE A 129 -11.735 3.004 -3.997 1.00 0.00 C ATOM 1939 C ILE A 129 -11.605 3.391 -2.523 1.00 0.00 C ATOM 1940 O ILE A 129 -12.109 4.432 -2.104 1.00 0.00 O ATOM 1941 CB ILE A 129 -12.619 1.778 -4.234 1.00 0.00 C ATOM 1942 CG1 ILE A 129 -12.968 1.633 -5.717 1.00 0.00 C ATOM 1943 CG2 ILE A 129 -13.870 1.825 -3.353 1.00 0.00 C ATOM 1944 CD1 ILE A 129 -13.179 0.163 -6.089 1.00 0.00 C ATOM 0 H ILE A 129 -10.220 1.833 -4.851 1.00 0.00 H new ATOM 0 HA ILE A 129 -12.233 3.832 -4.501 1.00 0.00 H new ATOM 0 HB ILE A 129 -12.056 0.890 -3.947 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -13.871 2.201 -5.939 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -12.168 2.055 -6.326 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -14.481 0.942 -3.541 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -13.576 1.846 -2.304 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -14.446 2.721 -3.586 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -13.426 0.087 -7.148 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -12.266 -0.398 -5.888 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -13.996 -0.249 -5.496 1.00 0.00 H new ATOM 1956 N TYR A 130 -10.925 2.534 -1.777 1.00 0.00 N ATOM 1957 CA TYR A 130 -10.721 2.773 -0.358 1.00 0.00 C ATOM 1958 C TYR A 130 -9.951 4.075 -0.127 1.00 0.00 C ATOM 1959 O TYR A 130 -10.243 4.815 0.812 1.00 0.00 O ATOM 1960 CB TYR A 130 -9.881 1.601 0.153 1.00 0.00 C ATOM 1961 CG TYR A 130 -10.114 1.262 1.625 1.00 0.00 C ATOM 1962 CD1 TYR A 130 -11.398 1.220 2.130 1.00 0.00 C ATOM 1963 CD2 TYR A 130 -9.040 0.998 2.451 1.00 0.00 C ATOM 1964 CE1 TYR A 130 -11.618 0.902 3.516 1.00 0.00 C ATOM 1965 CE2 TYR A 130 -9.260 0.679 3.838 1.00 0.00 C ATOM 1966 CZ TYR A 130 -10.538 0.647 4.303 1.00 0.00 C ATOM 1967 OH TYR A 130 -10.745 0.346 5.612 1.00 0.00 O ATOM 0 H TYR A 130 -10.508 1.672 -2.128 1.00 0.00 H new ATOM 0 HA TYR A 130 -11.678 2.857 0.158 1.00 0.00 H new ATOM 0 HB2 TYR A 130 -10.100 0.720 -0.451 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -8.826 1.833 0.007 1.00 0.00 H new ATOM 0 HD1 TYR A 130 -12.239 1.426 1.484 1.00 0.00 H new ATOM 0 HD2 TYR A 130 -8.035 1.031 2.057 1.00 0.00 H new ATOM 0 HE1 TYR A 130 -12.618 0.867 3.922 1.00 0.00 H new ATOM 0 HE2 TYR A 130 -8.428 0.470 4.495 1.00 0.00 H new ATOM 0 HH TYR A 130 -9.884 0.187 6.051 1.00 0.00 H new ATOM 1977 N LYS A 131 -8.984 4.315 -0.998 1.00 0.00 N ATOM 1978 CA LYS A 131 -8.169 5.515 -0.901 1.00 0.00 C ATOM 1979 C LYS A 131 -9.074 6.747 -0.972 1.00 0.00 C ATOM 1980 O LYS A 131 -8.942 7.666 -0.165 1.00 0.00 O ATOM 1981 CB LYS A 131 -7.065 5.501 -1.959 1.00 0.00 C ATOM 1982 CG LYS A 131 -6.070 6.640 -1.730 1.00 0.00 C ATOM 1983 CD LYS A 131 -6.425 7.858 -2.588 1.00 0.00 C ATOM 1984 CE LYS A 131 -5.680 7.822 -3.923 1.00 0.00 C ATOM 1985 NZ LYS A 131 -6.165 8.900 -4.816 1.00 0.00 N ATOM 0 H LYS A 131 -8.745 3.699 -1.775 1.00 0.00 H new ATOM 0 HA LYS A 131 -7.656 5.550 0.060 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -6.542 4.545 -1.931 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -7.506 5.593 -2.951 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -6.069 6.920 -0.677 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -5.062 6.302 -1.971 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -7.500 7.880 -2.768 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -6.172 8.772 -2.051 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -4.610 7.937 -3.752 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -5.824 6.853 -4.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -5.649 8.862 -5.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -7.182 8.773 -4.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -6.005 9.823 -4.365 1.00 0.00 H new ATOM 1999 N ARG A 132 -9.973 6.726 -1.945 1.00 0.00 N ATOM 2000 CA ARG A 132 -10.899 7.830 -2.132 1.00 0.00 C ATOM 2001 C ARG A 132 -11.898 7.886 -0.975 1.00 0.00 C ATOM 2002 O ARG A 132 -12.339 8.966 -0.583 1.00 0.00 O ATOM 2003 CB ARG A 132 -11.663 7.691 -3.450 1.00 0.00 C ATOM 2004 CG ARG A 132 -12.091 9.059 -3.983 1.00 0.00 C ATOM 2005 CD ARG A 132 -12.670 8.941 -5.395 1.00 0.00 C ATOM 2006 NE ARG A 132 -12.110 10.002 -6.261 1.00 0.00 N ATOM 2007 CZ ARG A 132 -12.347 11.310 -6.095 1.00 0.00 C ATOM 2008 NH1 ARG A 132 -13.135 11.727 -5.094 1.00 0.00 N ATOM 2009 NH2 ARG A 132 -11.796 12.203 -6.929 1.00 0.00 N ATOM 0 H ARG A 132 -10.080 5.962 -2.612 1.00 0.00 H new ATOM 0 HA ARG A 132 -10.316 8.751 -2.159 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -11.035 7.190 -4.187 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -12.542 7.064 -3.300 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -12.834 9.496 -3.317 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -11.235 9.734 -3.992 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -12.439 7.960 -5.811 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -13.756 9.024 -5.360 1.00 0.00 H new ATOM 0 HE ARG A 132 -11.506 9.720 -7.033 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -13.554 11.048 -4.458 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -13.315 12.723 -4.968 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -11.196 11.887 -7.691 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -11.977 13.199 -6.802 1.00 0.00 H new ATOM 2023 N TRP A 133 -12.227 6.710 -0.462 1.00 0.00 N ATOM 2024 CA TRP A 133 -13.166 6.612 0.643 1.00 0.00 C ATOM 2025 C TRP A 133 -12.568 7.354 1.840 1.00 0.00 C ATOM 2026 O TRP A 133 -13.064 8.410 2.231 1.00 0.00 O ATOM 2027 CB TRP A 133 -13.499 5.151 0.951 1.00 0.00 C ATOM 2028 CG TRP A 133 -14.555 4.544 0.026 1.00 0.00 C ATOM 2029 CD1 TRP A 133 -14.859 4.907 -1.228 1.00 0.00 C ATOM 2030 CD2 TRP A 133 -15.439 3.446 0.333 1.00 0.00 C ATOM 2031 NE1 TRP A 133 -15.872 4.127 -1.749 1.00 0.00 N ATOM 2032 CE2 TRP A 133 -16.235 3.210 -0.770 1.00 0.00 C ATOM 2033 CE3 TRP A 133 -15.563 2.677 1.504 1.00 0.00 C ATOM 2034 CZ2 TRP A 133 -17.210 2.206 -0.810 1.00 0.00 C ATOM 2035 CZ3 TRP A 133 -16.542 1.678 1.447 1.00 0.00 C ATOM 2036 CH2 TRP A 133 -17.350 1.427 0.346 1.00 0.00 C ATOM 0 H TRP A 133 -11.860 5.817 -0.791 1.00 0.00 H new ATOM 0 HA TRP A 133 -14.116 7.079 0.384 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -12.587 4.559 0.881 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -13.848 5.078 1.981 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -14.373 5.709 -1.764 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -16.279 4.209 -2.681 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -14.951 2.844 2.378 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -17.821 2.041 -1.685 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -16.678 1.059 2.321 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -18.083 0.635 0.381 1.00 0.00 H new ATOM 2047 N ILE A 134 -11.511 6.773 2.388 1.00 0.00 N ATOM 2048 CA ILE A 134 -10.840 7.367 3.532 1.00 0.00 C ATOM 2049 C ILE A 134 -10.665 8.867 3.293 1.00 0.00 C ATOM 2050 O ILE A 134 -10.993 9.680 4.157 1.00 0.00 O ATOM 2051 CB ILE A 134 -9.530 6.633 3.824 1.00 0.00 C ATOM 2052 CG1 ILE A 134 -9.794 5.289 4.507 1.00 0.00 C ATOM 2053 CG2 ILE A 134 -8.578 7.513 4.638 1.00 0.00 C ATOM 2054 CD1 ILE A 134 -8.522 4.440 4.558 1.00 0.00 C ATOM 0 H ILE A 134 -11.103 5.897 2.061 1.00 0.00 H new ATOM 0 HA ILE A 134 -11.448 7.257 4.430 1.00 0.00 H new ATOM 0 HB ILE A 134 -9.039 6.420 2.874 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -10.164 5.458 5.518 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -10.574 4.750 3.968 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -7.654 6.967 4.832 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -8.353 8.420 4.078 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -9.048 7.779 5.585 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -8.738 3.491 5.048 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -8.169 4.253 3.544 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -7.752 4.971 5.118 1.00 0.00 H new ATOM 2066 N ILE A 135 -10.148 9.191 2.116 1.00 0.00 N ATOM 2067 CA ILE A 135 -9.924 10.580 1.753 1.00 0.00 C ATOM 2068 C ILE A 135 -11.246 11.345 1.845 1.00 0.00 C ATOM 2069 O ILE A 135 -11.266 12.511 2.233 1.00 0.00 O ATOM 2070 CB ILE A 135 -9.254 10.673 0.382 1.00 0.00 C ATOM 2071 CG1 ILE A 135 -7.731 10.724 0.518 1.00 0.00 C ATOM 2072 CG2 ILE A 135 -9.797 11.861 -0.415 1.00 0.00 C ATOM 2073 CD1 ILE A 135 -7.225 9.611 1.439 1.00 0.00 C ATOM 0 H ILE A 135 -9.878 8.515 1.402 1.00 0.00 H new ATOM 0 HA ILE A 135 -9.233 11.051 2.452 1.00 0.00 H new ATOM 0 HB ILE A 135 -9.498 9.770 -0.178 1.00 0.00 H new ATOM 0 HG12 ILE A 135 -7.271 10.625 -0.465 1.00 0.00 H new ATOM 0 HG13 ILE A 135 -7.430 11.694 0.914 1.00 0.00 H new ATOM 0 HG21 ILE A 135 -9.304 11.904 -1.386 1.00 0.00 H new ATOM 0 HG22 ILE A 135 -10.871 11.742 -0.559 1.00 0.00 H new ATOM 0 HG23 ILE A 135 -9.604 12.784 0.131 1.00 0.00 H new ATOM 0 HD11 ILE A 135 -6.139 9.670 1.518 1.00 0.00 H new ATOM 0 HD12 ILE A 135 -7.668 9.728 2.428 1.00 0.00 H new ATOM 0 HD13 ILE A 135 -7.507 8.642 1.027 1.00 0.00 H new ATOM 2085 N LEU A 136 -12.318 10.657 1.480 1.00 0.00 N ATOM 2086 CA LEU A 136 -13.640 11.257 1.516 1.00 0.00 C ATOM 2087 C LEU A 136 -13.954 11.704 2.945 1.00 0.00 C ATOM 2088 O LEU A 136 -14.405 12.827 3.163 1.00 0.00 O ATOM 2089 CB LEU A 136 -14.680 10.300 0.930 1.00 0.00 C ATOM 2090 CG LEU A 136 -15.555 10.864 -0.192 1.00 0.00 C ATOM 2091 CD1 LEU A 136 -15.828 9.804 -1.260 1.00 0.00 C ATOM 2092 CD2 LEU A 136 -16.848 11.460 0.368 1.00 0.00 C ATOM 0 H LEU A 136 -12.297 9.689 1.158 1.00 0.00 H new ATOM 0 HA LEU A 136 -13.670 12.148 0.888 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -14.161 9.419 0.551 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -15.331 9.964 1.737 1.00 0.00 H new ATOM 0 HG LEU A 136 -15.010 11.675 -0.675 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -16.452 10.231 -2.045 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -14.884 9.468 -1.689 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -16.343 8.956 -0.808 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -17.451 11.854 -0.450 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -17.408 10.686 0.892 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -16.607 12.266 1.061 1.00 0.00 H new ATOM 2104 N GLY A 137 -13.702 10.801 3.882 1.00 0.00 N ATOM 2105 CA GLY A 137 -13.952 11.089 5.284 1.00 0.00 C ATOM 2106 C GLY A 137 -13.020 12.190 5.793 1.00 0.00 C ATOM 2107 O GLY A 137 -13.471 13.157 6.404 1.00 0.00 O ATOM 0 H GLY A 137 -13.328 9.870 3.698 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -14.989 11.396 5.416 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -13.809 10.185 5.876 1.00 0.00 H new ATOM 2111 N LEU A 138 -11.735 12.005 5.523 1.00 0.00 N ATOM 2112 CA LEU A 138 -10.736 12.971 5.945 1.00 0.00 C ATOM 2113 C LEU A 138 -11.150 14.367 5.475 1.00 0.00 C ATOM 2114 O LEU A 138 -11.108 15.324 6.247 1.00 0.00 O ATOM 2115 CB LEU A 138 -9.346 12.547 5.465 1.00 0.00 C ATOM 2116 CG LEU A 138 -8.576 11.602 6.390 1.00 0.00 C ATOM 2117 CD1 LEU A 138 -7.264 11.152 5.745 1.00 0.00 C ATOM 2118 CD2 LEU A 138 -8.350 12.241 7.762 1.00 0.00 C ATOM 0 H LEU A 138 -11.364 11.201 5.017 1.00 0.00 H new ATOM 0 HA LEU A 138 -10.676 13.007 7.033 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -9.450 12.066 4.492 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -8.746 13.444 5.314 1.00 0.00 H new ATOM 0 HG LEU A 138 -9.181 10.709 6.546 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -6.736 10.481 6.423 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -7.477 10.630 4.812 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -6.642 12.023 5.540 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -7.801 11.549 8.400 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -7.776 13.160 7.645 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -9.312 12.470 8.220 1.00 0.00 H new ATOM 2130 N ASN A 139 -11.541 14.439 4.212 1.00 0.00 N ATOM 2131 CA ASN A 139 -11.962 15.702 3.629 1.00 0.00 C ATOM 2132 C ASN A 139 -13.161 16.244 4.410 1.00 0.00 C ATOM 2133 O ASN A 139 -13.202 17.424 4.753 1.00 0.00 O ATOM 2134 CB ASN A 139 -12.390 15.521 2.171 1.00 0.00 C ATOM 2135 CG ASN A 139 -12.807 16.856 1.553 1.00 0.00 C ATOM 2136 OD1 ASN A 139 -11.993 17.630 1.074 1.00 0.00 O ATOM 2137 ND2 ASN A 139 -14.117 17.084 1.588 1.00 0.00 N ATOM 0 H ASN A 139 -11.575 13.643 3.575 1.00 0.00 H new ATOM 0 HA ASN A 139 -11.119 16.392 3.674 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -11.568 15.092 1.598 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -13.219 14.816 2.117 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -14.495 17.948 1.199 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -14.744 16.395 2.003 1.00 0.00 H new ATOM 2144 N LYS A 140 -14.109 15.354 4.668 1.00 0.00 N ATOM 2145 CA LYS A 140 -15.307 15.728 5.402 1.00 0.00 C ATOM 2146 C LYS A 140 -14.909 16.262 6.779 1.00 0.00 C ATOM 2147 O LYS A 140 -15.531 17.191 7.292 1.00 0.00 O ATOM 2148 CB LYS A 140 -16.289 14.557 5.457 1.00 0.00 C ATOM 2149 CG LYS A 140 -17.665 15.018 5.940 1.00 0.00 C ATOM 2150 CD LYS A 140 -18.771 14.501 5.017 1.00 0.00 C ATOM 2151 CE LYS A 140 -20.029 15.365 5.132 1.00 0.00 C ATOM 2152 NZ LYS A 140 -20.578 15.662 3.790 1.00 0.00 N ATOM 0 H LYS A 140 -14.072 14.376 4.382 1.00 0.00 H new ATOM 0 HA LYS A 140 -15.834 16.532 4.888 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -16.379 14.106 4.469 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -15.904 13.786 6.125 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -17.837 14.660 6.955 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -17.696 16.107 5.976 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -18.418 14.501 3.986 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -19.010 13.469 5.272 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -20.778 14.849 5.732 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -19.793 16.295 5.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -21.431 16.249 3.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -19.867 16.174 3.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -20.822 14.772 3.310 1.00 0.00 H new ATOM 2166 N ILE A 141 -13.874 15.653 7.339 1.00 0.00 N ATOM 2167 CA ILE A 141 -13.386 16.055 8.648 1.00 0.00 C ATOM 2168 C ILE A 141 -12.782 17.458 8.552 1.00 0.00 C ATOM 2169 O ILE A 141 -13.097 18.330 9.360 1.00 0.00 O ATOM 2170 CB ILE A 141 -12.422 15.006 9.206 1.00 0.00 C ATOM 2171 CG1 ILE A 141 -13.155 13.702 9.525 1.00 0.00 C ATOM 2172 CG2 ILE A 141 -11.663 15.550 10.418 1.00 0.00 C ATOM 2173 CD1 ILE A 141 -12.239 12.494 9.319 1.00 0.00 C ATOM 0 H ILE A 141 -13.359 14.884 6.910 1.00 0.00 H new ATOM 0 HA ILE A 141 -14.208 16.109 9.362 1.00 0.00 H new ATOM 0 HB ILE A 141 -11.682 14.778 8.439 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -13.510 13.723 10.556 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -14.034 13.609 8.887 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -10.985 14.785 10.796 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -11.090 16.430 10.124 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -12.373 15.823 11.199 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -12.785 11.580 9.553 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -11.906 12.463 8.282 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -11.373 12.578 9.976 1.00 0.00 H new ATOM 2185 N VAL A 142 -11.924 17.631 7.557 1.00 0.00 N ATOM 2186 CA VAL A 142 -11.273 18.913 7.346 1.00 0.00 C ATOM 2187 C VAL A 142 -12.338 19.993 7.142 1.00 0.00 C ATOM 2188 O VAL A 142 -12.163 21.131 7.578 1.00 0.00 O ATOM 2189 CB VAL A 142 -10.290 18.815 6.177 1.00 0.00 C ATOM 2190 CG1 VAL A 142 -10.174 20.152 5.444 1.00 0.00 C ATOM 2191 CG2 VAL A 142 -8.920 18.329 6.653 1.00 0.00 C ATOM 0 H VAL A 142 -11.665 16.905 6.889 1.00 0.00 H new ATOM 0 HA VAL A 142 -10.688 19.193 8.222 1.00 0.00 H new ATOM 0 HB VAL A 142 -10.680 18.081 5.472 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -9.469 20.054 4.618 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -11.151 20.440 5.055 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -9.819 20.916 6.135 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -8.240 18.268 5.803 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -8.521 19.028 7.388 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -9.021 17.344 7.108 1.00 0.00 H new ATOM 2201 N ARG A 143 -13.416 19.600 6.481 1.00 0.00 N ATOM 2202 CA ARG A 143 -14.508 20.520 6.215 1.00 0.00 C ATOM 2203 C ARG A 143 -15.133 20.997 7.528 1.00 0.00 C ATOM 2204 O ARG A 143 -15.330 22.195 7.727 1.00 0.00 O ATOM 2205 CB ARG A 143 -15.588 19.860 5.354 1.00 0.00 C ATOM 2206 CG ARG A 143 -15.207 19.898 3.873 1.00 0.00 C ATOM 2207 CD ARG A 143 -16.420 19.607 2.988 1.00 0.00 C ATOM 2208 NE ARG A 143 -16.619 20.712 2.023 1.00 0.00 N ATOM 2209 CZ ARG A 143 -17.283 21.842 2.302 1.00 0.00 C ATOM 2210 NH1 ARG A 143 -17.817 22.023 3.517 1.00 0.00 N ATOM 2211 NH2 ARG A 143 -17.415 22.791 1.364 1.00 0.00 N ATOM 0 H ARG A 143 -13.557 18.656 6.121 1.00 0.00 H new ATOM 0 HA ARG A 143 -14.098 21.372 5.673 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -15.729 18.827 5.670 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -16.539 20.372 5.502 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -14.797 20.877 3.624 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -14.424 19.165 3.676 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -16.274 18.668 2.454 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -17.310 19.487 3.605 1.00 0.00 H new ATOM 0 HE ARG A 143 -16.226 20.607 1.088 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -17.718 21.301 4.230 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -18.322 22.883 3.729 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -17.010 22.653 0.438 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -17.920 23.651 1.576 1.00 0.00 H new ATOM 2225 N MET A 144 -15.427 20.034 8.390 1.00 0.00 N ATOM 2226 CA MET A 144 -16.025 20.340 9.678 1.00 0.00 C ATOM 2227 C MET A 144 -15.082 21.189 10.533 1.00 0.00 C ATOM 2228 O MET A 144 -15.503 22.178 11.131 1.00 0.00 O ATOM 2229 CB MET A 144 -16.348 19.038 10.414 1.00 0.00 C ATOM 2230 CG MET A 144 -17.125 19.314 11.702 1.00 0.00 C ATOM 2231 SD MET A 144 -16.028 19.233 13.107 1.00 0.00 S ATOM 2232 CE MET A 144 -16.402 17.592 13.698 1.00 0.00 C ATOM 0 H MET A 144 -15.262 19.042 8.221 1.00 0.00 H new ATOM 0 HA MET A 144 -16.940 20.907 9.506 1.00 0.00 H new ATOM 0 HB2 MET A 144 -16.932 18.385 9.766 1.00 0.00 H new ATOM 0 HB3 MET A 144 -15.424 18.510 10.649 1.00 0.00 H new ATOM 0 HG2 MET A 144 -17.592 20.298 11.651 1.00 0.00 H new ATOM 0 HG3 MET A 144 -17.928 18.586 11.815 1.00 0.00 H new ATOM 0 HE1 MET A 144 -16.486 17.607 14.785 1.00 0.00 H new ATOM 0 HE2 MET A 144 -17.344 17.256 13.266 1.00 0.00 H new ATOM 0 HE3 MET A 144 -15.604 16.909 13.405 1.00 0.00 H new ATOM 2242 N TYR A 145 -13.825 20.772 10.563 1.00 0.00 N ATOM 2243 CA TYR A 145 -12.819 21.481 11.334 1.00 0.00 C ATOM 2244 C TYR A 145 -12.779 22.962 10.952 1.00 0.00 C ATOM 2245 O TYR A 145 -12.860 23.833 11.817 1.00 0.00 O ATOM 2246 CB TYR A 145 -11.479 20.838 10.974 1.00 0.00 C ATOM 2247 CG TYR A 145 -10.965 19.844 12.017 1.00 0.00 C ATOM 2248 CD1 TYR A 145 -11.806 18.870 12.516 1.00 0.00 C ATOM 2249 CD2 TYR A 145 -9.660 19.922 12.460 1.00 0.00 C ATOM 2250 CE1 TYR A 145 -11.322 17.934 13.498 1.00 0.00 C ATOM 2251 CE2 TYR A 145 -9.176 18.986 13.443 1.00 0.00 C ATOM 2252 CZ TYR A 145 -10.032 18.039 13.912 1.00 0.00 C ATOM 2253 OH TYR A 145 -9.574 17.156 14.841 1.00 0.00 O ATOM 0 H TYR A 145 -13.480 19.951 10.065 1.00 0.00 H new ATOM 0 HA TYR A 145 -13.039 21.419 12.400 1.00 0.00 H new ATOM 0 HB2 TYR A 145 -11.579 20.325 10.017 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -10.736 21.624 10.839 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -12.827 18.810 12.170 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -9.002 20.684 12.070 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -11.969 17.167 13.896 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -8.158 19.035 13.799 1.00 0.00 H new ATOM 0 HH TYR A 145 -8.634 17.350 15.041 1.00 0.00 H new