USER MOD reduce.3.24.130724 H: found=0, std=0, add=918, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 920 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 124 MET CE :methyl -170:sc= -3.44! (180deg=-3.12!) USER MOD Set 1.2: A 144 MET CE :methyl -136:sc= -0.53 (180deg=0) USER MOD Set 2.1: A 94 LYS NZ :NH3+ -123:sc= -3.11! (180deg=0) USER MOD Set 2.2: A 107 HIS : no HD1:sc= -6.37! C(o=-9.5!,f=-8.5!) USER MOD Set 3.1: A 60 ASN : amide:sc= -0.743 K(o=0.44,f=-4.9!) USER MOD Set 3.2: A 62 THR OG1 : rot -81:sc= 1.18 USER MOD Set 4.1: A 36 MET CE :methyl -177:sc= -0.733 (180deg=-0.694) USER MOD Set 4.2: A 51 MET CE :methyl -117:sc= -1.24 (180deg=-0.538) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot -66:sc= 0.599 USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.0559 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 84:sc= 0.581 USER MOD Single : A 41 GLN : amide:sc= -0.285 K(o=-0.28,f=-1.2) USER MOD Single : A 42 ASN : amide:sc=-0.00578 K(o=-0.0058,f=-0.97) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.987 USER MOD Single : A 49 GLN : amide:sc= -1.35 K(o=-1.3,f=0) USER MOD Single : A 53 ASN : amide:sc= 0.517 K(o=0.52,f=-0.012) USER MOD Single : A 70 THR OG1 : rot 83:sc= 0.0127 USER MOD Single : A 71 MET CE :methyl -165:sc= -3.05! (180deg=-3.33!) USER MOD Single : A 72 MET CE :methyl -156:sc= -0.0999 (180deg=-0.58) USER MOD Single : A 97 ASN : amide:sc= -2.36 K(o=-2.4,f=-7.9!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= -0.499 USER MOD Single : A 109 MET CE :methyl -101:sc= -1.71 (180deg=-5.44!) USER MOD Single : A 110 THR OG1 : rot 76:sc= 0.0255 USER MOD Single : A 111 ASN : amide:sc= -0.0174 K(o=-0.017,f=-1.1) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 ASN : amide:sc= -8.12! C(o=-8.1!,f=-7.2!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 145 MET CE :methyl -174:sc= 0 (180deg=-0.0526) USER MOD Single : A 146 THR OG1 : rot -5:sc= 0.494 USER MOD ----------------------------------------------------------------- ATOM 120 N ILE A 9 -2.369 6.267 9.265 1.00 0.00 N ATOM 121 CA ILE A 9 -1.856 4.997 9.764 1.00 0.00 C ATOM 122 C ILE A 9 -2.334 3.834 8.901 1.00 0.00 C ATOM 123 O ILE A 9 -1.570 2.918 8.599 1.00 0.00 O ATOM 124 CB ILE A 9 -2.288 4.750 11.222 1.00 0.00 C ATOM 125 CG1 ILE A 9 -1.503 5.660 12.170 1.00 0.00 C ATOM 126 CG2 ILE A 9 -2.086 3.289 11.594 1.00 0.00 C ATOM 127 CD1 ILE A 9 -2.083 7.052 12.289 1.00 0.00 C ATOM 0 HA ILE A 9 -0.769 5.056 9.720 1.00 0.00 H new ATOM 0 HB ILE A 9 -3.348 4.985 11.316 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -1.473 5.202 13.159 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -0.473 5.733 11.821 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -2.396 3.130 12.627 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -2.684 2.660 10.935 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -1.033 3.029 11.487 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -1.476 7.641 12.976 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -2.088 7.529 11.309 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -3.103 6.990 12.667 1.00 0.00 H new ATOM 139 N ALA A 10 -3.602 3.879 8.506 1.00 0.00 N ATOM 140 CA ALA A 10 -4.180 2.831 7.674 1.00 0.00 C ATOM 141 C ALA A 10 -3.436 2.710 6.348 1.00 0.00 C ATOM 142 O ALA A 10 -3.094 1.609 5.917 1.00 0.00 O ATOM 143 CB ALA A 10 -5.657 3.106 7.430 1.00 0.00 C ATOM 0 H ALA A 10 -4.248 4.630 8.749 1.00 0.00 H new ATOM 0 HA ALA A 10 -4.081 1.884 8.204 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -6.076 2.316 6.807 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -6.184 3.135 8.384 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -5.770 4.065 6.924 1.00 0.00 H new ATOM 149 N GLU A 11 -3.190 3.848 5.706 1.00 0.00 N ATOM 150 CA GLU A 11 -2.488 3.866 4.428 1.00 0.00 C ATOM 151 C GLU A 11 -1.090 3.272 4.567 1.00 0.00 C ATOM 152 O GLU A 11 -0.719 2.351 3.839 1.00 0.00 O ATOM 153 CB GLU A 11 -2.396 5.297 3.893 1.00 0.00 C ATOM 154 CG GLU A 11 -3.618 5.730 3.100 1.00 0.00 C ATOM 155 CD GLU A 11 -3.828 4.895 1.851 1.00 0.00 C ATOM 156 OE1 GLU A 11 -2.827 4.575 1.177 1.00 0.00 O ATOM 157 OE2 GLU A 11 -4.993 4.563 1.548 1.00 0.00 O ATOM 0 H GLU A 11 -3.466 4.768 6.049 1.00 0.00 H new ATOM 0 HA GLU A 11 -3.053 3.257 3.722 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -2.256 5.981 4.730 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -1.513 5.383 3.260 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -4.502 5.658 3.734 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -3.512 6.778 2.819 1.00 0.00 H new ATOM 164 N PHE A 12 -0.317 3.807 5.506 1.00 0.00 N ATOM 165 CA PHE A 12 1.042 3.332 5.740 1.00 0.00 C ATOM 166 C PHE A 12 1.041 1.864 6.155 1.00 0.00 C ATOM 167 O PHE A 12 1.987 1.127 5.877 1.00 0.00 O ATOM 168 CB PHE A 12 1.722 4.178 6.819 1.00 0.00 C ATOM 169 CG PHE A 12 2.069 5.566 6.362 1.00 0.00 C ATOM 170 CD1 PHE A 12 1.151 6.598 6.478 1.00 0.00 C ATOM 171 CD2 PHE A 12 3.313 5.839 5.816 1.00 0.00 C ATOM 172 CE1 PHE A 12 1.468 7.876 6.059 1.00 0.00 C ATOM 173 CE2 PHE A 12 3.635 7.116 5.395 1.00 0.00 C ATOM 174 CZ PHE A 12 2.711 8.135 5.516 1.00 0.00 C ATOM 0 H PHE A 12 -0.608 4.570 6.117 1.00 0.00 H new ATOM 0 HA PHE A 12 1.599 3.428 4.808 1.00 0.00 H new ATOM 0 HB2 PHE A 12 1.065 4.243 7.686 1.00 0.00 H new ATOM 0 HB3 PHE A 12 2.631 3.674 7.146 1.00 0.00 H new ATOM 0 HD1 PHE A 12 0.177 6.401 6.901 1.00 0.00 H new ATOM 0 HD2 PHE A 12 4.039 5.045 5.718 1.00 0.00 H new ATOM 0 HE1 PHE A 12 0.744 8.672 6.156 1.00 0.00 H new ATOM 0 HE2 PHE A 12 4.608 7.316 4.972 1.00 0.00 H new ATOM 0 HZ PHE A 12 2.960 9.133 5.187 1.00 0.00 H new ATOM 184 N LYS A 13 -0.029 1.445 6.824 1.00 0.00 N ATOM 185 CA LYS A 13 -0.156 0.065 7.278 1.00 0.00 C ATOM 186 C LYS A 13 -0.370 -0.878 6.098 1.00 0.00 C ATOM 187 O LYS A 13 0.468 -1.734 5.817 1.00 0.00 O ATOM 188 CB LYS A 13 -1.319 -0.063 8.265 1.00 0.00 C ATOM 189 CG LYS A 13 -1.334 -1.382 9.018 1.00 0.00 C ATOM 190 CD LYS A 13 -2.110 -1.272 10.319 1.00 0.00 C ATOM 191 CE LYS A 13 -3.580 -1.608 10.122 1.00 0.00 C ATOM 192 NZ LYS A 13 -4.409 -1.177 11.281 1.00 0.00 N ATOM 0 H LYS A 13 -0.821 2.042 7.064 1.00 0.00 H new ATOM 0 HA LYS A 13 0.771 -0.214 7.780 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -1.267 0.755 8.983 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -2.258 0.047 7.723 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -1.780 -2.155 8.392 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -0.311 -1.693 9.229 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -1.678 -1.945 11.059 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -2.017 -0.261 10.715 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -3.944 -1.125 9.216 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -3.690 -2.683 9.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -5.404 -1.424 11.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -4.078 -1.657 12.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -4.325 -0.148 11.405 1.00 0.00 H new ATOM 206 N GLU A 14 -1.497 -0.714 5.412 1.00 0.00 N ATOM 207 CA GLU A 14 -1.819 -1.551 4.262 1.00 0.00 C ATOM 208 C GLU A 14 -0.596 -1.745 3.370 1.00 0.00 C ATOM 209 O GLU A 14 -0.304 -2.857 2.932 1.00 0.00 O ATOM 210 CB GLU A 14 -2.960 -0.930 3.454 1.00 0.00 C ATOM 211 CG GLU A 14 -4.271 -0.846 4.218 1.00 0.00 C ATOM 212 CD GLU A 14 -4.751 -2.200 4.703 1.00 0.00 C ATOM 213 OE1 GLU A 14 -4.419 -3.215 4.055 1.00 0.00 O ATOM 214 OE2 GLU A 14 -5.459 -2.244 5.731 1.00 0.00 O ATOM 0 H GLU A 14 -2.201 -0.010 5.632 1.00 0.00 H new ATOM 0 HA GLU A 14 -2.135 -2.526 4.633 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -2.668 0.072 3.139 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -3.114 -1.517 2.548 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -4.147 -0.181 5.073 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -5.033 -0.403 3.577 1.00 0.00 H new ATOM 221 N ALA A 15 0.115 -0.653 3.106 1.00 0.00 N ATOM 222 CA ALA A 15 1.307 -0.702 2.268 1.00 0.00 C ATOM 223 C ALA A 15 2.376 -1.596 2.886 1.00 0.00 C ATOM 224 O ALA A 15 3.136 -2.254 2.175 1.00 0.00 O ATOM 225 CB ALA A 15 1.853 0.700 2.045 1.00 0.00 C ATOM 0 H ALA A 15 -0.114 0.276 3.460 1.00 0.00 H new ATOM 0 HA ALA A 15 1.027 -1.128 1.305 1.00 0.00 H new ATOM 0 HB1 ALA A 15 2.743 0.648 1.418 1.00 0.00 H new ATOM 0 HB2 ALA A 15 1.097 1.311 1.552 1.00 0.00 H new ATOM 0 HB3 ALA A 15 2.111 1.147 3.005 1.00 0.00 H new ATOM 231 N PHE A 16 2.430 -1.615 4.214 1.00 0.00 N ATOM 232 CA PHE A 16 3.408 -2.428 4.927 1.00 0.00 C ATOM 233 C PHE A 16 2.868 -3.832 5.180 1.00 0.00 C ATOM 234 O PHE A 16 3.613 -4.738 5.555 1.00 0.00 O ATOM 235 CB PHE A 16 3.781 -1.766 6.256 1.00 0.00 C ATOM 236 CG PHE A 16 4.857 -2.495 7.008 1.00 0.00 C ATOM 237 CD1 PHE A 16 6.194 -2.230 6.760 1.00 0.00 C ATOM 238 CD2 PHE A 16 4.531 -3.444 7.963 1.00 0.00 C ATOM 239 CE1 PHE A 16 7.186 -2.901 7.451 1.00 0.00 C ATOM 240 CE2 PHE A 16 5.519 -4.117 8.657 1.00 0.00 C ATOM 241 CZ PHE A 16 6.848 -3.844 8.401 1.00 0.00 C ATOM 0 H PHE A 16 1.808 -1.077 4.818 1.00 0.00 H new ATOM 0 HA PHE A 16 4.300 -2.507 4.305 1.00 0.00 H new ATOM 0 HB2 PHE A 16 4.111 -0.745 6.064 1.00 0.00 H new ATOM 0 HB3 PHE A 16 2.891 -1.701 6.883 1.00 0.00 H new ATOM 0 HD1 PHE A 16 6.464 -1.492 6.019 1.00 0.00 H new ATOM 0 HD2 PHE A 16 3.493 -3.661 8.168 1.00 0.00 H new ATOM 0 HE1 PHE A 16 8.225 -2.687 7.248 1.00 0.00 H new ATOM 0 HE2 PHE A 16 5.252 -4.855 9.398 1.00 0.00 H new ATOM 0 HZ PHE A 16 7.622 -4.367 8.943 1.00 0.00 H new ATOM 251 N SER A 17 1.566 -4.005 4.974 1.00 0.00 N ATOM 252 CA SER A 17 0.924 -5.297 5.184 1.00 0.00 C ATOM 253 C SER A 17 1.061 -6.179 3.946 1.00 0.00 C ATOM 254 O SER A 17 1.319 -7.379 4.050 1.00 0.00 O ATOM 255 CB SER A 17 -0.555 -5.106 5.526 1.00 0.00 C ATOM 256 OG SER A 17 -0.744 -4.995 6.926 1.00 0.00 O ATOM 0 H SER A 17 0.935 -3.267 4.662 1.00 0.00 H new ATOM 0 HA SER A 17 1.422 -5.791 6.018 1.00 0.00 H new ATOM 0 HB2 SER A 17 -0.933 -4.211 5.033 1.00 0.00 H new ATOM 0 HB3 SER A 17 -1.132 -5.948 5.144 1.00 0.00 H new ATOM 0 HG SER A 17 -1.697 -4.872 7.119 1.00 0.00 H new ATOM 262 N LEU A 18 0.886 -5.576 2.776 1.00 0.00 N ATOM 263 CA LEU A 18 0.990 -6.305 1.516 1.00 0.00 C ATOM 264 C LEU A 18 2.371 -6.934 1.364 1.00 0.00 C ATOM 265 O LEU A 18 2.501 -8.065 0.894 1.00 0.00 O ATOM 266 CB LEU A 18 0.710 -5.370 0.338 1.00 0.00 C ATOM 267 CG LEU A 18 1.781 -4.319 0.047 1.00 0.00 C ATOM 268 CD1 LEU A 18 2.876 -4.902 -0.833 1.00 0.00 C ATOM 269 CD2 LEU A 18 1.162 -3.094 -0.611 1.00 0.00 C ATOM 0 H LEU A 18 0.671 -4.584 2.673 1.00 0.00 H new ATOM 0 HA LEU A 18 0.247 -7.102 1.523 1.00 0.00 H new ATOM 0 HB2 LEU A 18 0.572 -5.977 -0.557 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -0.234 -4.857 0.524 1.00 0.00 H new ATOM 0 HG LEU A 18 2.228 -4.012 0.993 1.00 0.00 H new ATOM 0 HD11 LEU A 18 3.629 -4.139 -1.030 1.00 0.00 H new ATOM 0 HD12 LEU A 18 3.340 -5.748 -0.325 1.00 0.00 H new ATOM 0 HD13 LEU A 18 2.445 -5.238 -1.776 1.00 0.00 H new ATOM 0 HD21 LEU A 18 1.939 -2.356 -0.811 1.00 0.00 H new ATOM 0 HD22 LEU A 18 0.688 -3.385 -1.549 1.00 0.00 H new ATOM 0 HD23 LEU A 18 0.415 -2.662 0.055 1.00 0.00 H new ATOM 281 N PHE A 19 3.400 -6.195 1.765 1.00 0.00 N ATOM 282 CA PHE A 19 4.772 -6.681 1.674 1.00 0.00 C ATOM 283 C PHE A 19 5.014 -7.814 2.668 1.00 0.00 C ATOM 284 O PHE A 19 5.640 -8.821 2.337 1.00 0.00 O ATOM 285 CB PHE A 19 5.758 -5.540 1.933 1.00 0.00 C ATOM 286 CG PHE A 19 6.092 -4.746 0.702 1.00 0.00 C ATOM 287 CD1 PHE A 19 6.725 -5.346 -0.375 1.00 0.00 C ATOM 288 CD2 PHE A 19 5.773 -3.400 0.623 1.00 0.00 C ATOM 289 CE1 PHE A 19 7.033 -4.618 -1.509 1.00 0.00 C ATOM 290 CE2 PHE A 19 6.078 -2.667 -0.508 1.00 0.00 C ATOM 291 CZ PHE A 19 6.710 -3.277 -1.575 1.00 0.00 C ATOM 0 H PHE A 19 3.310 -5.257 2.156 1.00 0.00 H new ATOM 0 HA PHE A 19 4.929 -7.065 0.666 1.00 0.00 H new ATOM 0 HB2 PHE A 19 5.338 -4.871 2.684 1.00 0.00 H new ATOM 0 HB3 PHE A 19 6.677 -5.952 2.350 1.00 0.00 H new ATOM 0 HD1 PHE A 19 6.981 -6.394 -0.328 1.00 0.00 H new ATOM 0 HD2 PHE A 19 5.280 -2.918 1.455 1.00 0.00 H new ATOM 0 HE1 PHE A 19 7.526 -5.097 -2.342 1.00 0.00 H new ATOM 0 HE2 PHE A 19 5.823 -1.619 -0.558 1.00 0.00 H new ATOM 0 HZ PHE A 19 6.951 -2.706 -2.459 1.00 0.00 H new ATOM 301 N ASP A 20 4.515 -7.640 3.887 1.00 0.00 N ATOM 302 CA ASP A 20 4.677 -8.646 4.930 1.00 0.00 C ATOM 303 C ASP A 20 3.848 -9.889 4.619 1.00 0.00 C ATOM 304 O ASP A 20 2.658 -9.948 4.928 1.00 0.00 O ATOM 305 CB ASP A 20 4.270 -8.073 6.288 1.00 0.00 C ATOM 306 CG ASP A 20 4.790 -8.903 7.446 1.00 0.00 C ATOM 307 OD1 ASP A 20 5.971 -9.305 7.403 1.00 0.00 O ATOM 308 OD2 ASP A 20 4.015 -9.150 8.394 1.00 0.00 O ATOM 0 H ASP A 20 3.995 -6.812 4.177 1.00 0.00 H new ATOM 0 HA ASP A 20 5.728 -8.932 4.965 1.00 0.00 H new ATOM 0 HB2 ASP A 20 4.647 -7.054 6.377 1.00 0.00 H new ATOM 0 HB3 ASP A 20 3.183 -8.017 6.344 1.00 0.00 H new ATOM 313 N LYS A 21 4.485 -10.880 4.004 1.00 0.00 N ATOM 314 CA LYS A 21 3.809 -12.122 3.651 1.00 0.00 C ATOM 315 C LYS A 21 3.799 -13.091 4.829 1.00 0.00 C ATOM 316 O LYS A 21 2.774 -13.698 5.138 1.00 0.00 O ATOM 317 CB LYS A 21 4.491 -12.774 2.447 1.00 0.00 C ATOM 318 CG LYS A 21 4.547 -11.878 1.221 1.00 0.00 C ATOM 319 CD LYS A 21 3.172 -11.696 0.600 1.00 0.00 C ATOM 320 CE LYS A 21 3.264 -11.479 -0.903 1.00 0.00 C ATOM 321 NZ LYS A 21 1.920 -11.314 -1.522 1.00 0.00 N ATOM 0 H LYS A 21 5.470 -10.847 3.740 1.00 0.00 H new ATOM 0 HA LYS A 21 2.778 -11.883 3.391 1.00 0.00 H new ATOM 0 HB2 LYS A 21 5.506 -13.059 2.725 1.00 0.00 H new ATOM 0 HB3 LYS A 21 3.961 -13.692 2.192 1.00 0.00 H new ATOM 0 HG2 LYS A 21 4.954 -10.905 1.498 1.00 0.00 H new ATOM 0 HG3 LYS A 21 5.226 -12.309 0.485 1.00 0.00 H new ATOM 0 HD2 LYS A 21 2.560 -12.574 0.805 1.00 0.00 H new ATOM 0 HD3 LYS A 21 2.673 -10.844 1.062 1.00 0.00 H new ATOM 0 HE2 LYS A 21 3.869 -10.595 -1.106 1.00 0.00 H new ATOM 0 HE3 LYS A 21 3.774 -12.326 -1.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 2.025 -11.168 -2.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 1.351 -12.168 -1.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 1.443 -10.490 -1.102 1.00 0.00 H new ATOM 335 N ASP A 22 4.947 -13.229 5.484 1.00 0.00 N ATOM 336 CA ASP A 22 5.070 -14.122 6.631 1.00 0.00 C ATOM 337 C ASP A 22 4.118 -13.707 7.748 1.00 0.00 C ATOM 338 O ASP A 22 3.434 -14.542 8.337 1.00 0.00 O ATOM 339 CB ASP A 22 6.510 -14.129 7.147 1.00 0.00 C ATOM 340 CG ASP A 22 7.166 -12.766 7.049 1.00 0.00 C ATOM 341 OD1 ASP A 22 6.489 -11.758 7.342 1.00 0.00 O ATOM 342 OD2 ASP A 22 8.358 -12.707 6.679 1.00 0.00 O ATOM 0 H ASP A 22 5.805 -12.734 5.241 1.00 0.00 H new ATOM 0 HA ASP A 22 4.804 -15.128 6.307 1.00 0.00 H new ATOM 0 HB2 ASP A 22 6.519 -14.460 8.186 1.00 0.00 H new ATOM 0 HB3 ASP A 22 7.094 -14.852 6.577 1.00 0.00 H new ATOM 347 N GLY A 23 4.081 -12.409 8.035 1.00 0.00 N ATOM 348 CA GLY A 23 3.211 -11.905 9.082 1.00 0.00 C ATOM 349 C GLY A 23 3.942 -11.697 10.393 1.00 0.00 C ATOM 350 O GLY A 23 3.411 -11.997 11.463 1.00 0.00 O ATOM 0 H GLY A 23 4.638 -11.698 7.561 1.00 0.00 H new ATOM 0 HA2 GLY A 23 2.771 -10.961 8.761 1.00 0.00 H new ATOM 0 HA3 GLY A 23 2.389 -12.604 9.235 1.00 0.00 H new ATOM 354 N ASP A 24 5.165 -11.184 10.312 1.00 0.00 N ATOM 355 CA ASP A 24 5.971 -10.936 11.502 1.00 0.00 C ATOM 356 C ASP A 24 6.040 -9.444 11.811 1.00 0.00 C ATOM 357 O ASP A 24 5.817 -9.024 12.945 1.00 0.00 O ATOM 358 CB ASP A 24 7.382 -11.497 11.314 1.00 0.00 C ATOM 359 CG ASP A 24 8.075 -10.923 10.094 1.00 0.00 C ATOM 360 OD1 ASP A 24 7.370 -10.450 9.179 1.00 0.00 O ATOM 361 OD2 ASP A 24 9.323 -10.947 10.055 1.00 0.00 O ATOM 0 H ASP A 24 5.620 -10.932 9.435 1.00 0.00 H new ATOM 0 HA ASP A 24 5.497 -11.441 12.344 1.00 0.00 H new ATOM 0 HB2 ASP A 24 7.977 -11.281 12.201 1.00 0.00 H new ATOM 0 HB3 ASP A 24 7.329 -12.582 11.222 1.00 0.00 H new ATOM 366 N GLY A 25 6.353 -8.648 10.793 1.00 0.00 N ATOM 367 CA GLY A 25 6.447 -7.211 10.976 1.00 0.00 C ATOM 368 C GLY A 25 7.716 -6.633 10.382 1.00 0.00 C ATOM 369 O GLY A 25 8.232 -5.623 10.861 1.00 0.00 O ATOM 0 H GLY A 25 6.543 -8.972 9.845 1.00 0.00 H new ATOM 0 HA2 GLY A 25 5.583 -6.732 10.516 1.00 0.00 H new ATOM 0 HA3 GLY A 25 6.410 -6.980 12.041 1.00 0.00 H new ATOM 373 N THR A 26 8.224 -7.276 9.334 1.00 0.00 N ATOM 374 CA THR A 26 9.441 -6.821 8.676 1.00 0.00 C ATOM 375 C THR A 26 9.426 -7.169 7.191 1.00 0.00 C ATOM 376 O THR A 26 8.889 -8.202 6.792 1.00 0.00 O ATOM 377 CB THR A 26 10.695 -7.440 9.323 1.00 0.00 C ATOM 378 OG1 THR A 26 10.589 -8.868 9.328 1.00 0.00 O ATOM 379 CG2 THR A 26 10.874 -6.935 10.747 1.00 0.00 C ATOM 0 H THR A 26 7.810 -8.113 8.924 1.00 0.00 H new ATOM 0 HA THR A 26 9.477 -5.738 8.793 1.00 0.00 H new ATOM 0 HB THR A 26 11.564 -7.142 8.737 1.00 0.00 H new ATOM 0 HG1 THR A 26 9.860 -9.140 9.924 1.00 0.00 H new ATOM 0 HG21 THR A 26 11.765 -7.386 11.183 1.00 0.00 H new ATOM 0 HG22 THR A 26 10.983 -5.851 10.737 1.00 0.00 H new ATOM 0 HG23 THR A 26 10.002 -7.207 11.342 1.00 0.00 H new ATOM 387 N ILE A 27 10.019 -6.300 6.379 1.00 0.00 N ATOM 388 CA ILE A 27 10.074 -6.517 4.939 1.00 0.00 C ATOM 389 C ILE A 27 11.496 -6.829 4.484 1.00 0.00 C ATOM 390 O ILE A 27 12.246 -5.934 4.095 1.00 0.00 O ATOM 391 CB ILE A 27 9.557 -5.290 4.165 1.00 0.00 C ATOM 392 CG1 ILE A 27 8.108 -4.988 4.551 1.00 0.00 C ATOM 393 CG2 ILE A 27 9.674 -5.522 2.665 1.00 0.00 C ATOM 394 CD1 ILE A 27 7.606 -3.661 4.028 1.00 0.00 C ATOM 0 H ILE A 27 10.468 -5.440 6.694 1.00 0.00 H new ATOM 0 HA ILE A 27 9.431 -7.370 4.723 1.00 0.00 H new ATOM 0 HB ILE A 27 10.170 -4.428 4.429 1.00 0.00 H new ATOM 0 HG12 ILE A 27 7.467 -5.784 4.173 1.00 0.00 H new ATOM 0 HG13 ILE A 27 8.021 -4.997 5.637 1.00 0.00 H new ATOM 0 HG21 ILE A 27 9.305 -4.646 2.131 1.00 0.00 H new ATOM 0 HG22 ILE A 27 10.718 -5.693 2.404 1.00 0.00 H new ATOM 0 HG23 ILE A 27 9.083 -6.394 2.384 1.00 0.00 H new ATOM 0 HD11 ILE A 27 6.572 -3.514 4.340 1.00 0.00 H new ATOM 0 HD12 ILE A 27 8.223 -2.856 4.427 1.00 0.00 H new ATOM 0 HD13 ILE A 27 7.660 -3.655 2.939 1.00 0.00 H new ATOM 406 N THR A 28 11.860 -8.107 4.535 1.00 0.00 N ATOM 407 CA THR A 28 13.191 -8.539 4.128 1.00 0.00 C ATOM 408 C THR A 28 13.237 -8.847 2.636 1.00 0.00 C ATOM 409 O THR A 28 12.201 -9.040 1.999 1.00 0.00 O ATOM 410 CB THR A 28 13.642 -9.785 4.912 1.00 0.00 C ATOM 411 OG1 THR A 28 15.026 -10.049 4.659 1.00 0.00 O ATOM 412 CG2 THR A 28 12.810 -10.998 4.525 1.00 0.00 C ATOM 0 H THR A 28 11.251 -8.861 4.854 1.00 0.00 H new ATOM 0 HA THR A 28 13.871 -7.716 4.347 1.00 0.00 H new ATOM 0 HB THR A 28 13.499 -9.590 5.975 1.00 0.00 H new ATOM 0 HG1 THR A 28 15.305 -10.842 5.163 1.00 0.00 H new ATOM 0 HG21 THR A 28 13.147 -11.866 5.092 1.00 0.00 H new ATOM 0 HG22 THR A 28 11.760 -10.805 4.747 1.00 0.00 H new ATOM 0 HG23 THR A 28 12.926 -11.193 3.459 1.00 0.00 H new ATOM 420 N THR A 29 14.445 -8.893 2.082 1.00 0.00 N ATOM 421 CA THR A 29 14.625 -9.177 0.664 1.00 0.00 C ATOM 422 C THR A 29 13.673 -10.272 0.198 1.00 0.00 C ATOM 423 O THR A 29 13.157 -10.226 -0.919 1.00 0.00 O ATOM 424 CB THR A 29 16.073 -9.607 0.358 1.00 0.00 C ATOM 425 OG1 THR A 29 16.357 -10.858 0.992 1.00 0.00 O ATOM 426 CG2 THR A 29 17.062 -8.554 0.834 1.00 0.00 C ATOM 0 H THR A 29 15.313 -8.737 2.594 1.00 0.00 H new ATOM 0 HA THR A 29 14.405 -8.255 0.126 1.00 0.00 H new ATOM 0 HB THR A 29 16.176 -9.717 -0.722 1.00 0.00 H new ATOM 0 HG1 THR A 29 17.278 -11.125 0.791 1.00 0.00 H new ATOM 0 HG21 THR A 29 18.077 -8.879 0.607 1.00 0.00 H new ATOM 0 HG22 THR A 29 16.861 -7.611 0.326 1.00 0.00 H new ATOM 0 HG23 THR A 29 16.957 -8.416 1.910 1.00 0.00 H new ATOM 434 N LYS A 30 13.442 -11.256 1.060 1.00 0.00 N ATOM 435 CA LYS A 30 12.550 -12.363 0.737 1.00 0.00 C ATOM 436 C LYS A 30 11.137 -11.860 0.460 1.00 0.00 C ATOM 437 O LYS A 30 10.472 -12.329 -0.462 1.00 0.00 O ATOM 438 CB LYS A 30 12.525 -13.376 1.884 1.00 0.00 C ATOM 439 CG LYS A 30 11.728 -14.631 1.571 1.00 0.00 C ATOM 440 CD LYS A 30 10.256 -14.454 1.904 1.00 0.00 C ATOM 441 CE LYS A 30 9.460 -15.713 1.597 1.00 0.00 C ATOM 442 NZ LYS A 30 8.016 -15.550 1.924 1.00 0.00 N ATOM 0 H LYS A 30 13.861 -11.309 1.989 1.00 0.00 H new ATOM 0 HA LYS A 30 12.927 -12.850 -0.162 1.00 0.00 H new ATOM 0 HB2 LYS A 30 13.549 -13.658 2.131 1.00 0.00 H new ATOM 0 HB3 LYS A 30 12.104 -12.900 2.769 1.00 0.00 H new ATOM 0 HG2 LYS A 30 11.836 -14.878 0.515 1.00 0.00 H new ATOM 0 HG3 LYS A 30 12.132 -15.470 2.137 1.00 0.00 H new ATOM 0 HD2 LYS A 30 10.148 -14.202 2.959 1.00 0.00 H new ATOM 0 HD3 LYS A 30 9.851 -13.618 1.334 1.00 0.00 H new ATOM 0 HE2 LYS A 30 9.567 -15.962 0.541 1.00 0.00 H new ATOM 0 HE3 LYS A 30 9.869 -16.549 2.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 7.508 -16.430 1.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 7.911 -15.337 2.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 7.619 -14.769 1.363 1.00 0.00 H new ATOM 456 N GLU A 31 10.687 -10.901 1.263 1.00 0.00 N ATOM 457 CA GLU A 31 9.353 -10.334 1.102 1.00 0.00 C ATOM 458 C GLU A 31 9.359 -9.215 0.065 1.00 0.00 C ATOM 459 O GLU A 31 8.542 -9.202 -0.856 1.00 0.00 O ATOM 460 CB GLU A 31 8.836 -9.801 2.440 1.00 0.00 C ATOM 461 CG GLU A 31 8.520 -10.893 3.449 1.00 0.00 C ATOM 462 CD GLU A 31 8.682 -10.428 4.883 1.00 0.00 C ATOM 463 OE1 GLU A 31 7.712 -9.868 5.437 1.00 0.00 O ATOM 464 OE2 GLU A 31 9.777 -10.622 5.450 1.00 0.00 O ATOM 0 H GLU A 31 11.226 -10.501 2.031 1.00 0.00 H new ATOM 0 HA GLU A 31 8.690 -11.126 0.754 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.581 -9.129 2.866 1.00 0.00 H new ATOM 0 HB3 GLU A 31 7.937 -9.210 2.263 1.00 0.00 H new ATOM 0 HG2 GLU A 31 7.497 -11.238 3.296 1.00 0.00 H new ATOM 0 HG3 GLU A 31 9.174 -11.746 3.272 1.00 0.00 H new ATOM 471 N LEU A 32 10.286 -8.276 0.222 1.00 0.00 N ATOM 472 CA LEU A 32 10.399 -7.151 -0.699 1.00 0.00 C ATOM 473 C LEU A 32 10.659 -7.636 -2.122 1.00 0.00 C ATOM 474 O LEU A 32 10.116 -7.094 -3.083 1.00 0.00 O ATOM 475 CB LEU A 32 11.523 -6.213 -0.255 1.00 0.00 C ATOM 476 CG LEU A 32 11.793 -5.012 -1.162 1.00 0.00 C ATOM 477 CD1 LEU A 32 10.701 -3.966 -1.002 1.00 0.00 C ATOM 478 CD2 LEU A 32 13.158 -4.411 -0.858 1.00 0.00 C ATOM 0 H LEU A 32 10.970 -8.272 0.979 1.00 0.00 H new ATOM 0 HA LEU A 32 9.454 -6.607 -0.687 1.00 0.00 H new ATOM 0 HB2 LEU A 32 11.288 -5.843 0.743 1.00 0.00 H new ATOM 0 HB3 LEU A 32 12.442 -6.794 -0.171 1.00 0.00 H new ATOM 0 HG LEU A 32 11.791 -5.355 -2.197 1.00 0.00 H new ATOM 0 HD11 LEU A 32 10.910 -3.119 -1.655 1.00 0.00 H new ATOM 0 HD12 LEU A 32 9.738 -4.401 -1.269 1.00 0.00 H new ATOM 0 HD13 LEU A 32 10.671 -3.627 0.033 1.00 0.00 H new ATOM 0 HD21 LEU A 32 13.334 -3.557 -1.513 1.00 0.00 H new ATOM 0 HD22 LEU A 32 13.188 -4.084 0.181 1.00 0.00 H new ATOM 0 HD23 LEU A 32 13.931 -5.161 -1.025 1.00 0.00 H new ATOM 490 N GLY A 33 11.494 -8.664 -2.247 1.00 0.00 N ATOM 491 CA GLY A 33 11.810 -9.207 -3.556 1.00 0.00 C ATOM 492 C GLY A 33 10.666 -10.011 -4.142 1.00 0.00 C ATOM 493 O GLY A 33 10.611 -10.238 -5.351 1.00 0.00 O ATOM 0 H GLY A 33 11.957 -9.130 -1.466 1.00 0.00 H new ATOM 0 HA2 GLY A 33 12.061 -8.391 -4.234 1.00 0.00 H new ATOM 0 HA3 GLY A 33 12.694 -9.841 -3.479 1.00 0.00 H new ATOM 497 N THR A 34 9.748 -10.444 -3.283 1.00 0.00 N ATOM 498 CA THR A 34 8.602 -11.230 -3.721 1.00 0.00 C ATOM 499 C THR A 34 7.530 -10.340 -4.341 1.00 0.00 C ATOM 500 O THR A 34 6.756 -10.783 -5.190 1.00 0.00 O ATOM 501 CB THR A 34 7.983 -12.021 -2.553 1.00 0.00 C ATOM 502 OG1 THR A 34 7.514 -13.292 -3.017 1.00 0.00 O ATOM 503 CG2 THR A 34 6.833 -11.249 -1.926 1.00 0.00 C ATOM 0 H THR A 34 9.776 -10.263 -2.280 1.00 0.00 H new ATOM 0 HA THR A 34 8.968 -11.931 -4.471 1.00 0.00 H new ATOM 0 HB THR A 34 8.753 -12.172 -1.797 1.00 0.00 H new ATOM 0 HG1 THR A 34 7.123 -13.790 -2.269 1.00 0.00 H new ATOM 0 HG21 THR A 34 6.412 -11.827 -1.104 1.00 0.00 H new ATOM 0 HG22 THR A 34 7.199 -10.294 -1.548 1.00 0.00 H new ATOM 0 HG23 THR A 34 6.063 -11.071 -2.676 1.00 0.00 H new ATOM 511 N VAL A 35 7.491 -9.083 -3.913 1.00 0.00 N ATOM 512 CA VAL A 35 6.516 -8.129 -4.427 1.00 0.00 C ATOM 513 C VAL A 35 7.125 -7.253 -5.516 1.00 0.00 C ATOM 514 O VAL A 35 6.474 -6.943 -6.514 1.00 0.00 O ATOM 515 CB VAL A 35 5.966 -7.228 -3.306 1.00 0.00 C ATOM 516 CG1 VAL A 35 5.370 -5.955 -3.888 1.00 0.00 C ATOM 517 CG2 VAL A 35 4.934 -7.978 -2.477 1.00 0.00 C ATOM 0 H VAL A 35 8.124 -8.701 -3.211 1.00 0.00 H new ATOM 0 HA VAL A 35 5.697 -8.711 -4.849 1.00 0.00 H new ATOM 0 HB VAL A 35 6.791 -6.949 -2.651 1.00 0.00 H new ATOM 0 HG11 VAL A 35 4.986 -5.331 -3.081 1.00 0.00 H new ATOM 0 HG12 VAL A 35 6.140 -5.410 -4.434 1.00 0.00 H new ATOM 0 HG13 VAL A 35 4.556 -6.211 -4.566 1.00 0.00 H new ATOM 0 HG21 VAL A 35 4.556 -7.326 -1.690 1.00 0.00 H new ATOM 0 HG22 VAL A 35 4.109 -8.289 -3.118 1.00 0.00 H new ATOM 0 HG23 VAL A 35 5.397 -8.857 -2.029 1.00 0.00 H new ATOM 527 N MET A 36 8.378 -6.857 -5.317 1.00 0.00 N ATOM 528 CA MET A 36 9.076 -6.017 -6.284 1.00 0.00 C ATOM 529 C MET A 36 9.083 -6.667 -7.664 1.00 0.00 C ATOM 530 O MET A 36 8.998 -5.982 -8.683 1.00 0.00 O ATOM 531 CB MET A 36 10.511 -5.757 -5.823 1.00 0.00 C ATOM 532 CG MET A 36 10.627 -4.641 -4.798 1.00 0.00 C ATOM 533 SD MET A 36 10.372 -3.008 -5.518 1.00 0.00 S ATOM 534 CE MET A 36 11.885 -2.811 -6.456 1.00 0.00 C ATOM 0 H MET A 36 8.930 -7.104 -4.496 1.00 0.00 H new ATOM 0 HA MET A 36 8.546 -5.067 -6.352 1.00 0.00 H new ATOM 0 HB2 MET A 36 10.919 -6.674 -5.398 1.00 0.00 H new ATOM 0 HB3 MET A 36 11.123 -5.508 -6.690 1.00 0.00 H new ATOM 0 HG2 MET A 36 9.896 -4.803 -4.006 1.00 0.00 H new ATOM 0 HG3 MET A 36 11.613 -4.680 -4.334 1.00 0.00 H new ATOM 0 HE1 MET A 36 11.901 -1.824 -6.917 1.00 0.00 H new ATOM 0 HE2 MET A 36 12.742 -2.914 -5.790 1.00 0.00 H new ATOM 0 HE3 MET A 36 11.934 -3.575 -7.232 1.00 0.00 H new ATOM 544 N ARG A 37 9.183 -7.992 -7.689 1.00 0.00 N ATOM 545 CA ARG A 37 9.203 -8.734 -8.944 1.00 0.00 C ATOM 546 C ARG A 37 7.790 -8.906 -9.495 1.00 0.00 C ATOM 547 O ARG A 37 7.603 -9.130 -10.691 1.00 0.00 O ATOM 548 CB ARG A 37 9.853 -10.103 -8.742 1.00 0.00 C ATOM 549 CG ARG A 37 9.165 -10.955 -7.688 1.00 0.00 C ATOM 550 CD ARG A 37 7.905 -11.608 -8.235 1.00 0.00 C ATOM 551 NE ARG A 37 7.646 -12.904 -7.615 1.00 0.00 N ATOM 552 CZ ARG A 37 7.805 -14.064 -8.242 1.00 0.00 C ATOM 553 NH1 ARG A 37 8.222 -14.089 -9.500 1.00 0.00 N ATOM 554 NH2 ARG A 37 7.549 -15.202 -7.609 1.00 0.00 N ATOM 0 H ARG A 37 9.251 -8.574 -6.854 1.00 0.00 H new ATOM 0 HA ARG A 37 9.790 -8.164 -9.665 1.00 0.00 H new ATOM 0 HB2 ARG A 37 9.850 -10.641 -9.690 1.00 0.00 H new ATOM 0 HB3 ARG A 37 10.896 -9.962 -8.459 1.00 0.00 H new ATOM 0 HG2 ARG A 37 9.852 -11.725 -7.336 1.00 0.00 H new ATOM 0 HG3 ARG A 37 8.911 -10.336 -6.827 1.00 0.00 H new ATOM 0 HD2 ARG A 37 7.053 -10.949 -8.067 1.00 0.00 H new ATOM 0 HD3 ARG A 37 8.002 -11.735 -9.313 1.00 0.00 H new ATOM 0 HE ARG A 37 7.325 -12.920 -6.647 1.00 0.00 H new ATOM 0 HH11 ARG A 37 8.422 -13.216 -9.989 1.00 0.00 H new ATOM 0 HH12 ARG A 37 8.343 -14.981 -9.979 1.00 0.00 H new ATOM 0 HH21 ARG A 37 7.230 -15.186 -6.640 1.00 0.00 H new ATOM 0 HH22 ARG A 37 7.671 -16.092 -8.091 1.00 0.00 H new ATOM 568 N SER A 38 6.800 -8.799 -8.615 1.00 0.00 N ATOM 569 CA SER A 38 5.405 -8.947 -9.013 1.00 0.00 C ATOM 570 C SER A 38 4.975 -7.802 -9.925 1.00 0.00 C ATOM 571 O SER A 38 4.105 -7.968 -10.781 1.00 0.00 O ATOM 572 CB SER A 38 4.503 -8.996 -7.778 1.00 0.00 C ATOM 573 OG SER A 38 4.620 -10.241 -7.110 1.00 0.00 O ATOM 0 H SER A 38 6.938 -8.610 -7.622 1.00 0.00 H new ATOM 0 HA SER A 38 5.308 -9.883 -9.563 1.00 0.00 H new ATOM 0 HB2 SER A 38 4.769 -8.188 -7.097 1.00 0.00 H new ATOM 0 HB3 SER A 38 3.466 -8.835 -8.074 1.00 0.00 H new ATOM 0 HG SER A 38 5.398 -10.221 -6.514 1.00 0.00 H new ATOM 579 N LEU A 39 5.592 -6.641 -9.736 1.00 0.00 N ATOM 580 CA LEU A 39 5.275 -5.467 -10.542 1.00 0.00 C ATOM 581 C LEU A 39 6.054 -5.479 -11.853 1.00 0.00 C ATOM 582 O LEU A 39 5.533 -5.098 -12.900 1.00 0.00 O ATOM 583 CB LEU A 39 5.588 -4.189 -9.761 1.00 0.00 C ATOM 584 CG LEU A 39 4.639 -3.858 -8.608 1.00 0.00 C ATOM 585 CD1 LEU A 39 5.190 -2.710 -7.776 1.00 0.00 C ATOM 586 CD2 LEU A 39 3.254 -3.517 -9.138 1.00 0.00 C ATOM 0 H LEU A 39 6.314 -6.487 -9.032 1.00 0.00 H new ATOM 0 HA LEU A 39 4.210 -5.493 -10.774 1.00 0.00 H new ATOM 0 HB2 LEU A 39 6.599 -4.270 -9.361 1.00 0.00 H new ATOM 0 HB3 LEU A 39 5.587 -3.351 -10.458 1.00 0.00 H new ATOM 0 HG LEU A 39 4.555 -4.737 -7.968 1.00 0.00 H new ATOM 0 HD11 LEU A 39 4.502 -2.489 -6.960 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.160 -2.991 -7.366 1.00 0.00 H new ATOM 0 HD13 LEU A 39 5.304 -1.827 -8.405 1.00 0.00 H new ATOM 0 HD21 LEU A 39 2.592 -3.284 -8.304 1.00 0.00 H new ATOM 0 HD22 LEU A 39 3.320 -2.654 -9.800 1.00 0.00 H new ATOM 0 HD23 LEU A 39 2.856 -4.368 -9.690 1.00 0.00 H new ATOM 598 N GLY A 40 7.307 -5.921 -11.787 1.00 0.00 N ATOM 599 CA GLY A 40 8.137 -5.976 -12.975 1.00 0.00 C ATOM 600 C GLY A 40 9.540 -5.459 -12.727 1.00 0.00 C ATOM 601 O GLY A 40 10.134 -4.817 -13.593 1.00 0.00 O ATOM 0 H GLY A 40 7.761 -6.242 -10.932 1.00 0.00 H new ATOM 0 HA2 GLY A 40 8.190 -7.005 -13.330 1.00 0.00 H new ATOM 0 HA3 GLY A 40 7.672 -5.389 -13.767 1.00 0.00 H new ATOM 605 N GLN A 41 10.071 -5.738 -11.541 1.00 0.00 N ATOM 606 CA GLN A 41 11.412 -5.293 -11.181 1.00 0.00 C ATOM 607 C GLN A 41 12.383 -6.469 -11.144 1.00 0.00 C ATOM 608 O GLN A 41 13.298 -6.556 -11.962 1.00 0.00 O ATOM 609 CB GLN A 41 11.392 -4.591 -9.822 1.00 0.00 C ATOM 610 CG GLN A 41 10.466 -3.386 -9.774 1.00 0.00 C ATOM 611 CD GLN A 41 10.745 -2.390 -10.883 1.00 0.00 C ATOM 612 OE1 GLN A 41 11.876 -2.270 -11.354 1.00 0.00 O ATOM 613 NE2 GLN A 41 9.713 -1.670 -11.305 1.00 0.00 N ATOM 0 H GLN A 41 9.593 -6.270 -10.813 1.00 0.00 H new ATOM 0 HA GLN A 41 11.750 -4.589 -11.941 1.00 0.00 H new ATOM 0 HB2 GLN A 41 11.085 -5.305 -9.058 1.00 0.00 H new ATOM 0 HB3 GLN A 41 12.404 -4.272 -9.572 1.00 0.00 H new ATOM 0 HG2 GLN A 41 9.432 -3.724 -9.846 1.00 0.00 H new ATOM 0 HG3 GLN A 41 10.572 -2.889 -8.810 1.00 0.00 H new ATOM 0 HE21 GLN A 41 8.793 -1.803 -10.886 1.00 0.00 H new ATOM 0 HE22 GLN A 41 9.840 -0.984 -12.049 1.00 0.00 H new ATOM 622 N ASN A 42 12.178 -7.370 -10.189 1.00 0.00 N ATOM 623 CA ASN A 42 13.036 -8.540 -10.046 1.00 0.00 C ATOM 624 C ASN A 42 14.465 -8.128 -9.705 1.00 0.00 C ATOM 625 O ASN A 42 15.424 -8.509 -10.377 1.00 0.00 O ATOM 626 CB ASN A 42 13.025 -9.368 -11.333 1.00 0.00 C ATOM 627 CG ASN A 42 13.248 -10.845 -11.072 1.00 0.00 C ATOM 628 OD1 ASN A 42 13.780 -11.230 -10.031 1.00 0.00 O ATOM 629 ND2 ASN A 42 12.841 -11.681 -12.020 1.00 0.00 N ATOM 0 H ASN A 42 11.425 -7.312 -9.503 1.00 0.00 H new ATOM 0 HA ASN A 42 12.647 -9.147 -9.229 1.00 0.00 H new ATOM 0 HB2 ASN A 42 12.070 -9.232 -11.841 1.00 0.00 H new ATOM 0 HB3 ASN A 42 13.800 -9.000 -12.005 1.00 0.00 H new ATOM 0 HD21 ASN A 42 12.965 -12.686 -11.901 1.00 0.00 H new ATOM 0 HD22 ASN A 42 12.405 -11.318 -12.867 1.00 0.00 H new ATOM 636 N PRO A 43 14.612 -7.332 -8.636 1.00 0.00 N ATOM 637 CA PRO A 43 15.920 -6.851 -8.181 1.00 0.00 C ATOM 638 C PRO A 43 16.774 -7.967 -7.589 1.00 0.00 C ATOM 639 O PRO A 43 16.258 -9.010 -7.184 1.00 0.00 O ATOM 640 CB PRO A 43 15.565 -5.822 -7.105 1.00 0.00 C ATOM 641 CG PRO A 43 14.225 -6.240 -6.608 1.00 0.00 C ATOM 642 CD PRO A 43 13.513 -6.839 -7.789 1.00 0.00 C ATOM 0 HA PRO A 43 16.512 -6.444 -9.001 1.00 0.00 H new ATOM 0 HB2 PRO A 43 16.302 -5.819 -6.302 1.00 0.00 H new ATOM 0 HB3 PRO A 43 15.538 -4.813 -7.516 1.00 0.00 H new ATOM 0 HG2 PRO A 43 14.318 -6.965 -5.799 1.00 0.00 H new ATOM 0 HG3 PRO A 43 13.673 -5.388 -6.211 1.00 0.00 H new ATOM 0 HD2 PRO A 43 12.844 -7.646 -7.488 1.00 0.00 H new ATOM 0 HD3 PRO A 43 12.905 -6.099 -8.310 1.00 0.00 H new ATOM 650 N THR A 44 18.084 -7.743 -7.541 1.00 0.00 N ATOM 651 CA THR A 44 19.009 -8.730 -6.999 1.00 0.00 C ATOM 652 C THR A 44 19.293 -8.466 -5.525 1.00 0.00 C ATOM 653 O THR A 44 18.998 -7.388 -5.011 1.00 0.00 O ATOM 654 CB THR A 44 20.340 -8.737 -7.774 1.00 0.00 C ATOM 655 OG1 THR A 44 21.073 -7.537 -7.499 1.00 0.00 O ATOM 656 CG2 THR A 44 20.095 -8.855 -9.271 1.00 0.00 C ATOM 0 H THR A 44 18.528 -6.886 -7.871 1.00 0.00 H new ATOM 0 HA THR A 44 18.531 -9.704 -7.105 1.00 0.00 H new ATOM 0 HB THR A 44 20.920 -9.600 -7.448 1.00 0.00 H new ATOM 0 HG1 THR A 44 21.919 -7.550 -7.994 1.00 0.00 H new ATOM 0 HG21 THR A 44 21.050 -8.858 -9.797 1.00 0.00 H new ATOM 0 HG22 THR A 44 19.563 -9.783 -9.481 1.00 0.00 H new ATOM 0 HG23 THR A 44 19.497 -8.009 -9.610 1.00 0.00 H new ATOM 664 N GLU A 45 19.868 -9.457 -4.851 1.00 0.00 N ATOM 665 CA GLU A 45 20.192 -9.330 -3.435 1.00 0.00 C ATOM 666 C GLU A 45 20.819 -7.970 -3.140 1.00 0.00 C ATOM 667 O GLU A 45 20.442 -7.296 -2.182 1.00 0.00 O ATOM 668 CB GLU A 45 21.145 -10.447 -3.005 1.00 0.00 C ATOM 669 CG GLU A 45 20.435 -11.696 -2.512 1.00 0.00 C ATOM 670 CD GLU A 45 21.350 -12.616 -1.726 1.00 0.00 C ATOM 671 OE1 GLU A 45 22.133 -12.107 -0.897 1.00 0.00 O ATOM 672 OE2 GLU A 45 21.282 -13.844 -1.940 1.00 0.00 O ATOM 0 H GLU A 45 20.119 -10.356 -5.262 1.00 0.00 H new ATOM 0 HA GLU A 45 19.265 -9.414 -2.868 1.00 0.00 H new ATOM 0 HB2 GLU A 45 21.785 -10.711 -3.847 1.00 0.00 H new ATOM 0 HB3 GLU A 45 21.796 -10.073 -2.215 1.00 0.00 H new ATOM 0 HG2 GLU A 45 19.592 -11.406 -1.885 1.00 0.00 H new ATOM 0 HG3 GLU A 45 20.027 -12.238 -3.365 1.00 0.00 H new ATOM 679 N ALA A 46 21.777 -7.574 -3.971 1.00 0.00 N ATOM 680 CA ALA A 46 22.456 -6.295 -3.801 1.00 0.00 C ATOM 681 C ALA A 46 21.474 -5.134 -3.913 1.00 0.00 C ATOM 682 O ALA A 46 21.527 -4.187 -3.128 1.00 0.00 O ATOM 683 CB ALA A 46 23.570 -6.148 -4.827 1.00 0.00 C ATOM 0 H ALA A 46 22.101 -8.120 -4.769 1.00 0.00 H new ATOM 0 HA ALA A 46 22.892 -6.273 -2.802 1.00 0.00 H new ATOM 0 HB1 ALA A 46 24.068 -5.188 -4.688 1.00 0.00 H new ATOM 0 HB2 ALA A 46 24.292 -6.954 -4.698 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.149 -6.196 -5.831 1.00 0.00 H new ATOM 689 N GLU A 47 20.579 -5.214 -4.893 1.00 0.00 N ATOM 690 CA GLU A 47 19.587 -4.167 -5.107 1.00 0.00 C ATOM 691 C GLU A 47 18.629 -4.074 -3.922 1.00 0.00 C ATOM 692 O GLU A 47 18.332 -2.984 -3.434 1.00 0.00 O ATOM 693 CB GLU A 47 18.800 -4.435 -6.392 1.00 0.00 C ATOM 694 CG GLU A 47 19.677 -4.561 -7.627 1.00 0.00 C ATOM 695 CD GLU A 47 18.974 -4.105 -8.891 1.00 0.00 C ATOM 696 OE1 GLU A 47 18.864 -2.879 -9.098 1.00 0.00 O ATOM 697 OE2 GLU A 47 18.534 -4.974 -9.672 1.00 0.00 O ATOM 0 H GLU A 47 20.521 -5.992 -5.550 1.00 0.00 H new ATOM 0 HA GLU A 47 20.113 -3.217 -5.202 1.00 0.00 H new ATOM 0 HB2 GLU A 47 18.224 -5.352 -6.271 1.00 0.00 H new ATOM 0 HB3 GLU A 47 18.085 -3.627 -6.545 1.00 0.00 H new ATOM 0 HG2 GLU A 47 20.583 -3.971 -7.487 1.00 0.00 H new ATOM 0 HG3 GLU A 47 19.988 -5.599 -7.743 1.00 0.00 H new ATOM 704 N LEU A 48 18.150 -5.226 -3.466 1.00 0.00 N ATOM 705 CA LEU A 48 17.225 -5.276 -2.338 1.00 0.00 C ATOM 706 C LEU A 48 17.899 -4.788 -1.060 1.00 0.00 C ATOM 707 O LEU A 48 17.337 -3.980 -0.321 1.00 0.00 O ATOM 708 CB LEU A 48 16.706 -6.702 -2.143 1.00 0.00 C ATOM 709 CG LEU A 48 15.991 -7.326 -3.341 1.00 0.00 C ATOM 710 CD1 LEU A 48 16.163 -8.837 -3.338 1.00 0.00 C ATOM 711 CD2 LEU A 48 14.515 -6.956 -3.334 1.00 0.00 C ATOM 0 H LEU A 48 18.386 -6.137 -3.859 1.00 0.00 H new ATOM 0 HA LEU A 48 16.385 -4.617 -2.558 1.00 0.00 H new ATOM 0 HB2 LEU A 48 17.548 -7.340 -1.875 1.00 0.00 H new ATOM 0 HB3 LEU A 48 16.021 -6.705 -1.295 1.00 0.00 H new ATOM 0 HG LEU A 48 16.440 -6.931 -4.253 1.00 0.00 H new ATOM 0 HD11 LEU A 48 15.647 -9.264 -4.198 1.00 0.00 H new ATOM 0 HD12 LEU A 48 17.224 -9.083 -3.392 1.00 0.00 H new ATOM 0 HD13 LEU A 48 15.742 -9.249 -2.421 1.00 0.00 H new ATOM 0 HD21 LEU A 48 14.022 -7.409 -4.194 1.00 0.00 H new ATOM 0 HD22 LEU A 48 14.053 -7.321 -2.417 1.00 0.00 H new ATOM 0 HD23 LEU A 48 14.411 -5.872 -3.386 1.00 0.00 H new ATOM 723 N GLN A 49 19.106 -5.283 -0.807 1.00 0.00 N ATOM 724 CA GLN A 49 19.856 -4.896 0.382 1.00 0.00 C ATOM 725 C GLN A 49 20.145 -3.398 0.379 1.00 0.00 C ATOM 726 O GLN A 49 20.084 -2.742 1.419 1.00 0.00 O ATOM 727 CB GLN A 49 21.167 -5.680 0.462 1.00 0.00 C ATOM 728 CG GLN A 49 20.971 -7.185 0.558 1.00 0.00 C ATOM 729 CD GLN A 49 20.821 -7.663 1.988 1.00 0.00 C ATOM 730 OE1 GLN A 49 21.806 -7.989 2.652 1.00 0.00 O ATOM 731 NE2 GLN A 49 19.585 -7.709 2.472 1.00 0.00 N ATOM 0 H GLN A 49 19.585 -5.952 -1.409 1.00 0.00 H new ATOM 0 HA GLN A 49 19.248 -5.129 1.256 1.00 0.00 H new ATOM 0 HB2 GLN A 49 21.769 -5.456 -0.419 1.00 0.00 H new ATOM 0 HB3 GLN A 49 21.732 -5.339 1.330 1.00 0.00 H new ATOM 0 HG2 GLN A 49 20.086 -7.469 -0.011 1.00 0.00 H new ATOM 0 HG3 GLN A 49 21.821 -7.688 0.098 1.00 0.00 H new ATOM 0 HE21 GLN A 49 18.798 -7.430 1.887 1.00 0.00 H new ATOM 0 HE22 GLN A 49 19.423 -8.024 3.429 1.00 0.00 H new ATOM 740 N ASP A 50 20.460 -2.864 -0.796 1.00 0.00 N ATOM 741 CA ASP A 50 20.758 -1.443 -0.934 1.00 0.00 C ATOM 742 C ASP A 50 19.546 -0.595 -0.562 1.00 0.00 C ATOM 743 O ASP A 50 19.662 0.377 0.183 1.00 0.00 O ATOM 744 CB ASP A 50 21.196 -1.129 -2.366 1.00 0.00 C ATOM 745 CG ASP A 50 22.664 -1.425 -2.600 1.00 0.00 C ATOM 746 OD1 ASP A 50 23.430 -1.446 -1.613 1.00 0.00 O ATOM 747 OD2 ASP A 50 23.049 -1.635 -3.770 1.00 0.00 O ATOM 0 H ASP A 50 20.516 -3.393 -1.666 1.00 0.00 H new ATOM 0 HA ASP A 50 21.572 -1.200 -0.251 1.00 0.00 H new ATOM 0 HB2 ASP A 50 20.595 -1.713 -3.063 1.00 0.00 H new ATOM 0 HB3 ASP A 50 21.002 -0.078 -2.580 1.00 0.00 H new ATOM 752 N MET A 51 18.384 -0.969 -1.089 1.00 0.00 N ATOM 753 CA MET A 51 17.151 -0.242 -0.811 1.00 0.00 C ATOM 754 C MET A 51 16.733 -0.416 0.645 1.00 0.00 C ATOM 755 O MET A 51 16.303 0.538 1.295 1.00 0.00 O ATOM 756 CB MET A 51 16.031 -0.724 -1.736 1.00 0.00 C ATOM 757 CG MET A 51 16.325 -0.508 -3.211 1.00 0.00 C ATOM 758 SD MET A 51 14.935 -0.952 -4.269 1.00 0.00 S ATOM 759 CE MET A 51 15.205 -2.712 -4.463 1.00 0.00 C ATOM 0 H MET A 51 18.271 -1.770 -1.710 1.00 0.00 H new ATOM 0 HA MET A 51 17.334 0.817 -0.993 1.00 0.00 H new ATOM 0 HB2 MET A 51 15.858 -1.786 -1.560 1.00 0.00 H new ATOM 0 HB3 MET A 51 15.109 -0.204 -1.478 1.00 0.00 H new ATOM 0 HG2 MET A 51 16.583 0.538 -3.377 1.00 0.00 H new ATOM 0 HG3 MET A 51 17.196 -1.100 -3.494 1.00 0.00 H new ATOM 0 HE1 MET A 51 15.393 -2.938 -5.513 1.00 0.00 H new ATOM 0 HE2 MET A 51 16.065 -3.016 -3.867 1.00 0.00 H new ATOM 0 HE3 MET A 51 14.321 -3.255 -4.128 1.00 0.00 H new ATOM 769 N ILE A 52 16.863 -1.637 1.152 1.00 0.00 N ATOM 770 CA ILE A 52 16.500 -1.934 2.532 1.00 0.00 C ATOM 771 C ILE A 52 17.410 -1.199 3.510 1.00 0.00 C ATOM 772 O ILE A 52 16.952 -0.378 4.304 1.00 0.00 O ATOM 773 CB ILE A 52 16.569 -3.445 2.821 1.00 0.00 C ATOM 774 CG1 ILE A 52 15.520 -4.192 1.995 1.00 0.00 C ATOM 775 CG2 ILE A 52 16.370 -3.711 4.305 1.00 0.00 C ATOM 776 CD1 ILE A 52 15.823 -5.664 1.822 1.00 0.00 C ATOM 0 H ILE A 52 17.217 -2.437 0.628 1.00 0.00 H new ATOM 0 HA ILE A 52 15.473 -1.594 2.668 1.00 0.00 H new ATOM 0 HB ILE A 52 17.556 -3.809 2.536 1.00 0.00 H new ATOM 0 HG12 ILE A 52 14.547 -4.084 2.474 1.00 0.00 H new ATOM 0 HG13 ILE A 52 15.445 -3.727 1.012 1.00 0.00 H new ATOM 0 HG21 ILE A 52 16.422 -4.784 4.493 1.00 0.00 H new ATOM 0 HG22 ILE A 52 17.151 -3.205 4.873 1.00 0.00 H new ATOM 0 HG23 ILE A 52 15.395 -3.335 4.614 1.00 0.00 H new ATOM 0 HD11 ILE A 52 15.038 -6.130 1.227 1.00 0.00 H new ATOM 0 HD12 ILE A 52 16.781 -5.781 1.315 1.00 0.00 H new ATOM 0 HD13 ILE A 52 15.869 -6.143 2.800 1.00 0.00 H new ATOM 788 N ASN A 53 18.703 -1.499 3.446 1.00 0.00 N ATOM 789 CA ASN A 53 19.679 -0.865 4.326 1.00 0.00 C ATOM 790 C ASN A 53 19.418 0.633 4.439 1.00 0.00 C ATOM 791 O ASN A 53 19.408 1.190 5.536 1.00 0.00 O ATOM 792 CB ASN A 53 21.098 -1.109 3.807 1.00 0.00 C ATOM 793 CG ASN A 53 21.680 -2.417 4.308 1.00 0.00 C ATOM 794 OD1 ASN A 53 21.899 -2.593 5.507 1.00 0.00 O ATOM 795 ND2 ASN A 53 21.933 -3.342 3.390 1.00 0.00 N ATOM 0 H ASN A 53 19.099 -2.176 2.795 1.00 0.00 H new ATOM 0 HA ASN A 53 19.580 -1.308 5.317 1.00 0.00 H new ATOM 0 HB2 ASN A 53 21.088 -1.113 2.717 1.00 0.00 H new ATOM 0 HB3 ASN A 53 21.742 -0.286 4.117 1.00 0.00 H new ATOM 0 HD21 ASN A 53 22.325 -4.242 3.667 1.00 0.00 H new ATOM 0 HD22 ASN A 53 21.736 -3.153 2.407 1.00 0.00 H new ATOM 802 N GLU A 54 19.206 1.280 3.296 1.00 0.00 N ATOM 803 CA GLU A 54 18.945 2.714 3.268 1.00 0.00 C ATOM 804 C GLU A 54 18.088 3.135 4.458 1.00 0.00 C ATOM 805 O GLU A 54 18.480 3.995 5.246 1.00 0.00 O ATOM 806 CB GLU A 54 18.249 3.102 1.961 1.00 0.00 C ATOM 807 CG GLU A 54 19.205 3.291 0.795 1.00 0.00 C ATOM 808 CD GLU A 54 19.972 4.597 0.876 1.00 0.00 C ATOM 809 OE1 GLU A 54 20.832 4.725 1.772 1.00 0.00 O ATOM 810 OE2 GLU A 54 19.712 5.490 0.043 1.00 0.00 O ATOM 0 H GLU A 54 19.210 0.834 2.379 1.00 0.00 H new ATOM 0 HA GLU A 54 19.902 3.233 3.330 1.00 0.00 H new ATOM 0 HB2 GLU A 54 17.523 2.331 1.703 1.00 0.00 H new ATOM 0 HB3 GLU A 54 17.692 4.026 2.116 1.00 0.00 H new ATOM 0 HG2 GLU A 54 19.910 2.460 0.770 1.00 0.00 H new ATOM 0 HG3 GLU A 54 18.644 3.261 -0.139 1.00 0.00 H new ATOM 817 N VAL A 55 16.915 2.521 4.581 1.00 0.00 N ATOM 818 CA VAL A 55 16.002 2.831 5.675 1.00 0.00 C ATOM 819 C VAL A 55 16.378 2.065 6.938 1.00 0.00 C ATOM 820 O VAL A 55 16.213 2.565 8.052 1.00 0.00 O ATOM 821 CB VAL A 55 14.545 2.498 5.301 1.00 0.00 C ATOM 822 CG1 VAL A 55 13.617 2.770 6.475 1.00 0.00 C ATOM 823 CG2 VAL A 55 14.115 3.292 4.076 1.00 0.00 C ATOM 0 H VAL A 55 16.575 1.807 3.937 1.00 0.00 H new ATOM 0 HA VAL A 55 16.086 3.901 5.864 1.00 0.00 H new ATOM 0 HB VAL A 55 14.484 1.437 5.058 1.00 0.00 H new ATOM 0 HG11 VAL A 55 12.592 2.529 6.192 1.00 0.00 H new ATOM 0 HG12 VAL A 55 13.914 2.154 7.324 1.00 0.00 H new ATOM 0 HG13 VAL A 55 13.679 3.822 6.752 1.00 0.00 H new ATOM 0 HG21 VAL A 55 13.083 3.045 3.826 1.00 0.00 H new ATOM 0 HG22 VAL A 55 14.191 4.358 4.288 1.00 0.00 H new ATOM 0 HG23 VAL A 55 14.762 3.043 3.235 1.00 0.00 H new ATOM 833 N ASP A 56 16.884 0.850 6.759 1.00 0.00 N ATOM 834 CA ASP A 56 17.286 0.015 7.884 1.00 0.00 C ATOM 835 C ASP A 56 17.827 0.868 9.028 1.00 0.00 C ATOM 836 O ASP A 56 18.968 1.326 8.988 1.00 0.00 O ATOM 837 CB ASP A 56 18.343 -0.998 7.443 1.00 0.00 C ATOM 838 CG ASP A 56 18.588 -2.071 8.487 1.00 0.00 C ATOM 839 OD1 ASP A 56 17.605 -2.543 9.094 1.00 0.00 O ATOM 840 OD2 ASP A 56 19.764 -2.437 8.697 1.00 0.00 O ATOM 0 H ASP A 56 17.026 0.421 5.844 1.00 0.00 H new ATOM 0 HA ASP A 56 16.406 -0.521 8.239 1.00 0.00 H new ATOM 0 HB2 ASP A 56 18.026 -1.467 6.511 1.00 0.00 H new ATOM 0 HB3 ASP A 56 19.278 -0.477 7.236 1.00 0.00 H new ATOM 845 N ALA A 57 16.998 1.076 10.047 1.00 0.00 N ATOM 846 CA ALA A 57 17.393 1.872 11.202 1.00 0.00 C ATOM 847 C ALA A 57 18.037 1.001 12.275 1.00 0.00 C ATOM 848 O ALA A 57 19.226 1.136 12.567 1.00 0.00 O ATOM 849 CB ALA A 57 16.191 2.611 11.770 1.00 0.00 C ATOM 0 H ALA A 57 16.049 0.704 10.095 1.00 0.00 H new ATOM 0 HA ALA A 57 18.132 2.603 10.873 1.00 0.00 H new ATOM 0 HB1 ALA A 57 16.501 3.201 12.632 1.00 0.00 H new ATOM 0 HB2 ALA A 57 15.777 3.271 11.008 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.433 1.891 12.077 1.00 0.00 H new ATOM 855 N ASP A 58 17.246 0.109 12.859 1.00 0.00 N ATOM 856 CA ASP A 58 17.739 -0.785 13.900 1.00 0.00 C ATOM 857 C ASP A 58 19.045 -1.448 13.473 1.00 0.00 C ATOM 858 O ASP A 58 19.969 -1.595 14.272 1.00 0.00 O ATOM 859 CB ASP A 58 16.693 -1.852 14.224 1.00 0.00 C ATOM 860 CG ASP A 58 15.972 -2.350 12.987 1.00 0.00 C ATOM 861 OD1 ASP A 58 16.511 -2.173 11.875 1.00 0.00 O ATOM 862 OD2 ASP A 58 14.867 -2.916 13.131 1.00 0.00 O ATOM 0 H ASP A 58 16.260 -0.015 12.629 1.00 0.00 H new ATOM 0 HA ASP A 58 17.929 -0.191 14.794 1.00 0.00 H new ATOM 0 HB2 ASP A 58 17.177 -2.692 14.722 1.00 0.00 H new ATOM 0 HB3 ASP A 58 15.966 -1.443 14.925 1.00 0.00 H new ATOM 867 N GLY A 59 19.113 -1.848 12.207 1.00 0.00 N ATOM 868 CA GLY A 59 20.309 -2.493 11.696 1.00 0.00 C ATOM 869 C GLY A 59 20.150 -3.995 11.571 1.00 0.00 C ATOM 870 O GLY A 59 20.973 -4.757 12.076 1.00 0.00 O ATOM 0 H GLY A 59 18.362 -1.737 11.526 1.00 0.00 H new ATOM 0 HA2 GLY A 59 20.555 -2.074 10.720 1.00 0.00 H new ATOM 0 HA3 GLY A 59 21.147 -2.273 12.357 1.00 0.00 H new ATOM 874 N ASN A 60 19.086 -4.422 10.899 1.00 0.00 N ATOM 875 CA ASN A 60 18.820 -5.844 10.711 1.00 0.00 C ATOM 876 C ASN A 60 18.492 -6.148 9.253 1.00 0.00 C ATOM 877 O ASN A 60 17.629 -6.975 8.959 1.00 0.00 O ATOM 878 CB ASN A 60 17.665 -6.291 11.610 1.00 0.00 C ATOM 879 CG ASN A 60 16.473 -5.358 11.526 1.00 0.00 C ATOM 880 OD1 ASN A 60 16.432 -4.459 10.686 1.00 0.00 O ATOM 881 ND2 ASN A 60 15.495 -5.568 12.399 1.00 0.00 N ATOM 0 H ASN A 60 18.394 -3.804 10.475 1.00 0.00 H new ATOM 0 HA ASN A 60 19.719 -6.396 10.985 1.00 0.00 H new ATOM 0 HB2 ASN A 60 17.356 -7.297 11.327 1.00 0.00 H new ATOM 0 HB3 ASN A 60 18.011 -6.342 12.642 1.00 0.00 H new ATOM 0 HD21 ASN A 60 14.667 -4.972 12.391 1.00 0.00 H new ATOM 0 HD22 ASN A 60 15.571 -6.325 13.078 1.00 0.00 H new ATOM 888 N GLY A 61 19.187 -5.474 8.342 1.00 0.00 N ATOM 889 CA GLY A 61 18.956 -5.686 6.925 1.00 0.00 C ATOM 890 C GLY A 61 17.504 -5.991 6.614 1.00 0.00 C ATOM 891 O GLY A 61 17.205 -6.814 5.749 1.00 0.00 O ATOM 0 H GLY A 61 19.906 -4.785 8.560 1.00 0.00 H new ATOM 0 HA2 GLY A 61 19.264 -4.798 6.373 1.00 0.00 H new ATOM 0 HA3 GLY A 61 19.580 -6.510 6.577 1.00 0.00 H new ATOM 895 N THR A 62 16.597 -5.326 7.323 1.00 0.00 N ATOM 896 CA THR A 62 15.168 -5.531 7.120 1.00 0.00 C ATOM 897 C THR A 62 14.368 -4.315 7.573 1.00 0.00 C ATOM 898 O THR A 62 14.627 -3.751 8.636 1.00 0.00 O ATOM 899 CB THR A 62 14.666 -6.774 7.880 1.00 0.00 C ATOM 900 OG1 THR A 62 15.010 -6.673 9.266 1.00 0.00 O ATOM 901 CG2 THR A 62 15.264 -8.044 7.295 1.00 0.00 C ATOM 0 H THR A 62 16.827 -4.641 8.043 1.00 0.00 H new ATOM 0 HA THR A 62 15.019 -5.682 6.051 1.00 0.00 H new ATOM 0 HB THR A 62 13.582 -6.822 7.778 1.00 0.00 H new ATOM 0 HG1 THR A 62 15.941 -6.952 9.393 1.00 0.00 H new ATOM 0 HG21 THR A 62 14.895 -8.908 7.848 1.00 0.00 H new ATOM 0 HG22 THR A 62 14.976 -8.133 6.248 1.00 0.00 H new ATOM 0 HG23 THR A 62 16.351 -8.002 7.370 1.00 0.00 H new ATOM 909 N ILE A 63 13.395 -3.917 6.760 1.00 0.00 N ATOM 910 CA ILE A 63 12.556 -2.768 7.079 1.00 0.00 C ATOM 911 C ILE A 63 11.432 -3.157 8.033 1.00 0.00 C ATOM 912 O ILE A 63 10.918 -4.275 7.981 1.00 0.00 O ATOM 913 CB ILE A 63 11.945 -2.148 5.809 1.00 0.00 C ATOM 914 CG1 ILE A 63 13.051 -1.654 4.874 1.00 0.00 C ATOM 915 CG2 ILE A 63 11.006 -1.008 6.175 1.00 0.00 C ATOM 916 CD1 ILE A 63 12.566 -1.345 3.475 1.00 0.00 C ATOM 0 H ILE A 63 13.168 -4.373 5.876 1.00 0.00 H new ATOM 0 HA ILE A 63 13.199 -2.031 7.560 1.00 0.00 H new ATOM 0 HB ILE A 63 11.370 -2.914 5.289 1.00 0.00 H new ATOM 0 HG12 ILE A 63 13.502 -0.758 5.300 1.00 0.00 H new ATOM 0 HG13 ILE A 63 13.834 -2.410 4.820 1.00 0.00 H new ATOM 0 HG21 ILE A 63 10.582 -0.580 5.267 1.00 0.00 H new ATOM 0 HG22 ILE A 63 10.203 -1.387 6.807 1.00 0.00 H new ATOM 0 HG23 ILE A 63 11.560 -0.239 6.714 1.00 0.00 H new ATOM 0 HD11 ILE A 63 13.403 -1.000 2.868 1.00 0.00 H new ATOM 0 HD12 ILE A 63 12.141 -2.245 3.030 1.00 0.00 H new ATOM 0 HD13 ILE A 63 11.804 -0.567 3.518 1.00 0.00 H new ATOM 928 N ASP A 64 11.053 -2.227 8.902 1.00 0.00 N ATOM 929 CA ASP A 64 9.987 -2.470 9.867 1.00 0.00 C ATOM 930 C ASP A 64 8.821 -1.513 9.641 1.00 0.00 C ATOM 931 O ASP A 64 8.812 -0.745 8.678 1.00 0.00 O ATOM 932 CB ASP A 64 10.517 -2.321 11.294 1.00 0.00 C ATOM 933 CG ASP A 64 11.855 -3.006 11.489 1.00 0.00 C ATOM 934 OD1 ASP A 64 12.147 -3.963 10.741 1.00 0.00 O ATOM 935 OD2 ASP A 64 12.612 -2.584 12.388 1.00 0.00 O ATOM 0 H ASP A 64 11.468 -1.297 8.958 1.00 0.00 H new ATOM 0 HA ASP A 64 9.629 -3.490 9.726 1.00 0.00 H new ATOM 0 HB2 ASP A 64 10.616 -1.262 11.533 1.00 0.00 H new ATOM 0 HB3 ASP A 64 9.793 -2.739 11.993 1.00 0.00 H new ATOM 940 N PHE A 65 7.839 -1.563 10.535 1.00 0.00 N ATOM 941 CA PHE A 65 6.667 -0.702 10.433 1.00 0.00 C ATOM 942 C PHE A 65 7.060 0.768 10.554 1.00 0.00 C ATOM 943 O PHE A 65 6.666 1.610 9.747 1.00 0.00 O ATOM 944 CB PHE A 65 5.648 -1.060 11.516 1.00 0.00 C ATOM 945 CG PHE A 65 4.226 -0.784 11.118 1.00 0.00 C ATOM 946 CD1 PHE A 65 3.872 0.439 10.571 1.00 0.00 C ATOM 947 CD2 PHE A 65 3.245 -1.746 11.289 1.00 0.00 C ATOM 948 CE1 PHE A 65 2.565 0.697 10.204 1.00 0.00 C ATOM 949 CE2 PHE A 65 1.936 -1.495 10.924 1.00 0.00 C ATOM 950 CZ PHE A 65 1.596 -0.272 10.380 1.00 0.00 C ATOM 0 H PHE A 65 7.832 -2.191 11.339 1.00 0.00 H new ATOM 0 HA PHE A 65 6.216 -0.860 9.454 1.00 0.00 H new ATOM 0 HB2 PHE A 65 5.749 -2.117 11.763 1.00 0.00 H new ATOM 0 HB3 PHE A 65 5.879 -0.498 12.421 1.00 0.00 H new ATOM 0 HD1 PHE A 65 4.626 1.199 10.430 1.00 0.00 H new ATOM 0 HD2 PHE A 65 3.506 -2.704 11.713 1.00 0.00 H new ATOM 0 HE1 PHE A 65 2.301 1.655 9.780 1.00 0.00 H new ATOM 0 HE2 PHE A 65 1.180 -2.254 11.064 1.00 0.00 H new ATOM 0 HZ PHE A 65 0.574 -0.073 10.093 1.00 0.00 H new ATOM 960 N PRO A 66 7.854 1.084 11.588 1.00 0.00 N ATOM 961 CA PRO A 66 8.318 2.451 11.841 1.00 0.00 C ATOM 962 C PRO A 66 9.323 2.925 10.797 1.00 0.00 C ATOM 963 O PRO A 66 9.217 4.036 10.279 1.00 0.00 O ATOM 964 CB PRO A 66 8.982 2.352 13.216 1.00 0.00 C ATOM 965 CG PRO A 66 9.396 0.926 13.335 1.00 0.00 C ATOM 966 CD PRO A 66 8.361 0.130 12.589 1.00 0.00 C ATOM 0 HA PRO A 66 7.502 3.172 11.798 1.00 0.00 H new ATOM 0 HB2 PRO A 66 9.840 3.021 13.291 1.00 0.00 H new ATOM 0 HB3 PRO A 66 8.290 2.631 14.011 1.00 0.00 H new ATOM 0 HG2 PRO A 66 10.388 0.771 12.911 1.00 0.00 H new ATOM 0 HG3 PRO A 66 9.445 0.620 14.380 1.00 0.00 H new ATOM 0 HD2 PRO A 66 8.795 -0.753 12.119 1.00 0.00 H new ATOM 0 HD3 PRO A 66 7.568 -0.218 13.251 1.00 0.00 H new ATOM 974 N GLU A 67 10.298 2.074 10.492 1.00 0.00 N ATOM 975 CA GLU A 67 11.322 2.407 9.509 1.00 0.00 C ATOM 976 C GLU A 67 10.705 2.617 8.129 1.00 0.00 C ATOM 977 O GLU A 67 11.021 3.584 7.436 1.00 0.00 O ATOM 978 CB GLU A 67 12.378 1.301 9.444 1.00 0.00 C ATOM 979 CG GLU A 67 12.879 0.858 10.809 1.00 0.00 C ATOM 980 CD GLU A 67 13.976 -0.185 10.716 1.00 0.00 C ATOM 981 OE1 GLU A 67 14.505 -0.394 9.605 1.00 0.00 O ATOM 982 OE2 GLU A 67 14.304 -0.793 11.757 1.00 0.00 O ATOM 0 H GLU A 67 10.400 1.150 10.911 1.00 0.00 H new ATOM 0 HA GLU A 67 11.798 3.337 9.820 1.00 0.00 H new ATOM 0 HB2 GLU A 67 11.959 0.440 8.923 1.00 0.00 H new ATOM 0 HB3 GLU A 67 13.223 1.652 8.852 1.00 0.00 H new ATOM 0 HG2 GLU A 67 13.252 1.725 11.354 1.00 0.00 H new ATOM 0 HG3 GLU A 67 12.046 0.454 11.384 1.00 0.00 H new ATOM 989 N PHE A 68 9.823 1.703 7.737 1.00 0.00 N ATOM 990 CA PHE A 68 9.162 1.787 6.440 1.00 0.00 C ATOM 991 C PHE A 68 8.633 3.196 6.189 1.00 0.00 C ATOM 992 O PHE A 68 8.766 3.734 5.089 1.00 0.00 O ATOM 993 CB PHE A 68 8.015 0.777 6.363 1.00 0.00 C ATOM 994 CG PHE A 68 6.941 1.164 5.386 1.00 0.00 C ATOM 995 CD1 PHE A 68 7.021 0.774 4.059 1.00 0.00 C ATOM 996 CD2 PHE A 68 5.852 1.917 5.795 1.00 0.00 C ATOM 997 CE1 PHE A 68 6.034 1.127 3.157 1.00 0.00 C ATOM 998 CE2 PHE A 68 4.863 2.273 4.898 1.00 0.00 C ATOM 999 CZ PHE A 68 4.955 1.879 3.577 1.00 0.00 C ATOM 0 H PHE A 68 9.550 0.896 8.299 1.00 0.00 H new ATOM 0 HA PHE A 68 9.896 1.552 5.669 1.00 0.00 H new ATOM 0 HB2 PHE A 68 8.417 -0.197 6.082 1.00 0.00 H new ATOM 0 HB3 PHE A 68 7.572 0.666 7.353 1.00 0.00 H new ATOM 0 HD1 PHE A 68 7.864 0.187 3.725 1.00 0.00 H new ATOM 0 HD2 PHE A 68 5.775 2.229 6.826 1.00 0.00 H new ATOM 0 HE1 PHE A 68 6.107 0.815 2.126 1.00 0.00 H new ATOM 0 HE2 PHE A 68 4.018 2.859 5.229 1.00 0.00 H new ATOM 0 HZ PHE A 68 4.184 2.159 2.874 1.00 0.00 H new ATOM 1009 N LEU A 69 8.031 3.787 7.215 1.00 0.00 N ATOM 1010 CA LEU A 69 7.481 5.133 7.107 1.00 0.00 C ATOM 1011 C LEU A 69 8.520 6.104 6.554 1.00 0.00 C ATOM 1012 O LEU A 69 8.184 7.053 5.845 1.00 0.00 O ATOM 1013 CB LEU A 69 6.991 5.616 8.473 1.00 0.00 C ATOM 1014 CG LEU A 69 5.992 4.706 9.188 1.00 0.00 C ATOM 1015 CD1 LEU A 69 5.915 5.055 10.666 1.00 0.00 C ATOM 1016 CD2 LEU A 69 4.618 4.809 8.542 1.00 0.00 C ATOM 0 H LEU A 69 7.911 3.355 8.131 1.00 0.00 H new ATOM 0 HA LEU A 69 6.638 5.100 6.416 1.00 0.00 H new ATOM 0 HB2 LEU A 69 7.857 5.751 9.121 1.00 0.00 H new ATOM 0 HB3 LEU A 69 6.532 6.597 8.346 1.00 0.00 H new ATOM 0 HG LEU A 69 6.338 3.677 9.096 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.199 4.397 11.158 1.00 0.00 H new ATOM 0 HD12 LEU A 69 6.897 4.928 11.121 1.00 0.00 H new ATOM 0 HD13 LEU A 69 5.594 6.090 10.779 1.00 0.00 H new ATOM 0 HD21 LEU A 69 3.920 4.154 9.064 1.00 0.00 H new ATOM 0 HD22 LEU A 69 4.264 5.838 8.602 1.00 0.00 H new ATOM 0 HD23 LEU A 69 4.684 4.508 7.496 1.00 0.00 H new ATOM 1028 N THR A 70 9.785 5.859 6.883 1.00 0.00 N ATOM 1029 CA THR A 70 10.873 6.710 6.419 1.00 0.00 C ATOM 1030 C THR A 70 11.003 6.659 4.901 1.00 0.00 C ATOM 1031 O THR A 70 11.108 7.693 4.243 1.00 0.00 O ATOM 1032 CB THR A 70 12.216 6.299 7.052 1.00 0.00 C ATOM 1033 OG1 THR A 70 12.093 6.256 8.478 1.00 0.00 O ATOM 1034 CG2 THR A 70 13.319 7.272 6.662 1.00 0.00 C ATOM 0 H THR A 70 10.081 5.078 7.469 1.00 0.00 H new ATOM 0 HA THR A 70 10.631 7.728 6.726 1.00 0.00 H new ATOM 0 HB THR A 70 12.479 5.309 6.681 1.00 0.00 H new ATOM 0 HG1 THR A 70 11.703 5.398 8.747 1.00 0.00 H new ATOM 0 HG21 THR A 70 14.258 6.961 7.121 1.00 0.00 H new ATOM 0 HG22 THR A 70 13.430 7.280 5.578 1.00 0.00 H new ATOM 0 HG23 THR A 70 13.060 8.273 7.008 1.00 0.00 H new ATOM 1042 N MET A 71 10.993 5.449 4.352 1.00 0.00 N ATOM 1043 CA MET A 71 11.108 5.263 2.910 1.00 0.00 C ATOM 1044 C MET A 71 9.975 5.976 2.178 1.00 0.00 C ATOM 1045 O MET A 71 10.213 6.758 1.258 1.00 0.00 O ATOM 1046 CB MET A 71 11.097 3.773 2.563 1.00 0.00 C ATOM 1047 CG MET A 71 10.967 3.497 1.074 1.00 0.00 C ATOM 1048 SD MET A 71 10.167 1.919 0.727 1.00 0.00 S ATOM 1049 CE MET A 71 11.096 0.826 1.798 1.00 0.00 C ATOM 0 H MET A 71 10.906 4.583 4.883 1.00 0.00 H new ATOM 0 HA MET A 71 12.055 5.696 2.588 1.00 0.00 H new ATOM 0 HB2 MET A 71 12.016 3.316 2.930 1.00 0.00 H new ATOM 0 HB3 MET A 71 10.271 3.292 3.087 1.00 0.00 H new ATOM 0 HG2 MET A 71 10.395 4.300 0.608 1.00 0.00 H new ATOM 0 HG3 MET A 71 11.957 3.506 0.619 1.00 0.00 H new ATOM 0 HE1 MET A 71 10.911 -0.209 1.510 1.00 0.00 H new ATOM 0 HE2 MET A 71 12.160 1.044 1.705 1.00 0.00 H new ATOM 0 HE3 MET A 71 10.783 0.977 2.831 1.00 0.00 H new ATOM 1059 N MET A 72 8.743 5.701 2.594 1.00 0.00 N ATOM 1060 CA MET A 72 7.574 6.317 1.978 1.00 0.00 C ATOM 1061 C MET A 72 7.792 7.813 1.774 1.00 0.00 C ATOM 1062 O MET A 72 7.341 8.386 0.783 1.00 0.00 O ATOM 1063 CB MET A 72 6.333 6.084 2.841 1.00 0.00 C ATOM 1064 CG MET A 72 5.829 4.650 2.806 1.00 0.00 C ATOM 1065 SD MET A 72 4.824 4.303 1.349 1.00 0.00 S ATOM 1066 CE MET A 72 3.360 5.270 1.710 1.00 0.00 C ATOM 0 H MET A 72 8.529 5.056 3.355 1.00 0.00 H new ATOM 0 HA MET A 72 7.422 5.853 1.003 1.00 0.00 H new ATOM 0 HB2 MET A 72 6.561 6.355 3.872 1.00 0.00 H new ATOM 0 HB3 MET A 72 5.537 6.749 2.505 1.00 0.00 H new ATOM 0 HG2 MET A 72 6.680 3.969 2.826 1.00 0.00 H new ATOM 0 HG3 MET A 72 5.242 4.453 3.703 1.00 0.00 H new ATOM 0 HE1 MET A 72 2.508 4.856 1.170 1.00 0.00 H new ATOM 0 HE2 MET A 72 3.159 5.241 2.781 1.00 0.00 H new ATOM 0 HE3 MET A 72 3.520 6.302 1.399 1.00 0.00 H new ATOM 1284 N ARG A 86 5.623 15.191 -17.022 1.00 0.00 N ATOM 1285 CA ARG A 86 4.336 15.206 -17.707 1.00 0.00 C ATOM 1286 C ARG A 86 4.016 16.603 -18.232 1.00 0.00 C ATOM 1287 O ARG A 86 3.703 16.777 -19.409 1.00 0.00 O ATOM 1288 CB ARG A 86 3.227 14.736 -16.765 1.00 0.00 C ATOM 1289 CG ARG A 86 3.204 13.231 -16.553 1.00 0.00 C ATOM 1290 CD ARG A 86 2.580 12.511 -17.738 1.00 0.00 C ATOM 1291 NE ARG A 86 1.875 11.298 -17.332 1.00 0.00 N ATOM 1292 CZ ARG A 86 0.888 10.752 -18.034 1.00 0.00 C ATOM 1293 NH1 ARG A 86 0.492 11.308 -19.170 1.00 0.00 N ATOM 1294 NH2 ARG A 86 0.296 9.647 -17.599 1.00 0.00 N ATOM 0 HA ARG A 86 4.396 14.523 -18.555 1.00 0.00 H new ATOM 0 HB2 ARG A 86 3.349 15.228 -15.800 1.00 0.00 H new ATOM 0 HB3 ARG A 86 2.264 15.053 -17.165 1.00 0.00 H new ATOM 0 HG2 ARG A 86 4.220 12.868 -16.400 1.00 0.00 H new ATOM 0 HG3 ARG A 86 2.643 12.998 -15.648 1.00 0.00 H new ATOM 0 HD2 ARG A 86 1.886 13.181 -18.245 1.00 0.00 H new ATOM 0 HD3 ARG A 86 3.358 12.255 -18.457 1.00 0.00 H new ATOM 0 HE ARG A 86 2.156 10.845 -16.462 1.00 0.00 H new ATOM 0 HH11 ARG A 86 0.945 12.157 -19.507 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -0.266 10.887 -19.707 1.00 0.00 H new ATOM 0 HH21 ARG A 86 0.599 9.216 -16.725 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -0.462 9.228 -18.138 1.00 0.00 H new ATOM 1308 N GLU A 87 4.096 17.594 -17.349 1.00 0.00 N ATOM 1309 CA GLU A 87 3.813 18.974 -17.724 1.00 0.00 C ATOM 1310 C GLU A 87 4.275 19.256 -19.151 1.00 0.00 C ATOM 1311 O GLU A 87 3.554 19.870 -19.937 1.00 0.00 O ATOM 1312 CB GLU A 87 4.499 19.939 -16.754 1.00 0.00 C ATOM 1313 CG GLU A 87 4.068 19.758 -15.308 1.00 0.00 C ATOM 1314 CD GLU A 87 2.872 20.616 -14.944 1.00 0.00 C ATOM 1315 OE1 GLU A 87 2.787 21.758 -15.440 1.00 0.00 O ATOM 1316 OE2 GLU A 87 2.020 20.143 -14.162 1.00 0.00 O ATOM 0 H GLU A 87 4.354 17.467 -16.370 1.00 0.00 H new ATOM 0 HA GLU A 87 2.735 19.124 -17.674 1.00 0.00 H new ATOM 0 HB2 GLU A 87 5.578 19.803 -16.822 1.00 0.00 H new ATOM 0 HB3 GLU A 87 4.286 20.963 -17.062 1.00 0.00 H new ATOM 0 HG2 GLU A 87 3.825 18.710 -15.134 1.00 0.00 H new ATOM 0 HG3 GLU A 87 4.902 20.005 -14.651 1.00 0.00 H new ATOM 1323 N ALA A 88 5.481 18.804 -19.476 1.00 0.00 N ATOM 1324 CA ALA A 88 6.039 19.006 -20.808 1.00 0.00 C ATOM 1325 C ALA A 88 5.316 18.148 -21.842 1.00 0.00 C ATOM 1326 O ALA A 88 5.004 18.612 -22.939 1.00 0.00 O ATOM 1327 CB ALA A 88 7.528 18.694 -20.809 1.00 0.00 C ATOM 0 H ALA A 88 6.091 18.295 -18.836 1.00 0.00 H new ATOM 0 HA ALA A 88 5.898 20.052 -21.080 1.00 0.00 H new ATOM 0 HB1 ALA A 88 7.932 18.849 -21.810 1.00 0.00 H new ATOM 0 HB2 ALA A 88 8.038 19.352 -20.106 1.00 0.00 H new ATOM 0 HB3 ALA A 88 7.683 17.657 -20.512 1.00 0.00 H new ATOM 1333 N PHE A 89 5.053 16.896 -21.485 1.00 0.00 N ATOM 1334 CA PHE A 89 4.368 15.973 -22.383 1.00 0.00 C ATOM 1335 C PHE A 89 2.973 16.485 -22.729 1.00 0.00 C ATOM 1336 O PHE A 89 2.504 16.327 -23.856 1.00 0.00 O ATOM 1337 CB PHE A 89 4.270 14.585 -21.744 1.00 0.00 C ATOM 1338 CG PHE A 89 3.280 13.682 -22.422 1.00 0.00 C ATOM 1339 CD1 PHE A 89 3.651 12.928 -23.524 1.00 0.00 C ATOM 1340 CD2 PHE A 89 1.978 13.588 -21.958 1.00 0.00 C ATOM 1341 CE1 PHE A 89 2.742 12.097 -24.150 1.00 0.00 C ATOM 1342 CE2 PHE A 89 1.064 12.758 -22.580 1.00 0.00 C ATOM 1343 CZ PHE A 89 1.447 12.011 -23.677 1.00 0.00 C ATOM 0 H PHE A 89 5.304 16.497 -20.580 1.00 0.00 H new ATOM 0 HA PHE A 89 4.948 15.902 -23.303 1.00 0.00 H new ATOM 0 HB2 PHE A 89 5.253 14.114 -21.765 1.00 0.00 H new ATOM 0 HB3 PHE A 89 3.991 14.695 -20.696 1.00 0.00 H new ATOM 0 HD1 PHE A 89 4.662 12.991 -23.898 1.00 0.00 H new ATOM 0 HD2 PHE A 89 1.674 14.170 -21.101 1.00 0.00 H new ATOM 0 HE1 PHE A 89 3.044 11.515 -25.008 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.052 12.694 -22.209 1.00 0.00 H new ATOM 0 HZ PHE A 89 0.735 11.361 -24.164 1.00 0.00 H new ATOM 1353 N ARG A 90 2.316 17.100 -21.751 1.00 0.00 N ATOM 1354 CA ARG A 90 0.974 17.634 -21.951 1.00 0.00 C ATOM 1355 C ARG A 90 0.990 18.782 -22.957 1.00 0.00 C ATOM 1356 O ARG A 90 0.190 18.813 -23.892 1.00 0.00 O ATOM 1357 CB ARG A 90 0.390 18.115 -20.621 1.00 0.00 C ATOM 1358 CG ARG A 90 0.150 16.997 -19.621 1.00 0.00 C ATOM 1359 CD ARG A 90 -0.172 17.544 -18.239 1.00 0.00 C ATOM 1360 NE ARG A 90 -0.403 16.478 -17.268 1.00 0.00 N ATOM 1361 CZ ARG A 90 -0.323 16.651 -15.954 1.00 0.00 C ATOM 1362 NH1 ARG A 90 -0.021 17.842 -15.456 1.00 0.00 N ATOM 1363 NH2 ARG A 90 -0.547 15.632 -15.134 1.00 0.00 N ATOM 0 H ARG A 90 2.691 17.241 -20.813 1.00 0.00 H new ATOM 0 HA ARG A 90 0.347 16.835 -22.347 1.00 0.00 H new ATOM 0 HB2 ARG A 90 1.067 18.846 -20.180 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -0.552 18.628 -20.812 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -0.672 16.370 -19.966 1.00 0.00 H new ATOM 0 HG3 ARG A 90 1.034 16.362 -19.565 1.00 0.00 H new ATOM 0 HD2 ARG A 90 0.650 18.173 -17.898 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -1.056 18.179 -18.297 1.00 0.00 H new ATOM 0 HE ARG A 90 -0.639 15.550 -17.618 1.00 0.00 H new ATOM 0 HH11 ARG A 90 0.151 18.628 -16.083 1.00 0.00 H new ATOM 0 HH12 ARG A 90 0.040 17.972 -14.446 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -0.781 14.714 -15.513 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -0.485 15.766 -14.125 1.00 0.00 H new ATOM 1377 N VAL A 91 1.907 19.724 -22.757 1.00 0.00 N ATOM 1378 CA VAL A 91 2.028 20.873 -23.647 1.00 0.00 C ATOM 1379 C VAL A 91 2.131 20.432 -25.102 1.00 0.00 C ATOM 1380 O VAL A 91 1.455 20.975 -25.976 1.00 0.00 O ATOM 1381 CB VAL A 91 3.257 21.730 -23.292 1.00 0.00 C ATOM 1382 CG1 VAL A 91 3.391 22.897 -24.258 1.00 0.00 C ATOM 1383 CG2 VAL A 91 3.166 22.223 -21.856 1.00 0.00 C ATOM 0 H VAL A 91 2.576 19.714 -21.987 1.00 0.00 H new ATOM 0 HA VAL A 91 1.127 21.472 -23.516 1.00 0.00 H new ATOM 0 HB VAL A 91 4.149 21.110 -23.383 1.00 0.00 H new ATOM 0 HG11 VAL A 91 4.265 23.491 -23.991 1.00 0.00 H new ATOM 0 HG12 VAL A 91 3.506 22.518 -25.273 1.00 0.00 H new ATOM 0 HG13 VAL A 91 2.498 23.520 -24.202 1.00 0.00 H new ATOM 0 HG21 VAL A 91 4.043 22.827 -21.622 1.00 0.00 H new ATOM 0 HG22 VAL A 91 2.267 22.827 -21.735 1.00 0.00 H new ATOM 0 HG23 VAL A 91 3.123 21.369 -21.180 1.00 0.00 H new ATOM 1393 N PHE A 92 2.983 19.445 -25.357 1.00 0.00 N ATOM 1394 CA PHE A 92 3.177 18.931 -26.708 1.00 0.00 C ATOM 1395 C PHE A 92 1.915 18.235 -27.211 1.00 0.00 C ATOM 1396 O PHE A 92 1.392 18.568 -28.275 1.00 0.00 O ATOM 1397 CB PHE A 92 4.357 17.958 -26.742 1.00 0.00 C ATOM 1398 CG PHE A 92 5.696 18.639 -26.710 1.00 0.00 C ATOM 1399 CD1 PHE A 92 6.052 19.542 -27.698 1.00 0.00 C ATOM 1400 CD2 PHE A 92 6.598 18.374 -25.692 1.00 0.00 C ATOM 1401 CE1 PHE A 92 7.283 20.171 -27.672 1.00 0.00 C ATOM 1402 CE2 PHE A 92 7.830 19.000 -25.660 1.00 0.00 C ATOM 1403 CZ PHE A 92 8.173 19.898 -26.652 1.00 0.00 C ATOM 0 H PHE A 92 3.551 18.985 -24.645 1.00 0.00 H new ATOM 0 HA PHE A 92 3.392 19.775 -27.364 1.00 0.00 H new ATOM 0 HB2 PHE A 92 4.283 17.279 -25.892 1.00 0.00 H new ATOM 0 HB3 PHE A 92 4.289 17.349 -27.643 1.00 0.00 H new ATOM 0 HD1 PHE A 92 5.360 19.757 -28.498 1.00 0.00 H new ATOM 0 HD2 PHE A 92 6.336 17.671 -24.915 1.00 0.00 H new ATOM 0 HE1 PHE A 92 7.548 20.874 -28.448 1.00 0.00 H new ATOM 0 HE2 PHE A 92 8.524 18.787 -24.860 1.00 0.00 H new ATOM 0 HZ PHE A 92 9.136 20.386 -26.630 1.00 0.00 H new ATOM 1413 N ASP A 93 1.433 17.268 -26.439 1.00 0.00 N ATOM 1414 CA ASP A 93 0.232 16.525 -26.805 1.00 0.00 C ATOM 1415 C ASP A 93 -0.957 17.464 -26.977 1.00 0.00 C ATOM 1416 O ASP A 93 -1.412 18.090 -26.019 1.00 0.00 O ATOM 1417 CB ASP A 93 -0.084 15.470 -25.743 1.00 0.00 C ATOM 1418 CG ASP A 93 -0.838 14.284 -26.311 1.00 0.00 C ATOM 1419 OD1 ASP A 93 -1.435 14.427 -27.398 1.00 0.00 O ATOM 1420 OD2 ASP A 93 -0.831 13.213 -25.668 1.00 0.00 O ATOM 0 H ASP A 93 1.855 16.980 -25.556 1.00 0.00 H new ATOM 0 HA ASP A 93 0.418 16.027 -27.757 1.00 0.00 H new ATOM 0 HB2 ASP A 93 0.846 15.123 -25.292 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -0.674 15.925 -24.948 1.00 0.00 H new ATOM 1425 N LYS A 94 -1.457 17.559 -28.204 1.00 0.00 N ATOM 1426 CA LYS A 94 -2.593 18.422 -28.504 1.00 0.00 C ATOM 1427 C LYS A 94 -3.909 17.677 -28.302 1.00 0.00 C ATOM 1428 O LYS A 94 -4.722 18.052 -27.457 1.00 0.00 O ATOM 1429 CB LYS A 94 -2.503 18.939 -29.941 1.00 0.00 C ATOM 1430 CG LYS A 94 -1.452 20.018 -30.134 1.00 0.00 C ATOM 1431 CD LYS A 94 -1.607 20.714 -31.476 1.00 0.00 C ATOM 1432 CE LYS A 94 -0.735 21.957 -31.564 1.00 0.00 C ATOM 1433 NZ LYS A 94 -1.439 23.165 -31.053 1.00 0.00 N ATOM 0 H LYS A 94 -1.093 17.048 -29.008 1.00 0.00 H new ATOM 0 HA LYS A 94 -2.565 19.269 -27.818 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -2.281 18.104 -30.605 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -3.475 19.333 -30.238 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -1.531 20.751 -29.332 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -0.458 19.576 -30.065 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.341 20.025 -32.277 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -2.651 20.989 -31.626 1.00 0.00 H new ATOM 0 HE2 LYS A 94 0.180 21.800 -30.992 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -0.439 22.120 -32.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -1.462 23.893 -31.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -2.412 22.913 -30.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -0.936 23.534 -30.221 1.00 0.00 H new ATOM 1447 N ASP A 95 -4.112 16.621 -29.082 1.00 0.00 N ATOM 1448 CA ASP A 95 -5.328 15.822 -28.987 1.00 0.00 C ATOM 1449 C ASP A 95 -5.519 15.289 -27.570 1.00 0.00 C ATOM 1450 O ASP A 95 -6.632 15.277 -27.046 1.00 0.00 O ATOM 1451 CB ASP A 95 -5.279 14.660 -29.980 1.00 0.00 C ATOM 1452 CG ASP A 95 -4.131 13.709 -29.703 1.00 0.00 C ATOM 1453 OD1 ASP A 95 -3.109 14.161 -29.145 1.00 0.00 O ATOM 1454 OD2 ASP A 95 -4.254 12.514 -30.044 1.00 0.00 O ATOM 0 H ASP A 95 -3.450 16.298 -29.787 1.00 0.00 H new ATOM 0 HA ASP A 95 -6.175 16.463 -29.232 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -6.220 14.111 -29.939 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -5.184 15.054 -30.992 1.00 0.00 H new ATOM 1459 N GLY A 96 -4.425 14.849 -26.956 1.00 0.00 N ATOM 1460 CA GLY A 96 -4.493 14.320 -25.607 1.00 0.00 C ATOM 1461 C GLY A 96 -4.820 12.840 -25.580 1.00 0.00 C ATOM 1462 O GLY A 96 -5.620 12.389 -24.762 1.00 0.00 O ATOM 0 H GLY A 96 -3.492 14.850 -27.369 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -3.540 14.487 -25.106 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -5.249 14.866 -25.044 1.00 0.00 H new ATOM 1466 N ASN A 97 -4.200 12.082 -26.479 1.00 0.00 N ATOM 1467 CA ASN A 97 -4.431 10.644 -26.557 1.00 0.00 C ATOM 1468 C ASN A 97 -3.271 9.872 -25.937 1.00 0.00 C ATOM 1469 O ASN A 97 -3.475 8.914 -25.193 1.00 0.00 O ATOM 1470 CB ASN A 97 -4.624 10.216 -28.013 1.00 0.00 C ATOM 1471 CG ASN A 97 -3.324 10.224 -28.795 1.00 0.00 C ATOM 1472 OD1 ASN A 97 -2.598 11.218 -28.802 1.00 0.00 O ATOM 1473 ND2 ASN A 97 -3.025 9.113 -29.458 1.00 0.00 N ATOM 0 H ASN A 97 -3.534 12.440 -27.164 1.00 0.00 H new ATOM 0 HA ASN A 97 -5.337 10.416 -25.995 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -5.055 9.215 -28.041 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -5.338 10.884 -28.494 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -2.164 9.060 -30.002 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -3.657 8.313 -29.424 1.00 0.00 H new ATOM 1480 N GLY A 98 -2.050 10.298 -26.249 1.00 0.00 N ATOM 1481 CA GLY A 98 -0.874 9.637 -25.714 1.00 0.00 C ATOM 1482 C GLY A 98 0.352 9.845 -26.579 1.00 0.00 C ATOM 1483 O GLY A 98 1.434 10.144 -26.073 1.00 0.00 O ATOM 0 H GLY A 98 -1.855 11.089 -26.863 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -0.675 10.013 -24.710 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.072 8.569 -25.621 1.00 0.00 H new ATOM 1487 N TYR A 99 0.186 9.686 -27.888 1.00 0.00 N ATOM 1488 CA TYR A 99 1.289 9.855 -28.825 1.00 0.00 C ATOM 1489 C TYR A 99 1.336 11.282 -29.360 1.00 0.00 C ATOM 1490 O TYR A 99 0.300 11.915 -29.564 1.00 0.00 O ATOM 1491 CB TYR A 99 1.156 8.867 -29.985 1.00 0.00 C ATOM 1492 CG TYR A 99 1.361 7.425 -29.580 1.00 0.00 C ATOM 1493 CD1 TYR A 99 0.559 6.834 -28.612 1.00 0.00 C ATOM 1494 CD2 TYR A 99 2.357 6.653 -30.166 1.00 0.00 C ATOM 1495 CE1 TYR A 99 0.744 5.517 -28.238 1.00 0.00 C ATOM 1496 CE2 TYR A 99 2.548 5.335 -29.799 1.00 0.00 C ATOM 1497 CZ TYR A 99 1.739 4.772 -28.835 1.00 0.00 C ATOM 1498 OH TYR A 99 1.925 3.459 -28.466 1.00 0.00 O ATOM 0 H TYR A 99 -0.703 9.440 -28.324 1.00 0.00 H new ATOM 0 HA TYR A 99 2.219 9.656 -28.292 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.167 8.973 -30.430 1.00 0.00 H new ATOM 0 HB3 TYR A 99 1.882 9.126 -30.756 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.223 7.414 -28.144 1.00 0.00 H new ATOM 0 HD2 TYR A 99 2.993 7.091 -30.921 1.00 0.00 H new ATOM 0 HE1 TYR A 99 0.113 5.073 -27.482 1.00 0.00 H new ATOM 0 HE2 TYR A 99 3.327 4.749 -30.265 1.00 0.00 H new ATOM 0 HH TYR A 99 2.665 3.076 -28.982 1.00 0.00 H new ATOM 1508 N ILE A 100 2.546 11.783 -29.586 1.00 0.00 N ATOM 1509 CA ILE A 100 2.729 13.135 -30.099 1.00 0.00 C ATOM 1510 C ILE A 100 3.225 13.113 -31.541 1.00 0.00 C ATOM 1511 O ILE A 100 4.384 12.793 -31.805 1.00 0.00 O ATOM 1512 CB ILE A 100 3.725 13.935 -29.238 1.00 0.00 C ATOM 1513 CG1 ILE A 100 3.255 13.975 -27.782 1.00 0.00 C ATOM 1514 CG2 ILE A 100 3.888 15.344 -29.787 1.00 0.00 C ATOM 1515 CD1 ILE A 100 4.328 14.420 -26.813 1.00 0.00 C ATOM 0 H ILE A 100 3.414 11.273 -29.422 1.00 0.00 H new ATOM 0 HA ILE A 100 1.755 13.622 -30.059 1.00 0.00 H new ATOM 0 HB ILE A 100 4.695 13.439 -29.274 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.402 14.649 -27.702 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.905 12.984 -27.494 1.00 0.00 H new ATOM 0 HG21 ILE A 100 4.595 15.896 -29.168 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.263 15.295 -30.809 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.924 15.852 -29.778 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.925 14.425 -25.800 1.00 0.00 H new ATOM 0 HD12 ILE A 100 5.172 13.732 -26.864 1.00 0.00 H new ATOM 0 HD13 ILE A 100 4.661 15.424 -27.075 1.00 0.00 H new ATOM 1527 N SER A 101 2.340 13.458 -32.471 1.00 0.00 N ATOM 1528 CA SER A 101 2.687 13.477 -33.887 1.00 0.00 C ATOM 1529 C SER A 101 3.656 14.615 -34.194 1.00 0.00 C ATOM 1530 O SER A 101 3.813 15.542 -33.401 1.00 0.00 O ATOM 1531 CB SER A 101 1.426 13.621 -34.741 1.00 0.00 C ATOM 1532 OG SER A 101 0.766 14.846 -34.473 1.00 0.00 O ATOM 0 H SER A 101 1.377 13.728 -32.269 1.00 0.00 H new ATOM 0 HA SER A 101 3.175 12.533 -34.129 1.00 0.00 H new ATOM 0 HB2 SER A 101 1.691 13.570 -35.797 1.00 0.00 H new ATOM 0 HB3 SER A 101 0.751 12.789 -34.541 1.00 0.00 H new ATOM 0 HG SER A 101 -0.036 14.915 -35.032 1.00 0.00 H new ATOM 1538 N ALA A 102 4.305 14.535 -35.352 1.00 0.00 N ATOM 1539 CA ALA A 102 5.257 15.558 -35.766 1.00 0.00 C ATOM 1540 C ALA A 102 4.611 16.939 -35.769 1.00 0.00 C ATOM 1541 O ALA A 102 5.165 17.894 -35.224 1.00 0.00 O ATOM 1542 CB ALA A 102 5.817 15.231 -37.142 1.00 0.00 C ATOM 0 H ALA A 102 4.188 13.772 -36.019 1.00 0.00 H new ATOM 0 HA ALA A 102 6.076 15.571 -35.047 1.00 0.00 H new ATOM 0 HB1 ALA A 102 6.527 16.003 -37.439 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.323 14.266 -37.109 1.00 0.00 H new ATOM 0 HB3 ALA A 102 5.003 15.189 -37.866 1.00 0.00 H new ATOM 1548 N ALA A 103 3.439 17.038 -36.387 1.00 0.00 N ATOM 1549 CA ALA A 103 2.718 18.303 -36.459 1.00 0.00 C ATOM 1550 C ALA A 103 2.415 18.843 -35.066 1.00 0.00 C ATOM 1551 O ALA A 103 2.635 20.022 -34.786 1.00 0.00 O ATOM 1552 CB ALA A 103 1.431 18.132 -37.252 1.00 0.00 C ATOM 0 H ALA A 103 2.968 16.258 -36.845 1.00 0.00 H new ATOM 0 HA ALA A 103 3.354 19.026 -36.970 1.00 0.00 H new ATOM 0 HB1 ALA A 103 0.903 19.084 -37.298 1.00 0.00 H new ATOM 0 HB2 ALA A 103 1.668 17.799 -38.263 1.00 0.00 H new ATOM 0 HB3 ALA A 103 0.799 17.390 -36.764 1.00 0.00 H new ATOM 1558 N GLU A 104 1.910 17.974 -34.196 1.00 0.00 N ATOM 1559 CA GLU A 104 1.576 18.367 -32.831 1.00 0.00 C ATOM 1560 C GLU A 104 2.709 19.176 -32.205 1.00 0.00 C ATOM 1561 O GLU A 104 2.509 20.309 -31.767 1.00 0.00 O ATOM 1562 CB GLU A 104 1.286 17.130 -31.978 1.00 0.00 C ATOM 1563 CG GLU A 104 -0.150 16.645 -32.079 1.00 0.00 C ATOM 1564 CD GLU A 104 -0.430 15.460 -31.175 1.00 0.00 C ATOM 1565 OE1 GLU A 104 0.202 15.371 -30.101 1.00 0.00 O ATOM 1566 OE2 GLU A 104 -1.281 14.622 -31.540 1.00 0.00 O ATOM 0 H GLU A 104 1.723 16.995 -34.411 1.00 0.00 H new ATOM 0 HA GLU A 104 0.684 18.992 -32.868 1.00 0.00 H new ATOM 0 HB2 GLU A 104 1.955 16.325 -32.281 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.512 17.356 -30.936 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -0.824 17.462 -31.821 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -0.365 16.369 -33.111 1.00 0.00 H new ATOM 1573 N LEU A 105 3.898 18.585 -32.166 1.00 0.00 N ATOM 1574 CA LEU A 105 5.064 19.249 -31.594 1.00 0.00 C ATOM 1575 C LEU A 105 5.515 20.411 -32.473 1.00 0.00 C ATOM 1576 O LEU A 105 5.854 21.485 -31.974 1.00 0.00 O ATOM 1577 CB LEU A 105 6.210 18.251 -31.420 1.00 0.00 C ATOM 1578 CG LEU A 105 7.537 18.832 -30.931 1.00 0.00 C ATOM 1579 CD1 LEU A 105 8.294 17.809 -30.099 1.00 0.00 C ATOM 1580 CD2 LEU A 105 8.383 19.294 -32.109 1.00 0.00 C ATOM 0 H LEU A 105 4.080 17.647 -32.524 1.00 0.00 H new ATOM 0 HA LEU A 105 4.783 19.644 -30.618 1.00 0.00 H new ATOM 0 HB2 LEU A 105 5.892 17.482 -30.716 1.00 0.00 H new ATOM 0 HB3 LEU A 105 6.383 17.757 -32.376 1.00 0.00 H new ATOM 0 HG LEU A 105 7.323 19.695 -30.301 1.00 0.00 H new ATOM 0 HD11 LEU A 105 9.236 18.241 -29.760 1.00 0.00 H new ATOM 0 HD12 LEU A 105 7.693 17.526 -29.235 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.497 16.926 -30.705 1.00 0.00 H new ATOM 0 HD21 LEU A 105 9.324 19.705 -31.742 1.00 0.00 H new ATOM 0 HD22 LEU A 105 8.588 18.447 -32.764 1.00 0.00 H new ATOM 0 HD23 LEU A 105 7.844 20.061 -32.665 1.00 0.00 H new ATOM 1592 N ARG A 106 5.515 20.190 -33.783 1.00 0.00 N ATOM 1593 CA ARG A 106 5.924 21.218 -34.732 1.00 0.00 C ATOM 1594 C ARG A 106 5.268 22.556 -34.400 1.00 0.00 C ATOM 1595 O ARG A 106 5.943 23.579 -34.288 1.00 0.00 O ATOM 1596 CB ARG A 106 5.560 20.800 -36.158 1.00 0.00 C ATOM 1597 CG ARG A 106 6.143 21.710 -37.227 1.00 0.00 C ATOM 1598 CD ARG A 106 5.914 21.149 -38.622 1.00 0.00 C ATOM 1599 NE ARG A 106 6.525 19.833 -38.789 1.00 0.00 N ATOM 1600 CZ ARG A 106 5.931 18.822 -39.413 1.00 0.00 C ATOM 1601 NH1 ARG A 106 4.718 18.975 -39.926 1.00 0.00 N ATOM 1602 NH2 ARG A 106 6.551 17.654 -39.525 1.00 0.00 N ATOM 0 H ARG A 106 5.236 19.308 -34.212 1.00 0.00 H new ATOM 0 HA ARG A 106 7.005 21.334 -34.660 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.909 19.782 -36.330 1.00 0.00 H new ATOM 0 HB3 ARG A 106 4.475 20.786 -36.258 1.00 0.00 H new ATOM 0 HG2 ARG A 106 5.689 22.698 -37.152 1.00 0.00 H new ATOM 0 HG3 ARG A 106 7.212 21.836 -37.055 1.00 0.00 H new ATOM 0 HD2 ARG A 106 4.843 21.079 -38.813 1.00 0.00 H new ATOM 0 HD3 ARG A 106 6.325 21.836 -39.361 1.00 0.00 H new ATOM 0 HE ARG A 106 7.458 19.682 -38.406 1.00 0.00 H new ATOM 0 HH11 ARG A 106 4.238 19.871 -39.842 1.00 0.00 H new ATOM 0 HH12 ARG A 106 4.265 18.197 -40.405 1.00 0.00 H new ATOM 0 HH21 ARG A 106 7.484 17.532 -39.132 1.00 0.00 H new ATOM 0 HH22 ARG A 106 6.094 16.878 -40.004 1.00 0.00 H new ATOM 1616 N HIS A 107 3.948 22.539 -34.244 1.00 0.00 N ATOM 1617 CA HIS A 107 3.201 23.750 -33.924 1.00 0.00 C ATOM 1618 C HIS A 107 3.714 24.381 -32.633 1.00 0.00 C ATOM 1619 O HIS A 107 3.991 25.579 -32.582 1.00 0.00 O ATOM 1620 CB HIS A 107 1.710 23.436 -33.795 1.00 0.00 C ATOM 1621 CG HIS A 107 0.971 24.393 -32.911 1.00 0.00 C ATOM 1622 ND1 HIS A 107 0.188 25.417 -33.399 1.00 0.00 N ATOM 1623 CD2 HIS A 107 0.897 24.475 -31.562 1.00 0.00 C ATOM 1624 CE1 HIS A 107 -0.334 26.090 -32.389 1.00 0.00 C ATOM 1625 NE2 HIS A 107 0.081 25.538 -31.263 1.00 0.00 N ATOM 0 H HIS A 107 3.374 21.701 -34.334 1.00 0.00 H new ATOM 0 HA HIS A 107 3.346 24.461 -34.737 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.258 23.447 -34.787 1.00 0.00 H new ATOM 0 HB3 HIS A 107 1.592 22.426 -33.402 1.00 0.00 H new ATOM 0 HD2 HIS A 107 1.388 23.825 -30.853 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -0.988 26.945 -32.470 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -0.165 25.851 -30.324 1.00 0.00 H new ATOM 1634 N VAL A 108 3.837 23.565 -31.590 1.00 0.00 N ATOM 1635 CA VAL A 108 4.317 24.042 -30.299 1.00 0.00 C ATOM 1636 C VAL A 108 5.625 24.812 -30.449 1.00 0.00 C ATOM 1637 O VAL A 108 5.759 25.930 -29.953 1.00 0.00 O ATOM 1638 CB VAL A 108 4.530 22.878 -29.314 1.00 0.00 C ATOM 1639 CG1 VAL A 108 5.100 23.388 -27.999 1.00 0.00 C ATOM 1640 CG2 VAL A 108 3.226 22.129 -29.085 1.00 0.00 C ATOM 0 H VAL A 108 3.611 22.571 -31.615 1.00 0.00 H new ATOM 0 HA VAL A 108 3.550 24.708 -29.903 1.00 0.00 H new ATOM 0 HB VAL A 108 5.249 22.184 -29.749 1.00 0.00 H new ATOM 0 HG11 VAL A 108 5.244 22.551 -27.316 1.00 0.00 H new ATOM 0 HG12 VAL A 108 6.058 23.875 -28.182 1.00 0.00 H new ATOM 0 HG13 VAL A 108 4.408 24.104 -27.556 1.00 0.00 H new ATOM 0 HG21 VAL A 108 3.395 21.310 -28.386 1.00 0.00 H new ATOM 0 HG22 VAL A 108 2.483 22.811 -28.672 1.00 0.00 H new ATOM 0 HG23 VAL A 108 2.865 21.729 -30.033 1.00 0.00 H new ATOM 1650 N MET A 109 6.586 24.206 -31.138 1.00 0.00 N ATOM 1651 CA MET A 109 7.883 24.836 -31.355 1.00 0.00 C ATOM 1652 C MET A 109 7.718 26.227 -31.958 1.00 0.00 C ATOM 1653 O MET A 109 8.185 27.218 -31.396 1.00 0.00 O ATOM 1654 CB MET A 109 8.748 23.969 -32.272 1.00 0.00 C ATOM 1655 CG MET A 109 8.923 22.544 -31.774 1.00 0.00 C ATOM 1656 SD MET A 109 10.169 22.409 -30.478 1.00 0.00 S ATOM 1657 CE MET A 109 9.163 22.641 -29.015 1.00 0.00 C ATOM 0 H MET A 109 6.491 23.280 -31.555 1.00 0.00 H new ATOM 0 HA MET A 109 8.377 24.935 -30.388 1.00 0.00 H new ATOM 0 HB2 MET A 109 8.300 23.945 -33.265 1.00 0.00 H new ATOM 0 HB3 MET A 109 9.729 24.432 -32.376 1.00 0.00 H new ATOM 0 HG2 MET A 109 7.969 22.176 -31.395 1.00 0.00 H new ATOM 0 HG3 MET A 109 9.203 21.903 -32.610 1.00 0.00 H new ATOM 0 HE1 MET A 109 9.276 23.663 -28.654 1.00 0.00 H new ATOM 0 HE2 MET A 109 8.117 22.456 -29.260 1.00 0.00 H new ATOM 0 HE3 MET A 109 9.483 21.945 -28.240 1.00 0.00 H new ATOM 1667 N THR A 110 7.051 26.294 -33.106 1.00 0.00 N ATOM 1668 CA THR A 110 6.826 27.564 -33.786 1.00 0.00 C ATOM 1669 C THR A 110 6.405 28.648 -32.800 1.00 0.00 C ATOM 1670 O THR A 110 7.026 29.708 -32.727 1.00 0.00 O ATOM 1671 CB THR A 110 5.748 27.432 -34.878 1.00 0.00 C ATOM 1672 OG1 THR A 110 6.150 26.459 -35.849 1.00 0.00 O ATOM 1673 CG2 THR A 110 5.506 28.769 -35.563 1.00 0.00 C ATOM 0 H THR A 110 6.657 25.484 -33.584 1.00 0.00 H new ATOM 0 HA THR A 110 7.771 27.847 -34.251 1.00 0.00 H new ATOM 0 HB THR A 110 4.820 27.110 -34.405 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.024 25.559 -35.482 1.00 0.00 H new ATOM 0 HG21 THR A 110 4.741 28.651 -36.330 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.172 29.500 -34.827 1.00 0.00 H new ATOM 0 HG23 THR A 110 6.432 29.115 -36.023 1.00 0.00 H new ATOM 1681 N ASN A 111 5.347 28.375 -32.044 1.00 0.00 N ATOM 1682 CA ASN A 111 4.844 29.329 -31.062 1.00 0.00 C ATOM 1683 C ASN A 111 5.993 30.026 -30.341 1.00 0.00 C ATOM 1684 O ASN A 111 5.982 31.245 -30.164 1.00 0.00 O ATOM 1685 CB ASN A 111 3.945 28.620 -30.046 1.00 0.00 C ATOM 1686 CG ASN A 111 2.511 28.503 -30.526 1.00 0.00 C ATOM 1687 OD1 ASN A 111 2.219 28.716 -31.702 1.00 0.00 O ATOM 1688 ND2 ASN A 111 1.608 28.162 -29.613 1.00 0.00 N ATOM 0 H ASN A 111 4.822 27.502 -32.092 1.00 0.00 H new ATOM 0 HA ASN A 111 4.261 30.083 -31.591 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.341 27.624 -29.847 1.00 0.00 H new ATOM 0 HB3 ASN A 111 3.966 29.166 -29.103 1.00 0.00 H new ATOM 0 HD21 ASN A 111 0.627 28.067 -29.876 1.00 0.00 H new ATOM 0 HD22 ASN A 111 1.896 27.995 -28.649 1.00 0.00 H new ATOM 1695 N LEU A 112 6.985 29.245 -29.927 1.00 0.00 N ATOM 1696 CA LEU A 112 8.144 29.786 -29.226 1.00 0.00 C ATOM 1697 C LEU A 112 8.556 31.132 -29.813 1.00 0.00 C ATOM 1698 O LEU A 112 8.868 32.071 -29.081 1.00 0.00 O ATOM 1699 CB LEU A 112 9.315 28.804 -29.301 1.00 0.00 C ATOM 1700 CG LEU A 112 9.096 27.446 -28.633 1.00 0.00 C ATOM 1701 CD1 LEU A 112 10.247 26.504 -28.951 1.00 0.00 C ATOM 1702 CD2 LEU A 112 8.938 27.611 -27.129 1.00 0.00 C ATOM 0 H LEU A 112 7.010 28.235 -30.065 1.00 0.00 H new ATOM 0 HA LEU A 112 7.869 29.935 -28.182 1.00 0.00 H new ATOM 0 HB2 LEU A 112 9.555 28.636 -30.351 1.00 0.00 H new ATOM 0 HB3 LEU A 112 10.187 29.274 -28.846 1.00 0.00 H new ATOM 0 HG LEU A 112 8.178 27.011 -29.028 1.00 0.00 H new ATOM 0 HD11 LEU A 112 10.074 25.542 -28.467 1.00 0.00 H new ATOM 0 HD12 LEU A 112 10.313 26.361 -30.030 1.00 0.00 H new ATOM 0 HD13 LEU A 112 11.180 26.932 -28.584 1.00 0.00 H new ATOM 0 HD21 LEU A 112 8.783 26.635 -26.670 1.00 0.00 H new ATOM 0 HD22 LEU A 112 9.838 28.067 -26.716 1.00 0.00 H new ATOM 0 HD23 LEU A 112 8.080 28.250 -26.921 1.00 0.00 H new ATOM 1714 N GLY A 113 8.552 31.220 -31.140 1.00 0.00 N ATOM 1715 CA GLY A 113 8.925 32.456 -31.803 1.00 0.00 C ATOM 1716 C GLY A 113 9.541 32.219 -33.167 1.00 0.00 C ATOM 1717 O GLY A 113 9.284 32.968 -34.109 1.00 0.00 O ATOM 0 H GLY A 113 8.297 30.457 -31.767 1.00 0.00 H new ATOM 0 HA2 GLY A 113 8.043 33.087 -31.911 1.00 0.00 H new ATOM 0 HA3 GLY A 113 9.633 33.001 -31.178 1.00 0.00 H new ATOM 1721 N GLU A 114 10.357 31.174 -33.273 1.00 0.00 N ATOM 1722 CA GLU A 114 11.013 30.843 -34.533 1.00 0.00 C ATOM 1723 C GLU A 114 10.050 30.127 -35.476 1.00 0.00 C ATOM 1724 O GLU A 114 8.941 29.759 -35.088 1.00 0.00 O ATOM 1725 CB GLU A 114 12.242 29.968 -34.279 1.00 0.00 C ATOM 1726 CG GLU A 114 13.260 30.604 -33.347 1.00 0.00 C ATOM 1727 CD GLU A 114 13.887 31.854 -33.935 1.00 0.00 C ATOM 1728 OE1 GLU A 114 13.918 31.975 -35.177 1.00 0.00 O ATOM 1729 OE2 GLU A 114 14.347 32.711 -33.151 1.00 0.00 O ATOM 0 H GLU A 114 10.579 30.543 -32.503 1.00 0.00 H new ATOM 0 HA GLU A 114 11.330 31.774 -35.004 1.00 0.00 H new ATOM 0 HB2 GLU A 114 11.919 29.017 -33.856 1.00 0.00 H new ATOM 0 HB3 GLU A 114 12.723 29.746 -35.232 1.00 0.00 H new ATOM 0 HG2 GLU A 114 12.776 30.854 -32.403 1.00 0.00 H new ATOM 0 HG3 GLU A 114 14.043 29.880 -33.122 1.00 0.00 H new ATOM 1736 N LYS A 115 10.482 29.931 -36.717 1.00 0.00 N ATOM 1737 CA LYS A 115 9.662 29.258 -37.716 1.00 0.00 C ATOM 1738 C LYS A 115 10.341 27.985 -38.210 1.00 0.00 C ATOM 1739 O LYS A 115 11.239 28.034 -39.053 1.00 0.00 O ATOM 1740 CB LYS A 115 9.389 30.194 -38.896 1.00 0.00 C ATOM 1741 CG LYS A 115 8.316 31.231 -38.615 1.00 0.00 C ATOM 1742 CD LYS A 115 8.345 32.356 -39.636 1.00 0.00 C ATOM 1743 CE LYS A 115 6.995 33.047 -39.743 1.00 0.00 C ATOM 1744 NZ LYS A 115 6.897 33.885 -40.970 1.00 0.00 N ATOM 0 H LYS A 115 11.397 30.229 -37.055 1.00 0.00 H new ATOM 0 HA LYS A 115 8.715 28.986 -37.249 1.00 0.00 H new ATOM 0 HB2 LYS A 115 10.314 30.704 -39.165 1.00 0.00 H new ATOM 0 HB3 LYS A 115 9.090 29.599 -39.759 1.00 0.00 H new ATOM 0 HG2 LYS A 115 7.336 30.754 -38.626 1.00 0.00 H new ATOM 0 HG3 LYS A 115 8.459 31.642 -37.616 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.106 33.084 -39.355 1.00 0.00 H new ATOM 0 HD3 LYS A 115 8.629 31.957 -40.610 1.00 0.00 H new ATOM 0 HE2 LYS A 115 6.203 32.298 -39.751 1.00 0.00 H new ATOM 0 HE3 LYS A 115 6.835 33.671 -38.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 5.962 34.339 -41.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 7.637 34.616 -40.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 7.024 33.286 -41.811 1.00 0.00 H new ATOM 1758 N LEU A 116 9.907 26.846 -37.683 1.00 0.00 N ATOM 1759 CA LEU A 116 10.472 25.558 -38.071 1.00 0.00 C ATOM 1760 C LEU A 116 9.656 24.921 -39.191 1.00 0.00 C ATOM 1761 O LEU A 116 8.628 25.456 -39.607 1.00 0.00 O ATOM 1762 CB LEU A 116 10.527 24.618 -36.866 1.00 0.00 C ATOM 1763 CG LEU A 116 11.353 25.103 -35.674 1.00 0.00 C ATOM 1764 CD1 LEU A 116 11.168 24.174 -34.484 1.00 0.00 C ATOM 1765 CD2 LEU A 116 12.823 25.204 -36.050 1.00 0.00 C ATOM 0 H LEU A 116 9.165 26.788 -36.985 1.00 0.00 H new ATOM 0 HA LEU A 116 11.485 25.729 -38.436 1.00 0.00 H new ATOM 0 HB2 LEU A 116 9.508 24.436 -36.526 1.00 0.00 H new ATOM 0 HB3 LEU A 116 10.929 23.660 -37.196 1.00 0.00 H new ATOM 0 HG LEU A 116 11.002 26.096 -35.392 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.763 24.535 -33.645 1.00 0.00 H new ATOM 0 HD12 LEU A 116 10.116 24.152 -34.200 1.00 0.00 H new ATOM 0 HD13 LEU A 116 11.492 23.169 -34.753 1.00 0.00 H new ATOM 0 HD21 LEU A 116 13.396 25.551 -35.190 1.00 0.00 H new ATOM 0 HD22 LEU A 116 13.188 24.224 -36.358 1.00 0.00 H new ATOM 0 HD23 LEU A 116 12.941 25.910 -36.872 1.00 0.00 H new ATOM 1777 N THR A 117 10.119 23.773 -39.675 1.00 0.00 N ATOM 1778 CA THR A 117 9.432 23.061 -40.746 1.00 0.00 C ATOM 1779 C THR A 117 9.563 21.552 -40.575 1.00 0.00 C ATOM 1780 O THR A 117 10.405 21.074 -39.815 1.00 0.00 O ATOM 1781 CB THR A 117 9.983 23.459 -42.128 1.00 0.00 C ATOM 1782 OG1 THR A 117 11.373 23.128 -42.216 1.00 0.00 O ATOM 1783 CG2 THR A 117 9.795 24.948 -42.377 1.00 0.00 C ATOM 0 H THR A 117 10.968 23.316 -39.342 1.00 0.00 H new ATOM 0 HA THR A 117 8.380 23.341 -40.688 1.00 0.00 H new ATOM 0 HB THR A 117 9.430 22.906 -42.887 1.00 0.00 H new ATOM 0 HG1 THR A 117 11.715 23.383 -43.098 1.00 0.00 H new ATOM 0 HG21 THR A 117 10.192 25.206 -43.359 1.00 0.00 H new ATOM 0 HG22 THR A 117 8.733 25.192 -42.339 1.00 0.00 H new ATOM 0 HG23 THR A 117 10.325 25.515 -41.612 1.00 0.00 H new ATOM 1791 N ASP A 118 8.724 20.807 -41.286 1.00 0.00 N ATOM 1792 CA ASP A 118 8.747 19.350 -41.215 1.00 0.00 C ATOM 1793 C ASP A 118 10.177 18.835 -41.085 1.00 0.00 C ATOM 1794 O ASP A 118 10.449 17.922 -40.306 1.00 0.00 O ATOM 1795 CB ASP A 118 8.085 18.747 -42.454 1.00 0.00 C ATOM 1796 CG ASP A 118 7.643 17.313 -42.235 1.00 0.00 C ATOM 1797 OD1 ASP A 118 8.398 16.551 -41.596 1.00 0.00 O ATOM 1798 OD2 ASP A 118 6.542 16.954 -42.701 1.00 0.00 O ATOM 0 H ASP A 118 8.020 21.187 -41.918 1.00 0.00 H new ATOM 0 HA ASP A 118 8.188 19.045 -40.330 1.00 0.00 H new ATOM 0 HB2 ASP A 118 7.222 19.352 -42.732 1.00 0.00 H new ATOM 0 HB3 ASP A 118 8.783 18.785 -43.290 1.00 0.00 H new ATOM 1803 N GLU A 119 11.086 19.426 -41.855 1.00 0.00 N ATOM 1804 CA GLU A 119 12.487 19.024 -41.826 1.00 0.00 C ATOM 1805 C GLU A 119 13.084 19.229 -40.437 1.00 0.00 C ATOM 1806 O GLU A 119 13.673 18.315 -39.862 1.00 0.00 O ATOM 1807 CB GLU A 119 13.289 19.817 -42.860 1.00 0.00 C ATOM 1808 CG GLU A 119 12.964 19.446 -44.298 1.00 0.00 C ATOM 1809 CD GLU A 119 13.158 17.968 -44.577 1.00 0.00 C ATOM 1810 OE1 GLU A 119 14.190 17.413 -44.146 1.00 0.00 O ATOM 1811 OE2 GLU A 119 12.276 17.368 -45.227 1.00 0.00 O ATOM 0 H GLU A 119 10.877 20.184 -42.505 1.00 0.00 H new ATOM 0 HA GLU A 119 12.539 17.963 -42.071 1.00 0.00 H new ATOM 0 HB2 GLU A 119 13.099 20.881 -42.716 1.00 0.00 H new ATOM 0 HB3 GLU A 119 14.353 19.656 -42.684 1.00 0.00 H new ATOM 0 HG2 GLU A 119 11.932 19.721 -44.516 1.00 0.00 H new ATOM 0 HG3 GLU A 119 13.597 20.025 -44.971 1.00 0.00 H new ATOM 1818 N GLU A 120 12.927 20.438 -39.905 1.00 0.00 N ATOM 1819 CA GLU A 120 13.452 20.764 -38.584 1.00 0.00 C ATOM 1820 C GLU A 120 12.988 19.744 -37.547 1.00 0.00 C ATOM 1821 O GLU A 120 13.797 19.178 -36.812 1.00 0.00 O ATOM 1822 CB GLU A 120 13.010 22.168 -38.168 1.00 0.00 C ATOM 1823 CG GLU A 120 13.464 23.258 -39.124 1.00 0.00 C ATOM 1824 CD GLU A 120 14.931 23.604 -38.959 1.00 0.00 C ATOM 1825 OE1 GLU A 120 15.778 22.878 -39.521 1.00 0.00 O ATOM 1826 OE2 GLU A 120 15.233 24.600 -38.269 1.00 0.00 O ATOM 0 H GLU A 120 12.441 21.206 -40.368 1.00 0.00 H new ATOM 0 HA GLU A 120 14.540 20.734 -38.636 1.00 0.00 H new ATOM 0 HB2 GLU A 120 11.923 22.191 -38.095 1.00 0.00 H new ATOM 0 HB3 GLU A 120 13.401 22.383 -37.173 1.00 0.00 H new ATOM 0 HG2 GLU A 120 13.284 22.935 -40.149 1.00 0.00 H new ATOM 0 HG3 GLU A 120 12.863 24.153 -38.961 1.00 0.00 H new ATOM 1833 N VAL A 121 11.680 19.516 -37.495 1.00 0.00 N ATOM 1834 CA VAL A 121 11.107 18.565 -36.550 1.00 0.00 C ATOM 1835 C VAL A 121 11.578 17.146 -36.844 1.00 0.00 C ATOM 1836 O VAL A 121 11.913 16.390 -35.932 1.00 0.00 O ATOM 1837 CB VAL A 121 9.567 18.601 -36.581 1.00 0.00 C ATOM 1838 CG1 VAL A 121 8.990 17.541 -35.656 1.00 0.00 C ATOM 1839 CG2 VAL A 121 9.059 19.984 -36.204 1.00 0.00 C ATOM 0 H VAL A 121 10.997 19.977 -38.096 1.00 0.00 H new ATOM 0 HA VAL A 121 11.450 18.859 -35.558 1.00 0.00 H new ATOM 0 HB VAL A 121 9.236 18.382 -37.596 1.00 0.00 H new ATOM 0 HG11 VAL A 121 7.901 17.581 -35.691 1.00 0.00 H new ATOM 0 HG12 VAL A 121 9.327 16.555 -35.977 1.00 0.00 H new ATOM 0 HG13 VAL A 121 9.327 17.725 -34.636 1.00 0.00 H new ATOM 0 HG21 VAL A 121 7.969 19.991 -36.231 1.00 0.00 H new ATOM 0 HG22 VAL A 121 9.399 20.235 -35.199 1.00 0.00 H new ATOM 0 HG23 VAL A 121 9.444 20.718 -36.911 1.00 0.00 H new ATOM 1849 N ASP A 122 11.601 16.790 -38.124 1.00 0.00 N ATOM 1850 CA ASP A 122 12.033 15.461 -38.541 1.00 0.00 C ATOM 1851 C ASP A 122 13.281 15.031 -37.777 1.00 0.00 C ATOM 1852 O ASP A 122 13.376 13.895 -37.313 1.00 0.00 O ATOM 1853 CB ASP A 122 12.307 15.438 -40.045 1.00 0.00 C ATOM 1854 CG ASP A 122 11.051 15.195 -40.859 1.00 0.00 C ATOM 1855 OD1 ASP A 122 10.307 14.247 -40.533 1.00 0.00 O ATOM 1856 OD2 ASP A 122 10.812 15.955 -41.821 1.00 0.00 O ATOM 0 H ASP A 122 11.325 17.404 -38.891 1.00 0.00 H new ATOM 0 HA ASP A 122 11.231 14.758 -38.316 1.00 0.00 H new ATOM 0 HB2 ASP A 122 12.753 16.386 -40.345 1.00 0.00 H new ATOM 0 HB3 ASP A 122 13.036 14.659 -40.267 1.00 0.00 H new ATOM 1861 N GLU A 123 14.237 15.947 -37.652 1.00 0.00 N ATOM 1862 CA GLU A 123 15.480 15.660 -36.946 1.00 0.00 C ATOM 1863 C GLU A 123 15.206 15.276 -35.495 1.00 0.00 C ATOM 1864 O GLU A 123 15.870 14.403 -34.937 1.00 0.00 O ATOM 1865 CB GLU A 123 16.412 16.873 -36.997 1.00 0.00 C ATOM 1866 CG GLU A 123 16.890 17.215 -38.398 1.00 0.00 C ATOM 1867 CD GLU A 123 17.709 18.491 -38.440 1.00 0.00 C ATOM 1868 OE1 GLU A 123 17.205 19.534 -37.974 1.00 0.00 O ATOM 1869 OE2 GLU A 123 18.853 18.446 -38.938 1.00 0.00 O ATOM 0 H GLU A 123 14.174 16.892 -38.030 1.00 0.00 H new ATOM 0 HA GLU A 123 15.963 14.818 -37.441 1.00 0.00 H new ATOM 0 HB2 GLU A 123 15.895 17.736 -36.578 1.00 0.00 H new ATOM 0 HB3 GLU A 123 17.278 16.682 -36.363 1.00 0.00 H new ATOM 0 HG2 GLU A 123 17.489 16.390 -38.785 1.00 0.00 H new ATOM 0 HG3 GLU A 123 16.028 17.319 -39.057 1.00 0.00 H new ATOM 1876 N MET A 124 14.224 15.936 -34.890 1.00 0.00 N ATOM 1877 CA MET A 124 13.862 15.664 -33.504 1.00 0.00 C ATOM 1878 C MET A 124 13.175 14.308 -33.378 1.00 0.00 C ATOM 1879 O MET A 124 13.575 13.472 -32.567 1.00 0.00 O ATOM 1880 CB MET A 124 12.944 16.765 -32.968 1.00 0.00 C ATOM 1881 CG MET A 124 12.313 16.431 -31.626 1.00 0.00 C ATOM 1882 SD MET A 124 11.920 17.900 -30.658 1.00 0.00 S ATOM 1883 CE MET A 124 11.349 17.158 -29.132 1.00 0.00 C ATOM 0 H MET A 124 13.665 16.662 -35.337 1.00 0.00 H new ATOM 0 HA MET A 124 14.778 15.645 -32.913 1.00 0.00 H new ATOM 0 HB2 MET A 124 13.515 17.688 -32.872 1.00 0.00 H new ATOM 0 HB3 MET A 124 12.154 16.954 -33.695 1.00 0.00 H new ATOM 0 HG2 MET A 124 11.402 15.855 -31.790 1.00 0.00 H new ATOM 0 HG3 MET A 124 12.993 15.797 -31.057 1.00 0.00 H new ATOM 0 HE1 MET A 124 10.904 17.925 -28.499 1.00 0.00 H new ATOM 0 HE2 MET A 124 10.604 16.394 -29.355 1.00 0.00 H new ATOM 0 HE3 MET A 124 12.191 16.702 -28.612 1.00 0.00 H new ATOM 1893 N ILE A 125 12.140 14.097 -34.184 1.00 0.00 N ATOM 1894 CA ILE A 125 11.399 12.841 -34.162 1.00 0.00 C ATOM 1895 C ILE A 125 12.340 11.646 -34.258 1.00 0.00 C ATOM 1896 O ILE A 125 12.107 10.608 -33.638 1.00 0.00 O ATOM 1897 CB ILE A 125 10.378 12.770 -35.313 1.00 0.00 C ATOM 1898 CG1 ILE A 125 9.370 13.916 -35.201 1.00 0.00 C ATOM 1899 CG2 ILE A 125 9.664 11.427 -35.306 1.00 0.00 C ATOM 1900 CD1 ILE A 125 8.429 13.780 -34.025 1.00 0.00 C ATOM 0 H ILE A 125 11.795 14.779 -34.860 1.00 0.00 H new ATOM 0 HA ILE A 125 10.866 12.805 -33.212 1.00 0.00 H new ATOM 0 HB ILE A 125 10.911 12.871 -36.258 1.00 0.00 H new ATOM 0 HG12 ILE A 125 9.911 14.858 -35.116 1.00 0.00 H new ATOM 0 HG13 ILE A 125 8.786 13.966 -36.120 1.00 0.00 H new ATOM 0 HG21 ILE A 125 8.946 11.392 -36.125 1.00 0.00 H new ATOM 0 HG22 ILE A 125 10.393 10.626 -35.429 1.00 0.00 H new ATOM 0 HG23 ILE A 125 9.140 11.298 -34.359 1.00 0.00 H new ATOM 0 HD11 ILE A 125 7.743 14.627 -34.008 1.00 0.00 H new ATOM 0 HD12 ILE A 125 7.861 12.855 -34.119 1.00 0.00 H new ATOM 0 HD13 ILE A 125 9.004 13.760 -33.099 1.00 0.00 H new ATOM 1912 N ARG A 126 13.406 11.799 -35.038 1.00 0.00 N ATOM 1913 CA ARG A 126 14.383 10.732 -35.214 1.00 0.00 C ATOM 1914 C ARG A 126 15.358 10.688 -34.041 1.00 0.00 C ATOM 1915 O ARG A 126 16.434 10.100 -34.138 1.00 0.00 O ATOM 1916 CB ARG A 126 15.152 10.927 -36.523 1.00 0.00 C ATOM 1917 CG ARG A 126 16.199 12.026 -36.456 1.00 0.00 C ATOM 1918 CD ARG A 126 17.270 11.840 -37.520 1.00 0.00 C ATOM 1919 NE ARG A 126 18.226 10.797 -37.158 1.00 0.00 N ATOM 1920 CZ ARG A 126 18.941 10.116 -38.046 1.00 0.00 C ATOM 1921 NH1 ARG A 126 18.809 10.367 -39.341 1.00 0.00 N ATOM 1922 NH2 ARG A 126 19.791 9.182 -37.639 1.00 0.00 N ATOM 0 H ARG A 126 13.614 12.652 -35.558 1.00 0.00 H new ATOM 0 HA ARG A 126 13.846 9.784 -35.253 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.638 9.989 -36.792 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.445 11.159 -37.319 1.00 0.00 H new ATOM 0 HG2 ARG A 126 15.719 12.996 -36.587 1.00 0.00 H new ATOM 0 HG3 ARG A 126 16.662 12.030 -35.469 1.00 0.00 H new ATOM 0 HD2 ARG A 126 16.798 11.585 -38.469 1.00 0.00 H new ATOM 0 HD3 ARG A 126 17.799 12.781 -37.670 1.00 0.00 H new ATOM 0 HE ARG A 126 18.351 10.580 -36.169 1.00 0.00 H new ATOM 0 HH11 ARG A 126 18.157 11.085 -39.658 1.00 0.00 H new ATOM 0 HH12 ARG A 126 19.359 9.842 -40.021 1.00 0.00 H new ATOM 0 HH21 ARG A 126 19.896 8.987 -36.643 1.00 0.00 H new ATOM 0 HH22 ARG A 126 20.340 8.659 -38.322 1.00 0.00 H new ATOM 1936 N GLU A 127 14.973 11.316 -32.934 1.00 0.00 N ATOM 1937 CA GLU A 127 15.814 11.349 -31.744 1.00 0.00 C ATOM 1938 C GLU A 127 15.107 10.694 -30.560 1.00 0.00 C ATOM 1939 O GLU A 127 15.735 10.021 -29.743 1.00 0.00 O ATOM 1940 CB GLU A 127 16.186 12.791 -31.395 1.00 0.00 C ATOM 1941 CG GLU A 127 17.425 12.906 -30.523 1.00 0.00 C ATOM 1942 CD GLU A 127 17.648 14.315 -30.009 1.00 0.00 C ATOM 1943 OE1 GLU A 127 16.702 14.896 -29.438 1.00 0.00 O ATOM 1944 OE2 GLU A 127 18.770 14.837 -30.179 1.00 0.00 O ATOM 0 H GLU A 127 14.085 11.808 -32.837 1.00 0.00 H new ATOM 0 HA GLU A 127 16.724 10.788 -31.958 1.00 0.00 H new ATOM 0 HB2 GLU A 127 16.348 13.349 -32.317 1.00 0.00 H new ATOM 0 HB3 GLU A 127 15.346 13.260 -30.882 1.00 0.00 H new ATOM 0 HG2 GLU A 127 17.334 12.225 -29.677 1.00 0.00 H new ATOM 0 HG3 GLU A 127 18.298 12.589 -31.094 1.00 0.00 H new ATOM 1951 N ALA A 128 13.796 10.898 -30.475 1.00 0.00 N ATOM 1952 CA ALA A 128 13.003 10.328 -29.393 1.00 0.00 C ATOM 1953 C ALA A 128 12.127 9.186 -29.897 1.00 0.00 C ATOM 1954 O ALA A 128 11.855 8.231 -29.169 1.00 0.00 O ATOM 1955 CB ALA A 128 12.148 11.404 -28.741 1.00 0.00 C ATOM 0 H ALA A 128 13.261 11.454 -31.143 1.00 0.00 H new ATOM 0 HA ALA A 128 13.688 9.924 -28.648 1.00 0.00 H new ATOM 0 HB1 ALA A 128 11.561 10.964 -27.935 1.00 0.00 H new ATOM 0 HB2 ALA A 128 12.792 12.185 -28.336 1.00 0.00 H new ATOM 0 HB3 ALA A 128 11.477 11.836 -29.484 1.00 0.00 H new ATOM 1961 N ASP A 129 11.687 9.292 -31.146 1.00 0.00 N ATOM 1962 CA ASP A 129 10.841 8.268 -31.748 1.00 0.00 C ATOM 1963 C ASP A 129 11.525 6.905 -31.708 1.00 0.00 C ATOM 1964 O ASP A 129 12.451 6.642 -32.477 1.00 0.00 O ATOM 1965 CB ASP A 129 10.503 8.640 -33.193 1.00 0.00 C ATOM 1966 CG ASP A 129 9.417 7.760 -33.778 1.00 0.00 C ATOM 1967 OD1 ASP A 129 8.619 7.203 -32.996 1.00 0.00 O ATOM 1968 OD2 ASP A 129 9.365 7.626 -35.019 1.00 0.00 O ATOM 0 H ASP A 129 11.902 10.077 -31.761 1.00 0.00 H new ATOM 0 HA ASP A 129 9.918 8.209 -31.171 1.00 0.00 H new ATOM 0 HB2 ASP A 129 10.183 9.681 -33.232 1.00 0.00 H new ATOM 0 HB3 ASP A 129 11.401 8.560 -33.805 1.00 0.00 H new ATOM 1973 N ILE A 130 11.065 6.044 -30.807 1.00 0.00 N ATOM 1974 CA ILE A 130 11.633 4.709 -30.667 1.00 0.00 C ATOM 1975 C ILE A 130 10.960 3.724 -31.616 1.00 0.00 C ATOM 1976 O ILE A 130 11.628 3.037 -32.390 1.00 0.00 O ATOM 1977 CB ILE A 130 11.498 4.188 -29.224 1.00 0.00 C ATOM 1978 CG1 ILE A 130 12.217 5.125 -28.251 1.00 0.00 C ATOM 1979 CG2 ILE A 130 12.053 2.776 -29.116 1.00 0.00 C ATOM 1980 CD1 ILE A 130 13.638 5.444 -28.657 1.00 0.00 C ATOM 0 H ILE A 130 10.301 6.247 -30.163 1.00 0.00 H new ATOM 0 HA ILE A 130 12.691 4.788 -30.918 1.00 0.00 H new ATOM 0 HB ILE A 130 10.441 4.162 -28.960 1.00 0.00 H new ATOM 0 HG12 ILE A 130 11.653 6.055 -28.171 1.00 0.00 H new ATOM 0 HG13 ILE A 130 12.224 4.671 -27.260 1.00 0.00 H new ATOM 0 HG21 ILE A 130 11.950 2.422 -28.090 1.00 0.00 H new ATOM 0 HG22 ILE A 130 11.501 2.116 -29.785 1.00 0.00 H new ATOM 0 HG23 ILE A 130 13.107 2.777 -29.396 1.00 0.00 H new ATOM 0 HD11 ILE A 130 14.085 6.113 -27.921 1.00 0.00 H new ATOM 0 HD12 ILE A 130 14.217 4.522 -28.709 1.00 0.00 H new ATOM 0 HD13 ILE A 130 13.637 5.928 -29.634 1.00 0.00 H new ATOM 1992 N ASP A 131 9.635 3.660 -31.553 1.00 0.00 N ATOM 1993 CA ASP A 131 8.871 2.761 -32.409 1.00 0.00 C ATOM 1994 C ASP A 131 9.176 3.022 -33.881 1.00 0.00 C ATOM 1995 O ASP A 131 9.423 2.092 -34.648 1.00 0.00 O ATOM 1996 CB ASP A 131 7.373 2.925 -32.149 1.00 0.00 C ATOM 1997 CG ASP A 131 7.059 3.133 -30.680 1.00 0.00 C ATOM 1998 OD1 ASP A 131 7.505 2.307 -29.855 1.00 0.00 O ATOM 1999 OD2 ASP A 131 6.369 4.121 -30.355 1.00 0.00 O ATOM 0 H ASP A 131 9.067 4.221 -30.917 1.00 0.00 H new ATOM 0 HA ASP A 131 9.163 1.738 -32.172 1.00 0.00 H new ATOM 0 HB2 ASP A 131 6.999 3.774 -32.721 1.00 0.00 H new ATOM 0 HB3 ASP A 131 6.846 2.041 -32.508 1.00 0.00 H new ATOM 2004 N GLY A 132 9.155 4.294 -34.268 1.00 0.00 N ATOM 2005 CA GLY A 132 9.429 4.654 -35.647 1.00 0.00 C ATOM 2006 C GLY A 132 8.164 4.892 -36.446 1.00 0.00 C ATOM 2007 O GLY A 132 8.049 4.444 -37.587 1.00 0.00 O ATOM 0 H GLY A 132 8.953 5.081 -33.651 1.00 0.00 H new ATOM 0 HA2 GLY A 132 10.044 5.554 -35.669 1.00 0.00 H new ATOM 0 HA3 GLY A 132 10.009 3.860 -36.118 1.00 0.00 H new ATOM 2011 N ASP A 133 7.212 5.599 -35.847 1.00 0.00 N ATOM 2012 CA ASP A 133 5.948 5.896 -36.511 1.00 0.00 C ATOM 2013 C ASP A 133 5.719 7.402 -36.595 1.00 0.00 C ATOM 2014 O ASP A 133 4.584 7.861 -36.720 1.00 0.00 O ATOM 2015 CB ASP A 133 4.788 5.232 -35.767 1.00 0.00 C ATOM 2016 CG ASP A 133 4.967 5.272 -34.262 1.00 0.00 C ATOM 2017 OD1 ASP A 133 5.557 6.252 -33.761 1.00 0.00 O ATOM 2018 OD2 ASP A 133 4.518 4.323 -33.585 1.00 0.00 O ATOM 0 H ASP A 133 7.292 5.977 -34.903 1.00 0.00 H new ATOM 0 HA ASP A 133 5.996 5.497 -37.524 1.00 0.00 H new ATOM 0 HB2 ASP A 133 3.856 5.732 -36.033 1.00 0.00 H new ATOM 0 HB3 ASP A 133 4.698 4.195 -36.092 1.00 0.00 H new ATOM 2023 N GLY A 134 6.805 8.165 -36.526 1.00 0.00 N ATOM 2024 CA GLY A 134 6.701 9.611 -36.594 1.00 0.00 C ATOM 2025 C GLY A 134 5.928 10.193 -35.427 1.00 0.00 C ATOM 2026 O GLY A 134 5.273 11.226 -35.563 1.00 0.00 O ATOM 0 H GLY A 134 7.755 7.808 -36.424 1.00 0.00 H new ATOM 0 HA2 GLY A 134 7.701 10.043 -36.615 1.00 0.00 H new ATOM 0 HA3 GLY A 134 6.212 9.893 -37.526 1.00 0.00 H new ATOM 2030 N GLN A 135 6.004 9.528 -34.279 1.00 0.00 N ATOM 2031 CA GLN A 135 5.303 9.985 -33.085 1.00 0.00 C ATOM 2032 C GLN A 135 6.223 9.952 -31.869 1.00 0.00 C ATOM 2033 O GLN A 135 7.240 9.258 -31.865 1.00 0.00 O ATOM 2034 CB GLN A 135 4.069 9.118 -32.829 1.00 0.00 C ATOM 2035 CG GLN A 135 3.185 8.942 -34.053 1.00 0.00 C ATOM 2036 CD GLN A 135 1.721 8.774 -33.697 1.00 0.00 C ATOM 2037 OE1 GLN A 135 1.022 9.749 -33.419 1.00 0.00 O ATOM 2038 NE2 GLN A 135 1.249 7.533 -33.703 1.00 0.00 N ATOM 0 H GLN A 135 6.543 8.672 -34.150 1.00 0.00 H new ATOM 0 HA GLN A 135 4.986 11.015 -33.251 1.00 0.00 H new ATOM 0 HB2 GLN A 135 4.391 8.137 -32.479 1.00 0.00 H new ATOM 0 HB3 GLN A 135 3.481 9.565 -32.028 1.00 0.00 H new ATOM 0 HG2 GLN A 135 3.299 9.807 -34.706 1.00 0.00 H new ATOM 0 HG3 GLN A 135 3.520 8.071 -34.616 1.00 0.00 H new ATOM 0 HE21 GLN A 135 1.864 6.755 -33.940 1.00 0.00 H new ATOM 0 HE22 GLN A 135 0.271 7.358 -33.471 1.00 0.00 H new ATOM 2047 N VAL A 136 5.859 10.708 -30.837 1.00 0.00 N ATOM 2048 CA VAL A 136 6.651 10.764 -29.614 1.00 0.00 C ATOM 2049 C VAL A 136 5.763 10.663 -28.379 1.00 0.00 C ATOM 2050 O VAL A 136 5.351 11.675 -27.814 1.00 0.00 O ATOM 2051 CB VAL A 136 7.473 12.065 -29.538 1.00 0.00 C ATOM 2052 CG1 VAL A 136 8.212 12.153 -28.211 1.00 0.00 C ATOM 2053 CG2 VAL A 136 8.444 12.151 -30.705 1.00 0.00 C ATOM 0 H VAL A 136 5.021 11.290 -30.824 1.00 0.00 H new ATOM 0 HA VAL A 136 7.332 9.913 -29.638 1.00 0.00 H new ATOM 0 HB VAL A 136 6.788 12.911 -29.602 1.00 0.00 H new ATOM 0 HG11 VAL A 136 8.787 13.078 -28.175 1.00 0.00 H new ATOM 0 HG12 VAL A 136 7.492 12.141 -27.392 1.00 0.00 H new ATOM 0 HG13 VAL A 136 8.887 11.303 -28.113 1.00 0.00 H new ATOM 0 HG21 VAL A 136 9.016 13.076 -30.635 1.00 0.00 H new ATOM 0 HG22 VAL A 136 9.125 11.300 -30.675 1.00 0.00 H new ATOM 0 HG23 VAL A 136 7.888 12.138 -31.643 1.00 0.00 H new ATOM 2063 N ASN A 137 5.473 9.434 -27.965 1.00 0.00 N ATOM 2064 CA ASN A 137 4.633 9.200 -26.796 1.00 0.00 C ATOM 2065 C ASN A 137 5.382 9.540 -25.511 1.00 0.00 C ATOM 2066 O ASN A 137 6.548 9.933 -25.546 1.00 0.00 O ATOM 2067 CB ASN A 137 4.168 7.743 -26.759 1.00 0.00 C ATOM 2068 CG ASN A 137 5.280 6.773 -27.112 1.00 0.00 C ATOM 2069 OD1 ASN A 137 5.434 6.383 -28.269 1.00 0.00 O ATOM 2070 ND2 ASN A 137 6.060 6.379 -26.112 1.00 0.00 N ATOM 0 H ASN A 137 5.807 8.585 -28.421 1.00 0.00 H new ATOM 0 HA ASN A 137 3.761 9.850 -26.870 1.00 0.00 H new ATOM 0 HB2 ASN A 137 3.789 7.510 -25.764 1.00 0.00 H new ATOM 0 HB3 ASN A 137 3.339 7.611 -27.455 1.00 0.00 H new ATOM 0 HD21 ASN A 137 6.824 5.727 -26.288 1.00 0.00 H new ATOM 0 HD22 ASN A 137 5.895 6.729 -25.168 1.00 0.00 H new ATOM 2077 N TYR A 138 4.705 9.384 -24.379 1.00 0.00 N ATOM 2078 CA TYR A 138 5.305 9.676 -23.083 1.00 0.00 C ATOM 2079 C TYR A 138 6.662 8.992 -22.945 1.00 0.00 C ATOM 2080 O TYR A 138 7.664 9.635 -22.633 1.00 0.00 O ATOM 2081 CB TYR A 138 4.377 9.224 -21.954 1.00 0.00 C ATOM 2082 CG TYR A 138 4.911 9.529 -20.573 1.00 0.00 C ATOM 2083 CD1 TYR A 138 4.893 10.825 -20.071 1.00 0.00 C ATOM 2084 CD2 TYR A 138 5.433 8.522 -19.770 1.00 0.00 C ATOM 2085 CE1 TYR A 138 5.380 11.108 -18.809 1.00 0.00 C ATOM 2086 CE2 TYR A 138 5.921 8.797 -18.507 1.00 0.00 C ATOM 2087 CZ TYR A 138 5.892 10.091 -18.031 1.00 0.00 C ATOM 2088 OH TYR A 138 6.378 10.369 -16.774 1.00 0.00 O ATOM 0 H TYR A 138 3.740 9.057 -24.333 1.00 0.00 H new ATOM 0 HA TYR A 138 5.452 10.754 -23.014 1.00 0.00 H new ATOM 0 HB2 TYR A 138 3.408 9.709 -22.075 1.00 0.00 H new ATOM 0 HB3 TYR A 138 4.209 8.150 -22.041 1.00 0.00 H new ATOM 0 HD1 TYR A 138 4.492 11.624 -20.677 1.00 0.00 H new ATOM 0 HD2 TYR A 138 5.458 7.507 -20.139 1.00 0.00 H new ATOM 0 HE1 TYR A 138 5.360 12.121 -18.434 1.00 0.00 H new ATOM 0 HE2 TYR A 138 6.323 8.003 -17.896 1.00 0.00 H new ATOM 0 HH TYR A 138 6.701 9.543 -16.358 1.00 0.00 H new ATOM 2098 N GLU A 139 6.685 7.684 -23.181 1.00 0.00 N ATOM 2099 CA GLU A 139 7.919 6.912 -23.083 1.00 0.00 C ATOM 2100 C GLU A 139 9.013 7.522 -23.955 1.00 0.00 C ATOM 2101 O GLU A 139 10.058 7.939 -23.456 1.00 0.00 O ATOM 2102 CB GLU A 139 7.672 5.460 -23.498 1.00 0.00 C ATOM 2103 CG GLU A 139 8.888 4.564 -23.329 1.00 0.00 C ATOM 2104 CD GLU A 139 8.635 3.144 -23.795 1.00 0.00 C ATOM 2105 OE1 GLU A 139 7.908 2.967 -24.794 1.00 0.00 O ATOM 2106 OE2 GLU A 139 9.165 2.208 -23.159 1.00 0.00 O ATOM 0 H GLU A 139 5.864 7.137 -23.441 1.00 0.00 H new ATOM 0 HA GLU A 139 8.250 6.935 -22.045 1.00 0.00 H new ATOM 0 HB2 GLU A 139 6.849 5.057 -22.907 1.00 0.00 H new ATOM 0 HB3 GLU A 139 7.357 5.438 -24.541 1.00 0.00 H new ATOM 0 HG2 GLU A 139 9.724 4.983 -23.889 1.00 0.00 H new ATOM 0 HG3 GLU A 139 9.182 4.551 -22.280 1.00 0.00 H new ATOM 2113 N GLU A 140 8.764 7.571 -25.260 1.00 0.00 N ATOM 2114 CA GLU A 140 9.728 8.128 -26.201 1.00 0.00 C ATOM 2115 C GLU A 140 10.135 9.540 -25.790 1.00 0.00 C ATOM 2116 O GLU A 140 11.258 9.974 -26.048 1.00 0.00 O ATOM 2117 CB GLU A 140 9.143 8.146 -27.615 1.00 0.00 C ATOM 2118 CG GLU A 140 8.790 6.767 -28.145 1.00 0.00 C ATOM 2119 CD GLU A 140 7.866 6.822 -29.346 1.00 0.00 C ATOM 2120 OE1 GLU A 140 7.046 7.761 -29.420 1.00 0.00 O ATOM 2121 OE2 GLU A 140 7.962 5.926 -30.211 1.00 0.00 O ATOM 0 H GLU A 140 7.903 7.232 -25.689 1.00 0.00 H new ATOM 0 HA GLU A 140 10.615 7.494 -26.191 1.00 0.00 H new ATOM 0 HB2 GLU A 140 8.248 8.768 -27.621 1.00 0.00 H new ATOM 0 HB3 GLU A 140 9.860 8.613 -28.290 1.00 0.00 H new ATOM 0 HG2 GLU A 140 9.705 6.242 -28.419 1.00 0.00 H new ATOM 0 HG3 GLU A 140 8.316 6.188 -27.353 1.00 0.00 H new ATOM 2128 N PHE A 141 9.215 10.252 -25.149 1.00 0.00 N ATOM 2129 CA PHE A 141 9.477 11.616 -24.703 1.00 0.00 C ATOM 2130 C PHE A 141 10.342 11.620 -23.446 1.00 0.00 C ATOM 2131 O PHE A 141 11.195 12.490 -23.269 1.00 0.00 O ATOM 2132 CB PHE A 141 8.160 12.348 -24.432 1.00 0.00 C ATOM 2133 CG PHE A 141 8.269 13.402 -23.367 1.00 0.00 C ATOM 2134 CD1 PHE A 141 9.224 14.402 -23.458 1.00 0.00 C ATOM 2135 CD2 PHE A 141 7.415 13.393 -22.276 1.00 0.00 C ATOM 2136 CE1 PHE A 141 9.326 15.372 -22.479 1.00 0.00 C ATOM 2137 CE2 PHE A 141 7.513 14.361 -21.294 1.00 0.00 C ATOM 2138 CZ PHE A 141 8.469 15.352 -21.397 1.00 0.00 C ATOM 0 H PHE A 141 8.281 9.908 -24.926 1.00 0.00 H new ATOM 0 HA PHE A 141 10.016 12.134 -25.496 1.00 0.00 H new ATOM 0 HB2 PHE A 141 7.814 12.811 -25.356 1.00 0.00 H new ATOM 0 HB3 PHE A 141 7.403 11.621 -24.137 1.00 0.00 H new ATOM 0 HD1 PHE A 141 9.896 14.424 -24.303 1.00 0.00 H new ATOM 0 HD2 PHE A 141 6.664 12.621 -22.192 1.00 0.00 H new ATOM 0 HE1 PHE A 141 10.076 16.145 -22.560 1.00 0.00 H new ATOM 0 HE2 PHE A 141 6.843 14.342 -20.447 1.00 0.00 H new ATOM 0 HZ PHE A 141 8.546 16.110 -20.632 1.00 0.00 H new ATOM 2148 N VAL A 142 10.114 10.642 -22.575 1.00 0.00 N ATOM 2149 CA VAL A 142 10.873 10.532 -21.334 1.00 0.00 C ATOM 2150 C VAL A 142 12.342 10.236 -21.613 1.00 0.00 C ATOM 2151 O VAL A 142 13.230 10.897 -21.076 1.00 0.00 O ATOM 2152 CB VAL A 142 10.301 9.429 -20.423 1.00 0.00 C ATOM 2153 CG1 VAL A 142 11.219 9.190 -19.234 1.00 0.00 C ATOM 2154 CG2 VAL A 142 8.899 9.795 -19.960 1.00 0.00 C ATOM 0 H VAL A 142 9.411 9.915 -22.705 1.00 0.00 H new ATOM 0 HA VAL A 142 10.790 11.492 -20.825 1.00 0.00 H new ATOM 0 HB VAL A 142 10.239 8.504 -20.996 1.00 0.00 H new ATOM 0 HG11 VAL A 142 10.799 8.408 -18.602 1.00 0.00 H new ATOM 0 HG12 VAL A 142 12.202 8.881 -19.590 1.00 0.00 H new ATOM 0 HG13 VAL A 142 11.315 10.110 -18.658 1.00 0.00 H new ATOM 0 HG21 VAL A 142 8.510 9.005 -19.318 1.00 0.00 H new ATOM 0 HG22 VAL A 142 8.933 10.732 -19.404 1.00 0.00 H new ATOM 0 HG23 VAL A 142 8.248 9.911 -20.827 1.00 0.00 H new ATOM 2164 N GLN A 143 12.589 9.237 -22.454 1.00 0.00 N ATOM 2165 CA GLN A 143 13.951 8.853 -22.804 1.00 0.00 C ATOM 2166 C GLN A 143 14.777 10.073 -23.198 1.00 0.00 C ATOM 2167 O GLN A 143 15.881 10.277 -22.693 1.00 0.00 O ATOM 2168 CB GLN A 143 13.940 7.839 -23.949 1.00 0.00 C ATOM 2169 CG GLN A 143 13.191 6.558 -23.620 1.00 0.00 C ATOM 2170 CD GLN A 143 13.986 5.633 -22.719 1.00 0.00 C ATOM 2171 OE1 GLN A 143 13.878 5.698 -21.494 1.00 0.00 O ATOM 2172 NE2 GLN A 143 14.789 4.765 -23.322 1.00 0.00 N ATOM 0 H GLN A 143 11.864 8.679 -22.905 1.00 0.00 H new ATOM 0 HA GLN A 143 14.408 8.395 -21.927 1.00 0.00 H new ATOM 0 HB2 GLN A 143 13.487 8.300 -24.827 1.00 0.00 H new ATOM 0 HB3 GLN A 143 14.968 7.591 -24.214 1.00 0.00 H new ATOM 0 HG2 GLN A 143 12.247 6.808 -23.136 1.00 0.00 H new ATOM 0 HG3 GLN A 143 12.947 6.036 -24.545 1.00 0.00 H new ATOM 0 HE21 GLN A 143 14.847 4.746 -24.340 1.00 0.00 H new ATOM 0 HE22 GLN A 143 15.348 4.117 -22.767 1.00 0.00 H new ATOM 2181 N MET A 144 14.234 10.882 -24.102 1.00 0.00 N ATOM 2182 CA MET A 144 14.922 12.083 -24.563 1.00 0.00 C ATOM 2183 C MET A 144 15.360 12.945 -23.383 1.00 0.00 C ATOM 2184 O MET A 144 16.536 13.285 -23.254 1.00 0.00 O ATOM 2185 CB MET A 144 14.013 12.893 -25.490 1.00 0.00 C ATOM 2186 CG MET A 144 14.558 14.272 -25.823 1.00 0.00 C ATOM 2187 SD MET A 144 13.616 15.097 -27.120 1.00 0.00 S ATOM 2188 CE MET A 144 12.267 15.793 -26.168 1.00 0.00 C ATOM 0 H MET A 144 13.321 10.728 -24.530 1.00 0.00 H new ATOM 0 HA MET A 144 15.810 11.774 -25.115 1.00 0.00 H new ATOM 0 HB2 MET A 144 13.864 12.337 -26.416 1.00 0.00 H new ATOM 0 HB3 MET A 144 13.035 13.001 -25.022 1.00 0.00 H new ATOM 0 HG2 MET A 144 14.549 14.889 -24.924 1.00 0.00 H new ATOM 0 HG3 MET A 144 15.598 14.181 -26.136 1.00 0.00 H new ATOM 0 HE1 MET A 144 11.327 15.628 -26.695 1.00 0.00 H new ATOM 0 HE2 MET A 144 12.225 15.312 -25.191 1.00 0.00 H new ATOM 0 HE3 MET A 144 12.427 16.863 -26.039 1.00 0.00 H new ATOM 2198 N MET A 145 14.408 13.294 -22.524 1.00 0.00 N ATOM 2199 CA MET A 145 14.697 14.116 -21.355 1.00 0.00 C ATOM 2200 C MET A 145 15.863 13.537 -20.559 1.00 0.00 C ATOM 2201 O MET A 145 16.717 14.273 -20.064 1.00 0.00 O ATOM 2202 CB MET A 145 13.460 14.224 -20.462 1.00 0.00 C ATOM 2203 CG MET A 145 12.291 14.933 -21.127 1.00 0.00 C ATOM 2204 SD MET A 145 12.770 16.492 -21.896 1.00 0.00 S ATOM 2205 CE MET A 145 13.207 17.460 -20.454 1.00 0.00 C ATOM 0 H MET A 145 13.430 13.020 -22.616 1.00 0.00 H new ATOM 0 HA MET A 145 14.974 15.112 -21.702 1.00 0.00 H new ATOM 0 HB2 MET A 145 13.147 13.223 -20.166 1.00 0.00 H new ATOM 0 HB3 MET A 145 13.726 14.757 -19.549 1.00 0.00 H new ATOM 0 HG2 MET A 145 11.856 14.278 -21.882 1.00 0.00 H new ATOM 0 HG3 MET A 145 11.516 15.122 -20.384 1.00 0.00 H new ATOM 0 HE1 MET A 145 13.423 18.485 -20.756 1.00 0.00 H new ATOM 0 HE2 MET A 145 12.376 17.457 -19.748 1.00 0.00 H new ATOM 0 HE3 MET A 145 14.088 17.028 -19.979 1.00 0.00 H new ATOM 2215 N THR A 146 15.893 12.213 -20.439 1.00 0.00 N ATOM 2216 CA THR A 146 16.953 11.536 -19.703 1.00 0.00 C ATOM 2217 C THR A 146 18.072 11.089 -20.636 1.00 0.00 C ATOM 2218 O THR A 146 18.608 9.990 -20.497 1.00 0.00 O ATOM 2219 CB THR A 146 16.414 10.310 -18.942 1.00 0.00 C ATOM 2220 OG1 THR A 146 15.849 9.371 -19.864 1.00 0.00 O ATOM 2221 CG2 THR A 146 15.362 10.725 -17.924 1.00 0.00 C ATOM 0 H THR A 146 15.195 11.588 -20.842 1.00 0.00 H new ATOM 0 HA THR A 146 17.348 12.255 -18.985 1.00 0.00 H new ATOM 0 HB THR A 146 17.245 9.844 -18.413 1.00 0.00 H new ATOM 0 HG1 THR A 146 15.864 9.750 -20.768 1.00 0.00 H new ATOM 0 HG21 THR A 146 14.996 9.843 -17.399 1.00 0.00 H new ATOM 0 HG22 THR A 146 15.803 11.417 -17.207 1.00 0.00 H new ATOM 0 HG23 THR A 146 14.533 11.213 -18.436 1.00 0.00 H new