USER MOD reduce.3.24.130724 H: found=0, std=0, add=1012, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1014 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 41 SER OG : rot 75:sc= 0.719 USER MOD Set 1.2: A 121 THR OG1 : rot 76:sc= 1.21 USER MOD Set 2.1: A 108 SER OG : rot 180:sc= -0.0423 USER MOD Set 2.2: A 109 THR OG1 : rot 73:sc= 0.916 USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.0276 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 71:sc= 1.14 USER MOD Single : A 14 SER OG : rot 87:sc= 1.23 USER MOD Single : A 17 THR OG1 : rot 95:sc= 1.19 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot -20:sc= -1.29 USER MOD Single : A 20 ASN : amide:sc= -1.4 K(o=-1.4,f=-2.2) USER MOD Single : A 21 THR OG1 : rot 72:sc= -1.84! USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 69:sc= 0.0581 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= -1.73 USER MOD Single : A 33 ASN : amide:sc= -0.349 K(o=-0.35,f=-4.2!) USER MOD Single : A 40 THR OG1 : rot 33:sc= -0.867 USER MOD Single : A 44 LYS NZ :NH3+ -167:sc= -0.0443 (180deg=-0.214) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -1.93! C(o=-1.9!,f=-4.9!) USER MOD Single : A 57 SER OG : rot 180:sc= -1.92! USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 GLN : amide:sc= -2.86! K(o=-2.9!,f=-1.3) USER MOD Single : A 61 THR OG1 : rot 25:sc= 0.843 USER MOD Single : A 62 SER OG : rot 75:sc= 0.313 USER MOD Single : A 65 SER OG : rot -9:sc= 0.519 USER MOD Single : A 66 GLN : amide:sc= -0.221 X(o=-0.22,f=-0.057) USER MOD Single : A 70 ASN : amide:sc= -0.0796 K(o=-0.08,f=-1.4!) USER MOD Single : A 75 SER OG : rot 94:sc= 0.538 USER MOD Single : A 76 SER OG : rot 180:sc= -0.729 USER MOD Single : A 80 TYR OH : rot 118:sc= 0.0936 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -1.72 X(o=-1.7,f=-1.5) USER MOD Single : A 94 SER OG : rot 92:sc= 0.662 USER MOD Single : A 95 SER OG : rot -47:sc= -0.117 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= -0.796 K(o=-0.8,f=-0.045) USER MOD Single : A 100 ASN : amide:sc= 0.142 K(o=0.14,f=-2.1!) USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 ASN : amide:sc= -0.864 X(o=-0.86,f=-0.53) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 SER OG : rot 83:sc= 0.166 USER MOD Single : A 113 ASN : amide:sc= -1.02! K(o=-1!,f=-1.6) USER MOD Single : A 118 MET CE :methyl 144:sc= -4.79! (180deg=-6.33!) USER MOD Single : A 120 ASN : amide:sc= -0.574 K(o=-0.57,f=-1.6!) USER MOD Single : A 125 TYR OH : rot 180:sc=-0.000248 USER MOD Single : A 135 GLN : amide:sc= -0.0452 K(o=-0.045,f=-2.3!) USER MOD Single : A 139 SER OG : rot 89:sc= 1.19 USER MOD Single : A 142 THR OG1 : rot -90:sc= 0.0659 USER MOD Single : A 143 SER OG : rot 78:sc= 1.25 USER MOD Single : A 144 MET CE :methyl -172:sc= 0 (180deg=-0.0114) USER MOD Single : A 145 THR OG1 : rot -69:sc=-0.00627 USER MOD Single : A 146 SER OG : rot 68:sc= 0.0531 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 189 N GLN A 7 -14.246 19.519 5.903 1.00 53.51 N ATOM 190 CA GLN A 7 -15.181 19.088 4.870 1.00 54.24 C ATOM 191 C GLN A 7 -14.824 17.695 4.360 1.00 75.24 C ATOM 192 O GLN A 7 -15.688 16.825 4.240 1.00 4.21 O ATOM 193 CB GLN A 7 -15.184 20.082 3.707 1.00 23.14 C ATOM 194 CG GLN A 7 -15.274 21.534 4.150 1.00 22.11 C ATOM 195 CD GLN A 7 -15.310 22.499 2.982 1.00 24.11 C ATOM 196 OE1 GLN A 7 -14.270 22.865 2.431 1.00 31.44 O ATOM 197 NE2 GLN A 7 -16.510 22.918 2.596 1.00 22.31 N ATOM 0 HA GLN A 7 -16.177 19.051 5.311 1.00 54.24 H new ATOM 0 HB2 GLN A 7 -14.276 19.945 3.120 1.00 23.14 H new ATOM 0 HB3 GLN A 7 -16.025 19.858 3.050 1.00 23.14 H new ATOM 0 HG2 GLN A 7 -16.169 21.670 4.756 1.00 22.11 H new ATOM 0 HG3 GLN A 7 -14.420 21.770 4.785 1.00 22.11 H new ATOM 0 HE21 GLN A 7 -17.345 22.589 3.081 1.00 22.31 H new ATOM 0 HE22 GLN A 7 -16.596 23.568 1.815 1.00 22.31 H new ATOM 206 N LEU A 8 -13.546 17.489 4.062 1.00 71.15 N ATOM 207 CA LEU A 8 -13.074 16.201 3.565 1.00 41.43 C ATOM 208 C LEU A 8 -13.410 15.083 4.545 1.00 34.31 C ATOM 209 O LEU A 8 -13.931 14.037 4.157 1.00 32.12 O ATOM 210 CB LEU A 8 -11.563 16.247 3.325 1.00 1.53 C ATOM 211 CG LEU A 8 -11.120 16.451 1.875 1.00 22.13 C ATOM 212 CD1 LEU A 8 -11.140 15.131 1.120 1.00 23.00 C ATOM 213 CD2 LEU A 8 -12.009 17.476 1.185 1.00 52.14 C ATOM 0 H LEU A 8 -12.818 18.197 4.156 1.00 71.15 H new ATOM 0 HA LEU A 8 -13.580 15.996 2.621 1.00 41.43 H new ATOM 0 HB2 LEU A 8 -11.144 17.052 3.929 1.00 1.53 H new ATOM 0 HB3 LEU A 8 -11.129 15.316 3.689 1.00 1.53 H new ATOM 0 HG LEU A 8 -10.098 16.829 1.877 1.00 22.13 H new ATOM 0 HD11 LEU A 8 -10.822 15.296 0.091 1.00 23.00 H new ATOM 0 HD12 LEU A 8 -10.462 14.426 1.601 1.00 23.00 H new ATOM 0 HD13 LEU A 8 -12.151 14.723 1.127 1.00 23.00 H new ATOM 0 HD21 LEU A 8 -11.679 17.609 0.155 1.00 52.14 H new ATOM 0 HD22 LEU A 8 -13.041 17.127 1.194 1.00 52.14 H new ATOM 0 HD23 LEU A 8 -11.944 18.428 1.712 1.00 52.14 H new ATOM 225 N THR A 9 -13.110 15.311 5.820 1.00 33.42 N ATOM 226 CA THR A 9 -13.381 14.324 6.858 1.00 75.32 C ATOM 227 C THR A 9 -14.881 14.157 7.080 1.00 64.32 C ATOM 228 O THR A 9 -15.372 13.043 7.258 1.00 62.33 O ATOM 229 CB THR A 9 -12.716 14.712 8.191 1.00 71.35 C ATOM 230 OG1 THR A 9 -12.851 16.120 8.415 1.00 52.23 O ATOM 231 CG2 THR A 9 -11.242 14.332 8.191 1.00 22.02 C ATOM 0 H THR A 9 -12.679 16.171 6.159 1.00 33.42 H new ATOM 0 HA THR A 9 -12.960 13.380 6.513 1.00 75.32 H new ATOM 0 HB THR A 9 -13.215 14.168 8.993 1.00 71.35 H new ATOM 0 HG1 THR A 9 -12.427 16.358 9.266 1.00 52.23 H new ATOM 0 HG21 THR A 9 -10.793 14.616 9.143 1.00 22.02 H new ATOM 0 HG22 THR A 9 -11.144 13.256 8.050 1.00 22.02 H new ATOM 0 HG23 THR A 9 -10.732 14.852 7.380 1.00 22.02 H new ATOM 239 N SER A 10 -15.602 15.272 7.069 1.00 3.44 N ATOM 240 CA SER A 10 -17.046 15.251 7.273 1.00 53.22 C ATOM 241 C SER A 10 -17.741 14.482 6.154 1.00 5.23 C ATOM 242 O SER A 10 -18.652 13.691 6.400 1.00 52.14 O ATOM 243 CB SER A 10 -17.594 16.678 7.344 1.00 61.34 C ATOM 244 OG SER A 10 -17.490 17.200 8.658 1.00 53.21 O ATOM 0 H SER A 10 -15.211 16.202 6.921 1.00 3.44 H new ATOM 0 HA SER A 10 -17.247 14.745 8.217 1.00 53.22 H new ATOM 0 HB2 SER A 10 -17.045 17.316 6.651 1.00 61.34 H new ATOM 0 HB3 SER A 10 -18.637 16.686 7.028 1.00 61.34 H new ATOM 0 HG SER A 10 -17.845 18.113 8.676 1.00 53.21 H new ATOM 250 N THR A 11 -17.305 14.721 4.921 1.00 34.10 N ATOM 251 CA THR A 11 -17.885 14.053 3.763 1.00 54.23 C ATOM 252 C THR A 11 -17.405 12.610 3.662 1.00 62.34 C ATOM 253 O THR A 11 -18.208 11.686 3.526 1.00 52.13 O ATOM 254 CB THR A 11 -17.536 14.790 2.456 1.00 22.03 C ATOM 255 OG1 THR A 11 -17.637 16.206 2.649 1.00 34.33 O ATOM 256 CG2 THR A 11 -18.461 14.360 1.327 1.00 25.54 C ATOM 0 H THR A 11 -16.552 15.372 4.699 1.00 34.10 H new ATOM 0 HA THR A 11 -18.966 14.064 3.901 1.00 54.23 H new ATOM 0 HB THR A 11 -16.512 14.533 2.183 1.00 22.03 H new ATOM 0 HG1 THR A 11 -16.903 16.511 3.223 1.00 34.33 H new ATOM 0 HG21 THR A 11 -18.195 14.894 0.415 1.00 25.54 H new ATOM 0 HG22 THR A 11 -18.360 13.287 1.162 1.00 25.54 H new ATOM 0 HG23 THR A 11 -19.492 14.590 1.594 1.00 25.54 H new ATOM 264 N LEU A 12 -16.092 12.422 3.731 1.00 24.21 N ATOM 265 CA LEU A 12 -15.504 11.090 3.649 1.00 54.14 C ATOM 266 C LEU A 12 -16.085 10.172 4.719 1.00 73.23 C ATOM 267 O LEU A 12 -16.450 9.030 4.440 1.00 52.55 O ATOM 268 CB LEU A 12 -13.983 11.171 3.801 1.00 11.23 C ATOM 269 CG LEU A 12 -13.216 11.708 2.593 1.00 11.31 C ATOM 270 CD1 LEU A 12 -11.739 11.863 2.924 1.00 11.05 C ATOM 271 CD2 LEU A 12 -13.401 10.791 1.393 1.00 13.20 C ATOM 0 H LEU A 12 -15.414 13.176 3.844 1.00 24.21 H new ATOM 0 HA LEU A 12 -15.743 10.674 2.670 1.00 54.14 H new ATOM 0 HB2 LEU A 12 -13.757 11.803 4.660 1.00 11.23 H new ATOM 0 HB3 LEU A 12 -13.607 10.174 4.031 1.00 11.23 H new ATOM 0 HG LEU A 12 -13.616 12.690 2.340 1.00 11.31 H new ATOM 0 HD11 LEU A 12 -11.209 12.246 2.052 1.00 11.05 H new ATOM 0 HD12 LEU A 12 -11.623 12.560 3.754 1.00 11.05 H new ATOM 0 HD13 LEU A 12 -11.325 10.894 3.203 1.00 11.05 H new ATOM 0 HD21 LEU A 12 -12.848 11.189 0.542 1.00 13.20 H new ATOM 0 HD22 LEU A 12 -13.028 9.796 1.635 1.00 13.20 H new ATOM 0 HD23 LEU A 12 -14.460 10.730 1.141 1.00 13.20 H new ATOM 283 N ALA A 13 -16.170 10.679 5.944 1.00 30.40 N ATOM 284 CA ALA A 13 -16.711 9.906 7.055 1.00 75.23 C ATOM 285 C ALA A 13 -18.213 9.696 6.898 1.00 35.32 C ATOM 286 O ALA A 13 -18.736 8.627 7.214 1.00 30.44 O ATOM 287 CB ALA A 13 -16.408 10.598 8.377 1.00 14.44 C ATOM 0 H ALA A 13 -15.871 11.622 6.192 1.00 30.40 H new ATOM 0 HA ALA A 13 -16.232 8.927 7.051 1.00 75.23 H new ATOM 0 HB1 ALA A 13 -16.818 10.010 9.198 1.00 14.44 H new ATOM 0 HB2 ALA A 13 -15.329 10.691 8.500 1.00 14.44 H new ATOM 0 HB3 ALA A 13 -16.860 11.590 8.380 1.00 14.44 H new ATOM 293 N SER A 14 -18.901 10.721 6.408 1.00 15.15 N ATOM 294 CA SER A 14 -20.345 10.650 6.213 1.00 52.43 C ATOM 295 C SER A 14 -20.702 9.573 5.192 1.00 34.13 C ATOM 296 O SER A 14 -21.628 8.788 5.400 1.00 24.11 O ATOM 297 CB SER A 14 -20.886 12.005 5.752 1.00 72.53 C ATOM 298 OG SER A 14 -21.098 12.870 6.854 1.00 14.20 O ATOM 0 H SER A 14 -18.482 11.611 6.138 1.00 15.15 H new ATOM 0 HA SER A 14 -20.804 10.389 7.167 1.00 52.43 H new ATOM 0 HB2 SER A 14 -20.183 12.463 5.056 1.00 72.53 H new ATOM 0 HB3 SER A 14 -21.822 11.862 5.212 1.00 72.53 H new ATOM 0 HG SER A 14 -20.268 13.348 7.059 1.00 14.20 H new ATOM 304 N ALA A 15 -19.962 9.543 4.089 1.00 52.32 N ATOM 305 CA ALA A 15 -20.199 8.563 3.037 1.00 13.51 C ATOM 306 C ALA A 15 -19.853 7.155 3.510 1.00 3.21 C ATOM 307 O ALA A 15 -20.618 6.213 3.301 1.00 21.55 O ATOM 308 CB ALA A 15 -19.395 8.917 1.795 1.00 30.14 C ATOM 0 H ALA A 15 -19.193 10.186 3.901 1.00 52.32 H new ATOM 0 HA ALA A 15 -21.260 8.584 2.788 1.00 13.51 H new ATOM 0 HB1 ALA A 15 -19.582 8.176 1.017 1.00 30.14 H new ATOM 0 HB2 ALA A 15 -19.693 9.902 1.437 1.00 30.14 H new ATOM 0 HB3 ALA A 15 -18.333 8.926 2.040 1.00 30.14 H new ATOM 314 N LEU A 16 -18.694 7.019 4.147 1.00 12.03 N ATOM 315 CA LEU A 16 -18.246 5.725 4.650 1.00 53.34 C ATOM 316 C LEU A 16 -19.167 5.222 5.757 1.00 13.12 C ATOM 317 O LEU A 16 -19.182 4.032 6.075 1.00 60.35 O ATOM 318 CB LEU A 16 -16.812 5.828 5.172 1.00 55.13 C ATOM 319 CG LEU A 16 -15.734 6.103 4.122 1.00 72.41 C ATOM 320 CD1 LEU A 16 -14.406 6.421 4.792 1.00 0.44 C ATOM 321 CD2 LEU A 16 -15.588 4.915 3.184 1.00 54.44 C ATOM 0 H LEU A 16 -18.049 7.788 4.327 1.00 12.03 H new ATOM 0 HA LEU A 16 -18.276 5.012 3.826 1.00 53.34 H new ATOM 0 HB2 LEU A 16 -16.774 6.621 5.919 1.00 55.13 H new ATOM 0 HB3 LEU A 16 -16.565 4.897 5.683 1.00 55.13 H new ATOM 0 HG LEU A 16 -16.039 6.969 3.534 1.00 72.41 H new ATOM 0 HD11 LEU A 16 -13.651 6.614 4.030 1.00 0.44 H new ATOM 0 HD12 LEU A 16 -14.519 7.303 5.423 1.00 0.44 H new ATOM 0 HD13 LEU A 16 -14.095 5.574 5.404 1.00 0.44 H new ATOM 0 HD21 LEU A 16 -14.817 5.128 2.444 1.00 54.44 H new ATOM 0 HD22 LEU A 16 -15.306 4.032 3.757 1.00 54.44 H new ATOM 0 HD23 LEU A 16 -16.536 4.732 2.678 1.00 54.44 H new ATOM 333 N THR A 17 -19.937 6.135 6.340 1.00 34.35 N ATOM 334 CA THR A 17 -20.862 5.784 7.411 1.00 50.34 C ATOM 335 C THR A 17 -22.103 5.090 6.860 1.00 41.04 C ATOM 336 O THR A 17 -22.782 4.351 7.573 1.00 24.23 O ATOM 337 CB THR A 17 -21.296 7.028 8.208 1.00 63.53 C ATOM 338 OG1 THR A 17 -20.196 7.523 8.979 1.00 65.50 O ATOM 339 CG2 THR A 17 -22.461 6.702 9.130 1.00 53.53 C ATOM 0 H THR A 17 -19.939 7.124 6.089 1.00 34.35 H new ATOM 0 HA THR A 17 -20.332 5.102 8.076 1.00 50.34 H new ATOM 0 HB THR A 17 -21.617 7.792 7.500 1.00 63.53 H new ATOM 0 HG1 THR A 17 -19.735 8.227 8.477 1.00 65.50 H new ATOM 0 HG21 THR A 17 -22.749 7.596 9.682 1.00 53.53 H new ATOM 0 HG22 THR A 17 -23.307 6.353 8.538 1.00 53.53 H new ATOM 0 HG23 THR A 17 -22.163 5.923 9.832 1.00 53.53 H new ATOM 347 N LYS A 18 -22.393 5.330 5.585 1.00 64.34 N ATOM 348 CA LYS A 18 -23.550 4.727 4.937 1.00 33.54 C ATOM 349 C LYS A 18 -23.117 3.703 3.892 1.00 20.15 C ATOM 350 O LYS A 18 -23.907 3.297 3.040 1.00 14.54 O ATOM 351 CB LYS A 18 -24.414 5.807 4.280 1.00 32.42 C ATOM 352 CG LYS A 18 -23.613 6.844 3.513 1.00 64.55 C ATOM 353 CD LYS A 18 -24.514 7.760 2.704 1.00 21.24 C ATOM 354 CE LYS A 18 -24.881 9.013 3.486 1.00 51.53 C ATOM 355 NZ LYS A 18 -25.935 9.807 2.796 1.00 62.30 N ATOM 0 H LYS A 18 -21.841 5.939 4.980 1.00 64.34 H new ATOM 0 HA LYS A 18 -24.136 4.216 5.701 1.00 33.54 H new ATOM 0 HB2 LYS A 18 -25.121 5.331 3.601 1.00 32.42 H new ATOM 0 HB3 LYS A 18 -25.000 6.309 5.050 1.00 32.42 H new ATOM 0 HG2 LYS A 18 -23.022 7.437 4.211 1.00 64.55 H new ATOM 0 HG3 LYS A 18 -22.911 6.343 2.847 1.00 64.55 H new ATOM 0 HD2 LYS A 18 -24.012 8.041 1.778 1.00 21.24 H new ATOM 0 HD3 LYS A 18 -25.422 7.225 2.424 1.00 21.24 H new ATOM 0 HE2 LYS A 18 -25.230 8.732 4.480 1.00 51.53 H new ATOM 0 HE3 LYS A 18 -23.993 9.629 3.622 1.00 51.53 H new ATOM 0 HZ1 LYS A 18 -26.158 10.652 3.360 1.00 62.30 H new ATOM 0 HZ2 LYS A 18 -25.593 10.097 1.858 1.00 62.30 H new ATOM 0 HZ3 LYS A 18 -26.792 9.227 2.688 1.00 62.30 H new ATOM 369 N THR A 19 -21.857 3.287 3.966 1.00 51.21 N ATOM 370 CA THR A 19 -21.319 2.310 3.027 1.00 33.11 C ATOM 371 C THR A 19 -21.334 0.908 3.624 1.00 32.40 C ATOM 372 O THR A 19 -20.827 0.685 4.723 1.00 43.41 O ATOM 373 CB THR A 19 -19.878 2.664 2.613 1.00 62.35 C ATOM 374 OG1 THR A 19 -19.072 2.879 3.777 1.00 22.52 O ATOM 375 CG2 THR A 19 -19.856 3.908 1.737 1.00 32.24 C ATOM 0 H THR A 19 -21.190 3.611 4.666 1.00 51.21 H new ATOM 0 HA THR A 19 -21.959 2.333 2.145 1.00 33.11 H new ATOM 0 HB THR A 19 -19.473 1.829 2.041 1.00 62.35 H new ATOM 0 HG1 THR A 19 -19.650 3.068 4.545 1.00 22.52 H new ATOM 0 HG21 THR A 19 -18.828 4.138 1.457 1.00 32.24 H new ATOM 0 HG22 THR A 19 -20.445 3.730 0.838 1.00 32.24 H new ATOM 0 HG23 THR A 19 -20.279 4.748 2.288 1.00 32.24 H new ATOM 383 N ASN A 20 -21.919 -0.036 2.892 1.00 23.15 N ATOM 384 CA ASN A 20 -22.000 -1.417 3.351 1.00 72.14 C ATOM 385 C ASN A 20 -20.620 -1.947 3.729 1.00 22.24 C ATOM 386 O ASN A 20 -20.488 -2.796 4.611 1.00 31.23 O ATOM 387 CB ASN A 20 -22.617 -2.301 2.264 1.00 33.42 C ATOM 388 CG ASN A 20 -22.209 -1.872 0.868 1.00 31.44 C ATOM 389 OD1 ASN A 20 -22.912 -1.103 0.214 1.00 42.45 O ATOM 390 ND2 ASN A 20 -21.067 -2.370 0.407 1.00 12.03 N ATOM 0 H ASN A 20 -22.343 0.131 1.980 1.00 23.15 H new ATOM 0 HA ASN A 20 -22.635 -1.443 4.237 1.00 72.14 H new ATOM 0 HB2 ASN A 20 -22.314 -3.336 2.426 1.00 33.42 H new ATOM 0 HB3 ASN A 20 -23.703 -2.270 2.348 1.00 33.42 H new ATOM 0 HD21 ASN A 20 -20.740 -2.118 -0.526 1.00 12.03 H new ATOM 0 HD22 ASN A 20 -20.517 -3.005 0.986 1.00 12.03 H new ATOM 397 N THR A 21 -19.592 -1.439 3.055 1.00 61.54 N ATOM 398 CA THR A 21 -18.222 -1.860 3.320 1.00 35.20 C ATOM 399 C THR A 21 -17.803 -1.507 4.742 1.00 42.40 C ATOM 400 O THR A 21 -16.886 -2.112 5.299 1.00 51.53 O ATOM 401 CB THR A 21 -17.235 -1.215 2.329 1.00 24.41 C ATOM 402 OG1 THR A 21 -17.602 -1.545 0.985 1.00 73.41 O ATOM 403 CG2 THR A 21 -15.812 -1.682 2.601 1.00 23.35 C ATOM 0 H THR A 21 -19.683 -0.736 2.322 1.00 61.54 H new ATOM 0 HA THR A 21 -18.194 -2.943 3.196 1.00 35.20 H new ATOM 0 HB THR A 21 -17.278 -0.134 2.461 1.00 24.41 H new ATOM 0 HG1 THR A 21 -18.415 -1.056 0.738 1.00 73.41 H new ATOM 0 HG21 THR A 21 -15.133 -1.213 1.889 1.00 23.35 H new ATOM 0 HG22 THR A 21 -15.525 -1.402 3.615 1.00 23.35 H new ATOM 0 HG23 THR A 21 -15.758 -2.765 2.495 1.00 23.35 H new ATOM 411 N LEU A 22 -18.479 -0.523 5.325 1.00 72.40 N ATOM 412 CA LEU A 22 -18.176 -0.088 6.684 1.00 30.31 C ATOM 413 C LEU A 22 -19.186 -0.659 7.676 1.00 44.04 C ATOM 414 O LEU A 22 -18.827 -1.052 8.786 1.00 32.25 O ATOM 415 CB LEU A 22 -18.174 1.440 6.764 1.00 34.24 C ATOM 416 CG LEU A 22 -16.800 2.107 6.827 1.00 62.32 C ATOM 417 CD1 LEU A 22 -16.245 2.053 8.242 1.00 4.13 C ATOM 418 CD2 LEU A 22 -15.839 1.443 5.850 1.00 23.14 C ATOM 0 H LEU A 22 -19.240 -0.012 4.878 1.00 72.40 H new ATOM 0 HA LEU A 22 -17.186 -0.460 6.946 1.00 30.31 H new ATOM 0 HB2 LEU A 22 -18.705 1.830 5.896 1.00 34.24 H new ATOM 0 HB3 LEU A 22 -18.741 1.738 7.646 1.00 34.24 H new ATOM 0 HG LEU A 22 -16.912 3.153 6.542 1.00 62.32 H new ATOM 0 HD11 LEU A 22 -15.266 2.532 8.268 1.00 4.13 H new ATOM 0 HD12 LEU A 22 -16.922 2.574 8.919 1.00 4.13 H new ATOM 0 HD13 LEU A 22 -16.148 1.014 8.555 1.00 4.13 H new ATOM 0 HD21 LEU A 22 -14.866 1.931 5.908 1.00 23.14 H new ATOM 0 HD22 LEU A 22 -15.732 0.389 6.105 1.00 23.14 H new ATOM 0 HD23 LEU A 22 -16.230 1.534 4.837 1.00 23.14 H new ATOM 430 N LYS A 23 -20.448 -0.703 7.267 1.00 33.13 N ATOM 431 CA LYS A 23 -21.511 -1.229 8.117 1.00 1.22 C ATOM 432 C LYS A 23 -21.376 -2.739 8.284 1.00 14.24 C ATOM 433 O LYS A 23 -21.694 -3.287 9.338 1.00 21.02 O ATOM 434 CB LYS A 23 -22.880 -0.891 7.524 1.00 3.24 C ATOM 435 CG LYS A 23 -23.528 0.332 8.150 1.00 0.13 C ATOM 436 CD LYS A 23 -24.826 0.696 7.448 1.00 21.14 C ATOM 437 CE LYS A 23 -24.567 1.408 6.130 1.00 34.14 C ATOM 438 NZ LYS A 23 -25.796 2.063 5.602 1.00 52.25 N ATOM 0 H LYS A 23 -20.761 -0.381 6.351 1.00 33.13 H new ATOM 0 HA LYS A 23 -21.422 -0.763 9.098 1.00 1.22 H new ATOM 0 HB2 LYS A 23 -22.772 -0.726 6.452 1.00 3.24 H new ATOM 0 HB3 LYS A 23 -23.543 -1.747 7.649 1.00 3.24 H new ATOM 0 HG2 LYS A 23 -23.725 0.141 9.205 1.00 0.13 H new ATOM 0 HG3 LYS A 23 -22.839 1.175 8.102 1.00 0.13 H new ATOM 0 HD2 LYS A 23 -25.408 -0.207 7.266 1.00 21.14 H new ATOM 0 HD3 LYS A 23 -25.424 1.336 8.097 1.00 21.14 H new ATOM 0 HE2 LYS A 23 -23.788 2.157 6.269 1.00 34.14 H new ATOM 0 HE3 LYS A 23 -24.194 0.692 5.398 1.00 34.14 H new ATOM 0 HZ1 LYS A 23 -25.578 2.537 4.703 1.00 52.25 H new ATOM 0 HZ2 LYS A 23 -26.532 1.345 5.445 1.00 52.25 H new ATOM 0 HZ3 LYS A 23 -26.138 2.765 6.289 1.00 52.25 H new ATOM 452 N ALA A 24 -20.902 -3.406 7.237 1.00 13.41 N ATOM 453 CA ALA A 24 -20.722 -4.853 7.269 1.00 3.24 C ATOM 454 C ALA A 24 -19.556 -5.240 8.172 1.00 51.10 C ATOM 455 O ALA A 24 -19.674 -6.141 9.002 1.00 4.13 O ATOM 456 CB ALA A 24 -20.505 -5.389 5.862 1.00 40.14 C ATOM 0 H ALA A 24 -20.635 -2.968 6.355 1.00 13.41 H new ATOM 0 HA ALA A 24 -21.628 -5.299 7.679 1.00 3.24 H new ATOM 0 HB1 ALA A 24 -20.372 -6.470 5.901 1.00 40.14 H new ATOM 0 HB2 ALA A 24 -21.372 -5.152 5.245 1.00 40.14 H new ATOM 0 HB3 ALA A 24 -19.616 -4.929 5.431 1.00 40.14 H new ATOM 462 N VAL A 25 -18.429 -4.555 8.002 1.00 31.44 N ATOM 463 CA VAL A 25 -17.241 -4.828 8.802 1.00 41.24 C ATOM 464 C VAL A 25 -17.442 -4.396 10.250 1.00 33.11 C ATOM 465 O VAL A 25 -17.019 -5.085 11.179 1.00 1.35 O ATOM 466 CB VAL A 25 -16.003 -4.111 8.231 1.00 70.22 C ATOM 467 CG1 VAL A 25 -15.822 -4.450 6.759 1.00 72.31 C ATOM 468 CG2 VAL A 25 -16.120 -2.608 8.430 1.00 61.02 C ATOM 0 H VAL A 25 -18.314 -3.807 7.318 1.00 31.44 H new ATOM 0 HA VAL A 25 -17.077 -5.905 8.767 1.00 41.24 H new ATOM 0 HB VAL A 25 -15.122 -4.458 8.770 1.00 70.22 H new ATOM 0 HG11 VAL A 25 -14.943 -3.935 6.372 1.00 72.31 H new ATOM 0 HG12 VAL A 25 -15.690 -5.526 6.647 1.00 72.31 H new ATOM 0 HG13 VAL A 25 -16.703 -4.132 6.201 1.00 72.31 H new ATOM 0 HG21 VAL A 25 -15.237 -2.117 8.021 1.00 61.02 H new ATOM 0 HG22 VAL A 25 -17.009 -2.241 7.918 1.00 61.02 H new ATOM 0 HG23 VAL A 25 -16.198 -2.387 9.495 1.00 61.02 H new ATOM 478 N SER A 26 -18.091 -3.250 10.435 1.00 72.13 N ATOM 479 CA SER A 26 -18.346 -2.723 11.771 1.00 51.12 C ATOM 480 C SER A 26 -19.259 -3.657 12.558 1.00 32.04 C ATOM 481 O SER A 26 -18.978 -3.996 13.707 1.00 51.34 O ATOM 482 CB SER A 26 -18.975 -1.332 11.681 1.00 64.24 C ATOM 483 OG SER A 26 -19.526 -0.941 12.926 1.00 23.13 O ATOM 0 H SER A 26 -18.449 -2.669 9.677 1.00 72.13 H new ATOM 0 HA SER A 26 -17.393 -2.650 12.294 1.00 51.12 H new ATOM 0 HB2 SER A 26 -18.222 -0.608 11.370 1.00 64.24 H new ATOM 0 HB3 SER A 26 -19.754 -1.330 10.918 1.00 64.24 H new ATOM 0 HG SER A 26 -18.803 -0.782 13.568 1.00 23.13 H new ATOM 489 N ALA A 27 -20.356 -4.069 11.930 1.00 23.43 N ATOM 490 CA ALA A 27 -21.312 -4.965 12.570 1.00 61.12 C ATOM 491 C ALA A 27 -20.701 -6.343 12.801 1.00 34.12 C ATOM 492 O ALA A 27 -21.070 -7.046 13.742 1.00 55.32 O ATOM 493 CB ALA A 27 -22.574 -5.079 11.729 1.00 52.51 C ATOM 0 H ALA A 27 -20.605 -3.797 10.979 1.00 23.43 H new ATOM 0 HA ALA A 27 -21.574 -4.544 13.541 1.00 61.12 H new ATOM 0 HB1 ALA A 27 -23.278 -5.751 12.219 1.00 52.51 H new ATOM 0 HB2 ALA A 27 -23.028 -4.094 11.619 1.00 52.51 H new ATOM 0 HB3 ALA A 27 -22.321 -5.474 10.745 1.00 52.51 H new ATOM 499 N SER A 28 -19.767 -6.725 11.935 1.00 33.40 N ATOM 500 CA SER A 28 -19.110 -8.022 12.043 1.00 14.30 C ATOM 501 C SER A 28 -18.235 -8.086 13.291 1.00 42.41 C ATOM 502 O SER A 28 -17.974 -9.163 13.825 1.00 65.35 O ATOM 503 CB SER A 28 -18.263 -8.292 10.798 1.00 54.23 C ATOM 504 OG SER A 28 -17.724 -9.602 10.822 1.00 73.51 O ATOM 0 H SER A 28 -19.449 -6.155 11.151 1.00 33.40 H new ATOM 0 HA SER A 28 -19.882 -8.788 12.123 1.00 14.30 H new ATOM 0 HB2 SER A 28 -18.873 -8.163 9.904 1.00 54.23 H new ATOM 0 HB3 SER A 28 -17.454 -7.564 10.740 1.00 54.23 H new ATOM 0 HG SER A 28 -17.188 -9.750 10.015 1.00 73.51 H new ATOM 510 N LYS A 29 -17.784 -6.923 13.749 1.00 50.01 N ATOM 511 CA LYS A 29 -16.939 -6.844 14.935 1.00 5.22 C ATOM 512 C LYS A 29 -15.747 -7.788 14.818 1.00 40.10 C ATOM 513 O LYS A 29 -15.566 -8.701 15.624 1.00 34.02 O ATOM 514 CB LYS A 29 -17.750 -7.181 16.188 1.00 72.32 C ATOM 515 CG LYS A 29 -17.027 -6.861 17.485 1.00 2.42 C ATOM 516 CD LYS A 29 -16.658 -8.124 18.244 1.00 72.32 C ATOM 517 CE LYS A 29 -16.756 -7.920 19.749 1.00 51.43 C ATOM 518 NZ LYS A 29 -15.414 -7.857 20.389 1.00 42.14 N ATOM 0 H LYS A 29 -17.990 -6.022 13.317 1.00 50.01 H new ATOM 0 HA LYS A 29 -16.565 -5.824 15.016 1.00 5.22 H new ATOM 0 HB2 LYS A 29 -18.690 -6.631 16.161 1.00 72.32 H new ATOM 0 HB3 LYS A 29 -18.001 -8.242 16.174 1.00 72.32 H new ATOM 0 HG2 LYS A 29 -16.125 -6.289 17.268 1.00 2.42 H new ATOM 0 HG3 LYS A 29 -17.661 -6.232 18.110 1.00 2.42 H new ATOM 0 HD2 LYS A 29 -17.319 -8.937 17.942 1.00 72.32 H new ATOM 0 HD3 LYS A 29 -15.643 -8.424 17.982 1.00 72.32 H new ATOM 0 HE2 LYS A 29 -17.300 -6.999 19.956 1.00 51.43 H new ATOM 0 HE3 LYS A 29 -17.330 -8.735 20.189 1.00 51.43 H new ATOM 0 HZ1 LYS A 29 -15.524 -7.717 21.414 1.00 42.14 H new ATOM 0 HZ2 LYS A 29 -14.904 -8.746 20.214 1.00 42.14 H new ATOM 0 HZ3 LYS A 29 -14.875 -7.063 19.988 1.00 42.14 H new ATOM 532 N PRO A 30 -14.912 -7.564 13.791 1.00 21.41 N ATOM 533 CA PRO A 30 -13.722 -8.384 13.547 1.00 14.52 C ATOM 534 C PRO A 30 -12.642 -8.167 14.600 1.00 62.20 C ATOM 535 O PRO A 30 -12.622 -8.839 15.632 1.00 14.44 O ATOM 536 CB PRO A 30 -13.236 -7.904 12.177 1.00 15.33 C ATOM 537 CG PRO A 30 -13.754 -6.512 12.058 1.00 74.32 C ATOM 538 CD PRO A 30 -15.066 -6.494 12.792 1.00 35.13 C ATOM 0 HA PRO A 30 -13.947 -9.450 13.586 1.00 14.52 H new ATOM 0 HB2 PRO A 30 -12.148 -7.929 12.112 1.00 15.33 H new ATOM 0 HB3 PRO A 30 -13.618 -8.538 11.377 1.00 15.33 H new ATOM 0 HG2 PRO A 30 -13.055 -5.797 12.491 1.00 74.32 H new ATOM 0 HG3 PRO A 30 -13.888 -6.233 11.013 1.00 74.32 H new ATOM 0 HD2 PRO A 30 -15.250 -5.528 13.263 1.00 35.13 H new ATOM 0 HD3 PRO A 30 -15.904 -6.687 12.122 1.00 35.13 H new ATOM 546 N SER A 31 -11.743 -7.224 14.336 1.00 52.51 N ATOM 547 CA SER A 31 -10.657 -6.920 15.260 1.00 32.21 C ATOM 548 C SER A 31 -9.685 -5.917 14.646 1.00 33.12 C ATOM 549 O SER A 31 -9.639 -5.747 13.428 1.00 12.11 O ATOM 550 CB SER A 31 -9.913 -8.201 15.642 1.00 22.40 C ATOM 551 OG SER A 31 -10.119 -9.219 14.678 1.00 24.44 O ATOM 0 H SER A 31 -11.746 -6.657 13.488 1.00 52.51 H new ATOM 0 HA SER A 31 -11.089 -6.477 16.157 1.00 32.21 H new ATOM 0 HB2 SER A 31 -8.847 -7.992 15.733 1.00 22.40 H new ATOM 0 HB3 SER A 31 -10.254 -8.546 16.618 1.00 22.40 H new ATOM 0 HG SER A 31 -9.632 -10.026 14.945 1.00 24.44 H new ATOM 557 N ALA A 32 -8.909 -5.257 15.499 1.00 13.21 N ATOM 558 CA ALA A 32 -7.936 -4.272 15.041 1.00 34.51 C ATOM 559 C ALA A 32 -6.872 -4.921 14.162 1.00 5.24 C ATOM 560 O ALA A 32 -6.235 -4.252 13.349 1.00 1.30 O ATOM 561 CB ALA A 32 -7.290 -3.577 16.230 1.00 20.40 C ATOM 0 H ALA A 32 -8.935 -5.386 16.510 1.00 13.21 H new ATOM 0 HA ALA A 32 -8.461 -3.529 14.442 1.00 34.51 H new ATOM 0 HB1 ALA A 32 -6.566 -2.844 15.874 1.00 20.40 H new ATOM 0 HB2 ALA A 32 -8.057 -3.073 16.818 1.00 20.40 H new ATOM 0 HB3 ALA A 32 -6.783 -4.315 16.852 1.00 20.40 H new ATOM 567 N ASN A 33 -6.685 -6.225 14.331 1.00 24.31 N ATOM 568 CA ASN A 33 -5.696 -6.962 13.553 1.00 22.10 C ATOM 569 C ASN A 33 -6.131 -7.082 12.095 1.00 75.50 C ATOM 570 O ASN A 33 -5.356 -6.804 11.180 1.00 60.33 O ATOM 571 CB ASN A 33 -5.482 -8.355 14.150 1.00 24.32 C ATOM 572 CG ASN A 33 -5.536 -8.348 15.666 1.00 53.55 C ATOM 573 OD1 ASN A 33 -6.608 -8.466 16.260 1.00 24.21 O ATOM 574 ND2 ASN A 33 -4.376 -8.210 16.298 1.00 15.20 N ATOM 0 H ASN A 33 -7.205 -6.794 14.999 1.00 24.31 H new ATOM 0 HA ASN A 33 -4.757 -6.411 13.589 1.00 22.10 H new ATOM 0 HB2 ASN A 33 -6.243 -9.033 13.765 1.00 24.32 H new ATOM 0 HB3 ASN A 33 -4.516 -8.742 13.825 1.00 24.32 H new ATOM 0 HD21 ASN A 33 -4.349 -8.199 17.318 1.00 15.20 H new ATOM 0 HD22 ASN A 33 -3.512 -8.115 15.764 1.00 15.20 H new ATOM 581 N VAL A 34 -7.376 -7.500 11.888 1.00 42.15 N ATOM 582 CA VAL A 34 -7.915 -7.656 10.542 1.00 0.52 C ATOM 583 C VAL A 34 -8.356 -6.313 9.967 1.00 74.53 C ATOM 584 O VAL A 34 -8.204 -6.059 8.774 1.00 2.25 O ATOM 585 CB VAL A 34 -9.111 -8.627 10.525 1.00 63.14 C ATOM 586 CG1 VAL A 34 -9.752 -8.709 11.902 1.00 4.33 C ATOM 587 CG2 VAL A 34 -10.128 -8.200 9.479 1.00 12.41 C ATOM 0 H VAL A 34 -8.030 -7.736 12.634 1.00 42.15 H new ATOM 0 HA VAL A 34 -7.115 -8.066 9.926 1.00 0.52 H new ATOM 0 HB VAL A 34 -8.747 -9.620 10.261 1.00 63.14 H new ATOM 0 HG11 VAL A 34 -10.595 -9.399 11.870 1.00 4.33 H new ATOM 0 HG12 VAL A 34 -9.018 -9.065 12.624 1.00 4.33 H new ATOM 0 HG13 VAL A 34 -10.103 -7.721 12.199 1.00 4.33 H new ATOM 0 HG21 VAL A 34 -10.966 -8.897 9.481 1.00 12.41 H new ATOM 0 HG22 VAL A 34 -10.489 -7.198 9.710 1.00 12.41 H new ATOM 0 HG23 VAL A 34 -9.659 -8.199 8.495 1.00 12.41 H new ATOM 597 N ALA A 35 -8.903 -5.460 10.826 1.00 71.31 N ATOM 598 CA ALA A 35 -9.364 -4.143 10.406 1.00 13.21 C ATOM 599 C ALA A 35 -8.245 -3.360 9.728 1.00 52.23 C ATOM 600 O ALA A 35 -8.463 -2.695 8.716 1.00 2.54 O ATOM 601 CB ALA A 35 -9.906 -3.368 11.597 1.00 31.21 C ATOM 0 H ALA A 35 -9.038 -5.658 11.818 1.00 71.31 H new ATOM 0 HA ALA A 35 -10.166 -4.281 9.681 1.00 13.21 H new ATOM 0 HB1 ALA A 35 -10.247 -2.386 11.268 1.00 31.21 H new ATOM 0 HB2 ALA A 35 -10.741 -3.913 12.036 1.00 31.21 H new ATOM 0 HB3 ALA A 35 -9.119 -3.248 12.342 1.00 31.21 H new ATOM 607 N VAL A 36 -7.044 -3.443 10.293 1.00 35.33 N ATOM 608 CA VAL A 36 -5.890 -2.743 9.743 1.00 42.44 C ATOM 609 C VAL A 36 -5.510 -3.299 8.375 1.00 14.12 C ATOM 610 O VAL A 36 -5.129 -2.553 7.474 1.00 11.22 O ATOM 611 CB VAL A 36 -4.673 -2.843 10.681 1.00 71.43 C ATOM 612 CG1 VAL A 36 -3.425 -2.304 9.998 1.00 11.02 C ATOM 613 CG2 VAL A 36 -4.941 -2.101 11.982 1.00 61.04 C ATOM 0 H VAL A 36 -6.846 -3.989 11.132 1.00 35.33 H new ATOM 0 HA VAL A 36 -6.175 -1.696 9.640 1.00 42.44 H new ATOM 0 HB VAL A 36 -4.504 -3.894 10.916 1.00 71.43 H new ATOM 0 HG11 VAL A 36 -2.576 -2.383 10.677 1.00 11.02 H new ATOM 0 HG12 VAL A 36 -3.224 -2.883 9.097 1.00 11.02 H new ATOM 0 HG13 VAL A 36 -3.579 -1.259 9.730 1.00 11.02 H new ATOM 0 HG21 VAL A 36 -4.071 -2.182 12.633 1.00 61.04 H new ATOM 0 HG22 VAL A 36 -5.137 -1.050 11.768 1.00 61.04 H new ATOM 0 HG23 VAL A 36 -5.807 -2.538 12.478 1.00 61.04 H new ATOM 623 N ALA A 37 -5.618 -4.616 8.227 1.00 43.32 N ATOM 624 CA ALA A 37 -5.287 -5.272 6.968 1.00 13.32 C ATOM 625 C ALA A 37 -6.307 -4.930 5.886 1.00 61.40 C ATOM 626 O ALA A 37 -5.957 -4.780 4.716 1.00 53.43 O ATOM 627 CB ALA A 37 -5.208 -6.779 7.163 1.00 13.04 C ATOM 0 H ALA A 37 -5.932 -5.249 8.963 1.00 43.32 H new ATOM 0 HA ALA A 37 -4.313 -4.907 6.642 1.00 13.32 H new ATOM 0 HB1 ALA A 37 -4.960 -7.256 6.215 1.00 13.04 H new ATOM 0 HB2 ALA A 37 -4.437 -7.011 7.898 1.00 13.04 H new ATOM 0 HB3 ALA A 37 -6.170 -7.151 7.516 1.00 13.04 H new ATOM 633 N ILE A 38 -7.568 -4.809 6.287 1.00 32.11 N ATOM 634 CA ILE A 38 -8.638 -4.484 5.351 1.00 62.12 C ATOM 635 C ILE A 38 -8.533 -3.038 4.878 1.00 54.40 C ATOM 636 O ILE A 38 -8.703 -2.748 3.692 1.00 21.53 O ATOM 637 CB ILE A 38 -10.025 -4.706 5.984 1.00 50.54 C ATOM 638 CG1 ILE A 38 -10.226 -6.185 6.317 1.00 73.42 C ATOM 639 CG2 ILE A 38 -11.119 -4.216 5.045 1.00 63.51 C ATOM 640 CD1 ILE A 38 -11.456 -6.454 7.157 1.00 4.12 C ATOM 0 H ILE A 38 -7.874 -4.931 7.252 1.00 32.11 H new ATOM 0 HA ILE A 38 -8.526 -5.152 4.497 1.00 62.12 H new ATOM 0 HB ILE A 38 -10.083 -4.133 6.910 1.00 50.54 H new ATOM 0 HG12 ILE A 38 -10.299 -6.751 5.389 1.00 73.42 H new ATOM 0 HG13 ILE A 38 -9.347 -6.553 6.846 1.00 73.42 H new ATOM 0 HG21 ILE A 38 -12.094 -4.379 5.505 1.00 63.51 H new ATOM 0 HG22 ILE A 38 -10.983 -3.152 4.851 1.00 63.51 H new ATOM 0 HG23 ILE A 38 -11.065 -4.766 4.105 1.00 63.51 H new ATOM 0 HD11 ILE A 38 -11.535 -7.523 7.354 1.00 4.12 H new ATOM 0 HD12 ILE A 38 -11.377 -5.915 8.101 1.00 4.12 H new ATOM 0 HD13 ILE A 38 -12.343 -6.117 6.621 1.00 4.12 H new ATOM 652 N VAL A 39 -8.251 -2.134 5.810 1.00 63.04 N ATOM 653 CA VAL A 39 -8.120 -0.718 5.487 1.00 74.14 C ATOM 654 C VAL A 39 -6.859 -0.455 4.671 1.00 34.12 C ATOM 655 O VAL A 39 -6.854 0.383 3.769 1.00 52.42 O ATOM 656 CB VAL A 39 -8.085 0.146 6.762 1.00 44.51 C ATOM 657 CG1 VAL A 39 -6.887 -0.222 7.624 1.00 74.11 C ATOM 658 CG2 VAL A 39 -8.057 1.624 6.401 1.00 3.35 C ATOM 0 H VAL A 39 -8.109 -2.357 6.795 1.00 63.04 H new ATOM 0 HA VAL A 39 -8.994 -0.445 4.896 1.00 74.14 H new ATOM 0 HB VAL A 39 -8.990 -0.049 7.338 1.00 44.51 H new ATOM 0 HG11 VAL A 39 -6.879 0.399 8.520 1.00 74.11 H new ATOM 0 HG12 VAL A 39 -6.953 -1.272 7.910 1.00 74.11 H new ATOM 0 HG13 VAL A 39 -5.969 -0.057 7.060 1.00 74.11 H new ATOM 0 HG21 VAL A 39 -8.032 2.221 7.313 1.00 3.35 H new ATOM 0 HG22 VAL A 39 -7.170 1.836 5.804 1.00 3.35 H new ATOM 0 HG23 VAL A 39 -8.949 1.875 5.827 1.00 3.35 H new ATOM 668 N THR A 40 -5.790 -1.176 4.994 1.00 34.34 N ATOM 669 CA THR A 40 -4.523 -1.020 4.292 1.00 63.40 C ATOM 670 C THR A 40 -4.675 -1.328 2.807 1.00 2.11 C ATOM 671 O THR A 40 -4.109 -0.638 1.959 1.00 11.54 O ATOM 672 CB THR A 40 -3.436 -1.936 4.885 1.00 64.32 C ATOM 673 OG1 THR A 40 -4.008 -3.194 5.263 1.00 64.33 O ATOM 674 CG2 THR A 40 -2.782 -1.286 6.096 1.00 0.42 C ATOM 0 H THR A 40 -5.777 -1.874 5.738 1.00 34.34 H new ATOM 0 HA THR A 40 -4.220 0.020 4.416 1.00 63.40 H new ATOM 0 HB THR A 40 -2.673 -2.098 4.123 1.00 64.32 H new ATOM 0 HG1 THR A 40 -4.736 -3.421 4.647 1.00 64.33 H new ATOM 0 HG21 THR A 40 -2.018 -1.951 6.498 1.00 0.42 H new ATOM 0 HG22 THR A 40 -2.323 -0.343 5.799 1.00 0.42 H new ATOM 0 HG23 THR A 40 -3.537 -1.097 6.860 1.00 0.42 H new ATOM 682 N SER A 41 -5.445 -2.368 2.499 1.00 44.23 N ATOM 683 CA SER A 41 -5.669 -2.768 1.115 1.00 73.11 C ATOM 684 C SER A 41 -6.279 -1.625 0.310 1.00 3.41 C ATOM 685 O SER A 41 -5.866 -1.355 -0.818 1.00 32.32 O ATOM 686 CB SER A 41 -6.585 -3.992 1.059 1.00 51.11 C ATOM 687 OG SER A 41 -6.076 -5.048 1.856 1.00 10.51 O ATOM 0 H SER A 41 -5.923 -2.948 3.189 1.00 44.23 H new ATOM 0 HA SER A 41 -4.705 -3.023 0.676 1.00 73.11 H new ATOM 0 HB2 SER A 41 -7.582 -3.720 1.405 1.00 51.11 H new ATOM 0 HB3 SER A 41 -6.686 -4.327 0.027 1.00 51.11 H new ATOM 0 HG SER A 41 -6.223 -4.843 2.803 1.00 10.51 H new ATOM 693 N GLY A 42 -7.265 -0.955 0.899 1.00 41.21 N ATOM 694 CA GLY A 42 -7.917 0.152 0.224 1.00 53.20 C ATOM 695 C GLY A 42 -7.040 1.386 0.153 1.00 61.15 C ATOM 696 O GLY A 42 -7.039 2.099 -0.851 1.00 23.34 O ATOM 0 H GLY A 42 -7.624 -1.159 1.832 1.00 41.21 H new ATOM 0 HA2 GLY A 42 -8.192 -0.153 -0.786 1.00 53.20 H new ATOM 0 HA3 GLY A 42 -8.842 0.397 0.746 1.00 53.20 H new ATOM 700 N LEU A 43 -6.292 1.639 1.221 1.00 51.14 N ATOM 701 CA LEU A 43 -5.406 2.797 1.277 1.00 14.04 C ATOM 702 C LEU A 43 -4.330 2.713 0.200 1.00 24.21 C ATOM 703 O LEU A 43 -4.033 3.699 -0.475 1.00 64.14 O ATOM 704 CB LEU A 43 -4.755 2.899 2.658 1.00 20.00 C ATOM 705 CG LEU A 43 -5.652 3.408 3.788 1.00 14.42 C ATOM 706 CD1 LEU A 43 -4.963 3.239 5.133 1.00 11.51 C ATOM 707 CD2 LEU A 43 -6.027 4.865 3.556 1.00 72.24 C ATOM 0 H LEU A 43 -6.281 1.058 2.060 1.00 51.14 H new ATOM 0 HA LEU A 43 -6.004 3.690 1.097 1.00 14.04 H new ATOM 0 HB2 LEU A 43 -4.380 1.913 2.935 1.00 20.00 H new ATOM 0 HB3 LEU A 43 -3.891 3.559 2.582 1.00 20.00 H new ATOM 0 HG LEU A 43 -6.567 2.816 3.796 1.00 14.42 H new ATOM 0 HD11 LEU A 43 -5.616 3.606 5.925 1.00 11.51 H new ATOM 0 HD12 LEU A 43 -4.747 2.184 5.301 1.00 11.51 H new ATOM 0 HD13 LEU A 43 -4.032 3.805 5.138 1.00 11.51 H new ATOM 0 HD21 LEU A 43 -6.665 5.210 4.369 1.00 72.24 H new ATOM 0 HD22 LEU A 43 -5.123 5.472 3.521 1.00 72.24 H new ATOM 0 HD23 LEU A 43 -6.562 4.957 2.611 1.00 72.24 H new ATOM 719 N LYS A 44 -3.750 1.528 0.042 1.00 41.20 N ATOM 720 CA LYS A 44 -2.709 1.313 -0.956 1.00 32.33 C ATOM 721 C LYS A 44 -3.262 1.488 -2.367 1.00 21.24 C ATOM 722 O LYS A 44 -2.623 2.099 -3.224 1.00 72.43 O ATOM 723 CB LYS A 44 -2.109 -0.088 -0.803 1.00 2.33 C ATOM 724 CG LYS A 44 -0.868 -0.125 0.070 1.00 63.43 C ATOM 725 CD LYS A 44 -1.107 0.551 1.410 1.00 41.03 C ATOM 726 CE LYS A 44 0.124 0.474 2.300 1.00 25.54 C ATOM 727 NZ LYS A 44 -0.177 -0.175 3.607 1.00 41.02 N ATOM 0 H LYS A 44 -3.983 0.702 0.593 1.00 41.20 H new ATOM 0 HA LYS A 44 -1.928 2.057 -0.796 1.00 32.33 H new ATOM 0 HB2 LYS A 44 -2.862 -0.752 -0.378 1.00 2.33 H new ATOM 0 HB3 LYS A 44 -1.860 -0.478 -1.790 1.00 2.33 H new ATOM 0 HG2 LYS A 44 -0.567 -1.160 0.232 1.00 63.43 H new ATOM 0 HG3 LYS A 44 -0.045 0.369 -0.446 1.00 63.43 H new ATOM 0 HD2 LYS A 44 -1.376 1.595 1.249 1.00 41.03 H new ATOM 0 HD3 LYS A 44 -1.951 0.078 1.912 1.00 41.03 H new ATOM 0 HE2 LYS A 44 0.908 -0.085 1.789 1.00 25.54 H new ATOM 0 HE3 LYS A 44 0.510 1.478 2.473 1.00 25.54 H new ATOM 0 HZ1 LYS A 44 0.613 -0.015 4.264 1.00 41.02 H new ATOM 0 HZ2 LYS A 44 -1.047 0.233 4.005 1.00 41.02 H new ATOM 0 HZ3 LYS A 44 -0.308 -1.197 3.465 1.00 41.02 H new ATOM 741 N LYS A 45 -4.455 0.952 -2.601 1.00 35.21 N ATOM 742 CA LYS A 45 -5.097 1.052 -3.906 1.00 61.41 C ATOM 743 C LYS A 45 -5.511 2.490 -4.200 1.00 51.22 C ATOM 744 O LYS A 45 -5.311 2.990 -5.307 1.00 73.32 O ATOM 745 CB LYS A 45 -6.321 0.134 -3.967 1.00 44.45 C ATOM 746 CG LYS A 45 -7.051 0.184 -5.297 1.00 54.20 C ATOM 747 CD LYS A 45 -6.621 -0.951 -6.213 1.00 4.32 C ATOM 748 CE LYS A 45 -7.673 -1.238 -7.275 1.00 60.34 C ATOM 749 NZ LYS A 45 -7.249 -0.759 -8.619 1.00 41.12 N ATOM 0 H LYS A 45 -4.997 0.443 -1.903 1.00 35.21 H new ATOM 0 HA LYS A 45 -4.377 0.738 -4.662 1.00 61.41 H new ATOM 0 HB2 LYS A 45 -6.006 -0.891 -3.773 1.00 44.45 H new ATOM 0 HB3 LYS A 45 -7.013 0.411 -3.171 1.00 44.45 H new ATOM 0 HG2 LYS A 45 -8.126 0.127 -5.125 1.00 54.20 H new ATOM 0 HG3 LYS A 45 -6.856 1.139 -5.784 1.00 54.20 H new ATOM 0 HD2 LYS A 45 -5.677 -0.694 -6.694 1.00 4.32 H new ATOM 0 HD3 LYS A 45 -6.444 -1.850 -5.622 1.00 4.32 H new ATOM 0 HE2 LYS A 45 -7.865 -2.310 -7.316 1.00 60.34 H new ATOM 0 HE3 LYS A 45 -8.611 -0.757 -6.997 1.00 60.34 H new ATOM 0 HZ1 LYS A 45 -7.992 -0.973 -9.314 1.00 41.12 H new ATOM 0 HZ2 LYS A 45 -7.090 0.268 -8.587 1.00 41.12 H new ATOM 0 HZ3 LYS A 45 -6.368 -1.237 -8.896 1.00 41.12 H new ATOM 763 N ALA A 46 -6.089 3.150 -3.202 1.00 32.02 N ATOM 764 CA ALA A 46 -6.528 4.532 -3.352 1.00 51.50 C ATOM 765 C ALA A 46 -5.359 5.443 -3.713 1.00 14.15 C ATOM 766 O ALA A 46 -5.445 6.238 -4.650 1.00 1.14 O ATOM 767 CB ALA A 46 -7.201 5.014 -2.077 1.00 22.41 C ATOM 0 H ALA A 46 -6.264 2.750 -2.280 1.00 32.02 H new ATOM 0 HA ALA A 46 -7.250 4.571 -4.167 1.00 51.50 H new ATOM 0 HB1 ALA A 46 -7.523 6.047 -2.204 1.00 22.41 H new ATOM 0 HB2 ALA A 46 -8.067 4.387 -1.863 1.00 22.41 H new ATOM 0 HB3 ALA A 46 -6.496 4.953 -1.248 1.00 22.41 H new ATOM 773 N LEU A 47 -4.269 5.322 -2.965 1.00 1.13 N ATOM 774 CA LEU A 47 -3.082 6.137 -3.205 1.00 75.03 C ATOM 775 C LEU A 47 -2.422 5.759 -4.528 1.00 32.02 C ATOM 776 O LEU A 47 -1.876 6.611 -5.226 1.00 5.13 O ATOM 777 CB LEU A 47 -2.084 5.970 -2.059 1.00 22.21 C ATOM 778 CG LEU A 47 -2.625 6.238 -0.654 1.00 70.32 C ATOM 779 CD1 LEU A 47 -1.866 5.418 0.377 1.00 64.23 C ATOM 780 CD2 LEU A 47 -2.541 7.721 -0.324 1.00 3.25 C ATOM 0 H LEU A 47 -4.181 4.668 -2.187 1.00 1.13 H new ATOM 0 HA LEU A 47 -3.392 7.181 -3.259 1.00 75.03 H new ATOM 0 HB2 LEU A 47 -1.694 4.953 -2.089 1.00 22.21 H new ATOM 0 HB3 LEU A 47 -1.242 6.639 -2.236 1.00 22.21 H new ATOM 0 HG LEU A 47 -3.673 5.938 -0.627 1.00 70.32 H new ATOM 0 HD11 LEU A 47 -2.266 5.623 1.370 1.00 64.23 H new ATOM 0 HD12 LEU A 47 -1.978 4.357 0.152 1.00 64.23 H new ATOM 0 HD13 LEU A 47 -0.810 5.686 0.349 1.00 64.23 H new ATOM 0 HD21 LEU A 47 -2.930 7.893 0.679 1.00 3.25 H new ATOM 0 HD22 LEU A 47 -1.502 8.046 -0.371 1.00 3.25 H new ATOM 0 HD23 LEU A 47 -3.131 8.288 -1.044 1.00 3.25 H new ATOM 792 N GLY A 48 -2.479 4.475 -4.867 1.00 32.41 N ATOM 793 CA GLY A 48 -1.885 4.007 -6.105 1.00 60.02 C ATOM 794 C GLY A 48 -2.658 4.463 -7.327 1.00 72.23 C ATOM 795 O GLY A 48 -2.073 4.721 -8.379 1.00 13.25 O ATOM 0 H GLY A 48 -2.926 3.750 -4.306 1.00 32.41 H new ATOM 0 HA2 GLY A 48 -0.859 4.369 -6.172 1.00 60.02 H new ATOM 0 HA3 GLY A 48 -1.839 2.918 -6.093 1.00 60.02 H new ATOM 799 N ALA A 49 -3.976 4.560 -7.189 1.00 2.24 N ATOM 800 CA ALA A 49 -4.830 4.989 -8.290 1.00 62.14 C ATOM 801 C ALA A 49 -4.821 6.507 -8.434 1.00 72.32 C ATOM 802 O ALA A 49 -5.154 7.042 -9.492 1.00 64.20 O ATOM 803 CB ALA A 49 -6.250 4.483 -8.084 1.00 63.04 C ATOM 0 H ALA A 49 -4.476 4.347 -6.326 1.00 2.24 H new ATOM 0 HA ALA A 49 -4.434 4.562 -9.212 1.00 62.14 H new ATOM 0 HB1 ALA A 49 -6.877 4.811 -8.913 1.00 63.04 H new ATOM 0 HB2 ALA A 49 -6.245 3.394 -8.041 1.00 63.04 H new ATOM 0 HB3 ALA A 49 -6.646 4.882 -7.150 1.00 63.04 H new ATOM 809 N LEU A 50 -4.441 7.195 -7.363 1.00 51.43 N ATOM 810 CA LEU A 50 -4.390 8.654 -7.369 1.00 75.42 C ATOM 811 C LEU A 50 -2.967 9.148 -7.607 1.00 73.11 C ATOM 812 O LEU A 50 -2.677 10.333 -7.451 1.00 12.33 O ATOM 813 CB LEU A 50 -4.920 9.207 -6.045 1.00 0.34 C ATOM 814 CG LEU A 50 -6.420 9.503 -5.994 1.00 31.50 C ATOM 815 CD1 LEU A 50 -6.950 9.326 -4.580 1.00 4.21 C ATOM 816 CD2 LEU A 50 -6.704 10.909 -6.500 1.00 43.11 C ATOM 0 H LEU A 50 -4.164 6.767 -6.480 1.00 51.43 H new ATOM 0 HA LEU A 50 -5.020 9.012 -8.183 1.00 75.42 H new ATOM 0 HB2 LEU A 50 -4.684 8.494 -5.256 1.00 0.34 H new ATOM 0 HB3 LEU A 50 -4.381 10.126 -5.816 1.00 0.34 H new ATOM 0 HG LEU A 50 -6.933 8.795 -6.644 1.00 31.50 H new ATOM 0 HD11 LEU A 50 -8.019 9.541 -4.562 1.00 4.21 H new ATOM 0 HD12 LEU A 50 -6.781 8.300 -4.254 1.00 4.21 H new ATOM 0 HD13 LEU A 50 -6.431 10.010 -3.909 1.00 4.21 H new ATOM 0 HD21 LEU A 50 -7.776 11.102 -6.456 1.00 43.11 H new ATOM 0 HD22 LEU A 50 -6.179 11.633 -5.876 1.00 43.11 H new ATOM 0 HD23 LEU A 50 -6.360 11.001 -7.530 1.00 43.11 H new ATOM 828 N ARG A 51 -2.084 8.230 -7.987 1.00 41.34 N ATOM 829 CA ARG A 51 -0.690 8.573 -8.247 1.00 2.51 C ATOM 830 C ARG A 51 -0.090 9.339 -7.072 1.00 55.33 C ATOM 831 O ARG A 51 0.799 10.172 -7.251 1.00 11.23 O ATOM 832 CB ARG A 51 -0.579 9.408 -9.524 1.00 42.33 C ATOM 833 CG ARG A 51 -0.746 8.597 -10.800 1.00 23.54 C ATOM 834 CD ARG A 51 -2.106 8.835 -11.437 1.00 44.21 C ATOM 835 NE ARG A 51 -2.293 8.033 -12.642 1.00 54.11 N ATOM 836 CZ ARG A 51 -3.478 7.814 -13.202 1.00 64.03 C ATOM 837 NH1 ARG A 51 -4.573 8.335 -12.668 1.00 13.32 N ATOM 838 NH2 ARG A 51 -3.568 7.072 -14.299 1.00 64.02 N ATOM 0 H ARG A 51 -2.308 7.244 -8.122 1.00 41.34 H new ATOM 0 HA ARG A 51 -0.132 7.646 -8.377 1.00 2.51 H new ATOM 0 HB2 ARG A 51 -1.335 10.193 -9.501 1.00 42.33 H new ATOM 0 HB3 ARG A 51 0.393 9.901 -9.542 1.00 42.33 H new ATOM 0 HG2 ARG A 51 0.040 8.863 -11.507 1.00 23.54 H new ATOM 0 HG3 ARG A 51 -0.628 7.537 -10.577 1.00 23.54 H new ATOM 0 HD2 ARG A 51 -2.890 8.597 -10.718 1.00 44.21 H new ATOM 0 HD3 ARG A 51 -2.211 9.891 -11.685 1.00 44.21 H new ATOM 0 HE ARG A 51 -1.469 7.618 -13.078 1.00 54.11 H new ATOM 0 HH11 ARG A 51 -4.508 8.906 -11.825 1.00 13.32 H new ATOM 0 HH12 ARG A 51 -5.481 8.165 -13.100 1.00 13.32 H new ATOM 0 HH21 ARG A 51 -2.727 6.669 -14.713 1.00 64.02 H new ATOM 0 HH22 ARG A 51 -4.478 6.904 -14.728 1.00 64.02 H new ATOM 852 N ILE A 52 -0.583 9.051 -5.872 1.00 65.24 N ATOM 853 CA ILE A 52 -0.094 9.712 -4.668 1.00 64.31 C ATOM 854 C ILE A 52 1.346 9.311 -4.366 1.00 0.02 C ATOM 855 O ILE A 52 1.710 8.141 -4.473 1.00 51.42 O ATOM 856 CB ILE A 52 -0.974 9.382 -3.448 1.00 2.41 C ATOM 857 CG1 ILE A 52 -2.417 9.826 -3.697 1.00 2.10 C ATOM 858 CG2 ILE A 52 -0.417 10.047 -2.198 1.00 20.11 C ATOM 859 CD1 ILE A 52 -2.568 11.323 -3.859 1.00 15.23 C ATOM 0 H ILE A 52 -1.320 8.365 -5.708 1.00 65.24 H new ATOM 0 HA ILE A 52 -0.137 10.785 -4.857 1.00 64.31 H new ATOM 0 HB ILE A 52 -0.968 8.303 -3.295 1.00 2.41 H new ATOM 0 HG12 ILE A 52 -2.791 9.332 -4.594 1.00 2.10 H new ATOM 0 HG13 ILE A 52 -3.040 9.494 -2.866 1.00 2.10 H new ATOM 0 HG21 ILE A 52 -1.050 9.805 -1.344 1.00 20.11 H new ATOM 0 HG22 ILE A 52 0.595 9.686 -2.014 1.00 20.11 H new ATOM 0 HG23 ILE A 52 -0.397 11.128 -2.339 1.00 20.11 H new ATOM 0 HD11 ILE A 52 -3.616 11.566 -4.032 1.00 15.23 H new ATOM 0 HD12 ILE A 52 -2.224 11.823 -2.954 1.00 15.23 H new ATOM 0 HD13 ILE A 52 -1.972 11.659 -4.708 1.00 15.23 H new ATOM 871 N ASN A 53 2.160 10.290 -3.986 1.00 22.52 N ATOM 872 CA ASN A 53 3.561 10.039 -3.666 1.00 13.34 C ATOM 873 C ASN A 53 3.694 8.891 -2.669 1.00 12.32 C ATOM 874 O ASN A 53 2.935 8.803 -1.705 1.00 71.34 O ATOM 875 CB ASN A 53 4.210 11.302 -3.097 1.00 24.20 C ATOM 876 CG ASN A 53 5.387 10.990 -2.192 1.00 71.01 C ATOM 877 OD1 ASN A 53 6.272 10.214 -2.553 1.00 41.00 O ATOM 878 ND2 ASN A 53 5.402 11.594 -1.010 1.00 13.20 N ATOM 0 H ASN A 53 1.874 11.265 -3.892 1.00 22.52 H new ATOM 0 HA ASN A 53 4.074 9.759 -4.586 1.00 13.34 H new ATOM 0 HB2 ASN A 53 4.544 11.937 -3.918 1.00 24.20 H new ATOM 0 HB3 ASN A 53 3.466 11.869 -2.538 1.00 24.20 H new ATOM 0 HD21 ASN A 53 6.168 11.422 -0.359 1.00 13.20 H new ATOM 0 HD22 ASN A 53 4.647 12.230 -0.753 1.00 13.20 H new ATOM 885 N ALA A 54 4.665 8.016 -2.910 1.00 35.13 N ATOM 886 CA ALA A 54 4.899 6.875 -2.032 1.00 51.30 C ATOM 887 C ALA A 54 5.227 7.332 -0.615 1.00 11.34 C ATOM 888 O ALA A 54 4.801 6.715 0.361 1.00 54.35 O ATOM 889 CB ALA A 54 6.022 6.009 -2.583 1.00 34.42 C ATOM 0 H ALA A 54 5.302 8.075 -3.705 1.00 35.13 H new ATOM 0 HA ALA A 54 3.984 6.283 -1.992 1.00 51.30 H new ATOM 0 HB1 ALA A 54 6.187 5.161 -1.919 1.00 34.42 H new ATOM 0 HB2 ALA A 54 5.749 5.646 -3.574 1.00 34.42 H new ATOM 0 HB3 ALA A 54 6.936 6.599 -2.652 1.00 34.42 H new ATOM 895 N GLY A 55 5.986 8.417 -0.508 1.00 44.32 N ATOM 896 CA GLY A 55 6.359 8.938 0.794 1.00 61.31 C ATOM 897 C GLY A 55 5.154 9.254 1.658 1.00 43.24 C ATOM 898 O GLY A 55 5.066 8.808 2.802 1.00 65.20 O ATOM 0 H GLY A 55 6.350 8.946 -1.301 1.00 44.32 H new ATOM 0 HA2 GLY A 55 6.989 8.211 1.306 1.00 61.31 H new ATOM 0 HA3 GLY A 55 6.956 9.841 0.664 1.00 61.31 H new ATOM 902 N VAL A 56 4.222 10.029 1.111 1.00 4.30 N ATOM 903 CA VAL A 56 3.017 10.406 1.839 1.00 61.33 C ATOM 904 C VAL A 56 2.060 9.227 1.965 1.00 32.31 C ATOM 905 O VAL A 56 1.362 9.084 2.970 1.00 45.32 O ATOM 906 CB VAL A 56 2.287 11.574 1.149 1.00 61.12 C ATOM 907 CG1 VAL A 56 1.944 11.215 -0.288 1.00 2.41 C ATOM 908 CG2 VAL A 56 1.035 11.952 1.926 1.00 64.23 C ATOM 0 H VAL A 56 4.279 10.408 0.166 1.00 4.30 H new ATOM 0 HA VAL A 56 3.333 10.721 2.833 1.00 61.33 H new ATOM 0 HB VAL A 56 2.952 12.437 1.133 1.00 61.12 H new ATOM 0 HG11 VAL A 56 1.429 12.052 -0.759 1.00 2.41 H new ATOM 0 HG12 VAL A 56 2.860 10.997 -0.837 1.00 2.41 H new ATOM 0 HG13 VAL A 56 1.297 10.338 -0.299 1.00 2.41 H new ATOM 0 HG21 VAL A 56 0.531 12.779 1.425 1.00 64.23 H new ATOM 0 HG22 VAL A 56 0.364 11.094 1.975 1.00 64.23 H new ATOM 0 HG23 VAL A 56 1.311 12.254 2.936 1.00 64.23 H new ATOM 918 N SER A 57 2.032 8.381 0.940 1.00 40.03 N ATOM 919 CA SER A 57 1.158 7.214 0.934 1.00 1.14 C ATOM 920 C SER A 57 1.608 6.194 1.975 1.00 53.21 C ATOM 921 O SER A 57 0.827 5.345 2.405 1.00 34.31 O ATOM 922 CB SER A 57 1.140 6.571 -0.454 1.00 21.03 C ATOM 923 OG SER A 57 0.964 5.168 -0.363 1.00 41.33 O ATOM 0 H SER A 57 2.605 8.482 0.102 1.00 40.03 H new ATOM 0 HA SER A 57 0.150 7.544 1.186 1.00 1.14 H new ATOM 0 HB2 SER A 57 0.335 7.004 -1.049 1.00 21.03 H new ATOM 0 HB3 SER A 57 2.073 6.791 -0.972 1.00 21.03 H new ATOM 0 HG SER A 57 0.954 4.780 -1.263 1.00 41.33 H new ATOM 929 N SER A 58 2.872 6.282 2.374 1.00 4.42 N ATOM 930 CA SER A 58 3.429 5.364 3.361 1.00 5.31 C ATOM 931 C SER A 58 3.022 5.774 4.773 1.00 42.03 C ATOM 932 O SER A 58 2.602 4.941 5.575 1.00 74.21 O ATOM 933 CB SER A 58 4.954 5.325 3.248 1.00 30.24 C ATOM 934 OG SER A 58 5.552 5.075 4.509 1.00 31.05 O ATOM 0 H SER A 58 3.531 6.980 2.029 1.00 4.42 H new ATOM 0 HA SER A 58 3.032 4.369 3.162 1.00 5.31 H new ATOM 0 HB2 SER A 58 5.250 4.550 2.541 1.00 30.24 H new ATOM 0 HB3 SER A 58 5.317 6.273 2.851 1.00 30.24 H new ATOM 0 HG SER A 58 6.527 5.053 4.410 1.00 31.05 H new ATOM 940 N GLN A 59 3.151 7.063 5.069 1.00 63.13 N ATOM 941 CA GLN A 59 2.799 7.584 6.385 1.00 33.44 C ATOM 942 C GLN A 59 1.287 7.578 6.585 1.00 32.33 C ATOM 943 O GLN A 59 0.797 7.348 7.692 1.00 14.13 O ATOM 944 CB GLN A 59 3.343 9.003 6.558 1.00 14.13 C ATOM 945 CG GLN A 59 2.840 9.980 5.507 1.00 35.31 C ATOM 946 CD GLN A 59 3.575 11.305 5.543 1.00 55.34 C ATOM 947 OE1 GLN A 59 4.717 11.381 5.997 1.00 11.21 O ATOM 948 NE2 GLN A 59 2.924 12.357 5.061 1.00 54.12 N ATOM 0 H GLN A 59 3.497 7.766 4.416 1.00 63.13 H new ATOM 0 HA GLN A 59 3.250 6.936 7.137 1.00 33.44 H new ATOM 0 HB2 GLN A 59 3.067 9.371 7.546 1.00 14.13 H new ATOM 0 HB3 GLN A 59 4.432 8.973 6.522 1.00 14.13 H new ATOM 0 HG2 GLN A 59 2.951 9.534 4.519 1.00 35.31 H new ATOM 0 HG3 GLN A 59 1.775 10.155 5.659 1.00 35.31 H new ATOM 0 HE21 GLN A 59 1.978 12.248 4.695 1.00 54.12 H new ATOM 0 HE22 GLN A 59 3.369 13.275 5.057 1.00 54.12 H new ATOM 957 N LEU A 60 0.551 7.832 5.509 1.00 53.52 N ATOM 958 CA LEU A 60 -0.906 7.856 5.565 1.00 61.11 C ATOM 959 C LEU A 60 -1.456 6.512 6.032 1.00 63.12 C ATOM 960 O LEU A 60 -2.403 6.455 6.817 1.00 65.22 O ATOM 961 CB LEU A 60 -1.484 8.206 4.192 1.00 1.02 C ATOM 962 CG LEU A 60 -2.973 8.552 4.159 1.00 22.44 C ATOM 963 CD1 LEU A 60 -3.181 9.968 3.646 1.00 44.24 C ATOM 964 CD2 LEU A 60 -3.733 7.554 3.299 1.00 50.05 C ATOM 0 H LEU A 60 0.940 8.024 4.586 1.00 53.52 H new ATOM 0 HA LEU A 60 -1.204 8.620 6.284 1.00 61.11 H new ATOM 0 HB2 LEU A 60 -0.926 9.052 3.790 1.00 1.02 H new ATOM 0 HB3 LEU A 60 -1.312 7.363 3.522 1.00 1.02 H new ATOM 0 HG LEU A 60 -3.362 8.496 5.176 1.00 22.44 H new ATOM 0 HD11 LEU A 60 -4.247 10.196 3.630 1.00 44.24 H new ATOM 0 HD12 LEU A 60 -2.669 10.672 4.303 1.00 44.24 H new ATOM 0 HD13 LEU A 60 -2.776 10.053 2.637 1.00 44.24 H new ATOM 0 HD21 LEU A 60 -4.791 7.816 3.287 1.00 50.05 H new ATOM 0 HD22 LEU A 60 -3.342 7.578 2.282 1.00 50.05 H new ATOM 0 HD23 LEU A 60 -3.612 6.552 3.711 1.00 50.05 H new ATOM 976 N THR A 61 -0.852 5.431 5.547 1.00 15.24 N ATOM 977 CA THR A 61 -1.280 4.088 5.916 1.00 13.12 C ATOM 978 C THR A 61 -0.924 3.775 7.365 1.00 12.23 C ATOM 979 O THR A 61 -1.721 3.191 8.098 1.00 24.23 O ATOM 980 CB THR A 61 -0.642 3.024 5.001 1.00 21.04 C ATOM 981 OG1 THR A 61 0.716 3.376 4.715 1.00 14.33 O ATOM 982 CG2 THR A 61 -1.422 2.890 3.702 1.00 11.11 C ATOM 0 H THR A 61 -0.065 5.460 4.898 1.00 15.24 H new ATOM 0 HA THR A 61 -2.363 4.058 5.797 1.00 13.12 H new ATOM 0 HB THR A 61 -0.667 2.066 5.521 1.00 21.04 H new ATOM 0 HG1 THR A 61 1.065 3.945 5.433 1.00 14.33 H new ATOM 0 HG21 THR A 61 -0.953 2.134 3.072 1.00 11.11 H new ATOM 0 HG22 THR A 61 -2.448 2.594 3.922 1.00 11.11 H new ATOM 0 HG23 THR A 61 -1.425 3.846 3.179 1.00 11.11 H new ATOM 990 N SER A 62 0.278 4.169 7.772 1.00 42.45 N ATOM 991 CA SER A 62 0.742 3.928 9.133 1.00 74.43 C ATOM 992 C SER A 62 -0.159 4.629 10.145 1.00 44.31 C ATOM 993 O SER A 62 -0.463 4.083 11.204 1.00 20.50 O ATOM 994 CB SER A 62 2.184 4.410 9.296 1.00 65.55 C ATOM 995 OG SER A 62 3.047 3.761 8.378 1.00 55.52 O ATOM 0 H SER A 62 0.949 4.657 7.178 1.00 42.45 H new ATOM 0 HA SER A 62 0.703 2.855 9.320 1.00 74.43 H new ATOM 0 HB2 SER A 62 2.230 5.488 9.142 1.00 65.55 H new ATOM 0 HB3 SER A 62 2.522 4.219 10.315 1.00 65.55 H new ATOM 0 HG SER A 62 2.909 4.132 7.481 1.00 55.52 H new ATOM 1001 N ALA A 63 -0.581 5.843 9.810 1.00 3.02 N ATOM 1002 CA ALA A 63 -1.447 6.620 10.688 1.00 14.45 C ATOM 1003 C ALA A 63 -2.868 6.065 10.689 1.00 42.14 C ATOM 1004 O ALA A 63 -3.428 5.767 11.744 1.00 54.21 O ATOM 1005 CB ALA A 63 -1.451 8.083 10.267 1.00 63.43 C ATOM 0 H ALA A 63 -0.337 6.310 8.937 1.00 3.02 H new ATOM 0 HA ALA A 63 -1.054 6.546 11.702 1.00 14.45 H new ATOM 0 HB1 ALA A 63 -2.102 8.651 10.932 1.00 63.43 H new ATOM 0 HB2 ALA A 63 -0.438 8.481 10.324 1.00 63.43 H new ATOM 0 HB3 ALA A 63 -1.816 8.166 9.243 1.00 63.43 H new ATOM 1011 N VAL A 64 -3.446 5.929 9.499 1.00 72.14 N ATOM 1012 CA VAL A 64 -4.801 5.408 9.362 1.00 70.43 C ATOM 1013 C VAL A 64 -4.963 4.094 10.119 1.00 10.32 C ATOM 1014 O VAL A 64 -5.995 3.851 10.746 1.00 43.11 O ATOM 1015 CB VAL A 64 -5.170 5.185 7.884 1.00 0.22 C ATOM 1016 CG1 VAL A 64 -6.467 4.400 7.770 1.00 12.25 C ATOM 1017 CG2 VAL A 64 -5.277 6.517 7.156 1.00 32.10 C ATOM 0 H VAL A 64 -2.997 6.173 8.616 1.00 72.14 H new ATOM 0 HA VAL A 64 -5.472 6.155 9.787 1.00 70.43 H new ATOM 0 HB VAL A 64 -4.379 4.602 7.413 1.00 0.22 H new ATOM 0 HG11 VAL A 64 -6.712 4.252 6.718 1.00 12.25 H new ATOM 0 HG12 VAL A 64 -6.350 3.431 8.255 1.00 12.25 H new ATOM 0 HG13 VAL A 64 -7.271 4.953 8.255 1.00 12.25 H new ATOM 0 HG21 VAL A 64 -5.538 6.341 6.112 1.00 32.10 H new ATOM 0 HG22 VAL A 64 -6.048 7.127 7.626 1.00 32.10 H new ATOM 0 HG23 VAL A 64 -4.321 7.038 7.208 1.00 32.10 H new ATOM 1027 N SER A 65 -3.939 3.250 10.055 1.00 31.12 N ATOM 1028 CA SER A 65 -3.969 1.958 10.732 1.00 24.13 C ATOM 1029 C SER A 65 -3.945 2.139 12.247 1.00 34.13 C ATOM 1030 O SER A 65 -4.593 1.392 12.981 1.00 11.22 O ATOM 1031 CB SER A 65 -2.783 1.100 10.291 1.00 53.34 C ATOM 1032 OG SER A 65 -1.555 1.758 10.544 1.00 45.15 O ATOM 0 H SER A 65 -3.078 3.437 9.541 1.00 31.12 H new ATOM 0 HA SER A 65 -4.895 1.453 10.458 1.00 24.13 H new ATOM 0 HB2 SER A 65 -2.804 0.147 10.819 1.00 53.34 H new ATOM 0 HB3 SER A 65 -2.867 0.877 9.227 1.00 53.34 H new ATOM 0 HG SER A 65 -1.729 2.684 10.812 1.00 45.15 H new ATOM 1038 N GLN A 66 -3.195 3.134 12.707 1.00 34.31 N ATOM 1039 CA GLN A 66 -3.086 3.411 14.134 1.00 24.21 C ATOM 1040 C GLN A 66 -4.439 3.810 14.716 1.00 43.24 C ATOM 1041 O GLN A 66 -4.869 3.273 15.737 1.00 41.24 O ATOM 1042 CB GLN A 66 -2.063 4.522 14.382 1.00 1.01 C ATOM 1043 CG GLN A 66 -1.617 4.624 15.832 1.00 22.31 C ATOM 1044 CD GLN A 66 -0.132 4.369 16.004 1.00 31.33 C ATOM 1045 OE1 GLN A 66 0.554 5.093 16.726 1.00 22.20 O ATOM 1046 NE2 GLN A 66 0.372 3.335 15.341 1.00 40.44 N ATOM 0 H GLN A 66 -2.654 3.762 12.113 1.00 34.31 H new ATOM 0 HA GLN A 66 -2.751 2.501 14.631 1.00 24.21 H new ATOM 0 HB2 GLN A 66 -1.190 4.348 13.753 1.00 1.01 H new ATOM 0 HB3 GLN A 66 -2.492 5.475 14.074 1.00 1.01 H new ATOM 0 HG2 GLN A 66 -1.858 5.616 16.214 1.00 22.31 H new ATOM 0 HG3 GLN A 66 -2.177 3.907 16.432 1.00 22.31 H new ATOM 0 HE21 GLN A 66 -0.234 2.762 14.754 1.00 40.44 H new ATOM 0 HE22 GLN A 66 1.365 3.114 15.419 1.00 40.44 H new ATOM 1055 N ALA A 67 -5.104 4.755 14.060 1.00 43.03 N ATOM 1056 CA ALA A 67 -6.408 5.224 14.511 1.00 62.32 C ATOM 1057 C ALA A 67 -7.442 4.105 14.461 1.00 54.24 C ATOM 1058 O ALA A 67 -8.243 3.943 15.382 1.00 1.12 O ATOM 1059 CB ALA A 67 -6.865 6.405 13.668 1.00 3.20 C ATOM 0 H ALA A 67 -4.761 5.211 13.214 1.00 43.03 H new ATOM 0 HA ALA A 67 -6.311 5.547 15.547 1.00 62.32 H new ATOM 0 HB1 ALA A 67 -7.840 6.745 14.016 1.00 3.20 H new ATOM 0 HB2 ALA A 67 -6.144 7.217 13.759 1.00 3.20 H new ATOM 0 HB3 ALA A 67 -6.938 6.100 12.624 1.00 3.20 H new ATOM 1065 N VAL A 68 -7.420 3.333 13.379 1.00 52.23 N ATOM 1066 CA VAL A 68 -8.355 2.228 13.208 1.00 14.31 C ATOM 1067 C VAL A 68 -8.042 1.088 14.172 1.00 45.24 C ATOM 1068 O VAL A 68 -8.919 0.303 14.527 1.00 14.30 O ATOM 1069 CB VAL A 68 -8.328 1.687 11.766 1.00 31.03 C ATOM 1070 CG1 VAL A 68 -9.276 0.506 11.621 1.00 5.50 C ATOM 1071 CG2 VAL A 68 -8.680 2.789 10.777 1.00 21.54 C ATOM 0 H VAL A 68 -6.764 3.453 12.607 1.00 52.23 H new ATOM 0 HA VAL A 68 -9.349 2.620 13.423 1.00 14.31 H new ATOM 0 HB VAL A 68 -7.318 1.341 11.545 1.00 31.03 H new ATOM 0 HG11 VAL A 68 -9.244 0.137 10.596 1.00 5.50 H new ATOM 0 HG12 VAL A 68 -8.974 -0.289 12.302 1.00 5.50 H new ATOM 0 HG13 VAL A 68 -10.291 0.823 11.861 1.00 5.50 H new ATOM 0 HG21 VAL A 68 -8.656 2.389 9.763 1.00 21.54 H new ATOM 0 HG22 VAL A 68 -9.679 3.168 10.994 1.00 21.54 H new ATOM 0 HG23 VAL A 68 -7.958 3.600 10.864 1.00 21.54 H new ATOM 1081 N ALA A 69 -6.784 1.006 14.592 1.00 65.54 N ATOM 1082 CA ALA A 69 -6.354 -0.036 15.517 1.00 22.04 C ATOM 1083 C ALA A 69 -6.568 0.395 16.965 1.00 63.14 C ATOM 1084 O ALA A 69 -6.262 -0.350 17.895 1.00 53.33 O ATOM 1085 CB ALA A 69 -4.893 -0.384 15.278 1.00 24.00 C ATOM 0 H ALA A 69 -6.045 1.648 14.307 1.00 65.54 H new ATOM 0 HA ALA A 69 -6.961 -0.923 15.335 1.00 22.04 H new ATOM 0 HB1 ALA A 69 -4.586 -1.163 15.976 1.00 24.00 H new ATOM 0 HB2 ALA A 69 -4.767 -0.741 14.256 1.00 24.00 H new ATOM 0 HB3 ALA A 69 -4.278 0.503 15.431 1.00 24.00 H new ATOM 1091 N ASN A 70 -7.091 1.602 17.148 1.00 14.52 N ATOM 1092 CA ASN A 70 -7.344 2.131 18.483 1.00 30.34 C ATOM 1093 C ASN A 70 -8.835 2.104 18.806 1.00 62.13 C ATOM 1094 O ASN A 70 -9.227 2.022 19.971 1.00 54.22 O ATOM 1095 CB ASN A 70 -6.812 3.562 18.596 1.00 73.01 C ATOM 1096 CG ASN A 70 -5.305 3.608 18.756 1.00 33.41 C ATOM 1097 OD1 ASN A 70 -4.699 2.680 19.292 1.00 72.23 O ATOM 1098 ND2 ASN A 70 -4.693 4.690 18.291 1.00 0.31 N ATOM 0 H ASN A 70 -7.348 2.233 16.389 1.00 14.52 H new ATOM 0 HA ASN A 70 -6.823 1.498 19.202 1.00 30.34 H new ATOM 0 HB2 ASN A 70 -7.097 4.124 17.707 1.00 73.01 H new ATOM 0 HB3 ASN A 70 -7.280 4.054 19.448 1.00 73.01 H new ATOM 0 HD21 ASN A 70 -3.680 4.777 18.371 1.00 0.31 H new ATOM 0 HD22 ASN A 70 -5.236 5.435 17.854 1.00 0.31 H new ATOM 1105 N VAL A 71 -9.661 2.173 17.767 1.00 24.15 N ATOM 1106 CA VAL A 71 -11.109 2.155 17.940 1.00 74.45 C ATOM 1107 C VAL A 71 -11.577 0.823 18.519 1.00 4.10 C ATOM 1108 O VAL A 71 -12.642 0.742 19.132 1.00 63.53 O ATOM 1109 CB VAL A 71 -11.837 2.405 16.605 1.00 23.33 C ATOM 1110 CG1 VAL A 71 -11.384 1.403 15.555 1.00 1.23 C ATOM 1111 CG2 VAL A 71 -13.344 2.342 16.801 1.00 55.30 C ATOM 0 H VAL A 71 -9.353 2.242 16.797 1.00 24.15 H new ATOM 0 HA VAL A 71 -11.355 2.957 18.636 1.00 74.45 H new ATOM 0 HB VAL A 71 -11.582 3.404 16.252 1.00 23.33 H new ATOM 0 HG11 VAL A 71 -11.909 1.595 14.619 1.00 1.23 H new ATOM 0 HG12 VAL A 71 -10.310 1.503 15.396 1.00 1.23 H new ATOM 0 HG13 VAL A 71 -11.608 0.392 15.896 1.00 1.23 H new ATOM 0 HG21 VAL A 71 -13.843 2.521 15.848 1.00 55.30 H new ATOM 0 HG22 VAL A 71 -13.621 1.357 17.176 1.00 55.30 H new ATOM 0 HG23 VAL A 71 -13.650 3.103 17.519 1.00 55.30 H new ATOM 1121 N ARG A 72 -10.773 -0.216 18.320 1.00 32.34 N ATOM 1122 CA ARG A 72 -11.105 -1.544 18.822 1.00 31.31 C ATOM 1123 C ARG A 72 -12.376 -2.072 18.165 1.00 14.34 C ATOM 1124 O ARG A 72 -13.203 -1.314 17.657 1.00 41.41 O ATOM 1125 CB ARG A 72 -11.281 -1.510 20.341 1.00 62.41 C ATOM 1126 CG ARG A 72 -12.706 -1.775 20.796 1.00 32.13 C ATOM 1127 CD ARG A 72 -12.839 -1.665 22.308 1.00 42.41 C ATOM 1128 NE ARG A 72 -13.916 -0.759 22.697 1.00 24.33 N ATOM 1129 CZ ARG A 72 -15.205 -1.069 22.610 1.00 61.05 C ATOM 1130 NH1 ARG A 72 -15.575 -2.256 22.149 1.00 31.52 N ATOM 1131 NH2 ARG A 72 -16.126 -0.191 22.985 1.00 14.33 N ATOM 0 H ARG A 72 -9.888 -0.164 17.815 1.00 32.34 H new ATOM 0 HA ARG A 72 -10.282 -2.214 18.573 1.00 31.31 H new ATOM 0 HB2 ARG A 72 -10.621 -2.252 20.791 1.00 62.41 H new ATOM 0 HB3 ARG A 72 -10.965 -0.535 20.713 1.00 62.41 H new ATOM 0 HG2 ARG A 72 -13.380 -1.064 20.318 1.00 32.13 H new ATOM 0 HG3 ARG A 72 -13.012 -2.770 20.474 1.00 32.13 H new ATOM 0 HD2 ARG A 72 -13.027 -2.653 22.728 1.00 42.41 H new ATOM 0 HD3 ARG A 72 -11.898 -1.312 22.730 1.00 42.41 H new ATOM 0 HE ARG A 72 -13.665 0.162 23.055 1.00 24.33 H new ATOM 0 HH11 ARG A 72 -14.869 -2.934 21.860 1.00 31.52 H new ATOM 0 HH12 ARG A 72 -16.565 -2.492 22.083 1.00 31.52 H new ATOM 0 HH21 ARG A 72 -15.845 0.723 23.340 1.00 14.33 H new ATOM 0 HH22 ARG A 72 -17.115 -0.430 22.918 1.00 14.33 H new ATOM 1145 N PRO A 73 -12.539 -3.403 18.174 1.00 54.25 N ATOM 1146 CA PRO A 73 -13.707 -4.062 17.581 1.00 72.32 C ATOM 1147 C PRO A 73 -14.983 -3.803 18.376 1.00 72.22 C ATOM 1148 O PRO A 73 -14.933 -3.515 19.571 1.00 4.44 O ATOM 1149 CB PRO A 73 -13.339 -5.547 17.630 1.00 12.13 C ATOM 1150 CG PRO A 73 -12.364 -5.660 18.751 1.00 44.10 C ATOM 1151 CD PRO A 73 -11.595 -4.368 18.761 1.00 71.31 C ATOM 0 HA PRO A 73 -13.917 -3.694 16.577 1.00 72.32 H new ATOM 0 HB2 PRO A 73 -14.218 -6.167 17.806 1.00 12.13 H new ATOM 0 HB3 PRO A 73 -12.900 -5.877 16.689 1.00 12.13 H new ATOM 0 HG2 PRO A 73 -12.877 -5.817 19.700 1.00 44.10 H new ATOM 0 HG3 PRO A 73 -11.698 -6.510 18.605 1.00 44.10 H new ATOM 0 HD2 PRO A 73 -11.304 -4.081 19.772 1.00 71.31 H new ATOM 0 HD3 PRO A 73 -10.679 -4.441 18.175 1.00 71.31 H new ATOM 1159 N GLY A 74 -16.126 -3.910 17.704 1.00 73.35 N ATOM 1160 CA GLY A 74 -17.398 -3.686 18.365 1.00 0.10 C ATOM 1161 C GLY A 74 -17.814 -2.228 18.340 1.00 61.45 C ATOM 1162 O GLY A 74 -18.634 -1.796 19.150 1.00 30.43 O ATOM 0 H GLY A 74 -16.193 -4.148 16.714 1.00 73.35 H new ATOM 0 HA2 GLY A 74 -18.167 -4.289 17.881 1.00 0.10 H new ATOM 0 HA3 GLY A 74 -17.332 -4.024 19.399 1.00 0.10 H new ATOM 1166 N SER A 75 -17.247 -1.468 17.408 1.00 70.41 N ATOM 1167 CA SER A 75 -17.560 -0.049 17.285 1.00 63.15 C ATOM 1168 C SER A 75 -18.291 0.234 15.976 1.00 44.13 C ATOM 1169 O SER A 75 -17.992 -0.366 14.944 1.00 2.02 O ATOM 1170 CB SER A 75 -16.279 0.785 17.359 1.00 45.11 C ATOM 1171 OG SER A 75 -15.290 0.133 18.136 1.00 44.32 O ATOM 0 H SER A 75 -16.569 -1.811 16.728 1.00 70.41 H new ATOM 0 HA SER A 75 -18.213 0.228 18.112 1.00 63.15 H new ATOM 0 HB2 SER A 75 -15.898 0.962 16.353 1.00 45.11 H new ATOM 0 HB3 SER A 75 -16.501 1.761 17.792 1.00 45.11 H new ATOM 0 HG SER A 75 -14.704 -0.388 17.549 1.00 44.32 H new ATOM 1177 N SER A 76 -19.249 1.153 16.029 1.00 50.20 N ATOM 1178 CA SER A 76 -20.026 1.514 14.849 1.00 2.35 C ATOM 1179 C SER A 76 -19.110 1.900 13.691 1.00 70.42 C ATOM 1180 O SER A 76 -17.934 2.216 13.876 1.00 11.44 O ATOM 1181 CB SER A 76 -20.974 2.671 15.171 1.00 63.11 C ATOM 1182 OG SER A 76 -22.326 2.288 14.991 1.00 23.52 O ATOM 0 H SER A 76 -19.506 1.661 16.875 1.00 50.20 H new ATOM 0 HA SER A 76 -20.612 0.645 14.551 1.00 2.35 H new ATOM 0 HB2 SER A 76 -20.819 2.997 16.200 1.00 63.11 H new ATOM 0 HB3 SER A 76 -20.745 3.522 14.529 1.00 63.11 H new ATOM 0 HG SER A 76 -22.911 3.044 15.205 1.00 23.52 H new ATOM 1188 N PRO A 77 -19.659 1.872 12.469 1.00 55.32 N ATOM 1189 CA PRO A 77 -18.910 2.216 11.256 1.00 55.04 C ATOM 1190 C PRO A 77 -18.579 3.703 11.181 1.00 73.32 C ATOM 1191 O PRO A 77 -17.828 4.137 10.308 1.00 22.01 O ATOM 1192 CB PRO A 77 -19.865 1.823 10.126 1.00 53.34 C ATOM 1193 CG PRO A 77 -21.222 1.898 10.733 1.00 14.14 C ATOM 1194 CD PRO A 77 -21.055 1.503 12.174 1.00 42.11 C ATOM 0 HA PRO A 77 -17.946 1.708 11.214 1.00 55.04 H new ATOM 0 HB2 PRO A 77 -19.773 2.500 9.277 1.00 53.34 H new ATOM 0 HB3 PRO A 77 -19.651 0.820 9.758 1.00 53.34 H new ATOM 0 HG2 PRO A 77 -21.631 2.905 10.650 1.00 14.14 H new ATOM 0 HG3 PRO A 77 -21.915 1.229 10.223 1.00 14.14 H new ATOM 0 HD2 PRO A 77 -21.756 2.032 12.820 1.00 42.11 H new ATOM 0 HD3 PRO A 77 -21.229 0.437 12.321 1.00 42.11 H new ATOM 1202 N ALA A 78 -19.145 4.476 12.101 1.00 2.31 N ATOM 1203 CA ALA A 78 -18.908 5.914 12.140 1.00 43.14 C ATOM 1204 C ALA A 78 -17.504 6.226 12.649 1.00 55.12 C ATOM 1205 O ALA A 78 -16.819 7.100 12.117 1.00 32.14 O ATOM 1206 CB ALA A 78 -19.950 6.598 13.012 1.00 53.34 C ATOM 0 H ALA A 78 -19.771 4.131 12.829 1.00 2.31 H new ATOM 0 HA ALA A 78 -18.992 6.298 11.123 1.00 43.14 H new ATOM 0 HB1 ALA A 78 -19.760 7.671 13.032 1.00 53.34 H new ATOM 0 HB2 ALA A 78 -20.944 6.413 12.605 1.00 53.34 H new ATOM 0 HB3 ALA A 78 -19.894 6.201 14.026 1.00 53.34 H new ATOM 1212 N VAL A 79 -17.080 5.504 13.682 1.00 41.42 N ATOM 1213 CA VAL A 79 -15.758 5.703 14.262 1.00 64.22 C ATOM 1214 C VAL A 79 -14.668 5.158 13.346 1.00 53.12 C ATOM 1215 O VAL A 79 -13.600 5.756 13.209 1.00 50.14 O ATOM 1216 CB VAL A 79 -15.641 5.024 15.640 1.00 40.43 C ATOM 1217 CG1 VAL A 79 -16.366 5.840 16.700 1.00 4.10 C ATOM 1218 CG2 VAL A 79 -16.187 3.605 15.582 1.00 5.40 C ATOM 0 H VAL A 79 -17.634 4.776 14.134 1.00 41.42 H new ATOM 0 HA VAL A 79 -15.624 6.778 14.382 1.00 64.22 H new ATOM 0 HB VAL A 79 -14.587 4.973 15.913 1.00 40.43 H new ATOM 0 HG11 VAL A 79 -16.273 5.345 17.667 1.00 4.10 H new ATOM 0 HG12 VAL A 79 -15.925 6.835 16.758 1.00 4.10 H new ATOM 0 HG13 VAL A 79 -17.420 5.925 16.436 1.00 4.10 H new ATOM 0 HG21 VAL A 79 -16.097 3.140 16.564 1.00 5.40 H new ATOM 0 HG22 VAL A 79 -17.236 3.631 15.288 1.00 5.40 H new ATOM 0 HG23 VAL A 79 -15.620 3.026 14.853 1.00 5.40 H new ATOM 1228 N TYR A 80 -14.944 4.019 12.719 1.00 10.22 N ATOM 1229 CA TYR A 80 -13.987 3.392 11.816 1.00 61.50 C ATOM 1230 C TYR A 80 -13.715 4.280 10.607 1.00 2.43 C ATOM 1231 O TYR A 80 -12.565 4.493 10.224 1.00 31.03 O ATOM 1232 CB TYR A 80 -14.506 2.029 11.356 1.00 73.24 C ATOM 1233 CG TYR A 80 -14.206 0.908 12.324 1.00 41.14 C ATOM 1234 CD1 TYR A 80 -12.965 0.281 12.329 1.00 32.25 C ATOM 1235 CD2 TYR A 80 -15.162 0.476 13.235 1.00 73.22 C ATOM 1236 CE1 TYR A 80 -12.687 -0.745 13.212 1.00 31.41 C ATOM 1237 CE2 TYR A 80 -14.891 -0.548 14.123 1.00 2.24 C ATOM 1238 CZ TYR A 80 -13.653 -1.155 14.107 1.00 70.40 C ATOM 1239 OH TYR A 80 -13.379 -2.175 14.989 1.00 52.22 O ATOM 0 H TYR A 80 -15.823 3.512 12.820 1.00 10.22 H new ATOM 0 HA TYR A 80 -13.052 3.253 12.359 1.00 61.50 H new ATOM 0 HB2 TYR A 80 -15.584 2.091 11.208 1.00 73.24 H new ATOM 0 HB3 TYR A 80 -14.065 1.790 10.388 1.00 73.24 H new ATOM 0 HD1 TYR A 80 -12.206 0.601 11.631 1.00 32.25 H new ATOM 0 HD2 TYR A 80 -16.133 0.948 13.250 1.00 73.22 H new ATOM 0 HE1 TYR A 80 -11.719 -1.223 13.201 1.00 31.41 H new ATOM 0 HE2 TYR A 80 -15.645 -0.871 14.826 1.00 2.24 H new ATOM 0 HH TYR A 80 -13.439 -1.838 15.907 1.00 52.22 H new ATOM 1249 N ALA A 81 -14.784 4.798 10.009 1.00 65.12 N ATOM 1250 CA ALA A 81 -14.662 5.666 8.844 1.00 45.20 C ATOM 1251 C ALA A 81 -13.926 6.955 9.194 1.00 31.34 C ATOM 1252 O ALA A 81 -13.189 7.503 8.375 1.00 62.34 O ATOM 1253 CB ALA A 81 -16.037 5.980 8.274 1.00 22.13 C ATOM 0 H ALA A 81 -15.743 4.631 10.312 1.00 65.12 H new ATOM 0 HA ALA A 81 -14.079 5.139 8.089 1.00 45.20 H new ATOM 0 HB1 ALA A 81 -15.931 6.629 7.405 1.00 22.13 H new ATOM 0 HB2 ALA A 81 -16.528 5.053 7.977 1.00 22.13 H new ATOM 0 HB3 ALA A 81 -16.638 6.483 9.031 1.00 22.13 H new ATOM 1259 N LYS A 82 -14.130 7.434 10.417 1.00 13.24 N ATOM 1260 CA LYS A 82 -13.486 8.659 10.877 1.00 15.34 C ATOM 1261 C LYS A 82 -12.011 8.417 11.176 1.00 41.24 C ATOM 1262 O LYS A 82 -11.167 9.279 10.925 1.00 34.51 O ATOM 1263 CB LYS A 82 -14.191 9.192 12.126 1.00 71.11 C ATOM 1264 CG LYS A 82 -13.599 10.488 12.652 1.00 60.15 C ATOM 1265 CD LYS A 82 -14.410 11.693 12.207 1.00 53.24 C ATOM 1266 CE LYS A 82 -15.007 12.432 13.394 1.00 2.23 C ATOM 1267 NZ LYS A 82 -15.690 13.688 12.978 1.00 2.12 N ATOM 0 H LYS A 82 -14.737 6.992 11.108 1.00 13.24 H new ATOM 0 HA LYS A 82 -13.560 9.401 10.082 1.00 15.34 H new ATOM 0 HB2 LYS A 82 -15.245 9.350 11.898 1.00 71.11 H new ATOM 0 HB3 LYS A 82 -14.144 8.436 12.910 1.00 71.11 H new ATOM 0 HG2 LYS A 82 -13.561 10.456 13.741 1.00 60.15 H new ATOM 0 HG3 LYS A 82 -12.572 10.589 12.300 1.00 60.15 H new ATOM 0 HD2 LYS A 82 -13.774 12.371 11.638 1.00 53.24 H new ATOM 0 HD3 LYS A 82 -15.209 11.369 11.540 1.00 53.24 H new ATOM 0 HE2 LYS A 82 -15.719 11.784 13.905 1.00 2.23 H new ATOM 0 HE3 LYS A 82 -14.219 12.667 14.109 1.00 2.23 H new ATOM 0 HZ1 LYS A 82 -16.084 14.163 13.815 1.00 2.12 H new ATOM 0 HZ2 LYS A 82 -15.005 14.318 12.513 1.00 2.12 H new ATOM 0 HZ3 LYS A 82 -16.459 13.462 12.315 1.00 2.12 H new ATOM 1281 N ALA A 83 -11.705 7.241 11.712 1.00 75.23 N ATOM 1282 CA ALA A 83 -10.331 6.884 12.042 1.00 44.23 C ATOM 1283 C ALA A 83 -9.498 6.679 10.781 1.00 11.44 C ATOM 1284 O ALA A 83 -8.275 6.554 10.845 1.00 22.24 O ATOM 1285 CB ALA A 83 -10.301 5.632 12.905 1.00 30.45 C ATOM 0 H ALA A 83 -12.391 6.518 11.927 1.00 75.23 H new ATOM 0 HA ALA A 83 -9.895 7.709 12.605 1.00 44.23 H new ATOM 0 HB1 ALA A 83 -9.268 5.379 13.143 1.00 30.45 H new ATOM 0 HB2 ALA A 83 -10.852 5.813 13.828 1.00 30.45 H new ATOM 0 HB3 ALA A 83 -10.762 4.806 12.364 1.00 30.45 H new ATOM 1291 N ILE A 84 -10.170 6.644 9.634 1.00 51.22 N ATOM 1292 CA ILE A 84 -9.492 6.454 8.358 1.00 72.13 C ATOM 1293 C ILE A 84 -9.452 7.752 7.558 1.00 63.35 C ATOM 1294 O ILE A 84 -8.613 7.922 6.674 1.00 54.04 O ATOM 1295 CB ILE A 84 -10.177 5.364 7.513 1.00 52.22 C ATOM 1296 CG1 ILE A 84 -10.203 4.038 8.275 1.00 75.53 C ATOM 1297 CG2 ILE A 84 -9.465 5.201 6.179 1.00 62.22 C ATOM 1298 CD1 ILE A 84 -11.180 3.033 7.706 1.00 33.32 C ATOM 0 H ILE A 84 -11.183 6.745 9.563 1.00 51.22 H new ATOM 0 HA ILE A 84 -8.474 6.139 8.586 1.00 72.13 H new ATOM 0 HB ILE A 84 -11.205 5.669 7.318 1.00 52.22 H new ATOM 0 HG12 ILE A 84 -9.203 3.605 8.268 1.00 75.53 H new ATOM 0 HG13 ILE A 84 -10.459 4.232 9.317 1.00 75.53 H new ATOM 0 HG21 ILE A 84 -9.961 4.427 5.594 1.00 62.22 H new ATOM 0 HG22 ILE A 84 -9.495 6.144 5.633 1.00 62.22 H new ATOM 0 HG23 ILE A 84 -8.428 4.915 6.353 1.00 62.22 H new ATOM 0 HD11 ILE A 84 -11.145 2.117 8.296 1.00 33.32 H new ATOM 0 HD12 ILE A 84 -12.188 3.447 7.738 1.00 33.32 H new ATOM 0 HD13 ILE A 84 -10.912 2.810 6.673 1.00 33.32 H new ATOM 1310 N ALA A 85 -10.362 8.665 7.876 1.00 31.33 N ATOM 1311 CA ALA A 85 -10.429 9.950 7.191 1.00 41.34 C ATOM 1312 C ALA A 85 -9.667 11.023 7.961 1.00 2.30 C ATOM 1313 O ALA A 85 -9.036 11.897 7.367 1.00 0.54 O ATOM 1314 CB ALA A 85 -11.877 10.368 6.992 1.00 34.13 C ATOM 0 H ALA A 85 -11.064 8.539 8.605 1.00 31.33 H new ATOM 0 HA ALA A 85 -9.958 9.838 6.214 1.00 41.34 H new ATOM 0 HB1 ALA A 85 -11.911 11.329 6.479 1.00 34.13 H new ATOM 0 HB2 ALA A 85 -12.393 9.618 6.392 1.00 34.13 H new ATOM 0 HB3 ALA A 85 -12.367 10.456 7.962 1.00 34.13 H new ATOM 1320 N ALA A 86 -9.730 10.951 9.286 1.00 64.20 N ATOM 1321 CA ALA A 86 -9.045 11.916 10.137 1.00 65.34 C ATOM 1322 C ALA A 86 -7.557 11.981 9.806 1.00 34.34 C ATOM 1323 O ALA A 86 -7.025 13.027 9.436 1.00 41.24 O ATOM 1324 CB ALA A 86 -9.247 11.564 11.604 1.00 1.44 C ATOM 0 H ALA A 86 -10.249 10.234 9.794 1.00 64.20 H new ATOM 0 HA ALA A 86 -9.476 12.899 9.949 1.00 65.34 H new ATOM 0 HB1 ALA A 86 -8.730 12.293 12.228 1.00 1.44 H new ATOM 0 HB2 ALA A 86 -10.312 11.576 11.838 1.00 1.44 H new ATOM 0 HB3 ALA A 86 -8.844 10.570 11.798 1.00 1.44 H new ATOM 1330 N PRO A 87 -6.869 10.838 9.945 1.00 15.31 N ATOM 1331 CA PRO A 87 -5.434 10.740 9.665 1.00 74.22 C ATOM 1332 C PRO A 87 -5.123 10.862 8.178 1.00 1.20 C ATOM 1333 O PRO A 87 -4.009 11.219 7.794 1.00 70.32 O ATOM 1334 CB PRO A 87 -5.068 9.343 10.174 1.00 21.35 C ATOM 1335 CG PRO A 87 -6.340 8.569 10.102 1.00 63.05 C ATOM 1336 CD PRO A 87 -7.441 9.554 10.383 1.00 53.12 C ATOM 0 HA PRO A 87 -4.871 11.544 10.140 1.00 74.22 H new ATOM 0 HB2 PRO A 87 -4.292 8.888 9.558 1.00 21.35 H new ATOM 0 HB3 PRO A 87 -4.685 9.381 11.194 1.00 21.35 H new ATOM 0 HG2 PRO A 87 -6.465 8.114 9.119 1.00 63.05 H new ATOM 0 HG3 PRO A 87 -6.346 7.759 10.831 1.00 63.05 H new ATOM 0 HD2 PRO A 87 -8.349 9.310 9.832 1.00 53.12 H new ATOM 0 HD3 PRO A 87 -7.705 9.571 11.440 1.00 53.12 H new ATOM 1344 N SER A 88 -6.114 10.566 7.343 1.00 23.50 N ATOM 1345 CA SER A 88 -5.945 10.639 5.897 1.00 64.32 C ATOM 1346 C SER A 88 -6.001 12.086 5.417 1.00 4.00 C ATOM 1347 O SER A 88 -5.238 12.492 4.539 1.00 20.43 O ATOM 1348 CB SER A 88 -7.024 9.814 5.193 1.00 72.03 C ATOM 1349 OG SER A 88 -6.979 10.008 3.790 1.00 41.22 O ATOM 0 H SER A 88 -7.043 10.273 7.644 1.00 23.50 H new ATOM 0 HA SER A 88 -4.966 10.229 5.649 1.00 64.32 H new ATOM 0 HB2 SER A 88 -6.886 8.757 5.422 1.00 72.03 H new ATOM 0 HB3 SER A 88 -8.007 10.096 5.571 1.00 72.03 H new ATOM 0 HG SER A 88 -7.677 9.469 3.363 1.00 41.22 H new ATOM 1355 N VAL A 89 -6.911 12.862 5.999 1.00 52.03 N ATOM 1356 CA VAL A 89 -7.068 14.264 5.632 1.00 35.21 C ATOM 1357 C VAL A 89 -5.885 15.095 6.118 1.00 15.31 C ATOM 1358 O VAL A 89 -5.308 15.871 5.359 1.00 41.42 O ATOM 1359 CB VAL A 89 -8.368 14.853 6.211 1.00 11.14 C ATOM 1360 CG1 VAL A 89 -8.334 16.373 6.163 1.00 70.01 C ATOM 1361 CG2 VAL A 89 -9.577 14.315 5.461 1.00 34.42 C ATOM 0 H VAL A 89 -7.550 12.543 6.727 1.00 52.03 H new ATOM 0 HA VAL A 89 -7.113 14.304 4.544 1.00 35.21 H new ATOM 0 HB VAL A 89 -8.451 14.548 7.254 1.00 11.14 H new ATOM 0 HG11 VAL A 89 -9.261 16.771 6.576 1.00 70.01 H new ATOM 0 HG12 VAL A 89 -7.490 16.737 6.749 1.00 70.01 H new ATOM 0 HG13 VAL A 89 -8.227 16.702 5.129 1.00 70.01 H new ATOM 0 HG21 VAL A 89 -10.487 14.742 5.883 1.00 34.42 H new ATOM 0 HG22 VAL A 89 -9.503 14.588 4.408 1.00 34.42 H new ATOM 0 HG23 VAL A 89 -9.609 13.229 5.553 1.00 34.42 H new ATOM 1371 N GLN A 90 -5.532 14.925 7.388 1.00 51.20 N ATOM 1372 CA GLN A 90 -4.418 15.660 7.975 1.00 70.33 C ATOM 1373 C GLN A 90 -3.149 15.474 7.151 1.00 43.51 C ATOM 1374 O GLN A 90 -2.366 16.410 6.979 1.00 33.42 O ATOM 1375 CB GLN A 90 -4.177 15.199 9.413 1.00 71.42 C ATOM 1376 CG GLN A 90 -3.626 13.785 9.515 1.00 24.44 C ATOM 1377 CD GLN A 90 -3.405 13.348 10.950 1.00 62.30 C ATOM 1378 OE1 GLN A 90 -2.327 12.870 11.306 1.00 65.10 O ATOM 1379 NE2 GLN A 90 -4.427 13.508 11.782 1.00 72.42 N ATOM 0 H GLN A 90 -6.001 14.285 8.030 1.00 51.20 H new ATOM 0 HA GLN A 90 -4.676 16.719 7.978 1.00 70.33 H new ATOM 0 HB2 GLN A 90 -3.482 15.887 9.894 1.00 71.42 H new ATOM 0 HB3 GLN A 90 -5.115 15.255 9.966 1.00 71.42 H new ATOM 0 HG2 GLN A 90 -4.316 13.094 9.031 1.00 24.44 H new ATOM 0 HG3 GLN A 90 -2.683 13.726 8.972 1.00 24.44 H new ATOM 0 HE21 GLN A 90 -5.302 13.908 11.444 1.00 72.42 H new ATOM 0 HE22 GLN A 90 -4.337 13.231 12.759 1.00 72.42 H new ATOM 1388 N ILE A 91 -2.951 14.262 6.642 1.00 0.54 N ATOM 1389 CA ILE A 91 -1.777 13.956 5.834 1.00 64.35 C ATOM 1390 C ILE A 91 -1.981 14.379 4.383 1.00 34.40 C ATOM 1391 O ILE A 91 -1.049 14.838 3.722 1.00 15.44 O ATOM 1392 CB ILE A 91 -1.442 12.453 5.877 1.00 24.10 C ATOM 1393 CG1 ILE A 91 -0.797 12.090 7.217 1.00 13.25 C ATOM 1394 CG2 ILE A 91 -0.522 12.083 4.723 1.00 51.35 C ATOM 1395 CD1 ILE A 91 -1.185 10.717 7.721 1.00 2.21 C ATOM 0 H ILE A 91 -3.588 13.477 6.775 1.00 0.54 H new ATOM 0 HA ILE A 91 -0.946 14.518 6.259 1.00 64.35 H new ATOM 0 HB ILE A 91 -2.367 11.886 5.775 1.00 24.10 H new ATOM 0 HG12 ILE A 91 0.287 12.138 7.114 1.00 13.25 H new ATOM 0 HG13 ILE A 91 -1.080 12.835 7.961 1.00 13.25 H new ATOM 0 HG21 ILE A 91 -0.294 11.018 4.767 1.00 51.35 H new ATOM 0 HG22 ILE A 91 -1.015 12.310 3.778 1.00 51.35 H new ATOM 0 HG23 ILE A 91 0.403 12.655 4.797 1.00 51.35 H new ATOM 0 HD11 ILE A 91 -0.692 10.526 8.674 1.00 2.21 H new ATOM 0 HD12 ILE A 91 -2.266 10.671 7.856 1.00 2.21 H new ATOM 0 HD13 ILE A 91 -0.878 9.963 6.996 1.00 2.21 H new ATOM 1407 N LEU A 92 -3.207 14.222 3.895 1.00 61.31 N ATOM 1408 CA LEU A 92 -3.535 14.590 2.522 1.00 31.03 C ATOM 1409 C LEU A 92 -3.398 16.094 2.314 1.00 51.22 C ATOM 1410 O LEU A 92 -3.001 16.549 1.240 1.00 70.22 O ATOM 1411 CB LEU A 92 -4.958 14.144 2.181 1.00 32.04 C ATOM 1412 CG LEU A 92 -5.108 12.714 1.660 1.00 30.21 C ATOM 1413 CD1 LEU A 92 -6.577 12.344 1.529 1.00 64.51 C ATOM 1414 CD2 LEU A 92 -4.396 12.556 0.324 1.00 64.41 C ATOM 0 H LEU A 92 -3.989 13.843 4.429 1.00 61.31 H new ATOM 0 HA LEU A 92 -2.833 14.085 1.858 1.00 31.03 H new ATOM 0 HB2 LEU A 92 -5.574 14.250 3.074 1.00 32.04 H new ATOM 0 HB3 LEU A 92 -5.361 14.826 1.432 1.00 32.04 H new ATOM 0 HG LEU A 92 -4.647 12.036 2.378 1.00 30.21 H new ATOM 0 HD11 LEU A 92 -6.663 11.323 1.157 1.00 64.51 H new ATOM 0 HD12 LEU A 92 -7.059 12.417 2.504 1.00 64.51 H new ATOM 0 HD13 LEU A 92 -7.063 13.026 0.832 1.00 64.51 H new ATOM 0 HD21 LEU A 92 -4.513 11.532 -0.032 1.00 64.41 H new ATOM 0 HD22 LEU A 92 -4.828 13.244 -0.402 1.00 64.41 H new ATOM 0 HD23 LEU A 92 -3.336 12.778 0.448 1.00 64.41 H new ATOM 1426 N VAL A 93 -3.726 16.863 3.347 1.00 32.33 N ATOM 1427 CA VAL A 93 -3.635 18.317 3.278 1.00 35.52 C ATOM 1428 C VAL A 93 -2.208 18.791 3.525 1.00 71.02 C ATOM 1429 O VAL A 93 -1.767 19.789 2.956 1.00 12.45 O ATOM 1430 CB VAL A 93 -4.572 18.986 4.303 1.00 64.44 C ATOM 1431 CG1 VAL A 93 -4.069 18.750 5.719 1.00 64.24 C ATOM 1432 CG2 VAL A 93 -4.699 20.474 4.014 1.00 31.20 C ATOM 0 H VAL A 93 -4.057 16.503 4.242 1.00 32.33 H new ATOM 0 HA VAL A 93 -3.941 18.607 2.273 1.00 35.52 H new ATOM 0 HB VAL A 93 -5.561 18.536 4.215 1.00 64.44 H new ATOM 0 HG11 VAL A 93 -4.743 19.229 6.429 1.00 64.24 H new ATOM 0 HG12 VAL A 93 -4.033 17.679 5.919 1.00 64.24 H new ATOM 0 HG13 VAL A 93 -3.070 19.172 5.825 1.00 64.24 H new ATOM 0 HG21 VAL A 93 -5.364 20.931 4.747 1.00 31.20 H new ATOM 0 HG22 VAL A 93 -3.716 20.942 4.074 1.00 31.20 H new ATOM 0 HG23 VAL A 93 -5.108 20.617 3.014 1.00 31.20 H new ATOM 1442 N SER A 94 -1.489 18.067 4.376 1.00 62.41 N ATOM 1443 CA SER A 94 -0.110 18.415 4.701 1.00 62.42 C ATOM 1444 C SER A 94 0.812 18.147 3.516 1.00 3.51 C ATOM 1445 O SER A 94 1.805 18.847 3.318 1.00 53.53 O ATOM 1446 CB SER A 94 0.365 17.622 5.921 1.00 53.21 C ATOM 1447 OG SER A 94 -0.140 18.179 7.121 1.00 3.23 O ATOM 0 H SER A 94 -1.838 17.236 4.853 1.00 62.41 H new ATOM 0 HA SER A 94 -0.075 19.480 4.932 1.00 62.42 H new ATOM 0 HB2 SER A 94 0.040 16.585 5.833 1.00 53.21 H new ATOM 0 HB3 SER A 94 1.455 17.613 5.951 1.00 53.21 H new ATOM 0 HG SER A 94 -0.991 17.749 7.349 1.00 3.23 H new ATOM 1453 N SER A 95 0.475 17.129 2.730 1.00 2.14 N ATOM 1454 CA SER A 95 1.274 16.765 1.566 1.00 0.43 C ATOM 1455 C SER A 95 0.756 17.465 0.311 1.00 31.35 C ATOM 1456 O SER A 95 1.309 17.304 -0.776 1.00 21.54 O ATOM 1457 CB SER A 95 1.256 15.250 1.362 1.00 12.32 C ATOM 1458 OG SER A 95 2.443 14.806 0.729 1.00 72.22 O ATOM 0 H SER A 95 -0.346 16.542 2.878 1.00 2.14 H new ATOM 0 HA SER A 95 2.300 17.088 1.745 1.00 0.43 H new ATOM 0 HB2 SER A 95 1.146 14.752 2.325 1.00 12.32 H new ATOM 0 HB3 SER A 95 0.392 14.972 0.758 1.00 12.32 H new ATOM 0 HG SER A 95 2.639 15.382 -0.039 1.00 72.22 H new ATOM 1464 N GLY A 96 -0.311 18.242 0.473 1.00 43.41 N ATOM 1465 CA GLY A 96 -0.886 18.955 -0.652 1.00 13.41 C ATOM 1466 C GLY A 96 -1.623 18.034 -1.606 1.00 4.10 C ATOM 1467 O GLY A 96 -2.066 18.460 -2.672 1.00 54.42 O ATOM 0 H GLY A 96 -0.787 18.390 1.363 1.00 43.41 H new ATOM 0 HA2 GLY A 96 -1.573 19.716 -0.283 1.00 13.41 H new ATOM 0 HA3 GLY A 96 -0.095 19.475 -1.192 1.00 13.41 H new ATOM 1471 N SER A 97 -1.751 16.767 -1.224 1.00 3.02 N ATOM 1472 CA SER A 97 -2.433 15.783 -2.055 1.00 3.04 C ATOM 1473 C SER A 97 -3.865 16.218 -2.348 1.00 4.21 C ATOM 1474 O SER A 97 -4.473 15.777 -3.324 1.00 30.31 O ATOM 1475 CB SER A 97 -2.434 14.416 -1.367 1.00 21.04 C ATOM 1476 OG SER A 97 -1.145 13.827 -1.401 1.00 21.00 O ATOM 0 H SER A 97 -1.391 16.398 -0.344 1.00 3.02 H new ATOM 0 HA SER A 97 -1.895 15.706 -3.000 1.00 3.04 H new ATOM 0 HB2 SER A 97 -2.760 14.526 -0.333 1.00 21.04 H new ATOM 0 HB3 SER A 97 -3.151 13.758 -1.859 1.00 21.04 H new ATOM 0 HG SER A 97 -1.172 12.955 -0.954 1.00 21.00 H new ATOM 1482 N VAL A 98 -4.399 17.088 -1.497 1.00 4.12 N ATOM 1483 CA VAL A 98 -5.759 17.586 -1.664 1.00 20.54 C ATOM 1484 C VAL A 98 -5.821 19.096 -1.461 1.00 53.01 C ATOM 1485 O VAL A 98 -5.282 19.625 -0.490 1.00 12.20 O ATOM 1486 CB VAL A 98 -6.730 16.907 -0.678 1.00 51.30 C ATOM 1487 CG1 VAL A 98 -6.589 15.394 -0.748 1.00 31.50 C ATOM 1488 CG2 VAL A 98 -6.489 17.409 0.737 1.00 31.04 C ATOM 0 H VAL A 98 -3.910 17.463 -0.684 1.00 4.12 H new ATOM 0 HA VAL A 98 -6.060 17.347 -2.684 1.00 20.54 H new ATOM 0 HB VAL A 98 -7.750 17.166 -0.961 1.00 51.30 H new ATOM 0 HG11 VAL A 98 -7.282 14.931 -0.045 1.00 31.50 H new ATOM 0 HG12 VAL A 98 -6.816 15.054 -1.758 1.00 31.50 H new ATOM 0 HG13 VAL A 98 -5.568 15.111 -0.490 1.00 31.50 H new ATOM 0 HG21 VAL A 98 -7.183 16.919 1.420 1.00 31.04 H new ATOM 0 HG22 VAL A 98 -5.465 17.181 1.035 1.00 31.04 H new ATOM 0 HG23 VAL A 98 -6.645 18.487 0.772 1.00 31.04 H new ATOM 1498 N ASN A 99 -6.483 19.784 -2.385 1.00 42.20 N ATOM 1499 CA ASN A 99 -6.616 21.234 -2.308 1.00 11.52 C ATOM 1500 C ASN A 99 -8.063 21.661 -2.536 1.00 23.44 C ATOM 1501 O ASN A 99 -8.968 20.829 -2.571 1.00 54.41 O ATOM 1502 CB ASN A 99 -5.707 21.906 -3.340 1.00 32.23 C ATOM 1503 CG ASN A 99 -4.881 20.903 -4.121 1.00 41.45 C ATOM 1504 OD1 ASN A 99 -3.678 20.762 -3.895 1.00 24.32 O ATOM 1505 ND2 ASN A 99 -5.523 20.202 -5.048 1.00 62.34 N ATOM 0 H ASN A 99 -6.936 19.361 -3.195 1.00 42.20 H new ATOM 0 HA ASN A 99 -6.316 21.548 -1.308 1.00 11.52 H new ATOM 0 HB2 ASN A 99 -6.315 22.489 -4.032 1.00 32.23 H new ATOM 0 HB3 ASN A 99 -5.042 22.605 -2.834 1.00 32.23 H new ATOM 0 HD21 ASN A 99 -5.019 19.514 -5.607 1.00 62.34 H new ATOM 0 HD22 ASN A 99 -6.520 20.352 -5.201 1.00 62.34 H new ATOM 1512 N ASN A 100 -8.274 22.964 -2.689 1.00 45.43 N ATOM 1513 CA ASN A 100 -9.610 23.502 -2.913 1.00 1.32 C ATOM 1514 C ASN A 100 -9.950 23.513 -4.401 1.00 63.24 C ATOM 1515 O ASN A 100 -10.174 24.571 -4.988 1.00 52.11 O ATOM 1516 CB ASN A 100 -9.714 24.918 -2.344 1.00 13.45 C ATOM 1517 CG ASN A 100 -8.862 25.107 -1.105 1.00 25.21 C ATOM 1518 OD1 ASN A 100 -7.636 25.171 -1.185 1.00 52.14 O ATOM 1519 ND2 ASN A 100 -9.510 25.200 0.051 1.00 51.10 N ATOM 0 H ASN A 100 -7.536 23.667 -2.662 1.00 45.43 H new ATOM 0 HA ASN A 100 -10.325 22.858 -2.400 1.00 1.32 H new ATOM 0 HB2 ASN A 100 -9.408 25.636 -3.105 1.00 13.45 H new ATOM 0 HB3 ASN A 100 -10.755 25.134 -2.102 1.00 13.45 H new ATOM 0 HD21 ASN A 100 -8.989 25.330 0.918 1.00 51.10 H new ATOM 0 HD22 ASN A 100 -10.528 25.142 0.071 1.00 51.10 H new ATOM 1526 N ASN A 101 -9.986 22.329 -5.003 1.00 71.23 N ATOM 1527 CA ASN A 101 -10.298 22.202 -6.422 1.00 65.30 C ATOM 1528 C ASN A 101 -10.278 20.740 -6.854 1.00 53.30 C ATOM 1529 O ASN A 101 -11.027 20.334 -7.743 1.00 24.20 O ATOM 1530 CB ASN A 101 -9.302 23.007 -7.258 1.00 44.55 C ATOM 1531 CG ASN A 101 -9.981 24.060 -8.113 1.00 11.31 C ATOM 1532 OD1 ASN A 101 -10.746 23.739 -9.023 1.00 71.44 O ATOM 1533 ND2 ASN A 101 -9.705 25.326 -7.822 1.00 43.10 N ATOM 0 H ASN A 101 -9.803 21.444 -4.531 1.00 71.23 H new ATOM 0 HA ASN A 101 -11.301 22.596 -6.585 1.00 65.30 H new ATOM 0 HB2 ASN A 101 -8.583 23.489 -6.596 1.00 44.55 H new ATOM 0 HB3 ASN A 101 -8.740 22.329 -7.900 1.00 44.55 H new ATOM 0 HD21 ASN A 101 -10.133 26.078 -8.362 1.00 43.10 H new ATOM 0 HD22 ASN A 101 -9.065 25.546 -7.059 1.00 43.10 H new ATOM 1540 N ASN A 102 -9.416 19.952 -6.220 1.00 42.32 N ATOM 1541 CA ASN A 102 -9.297 18.534 -6.540 1.00 23.43 C ATOM 1542 C ASN A 102 -9.765 17.673 -5.370 1.00 72.13 C ATOM 1543 O ASN A 102 -9.912 16.458 -5.501 1.00 51.33 O ATOM 1544 CB ASN A 102 -7.850 18.189 -6.896 1.00 73.53 C ATOM 1545 CG ASN A 102 -7.501 16.751 -6.565 1.00 71.13 C ATOM 1546 OD1 ASN A 102 -7.805 15.835 -7.329 1.00 52.14 O ATOM 1547 ND2 ASN A 102 -6.858 16.546 -5.421 1.00 0.31 N ATOM 0 H ASN A 102 -8.789 20.271 -5.481 1.00 42.32 H new ATOM 0 HA ASN A 102 -9.934 18.326 -7.400 1.00 23.43 H new ATOM 0 HB2 ASN A 102 -7.689 18.364 -7.960 1.00 73.53 H new ATOM 0 HB3 ASN A 102 -7.177 18.857 -6.358 1.00 73.53 H new ATOM 0 HD21 ASN A 102 -6.596 15.599 -5.146 1.00 0.31 H new ATOM 0 HD22 ASN A 102 -6.626 17.335 -4.818 1.00 0.31 H new ATOM 1554 N ALA A 103 -9.997 18.311 -4.228 1.00 70.44 N ATOM 1555 CA ALA A 103 -10.450 17.604 -3.037 1.00 64.53 C ATOM 1556 C ALA A 103 -11.667 16.737 -3.342 1.00 64.41 C ATOM 1557 O ALA A 103 -11.797 15.628 -2.824 1.00 50.42 O ATOM 1558 CB ALA A 103 -10.769 18.593 -1.925 1.00 50.44 C ATOM 0 H ALA A 103 -9.879 19.316 -4.102 1.00 70.44 H new ATOM 0 HA ALA A 103 -9.644 16.949 -2.706 1.00 64.53 H new ATOM 0 HB1 ALA A 103 -11.106 18.051 -1.042 1.00 50.44 H new ATOM 0 HB2 ALA A 103 -9.875 19.166 -1.680 1.00 50.44 H new ATOM 0 HB3 ALA A 103 -11.555 19.272 -2.256 1.00 50.44 H new ATOM 1564 N LYS A 104 -12.556 17.251 -4.184 1.00 20.45 N ATOM 1565 CA LYS A 104 -13.764 16.524 -4.559 1.00 44.42 C ATOM 1566 C LYS A 104 -13.427 15.335 -5.453 1.00 21.11 C ATOM 1567 O LYS A 104 -14.057 14.282 -5.361 1.00 62.21 O ATOM 1568 CB LYS A 104 -14.741 17.457 -5.279 1.00 14.03 C ATOM 1569 CG LYS A 104 -14.094 18.290 -6.371 1.00 4.22 C ATOM 1570 CD LYS A 104 -15.090 18.656 -7.458 1.00 11.23 C ATOM 1571 CE LYS A 104 -16.092 19.692 -6.970 1.00 41.41 C ATOM 1572 NZ LYS A 104 -16.455 20.660 -8.043 1.00 51.23 N ATOM 0 H LYS A 104 -12.463 18.168 -4.620 1.00 20.45 H new ATOM 0 HA LYS A 104 -14.232 16.150 -3.648 1.00 44.42 H new ATOM 0 HB2 LYS A 104 -15.544 16.862 -5.715 1.00 14.03 H new ATOM 0 HB3 LYS A 104 -15.199 18.124 -4.548 1.00 14.03 H new ATOM 0 HG2 LYS A 104 -13.677 19.199 -5.937 1.00 4.22 H new ATOM 0 HG3 LYS A 104 -13.264 17.736 -6.809 1.00 4.22 H new ATOM 0 HD2 LYS A 104 -14.557 19.044 -8.326 1.00 11.23 H new ATOM 0 HD3 LYS A 104 -15.620 17.761 -7.784 1.00 11.23 H new ATOM 0 HE2 LYS A 104 -16.991 19.189 -6.615 1.00 41.41 H new ATOM 0 HE3 LYS A 104 -15.673 20.231 -6.121 1.00 41.41 H new ATOM 0 HZ1 LYS A 104 -17.139 21.349 -7.672 1.00 51.23 H new ATOM 0 HZ2 LYS A 104 -15.601 21.159 -8.364 1.00 51.23 H new ATOM 0 HZ3 LYS A 104 -16.879 20.148 -8.843 1.00 51.23 H new ATOM 1586 N GLN A 105 -12.430 15.511 -6.314 1.00 52.11 N ATOM 1587 CA GLN A 105 -12.011 14.451 -7.223 1.00 61.43 C ATOM 1588 C GLN A 105 -11.257 13.357 -6.472 1.00 53.41 C ATOM 1589 O GLN A 105 -11.547 12.171 -6.626 1.00 13.41 O ATOM 1590 CB GLN A 105 -11.131 15.022 -8.335 1.00 70.11 C ATOM 1591 CG GLN A 105 -11.555 14.590 -9.730 1.00 1.24 C ATOM 1592 CD GLN A 105 -12.057 15.748 -10.571 1.00 33.12 C ATOM 1593 OE1 GLN A 105 -13.250 15.850 -10.859 1.00 31.15 O ATOM 1594 NE2 GLN A 105 -11.146 16.628 -10.971 1.00 35.21 N ATOM 0 H GLN A 105 -11.898 16.377 -6.401 1.00 52.11 H new ATOM 0 HA GLN A 105 -12.905 14.012 -7.667 1.00 61.43 H new ATOM 0 HB2 GLN A 105 -11.150 16.110 -8.279 1.00 70.11 H new ATOM 0 HB3 GLN A 105 -10.100 14.712 -8.166 1.00 70.11 H new ATOM 0 HG2 GLN A 105 -10.710 14.120 -10.233 1.00 1.24 H new ATOM 0 HG3 GLN A 105 -12.339 13.837 -9.651 1.00 1.24 H new ATOM 0 HE21 GLN A 105 -10.168 16.504 -10.709 1.00 35.21 H new ATOM 0 HE22 GLN A 105 -11.424 17.427 -11.540 1.00 35.21 H new ATOM 1603 N VAL A 106 -10.287 13.765 -5.660 1.00 23.24 N ATOM 1604 CA VAL A 106 -9.492 12.820 -4.885 1.00 40.13 C ATOM 1605 C VAL A 106 -10.349 12.092 -3.856 1.00 2.54 C ATOM 1606 O VAL A 106 -10.163 10.902 -3.608 1.00 25.35 O ATOM 1607 CB VAL A 106 -8.329 13.526 -4.161 1.00 0.13 C ATOM 1608 CG1 VAL A 106 -8.855 14.633 -3.260 1.00 13.13 C ATOM 1609 CG2 VAL A 106 -7.511 12.523 -3.363 1.00 52.12 C ATOM 0 H VAL A 106 -10.033 14.743 -5.522 1.00 23.24 H new ATOM 0 HA VAL A 106 -9.086 12.096 -5.591 1.00 40.13 H new ATOM 0 HB VAL A 106 -7.678 13.977 -4.910 1.00 0.13 H new ATOM 0 HG11 VAL A 106 -8.020 15.120 -2.757 1.00 13.13 H new ATOM 0 HG12 VAL A 106 -9.394 15.366 -3.861 1.00 13.13 H new ATOM 0 HG13 VAL A 106 -9.528 14.207 -2.516 1.00 13.13 H new ATOM 0 HG21 VAL A 106 -6.694 13.039 -2.858 1.00 52.12 H new ATOM 0 HG22 VAL A 106 -8.149 12.041 -2.622 1.00 52.12 H new ATOM 0 HG23 VAL A 106 -7.103 11.769 -4.036 1.00 52.12 H new ATOM 1619 N ALA A 107 -11.291 12.817 -3.261 1.00 21.22 N ATOM 1620 CA ALA A 107 -12.181 12.241 -2.261 1.00 0.03 C ATOM 1621 C ALA A 107 -13.074 11.167 -2.874 1.00 62.03 C ATOM 1622 O ALA A 107 -13.372 10.156 -2.238 1.00 2.03 O ATOM 1623 CB ALA A 107 -13.027 13.328 -1.617 1.00 4.14 C ATOM 0 H ALA A 107 -11.457 13.805 -3.455 1.00 21.22 H new ATOM 0 HA ALA A 107 -11.567 11.771 -1.493 1.00 0.03 H new ATOM 0 HB1 ALA A 107 -13.687 12.882 -0.872 1.00 4.14 H new ATOM 0 HB2 ALA A 107 -12.376 14.058 -1.135 1.00 4.14 H new ATOM 0 HB3 ALA A 107 -13.625 13.824 -2.381 1.00 4.14 H new ATOM 1629 N SER A 108 -13.498 11.394 -4.113 1.00 55.30 N ATOM 1630 CA SER A 108 -14.362 10.448 -4.811 1.00 24.41 C ATOM 1631 C SER A 108 -13.590 9.188 -5.192 1.00 13.24 C ATOM 1632 O SER A 108 -14.074 8.070 -5.010 1.00 12.20 O ATOM 1633 CB SER A 108 -14.956 11.094 -6.063 1.00 22.24 C ATOM 1634 OG SER A 108 -14.604 10.368 -7.228 1.00 22.15 O ATOM 0 H SER A 108 -13.258 12.224 -4.654 1.00 55.30 H new ATOM 0 HA SER A 108 -15.172 10.168 -4.137 1.00 24.41 H new ATOM 0 HB2 SER A 108 -16.041 11.139 -5.973 1.00 22.24 H new ATOM 0 HB3 SER A 108 -14.601 12.121 -6.150 1.00 22.24 H new ATOM 0 HG SER A 108 -14.998 10.801 -8.014 1.00 22.15 H new ATOM 1640 N THR A 109 -12.386 9.377 -5.722 1.00 41.30 N ATOM 1641 CA THR A 109 -11.546 8.258 -6.131 1.00 35.14 C ATOM 1642 C THR A 109 -10.983 7.521 -4.921 1.00 4.11 C ATOM 1643 O THR A 109 -10.836 6.299 -4.937 1.00 15.50 O ATOM 1644 CB THR A 109 -10.380 8.726 -7.022 1.00 34.41 C ATOM 1645 OG1 THR A 109 -10.797 9.827 -7.835 1.00 1.33 O ATOM 1646 CG2 THR A 109 -9.887 7.592 -7.908 1.00 53.13 C ATOM 0 H THR A 109 -11.970 10.295 -5.878 1.00 41.30 H new ATOM 0 HA THR A 109 -12.180 7.580 -6.702 1.00 35.14 H new ATOM 0 HB THR A 109 -9.561 9.042 -6.375 1.00 34.41 H new ATOM 0 HG1 THR A 109 -10.880 10.631 -7.280 1.00 1.33 H new ATOM 0 HG21 THR A 109 -9.064 7.946 -8.528 1.00 53.13 H new ATOM 0 HG22 THR A 109 -9.543 6.767 -7.285 1.00 53.13 H new ATOM 0 HG23 THR A 109 -10.701 7.249 -8.547 1.00 53.13 H new ATOM 1654 N LEU A 110 -10.670 8.273 -3.871 1.00 41.30 N ATOM 1655 CA LEU A 110 -10.123 7.692 -2.650 1.00 22.44 C ATOM 1656 C LEU A 110 -11.071 6.644 -2.073 1.00 43.44 C ATOM 1657 O LEU A 110 -10.673 5.507 -1.819 1.00 32.25 O ATOM 1658 CB LEU A 110 -9.862 8.786 -1.613 1.00 61.00 C ATOM 1659 CG LEU A 110 -9.489 8.305 -0.210 1.00 3.14 C ATOM 1660 CD1 LEU A 110 -8.062 8.709 0.131 1.00 54.41 C ATOM 1661 CD2 LEU A 110 -10.462 8.861 0.820 1.00 42.25 C ATOM 0 H LEU A 110 -10.786 9.286 -3.841 1.00 41.30 H new ATOM 0 HA LEU A 110 -9.181 7.205 -2.900 1.00 22.44 H new ATOM 0 HB2 LEU A 110 -9.059 9.425 -1.982 1.00 61.00 H new ATOM 0 HB3 LEU A 110 -10.754 9.407 -1.537 1.00 61.00 H new ATOM 0 HG LEU A 110 -9.552 7.217 -0.191 1.00 3.14 H new ATOM 0 HD11 LEU A 110 -7.814 8.358 1.133 1.00 54.41 H new ATOM 0 HD12 LEU A 110 -7.376 8.264 -0.589 1.00 54.41 H new ATOM 0 HD13 LEU A 110 -7.973 9.795 0.094 1.00 54.41 H new ATOM 0 HD21 LEU A 110 -10.182 8.509 1.813 1.00 42.25 H new ATOM 0 HD22 LEU A 110 -10.431 9.950 0.799 1.00 42.25 H new ATOM 0 HD23 LEU A 110 -11.472 8.523 0.587 1.00 42.25 H new ATOM 1673 N SER A 111 -12.324 7.036 -1.872 1.00 33.25 N ATOM 1674 CA SER A 111 -13.328 6.132 -1.324 1.00 14.42 C ATOM 1675 C SER A 111 -13.658 5.020 -2.316 1.00 43.30 C ATOM 1676 O SER A 111 -13.878 3.873 -1.929 1.00 45.54 O ATOM 1677 CB SER A 111 -14.599 6.904 -0.965 1.00 21.22 C ATOM 1678 OG SER A 111 -14.304 8.014 -0.135 1.00 55.13 O ATOM 0 H SER A 111 -12.669 7.973 -2.080 1.00 33.25 H new ATOM 0 HA SER A 111 -12.919 5.680 -0.421 1.00 14.42 H new ATOM 0 HB2 SER A 111 -15.089 7.247 -1.876 1.00 21.22 H new ATOM 0 HB3 SER A 111 -15.299 6.241 -0.456 1.00 21.22 H new ATOM 0 HG SER A 111 -14.010 8.767 -0.689 1.00 55.13 H new ATOM 1684 N GLU A 112 -13.692 5.372 -3.598 1.00 74.31 N ATOM 1685 CA GLU A 112 -13.995 4.404 -4.647 1.00 21.44 C ATOM 1686 C GLU A 112 -12.994 3.253 -4.632 1.00 72.12 C ATOM 1687 O GLU A 112 -13.373 2.086 -4.720 1.00 40.14 O ATOM 1688 CB GLU A 112 -13.987 5.085 -6.017 1.00 12.11 C ATOM 1689 CG GLU A 112 -13.955 4.109 -7.181 1.00 35.42 C ATOM 1690 CD GLU A 112 -14.409 4.739 -8.484 1.00 74.33 C ATOM 1691 OE1 GLU A 112 -14.151 5.944 -8.681 1.00 4.12 O ATOM 1692 OE2 GLU A 112 -15.021 4.025 -9.306 1.00 70.01 O ATOM 0 H GLU A 112 -13.514 6.318 -3.935 1.00 74.31 H new ATOM 0 HA GLU A 112 -14.989 3.999 -4.456 1.00 21.44 H new ATOM 0 HB2 GLU A 112 -14.872 5.714 -6.106 1.00 12.11 H new ATOM 0 HB3 GLU A 112 -13.120 5.743 -6.081 1.00 12.11 H new ATOM 0 HG2 GLU A 112 -12.942 3.726 -7.301 1.00 35.42 H new ATOM 0 HG3 GLU A 112 -14.594 3.256 -6.952 1.00 35.42 H new ATOM 1699 N ASN A 113 -11.713 3.592 -4.520 1.00 35.40 N ATOM 1700 CA ASN A 113 -10.657 2.587 -4.494 1.00 42.53 C ATOM 1701 C ASN A 113 -10.520 1.977 -3.103 1.00 73.44 C ATOM 1702 O ASN A 113 -10.255 0.782 -2.961 1.00 40.34 O ATOM 1703 CB ASN A 113 -9.325 3.207 -4.925 1.00 22.01 C ATOM 1704 CG ASN A 113 -9.259 3.454 -6.420 1.00 21.32 C ATOM 1705 OD1 ASN A 113 -8.784 2.611 -7.180 1.00 33.42 O ATOM 1706 ND2 ASN A 113 -9.737 4.617 -6.848 1.00 10.10 N ATOM 0 H ASN A 113 -11.382 4.554 -4.446 1.00 35.40 H new ATOM 0 HA ASN A 113 -10.926 1.795 -5.193 1.00 42.53 H new ATOM 0 HB2 ASN A 113 -9.178 4.149 -4.397 1.00 22.01 H new ATOM 0 HB3 ASN A 113 -8.508 2.547 -4.632 1.00 22.01 H new ATOM 0 HD21 ASN A 113 -9.719 4.841 -7.843 1.00 10.10 H new ATOM 0 HD22 ASN A 113 -10.122 5.287 -6.182 1.00 10.10 H new ATOM 1713 N LEU A 114 -10.703 2.803 -2.080 1.00 71.23 N ATOM 1714 CA LEU A 114 -10.602 2.345 -0.699 1.00 70.34 C ATOM 1715 C LEU A 114 -11.666 1.296 -0.393 1.00 60.34 C ATOM 1716 O LEU A 114 -11.374 0.252 0.190 1.00 30.34 O ATOM 1717 CB LEU A 114 -10.742 3.526 0.263 1.00 24.01 C ATOM 1718 CG LEU A 114 -10.952 3.172 1.736 1.00 41.44 C ATOM 1719 CD1 LEU A 114 -10.307 4.216 2.634 1.00 51.42 C ATOM 1720 CD2 LEU A 114 -12.435 3.042 2.047 1.00 33.41 C ATOM 0 H LEU A 114 -10.922 3.794 -2.180 1.00 71.23 H new ATOM 0 HA LEU A 114 -9.621 1.890 -0.565 1.00 70.34 H new ATOM 0 HB2 LEU A 114 -9.847 4.142 0.182 1.00 24.01 H new ATOM 0 HB3 LEU A 114 -11.581 4.139 -0.066 1.00 24.01 H new ATOM 0 HG LEU A 114 -10.475 2.211 1.930 1.00 41.44 H new ATOM 0 HD11 LEU A 114 -10.467 3.947 3.678 1.00 51.42 H new ATOM 0 HD12 LEU A 114 -9.237 4.260 2.431 1.00 51.42 H new ATOM 0 HD13 LEU A 114 -10.754 5.191 2.438 1.00 51.42 H new ATOM 0 HD21 LEU A 114 -12.565 2.790 3.099 1.00 33.41 H new ATOM 0 HD22 LEU A 114 -12.935 3.987 1.836 1.00 33.41 H new ATOM 0 HD23 LEU A 114 -12.869 2.256 1.429 1.00 33.41 H new ATOM 1732 N VAL A 115 -12.901 1.580 -0.792 1.00 50.32 N ATOM 1733 CA VAL A 115 -14.009 0.660 -0.564 1.00 2.11 C ATOM 1734 C VAL A 115 -13.877 -0.586 -1.433 1.00 23.44 C ATOM 1735 O VAL A 115 -14.115 -1.703 -0.974 1.00 65.45 O ATOM 1736 CB VAL A 115 -15.365 1.332 -0.853 1.00 20.35 C ATOM 1737 CG1 VAL A 115 -16.467 0.289 -0.951 1.00 15.01 C ATOM 1738 CG2 VAL A 115 -15.688 2.362 0.221 1.00 61.13 C ATOM 0 H VAL A 115 -13.160 2.440 -1.275 1.00 50.32 H new ATOM 0 HA VAL A 115 -13.970 0.373 0.487 1.00 2.11 H new ATOM 0 HB VAL A 115 -15.299 1.847 -1.811 1.00 20.35 H new ATOM 0 HG11 VAL A 115 -17.417 0.782 -1.155 1.00 15.01 H new ATOM 0 HG12 VAL A 115 -16.238 -0.407 -1.758 1.00 15.01 H new ATOM 0 HG13 VAL A 115 -16.536 -0.257 -0.010 1.00 15.01 H new ATOM 0 HG21 VAL A 115 -16.649 2.827 0.002 1.00 61.13 H new ATOM 0 HG22 VAL A 115 -15.736 1.871 1.193 1.00 61.13 H new ATOM 0 HG23 VAL A 115 -14.911 3.126 0.238 1.00 61.13 H new ATOM 1748 N ARG A 116 -13.496 -0.385 -2.690 1.00 43.23 N ATOM 1749 CA ARG A 116 -13.332 -1.493 -3.624 1.00 11.34 C ATOM 1750 C ARG A 116 -12.394 -2.551 -3.053 1.00 51.54 C ATOM 1751 O ARG A 116 -12.696 -3.744 -3.084 1.00 30.01 O ATOM 1752 CB ARG A 116 -12.792 -0.984 -4.962 1.00 40.14 C ATOM 1753 CG ARG A 116 -12.294 -2.090 -5.878 1.00 74.14 C ATOM 1754 CD ARG A 116 -11.765 -1.532 -7.190 1.00 22.15 C ATOM 1755 NE ARG A 116 -11.540 -2.581 -8.180 1.00 44.44 N ATOM 1756 CZ ARG A 116 -11.260 -2.339 -9.456 1.00 42.32 C ATOM 1757 NH1 ARG A 116 -11.169 -1.090 -9.893 1.00 34.32 N ATOM 1758 NH2 ARG A 116 -11.067 -3.347 -10.297 1.00 21.32 N ATOM 0 H ARG A 116 -13.295 0.534 -3.085 1.00 43.23 H new ATOM 0 HA ARG A 116 -14.309 -1.948 -3.784 1.00 11.34 H new ATOM 0 HB2 ARG A 116 -13.577 -0.427 -5.473 1.00 40.14 H new ATOM 0 HB3 ARG A 116 -11.977 -0.286 -4.773 1.00 40.14 H new ATOM 0 HG2 ARG A 116 -11.506 -2.652 -5.376 1.00 74.14 H new ATOM 0 HG3 ARG A 116 -13.105 -2.789 -6.080 1.00 74.14 H new ATOM 0 HD2 ARG A 116 -12.474 -0.805 -7.587 1.00 22.15 H new ATOM 0 HD3 ARG A 116 -10.831 -1.000 -7.007 1.00 22.15 H new ATOM 0 HE ARG A 116 -11.601 -3.553 -7.876 1.00 44.44 H new ATOM 0 HH11 ARG A 116 -11.314 -0.312 -9.249 1.00 34.32 H new ATOM 0 HH12 ARG A 116 -10.954 -0.907 -10.873 1.00 34.32 H new ATOM 0 HH21 ARG A 116 -11.134 -4.309 -9.964 1.00 21.32 H new ATOM 0 HH22 ARG A 116 -10.852 -3.160 -11.276 1.00 21.32 H new ATOM 1772 N GLU A 117 -11.254 -2.106 -2.534 1.00 1.41 N ATOM 1773 CA GLU A 117 -10.271 -3.016 -1.957 1.00 5.31 C ATOM 1774 C GLU A 117 -10.697 -3.466 -0.563 1.00 12.43 C ATOM 1775 O GLU A 117 -10.535 -4.629 -0.198 1.00 51.04 O ATOM 1776 CB GLU A 117 -8.897 -2.343 -1.891 1.00 14.14 C ATOM 1777 CG GLU A 117 -7.766 -3.219 -2.401 1.00 41.31 C ATOM 1778 CD GLU A 117 -8.047 -3.794 -3.775 1.00 74.25 C ATOM 1779 OE1 GLU A 117 -8.440 -3.020 -4.674 1.00 63.41 O ATOM 1780 OE2 GLU A 117 -7.875 -5.019 -3.954 1.00 25.35 O ATOM 0 H GLU A 117 -10.988 -1.122 -2.501 1.00 1.41 H new ATOM 0 HA GLU A 117 -10.207 -3.895 -2.599 1.00 5.31 H new ATOM 0 HB2 GLU A 117 -8.924 -1.423 -2.474 1.00 14.14 H new ATOM 0 HB3 GLU A 117 -8.689 -2.060 -0.859 1.00 14.14 H new ATOM 0 HG2 GLU A 117 -6.847 -2.634 -2.437 1.00 41.31 H new ATOM 0 HG3 GLU A 117 -7.598 -4.034 -1.698 1.00 41.31 H new ATOM 1787 N MET A 118 -11.242 -2.533 0.211 1.00 31.21 N ATOM 1788 CA MET A 118 -11.693 -2.833 1.566 1.00 54.25 C ATOM 1789 C MET A 118 -12.669 -4.006 1.566 1.00 33.42 C ATOM 1790 O MET A 118 -12.558 -4.917 2.387 1.00 51.13 O ATOM 1791 CB MET A 118 -12.354 -1.603 2.191 1.00 15.10 C ATOM 1792 CG MET A 118 -11.381 -0.698 2.927 1.00 61.53 C ATOM 1793 SD MET A 118 -11.754 -0.561 4.686 1.00 34.23 S ATOM 1794 CE MET A 118 -12.961 0.763 4.673 1.00 5.32 C ATOM 0 H MET A 118 -11.382 -1.564 -0.076 1.00 31.21 H new ATOM 0 HA MET A 118 -10.822 -3.108 2.160 1.00 54.25 H new ATOM 0 HB2 MET A 118 -12.849 -1.029 1.407 1.00 15.10 H new ATOM 0 HB3 MET A 118 -13.129 -1.930 2.885 1.00 15.10 H new ATOM 0 HG2 MET A 118 -10.369 -1.083 2.803 1.00 61.53 H new ATOM 0 HG3 MET A 118 -11.402 0.294 2.477 1.00 61.53 H new ATOM 0 HE1 MET A 118 -13.717 0.573 5.435 1.00 5.32 H new ATOM 0 HE2 MET A 118 -12.464 1.710 4.883 1.00 5.32 H new ATOM 0 HE3 MET A 118 -13.437 0.812 3.694 1.00 5.32 H new ATOM 1804 N ALA A 119 -13.625 -3.975 0.644 1.00 41.03 N ATOM 1805 CA ALA A 119 -14.618 -5.036 0.538 1.00 74.00 C ATOM 1806 C ALA A 119 -13.987 -6.333 0.043 1.00 44.11 C ATOM 1807 O ALA A 119 -14.336 -7.419 0.503 1.00 33.33 O ATOM 1808 CB ALA A 119 -15.748 -4.610 -0.389 1.00 60.34 C ATOM 0 H ALA A 119 -13.733 -3.226 -0.040 1.00 41.03 H new ATOM 0 HA ALA A 119 -15.026 -5.218 1.532 1.00 74.00 H new ATOM 0 HB1 ALA A 119 -16.483 -5.412 -0.459 1.00 60.34 H new ATOM 0 HB2 ALA A 119 -16.226 -3.714 0.007 1.00 60.34 H new ATOM 0 HB3 ALA A 119 -15.346 -4.399 -1.380 1.00 60.34 H new ATOM 1814 N ASN A 120 -13.055 -6.211 -0.897 1.00 32.01 N ATOM 1815 CA ASN A 120 -12.375 -7.375 -1.454 1.00 4.32 C ATOM 1816 C ASN A 120 -11.592 -8.116 -0.375 1.00 4.20 C ATOM 1817 O ASN A 120 -11.394 -9.329 -0.457 1.00 51.31 O ATOM 1818 CB ASN A 120 -11.433 -6.949 -2.583 1.00 20.42 C ATOM 1819 CG ASN A 120 -12.181 -6.567 -3.845 1.00 54.45 C ATOM 1820 OD1 ASN A 120 -13.290 -7.041 -4.092 1.00 42.43 O ATOM 1821 ND2 ASN A 120 -11.574 -5.706 -4.655 1.00 64.10 N ATOM 0 H ASN A 120 -12.754 -5.319 -1.289 1.00 32.01 H new ATOM 0 HA ASN A 120 -13.131 -8.049 -1.856 1.00 4.32 H new ATOM 0 HB2 ASN A 120 -10.831 -6.104 -2.251 1.00 20.42 H new ATOM 0 HB3 ASN A 120 -10.744 -7.764 -2.805 1.00 20.42 H new ATOM 0 HD21 ASN A 120 -12.028 -5.413 -5.520 1.00 64.10 H new ATOM 0 HD22 ASN A 120 -10.655 -5.338 -4.411 1.00 64.10 H new ATOM 1828 N THR A 121 -11.147 -7.379 0.637 1.00 32.34 N ATOM 1829 CA THR A 121 -10.385 -7.965 1.733 1.00 53.00 C ATOM 1830 C THR A 121 -11.299 -8.373 2.882 1.00 71.33 C ATOM 1831 O THR A 121 -11.161 -9.461 3.441 1.00 41.33 O ATOM 1832 CB THR A 121 -9.319 -6.986 2.262 1.00 71.32 C ATOM 1833 OG1 THR A 121 -8.925 -6.083 1.224 1.00 43.22 O ATOM 1834 CG2 THR A 121 -8.101 -7.739 2.777 1.00 1.45 C ATOM 0 H THR A 121 -11.301 -6.374 0.721 1.00 32.34 H new ATOM 0 HA THR A 121 -9.889 -8.851 1.335 1.00 53.00 H new ATOM 0 HB THR A 121 -9.753 -6.422 3.087 1.00 71.32 H new ATOM 0 HG1 THR A 121 -9.624 -5.408 1.095 1.00 43.22 H new ATOM 0 HG21 THR A 121 -7.362 -7.027 3.145 1.00 1.45 H new ATOM 0 HG22 THR A 121 -8.400 -8.404 3.588 1.00 1.45 H new ATOM 0 HG23 THR A 121 -7.667 -8.326 1.968 1.00 1.45 H new ATOM 1842 N ALA A 122 -12.233 -7.495 3.230 1.00 2.23 N ATOM 1843 CA ALA A 122 -13.173 -7.766 4.311 1.00 60.42 C ATOM 1844 C ALA A 122 -13.943 -9.057 4.058 1.00 22.11 C ATOM 1845 O ALA A 122 -14.164 -9.849 4.974 1.00 61.30 O ATOM 1846 CB ALA A 122 -14.134 -6.599 4.481 1.00 52.34 C ATOM 0 H ALA A 122 -12.359 -6.589 2.779 1.00 2.23 H new ATOM 0 HA ALA A 122 -12.603 -7.889 5.232 1.00 60.42 H new ATOM 0 HB1 ALA A 122 -14.830 -6.816 5.292 1.00 52.34 H new ATOM 0 HB2 ALA A 122 -13.571 -5.696 4.717 1.00 52.34 H new ATOM 0 HB3 ALA A 122 -14.690 -6.448 3.556 1.00 52.34 H new ATOM 1852 N ARG A 123 -14.351 -9.262 2.810 1.00 70.25 N ATOM 1853 CA ARG A 123 -15.099 -10.456 2.437 1.00 73.30 C ATOM 1854 C ARG A 123 -14.335 -11.719 2.821 1.00 64.43 C ATOM 1855 O ARG A 123 -14.934 -12.749 3.135 1.00 45.01 O ATOM 1856 CB ARG A 123 -15.383 -10.458 0.933 1.00 32.53 C ATOM 1857 CG ARG A 123 -14.171 -10.803 0.085 1.00 43.23 C ATOM 1858 CD ARG A 123 -14.537 -10.931 -1.385 1.00 52.33 C ATOM 1859 NE ARG A 123 -15.163 -12.216 -1.683 1.00 54.22 N ATOM 1860 CZ ARG A 123 -14.487 -13.354 -1.798 1.00 74.40 C ATOM 1861 NH1 ARG A 123 -13.171 -13.367 -1.640 1.00 3.13 N ATOM 1862 NH2 ARG A 123 -15.129 -14.484 -2.070 1.00 52.43 N ATOM 0 H ARG A 123 -14.176 -8.616 2.040 1.00 70.25 H new ATOM 0 HA ARG A 123 -16.045 -10.444 2.979 1.00 73.30 H new ATOM 0 HB2 ARG A 123 -16.178 -11.173 0.723 1.00 32.53 H new ATOM 0 HB3 ARG A 123 -15.753 -9.475 0.640 1.00 32.53 H new ATOM 0 HG2 ARG A 123 -13.410 -10.032 0.206 1.00 43.23 H new ATOM 0 HG3 ARG A 123 -13.735 -11.739 0.435 1.00 43.23 H new ATOM 0 HD2 ARG A 123 -15.216 -10.124 -1.661 1.00 52.33 H new ATOM 0 HD3 ARG A 123 -13.640 -10.815 -1.993 1.00 52.33 H new ATOM 0 HE ARG A 123 -16.175 -12.241 -1.810 1.00 54.22 H new ATOM 0 HH11 ARG A 123 -12.674 -12.501 -1.429 1.00 3.13 H new ATOM 0 HH12 ARG A 123 -12.655 -14.243 -1.729 1.00 3.13 H new ATOM 0 HH21 ARG A 123 -16.142 -14.479 -2.191 1.00 52.43 H new ATOM 0 HH22 ARG A 123 -14.609 -15.357 -2.158 1.00 52.43 H new ATOM 1876 N ARG A 124 -13.008 -11.633 2.796 1.00 22.22 N ATOM 1877 CA ARG A 124 -12.162 -12.769 3.141 1.00 52.32 C ATOM 1878 C ARG A 124 -12.102 -12.964 4.654 1.00 1.43 C ATOM 1879 O ARG A 124 -11.701 -14.022 5.138 1.00 2.10 O ATOM 1880 CB ARG A 124 -10.751 -12.568 2.585 1.00 21.02 C ATOM 1881 CG ARG A 124 -10.727 -12.008 1.173 1.00 53.11 C ATOM 1882 CD ARG A 124 -9.321 -11.601 0.758 1.00 72.50 C ATOM 1883 NE ARG A 124 -9.281 -11.082 -0.606 1.00 42.13 N ATOM 1884 CZ ARG A 124 -9.401 -11.846 -1.687 1.00 22.02 C ATOM 1885 NH1 ARG A 124 -9.569 -13.155 -1.562 1.00 22.33 N ATOM 1886 NH2 ARG A 124 -9.355 -11.300 -2.895 1.00 1.35 N ATOM 0 H ARG A 124 -12.496 -10.788 2.540 1.00 22.22 H new ATOM 0 HA ARG A 124 -12.597 -13.663 2.695 1.00 52.32 H new ATOM 0 HB2 ARG A 124 -10.203 -11.894 3.243 1.00 21.02 H new ATOM 0 HB3 ARG A 124 -10.225 -13.523 2.597 1.00 21.02 H new ATOM 0 HG2 ARG A 124 -11.111 -12.755 0.478 1.00 53.11 H new ATOM 0 HG3 ARG A 124 -11.390 -11.145 1.112 1.00 53.11 H new ATOM 0 HD2 ARG A 124 -8.946 -10.843 1.445 1.00 72.50 H new ATOM 0 HD3 ARG A 124 -8.656 -12.461 0.838 1.00 72.50 H new ATOM 0 HE ARG A 124 -9.154 -10.078 -0.737 1.00 42.13 H new ATOM 0 HH11 ARG A 124 -9.606 -13.578 -0.635 1.00 22.33 H new ATOM 0 HH12 ARG A 124 -9.661 -13.739 -2.393 1.00 22.33 H new ATOM 0 HH21 ARG A 124 -9.227 -10.293 -2.995 1.00 1.35 H new ATOM 0 HH22 ARG A 124 -9.447 -11.887 -3.724 1.00 1.35 H new ATOM 1900 N TYR A 125 -12.503 -11.935 5.393 1.00 0.20 N ATOM 1901 CA TYR A 125 -12.492 -11.991 6.849 1.00 21.20 C ATOM 1902 C TYR A 125 -13.870 -12.362 7.391 1.00 42.02 C ATOM 1903 O TYR A 125 -14.200 -12.061 8.538 1.00 52.43 O ATOM 1904 CB TYR A 125 -12.049 -10.647 7.429 1.00 63.20 C ATOM 1905 CG TYR A 125 -10.590 -10.335 7.188 1.00 43.40 C ATOM 1906 CD1 TYR A 125 -9.594 -10.943 7.942 1.00 53.52 C ATOM 1907 CD2 TYR A 125 -10.207 -9.430 6.203 1.00 74.31 C ATOM 1908 CE1 TYR A 125 -8.260 -10.660 7.724 1.00 43.44 C ATOM 1909 CE2 TYR A 125 -8.874 -9.142 5.978 1.00 33.11 C ATOM 1910 CZ TYR A 125 -7.904 -9.759 6.741 1.00 14.14 C ATOM 1911 OH TYR A 125 -6.577 -9.475 6.520 1.00 64.51 O ATOM 0 H TYR A 125 -12.839 -11.053 5.007 1.00 0.20 H new ATOM 0 HA TYR A 125 -11.783 -12.761 7.152 1.00 21.20 H new ATOM 0 HB2 TYR A 125 -12.658 -9.855 6.994 1.00 63.20 H new ATOM 0 HB3 TYR A 125 -12.240 -10.643 8.502 1.00 63.20 H new ATOM 0 HD1 TYR A 125 -9.868 -11.649 8.712 1.00 53.52 H new ATOM 0 HD2 TYR A 125 -10.964 -8.945 5.604 1.00 74.31 H new ATOM 0 HE1 TYR A 125 -7.499 -11.142 8.320 1.00 43.44 H new ATOM 0 HE2 TYR A 125 -8.593 -8.438 5.209 1.00 33.11 H new ATOM 0 HH TYR A 125 -6.499 -8.822 5.793 1.00 64.51 H new ATOM 1921 N ARG A 126 -14.668 -13.019 6.557 1.00 15.40 N ATOM 1922 CA ARG A 126 -16.011 -13.431 6.949 1.00 51.22 C ATOM 1923 C ARG A 126 -16.933 -12.223 7.084 1.00 64.50 C ATOM 1924 O ARG A 126 -17.801 -12.186 7.957 1.00 53.42 O ATOM 1925 CB ARG A 126 -15.964 -14.202 8.270 1.00 61.10 C ATOM 1926 CG ARG A 126 -16.948 -15.359 8.336 1.00 44.41 C ATOM 1927 CD ARG A 126 -17.989 -15.143 9.423 1.00 61.55 C ATOM 1928 NE ARG A 126 -18.722 -16.368 9.729 1.00 54.13 N ATOM 1929 CZ ARG A 126 -19.789 -16.409 10.519 1.00 2.13 C ATOM 1930 NH1 ARG A 126 -20.244 -15.297 11.080 1.00 72.40 N ATOM 1931 NH2 ARG A 126 -20.403 -17.563 10.749 1.00 3.25 N ATOM 0 H ARG A 126 -14.408 -13.278 5.605 1.00 15.40 H new ATOM 0 HA ARG A 126 -16.407 -14.082 6.170 1.00 51.22 H new ATOM 0 HB2 ARG A 126 -14.955 -14.585 8.421 1.00 61.10 H new ATOM 0 HB3 ARG A 126 -16.170 -13.514 9.090 1.00 61.10 H new ATOM 0 HG2 ARG A 126 -17.445 -15.471 7.372 1.00 44.41 H new ATOM 0 HG3 ARG A 126 -16.408 -16.287 8.527 1.00 44.41 H new ATOM 0 HD2 ARG A 126 -17.500 -14.778 10.326 1.00 61.55 H new ATOM 0 HD3 ARG A 126 -18.690 -14.371 9.106 1.00 61.55 H new ATOM 0 HE ARG A 126 -18.397 -17.241 9.313 1.00 54.13 H new ATOM 0 HH11 ARG A 126 -19.775 -14.409 10.905 1.00 72.40 H new ATOM 0 HH12 ARG A 126 -21.063 -15.330 11.686 1.00 72.40 H new ATOM 0 HH21 ARG A 126 -20.056 -18.420 10.319 1.00 3.25 H new ATOM 0 HH22 ARG A 126 -21.222 -17.593 11.356 1.00 3.25 H new ATOM 2041 N VAL A 134 -20.572 -3.386 -3.197 1.00 23.33 N ATOM 2042 CA VAL A 134 -19.458 -2.449 -3.291 1.00 63.31 C ATOM 2043 C VAL A 134 -19.740 -1.362 -4.322 1.00 13.45 C ATOM 2044 O VAL A 134 -19.412 -0.195 -4.112 1.00 53.50 O ATOM 2045 CB VAL A 134 -18.150 -3.170 -3.665 1.00 42.42 C ATOM 2046 CG1 VAL A 134 -16.951 -2.266 -3.415 1.00 13.14 C ATOM 2047 CG2 VAL A 134 -18.017 -4.471 -2.889 1.00 24.32 C ATOM 0 HA VAL A 134 -19.344 -1.992 -2.308 1.00 63.31 H new ATOM 0 HB VAL A 134 -18.180 -3.409 -4.728 1.00 42.42 H new ATOM 0 HG11 VAL A 134 -16.036 -2.793 -3.685 1.00 13.14 H new ATOM 0 HG12 VAL A 134 -17.043 -1.364 -4.020 1.00 13.14 H new ATOM 0 HG13 VAL A 134 -16.915 -1.993 -2.360 1.00 13.14 H new ATOM 0 HG21 VAL A 134 -17.087 -4.967 -3.166 1.00 24.32 H new ATOM 0 HG22 VAL A 134 -18.010 -4.258 -1.820 1.00 24.32 H new ATOM 0 HG23 VAL A 134 -18.859 -5.122 -3.124 1.00 24.32 H new ATOM 2057 N GLN A 135 -20.351 -1.754 -5.435 1.00 75.12 N ATOM 2058 CA GLN A 135 -20.677 -0.812 -6.500 1.00 51.11 C ATOM 2059 C GLN A 135 -21.518 0.342 -5.966 1.00 22.41 C ATOM 2060 O GLN A 135 -21.348 1.489 -6.378 1.00 24.10 O ATOM 2061 CB GLN A 135 -21.424 -1.525 -7.629 1.00 3.15 C ATOM 2062 CG GLN A 135 -22.681 -2.244 -7.166 1.00 53.45 C ATOM 2063 CD GLN A 135 -23.950 -1.532 -7.590 1.00 14.54 C ATOM 2064 OE1 GLN A 135 -23.983 -0.306 -7.695 1.00 43.42 O ATOM 2065 NE2 GLN A 135 -25.005 -2.299 -7.838 1.00 53.13 N ATOM 0 H GLN A 135 -20.630 -2.717 -5.623 1.00 75.12 H new ATOM 0 HA GLN A 135 -19.744 -0.407 -6.891 1.00 51.11 H new ATOM 0 HB2 GLN A 135 -21.693 -0.796 -8.393 1.00 3.15 H new ATOM 0 HB3 GLN A 135 -20.755 -2.246 -8.098 1.00 3.15 H new ATOM 0 HG2 GLN A 135 -22.685 -3.257 -7.569 1.00 53.45 H new ATOM 0 HG3 GLN A 135 -22.665 -2.333 -6.080 1.00 53.45 H new ATOM 0 HE21 GLN A 135 -24.934 -3.312 -7.739 1.00 53.13 H new ATOM 0 HE22 GLN A 135 -25.886 -1.876 -8.128 1.00 53.13 H new ATOM 2074 N ALA A 136 -22.427 0.030 -5.047 1.00 53.53 N ATOM 2075 CA ALA A 136 -23.293 1.042 -4.456 1.00 71.13 C ATOM 2076 C ALA A 136 -22.497 2.002 -3.578 1.00 52.22 C ATOM 2077 O ALA A 136 -22.809 3.191 -3.500 1.00 51.22 O ATOM 2078 CB ALA A 136 -24.401 0.382 -3.648 1.00 41.25 C ATOM 0 H ALA A 136 -22.582 -0.915 -4.696 1.00 53.53 H new ATOM 0 HA ALA A 136 -23.741 1.618 -5.266 1.00 71.13 H new ATOM 0 HB1 ALA A 136 -25.040 1.150 -3.212 1.00 41.25 H new ATOM 0 HB2 ALA A 136 -24.995 -0.258 -4.300 1.00 41.25 H new ATOM 0 HB3 ALA A 136 -23.962 -0.219 -2.852 1.00 41.25 H new ATOM 2084 N ASP A 137 -21.469 1.480 -2.920 1.00 60.20 N ATOM 2085 CA ASP A 137 -20.628 2.291 -2.047 1.00 52.54 C ATOM 2086 C ASP A 137 -19.768 3.253 -2.862 1.00 14.24 C ATOM 2087 O ASP A 137 -19.539 4.392 -2.458 1.00 24.34 O ATOM 2088 CB ASP A 137 -19.736 1.395 -1.187 1.00 64.43 C ATOM 2089 CG ASP A 137 -20.473 0.820 0.007 1.00 53.31 C ATOM 2090 OD1 ASP A 137 -21.659 1.162 0.192 1.00 34.20 O ATOM 2091 OD2 ASP A 137 -19.864 0.028 0.756 1.00 41.23 O ATOM 0 H ASP A 137 -21.197 0.498 -2.974 1.00 60.20 H new ATOM 0 HA ASP A 137 -21.279 2.875 -1.396 1.00 52.54 H new ATOM 0 HB2 ASP A 137 -19.348 0.580 -1.798 1.00 64.43 H new ATOM 0 HB3 ASP A 137 -18.877 1.969 -0.838 1.00 64.43 H new ATOM 2096 N VAL A 138 -19.295 2.785 -4.013 1.00 72.04 N ATOM 2097 CA VAL A 138 -18.460 3.603 -4.885 1.00 1.30 C ATOM 2098 C VAL A 138 -19.267 4.733 -5.515 1.00 45.10 C ATOM 2099 O VAL A 138 -18.785 5.860 -5.638 1.00 20.32 O ATOM 2100 CB VAL A 138 -17.821 2.759 -6.004 1.00 70.33 C ATOM 2101 CG1 VAL A 138 -17.168 3.658 -7.044 1.00 75.40 C ATOM 2102 CG2 VAL A 138 -16.811 1.782 -5.422 1.00 34.41 C ATOM 0 H VAL A 138 -19.476 1.844 -4.363 1.00 72.04 H new ATOM 0 HA VAL A 138 -17.671 4.025 -4.263 1.00 1.30 H new ATOM 0 HB VAL A 138 -18.606 2.185 -6.497 1.00 70.33 H new ATOM 0 HG11 VAL A 138 -16.722 3.044 -7.827 1.00 75.40 H new ATOM 0 HG12 VAL A 138 -17.920 4.314 -7.482 1.00 75.40 H new ATOM 0 HG13 VAL A 138 -16.393 4.260 -6.569 1.00 75.40 H new ATOM 0 HG21 VAL A 138 -16.369 1.194 -6.226 1.00 34.41 H new ATOM 0 HG22 VAL A 138 -16.027 2.335 -4.904 1.00 34.41 H new ATOM 0 HG23 VAL A 138 -17.312 1.117 -4.719 1.00 34.41 H new ATOM 2112 N SER A 139 -20.498 4.426 -5.910 1.00 51.44 N ATOM 2113 CA SER A 139 -21.371 5.415 -6.531 1.00 22.03 C ATOM 2114 C SER A 139 -21.894 6.405 -5.494 1.00 71.21 C ATOM 2115 O SER A 139 -22.140 7.572 -5.801 1.00 62.40 O ATOM 2116 CB SER A 139 -22.543 4.725 -7.230 1.00 10.12 C ATOM 2117 OG SER A 139 -22.116 3.556 -7.908 1.00 0.12 O ATOM 0 H SER A 139 -20.914 3.500 -5.811 1.00 51.44 H new ATOM 0 HA SER A 139 -20.788 5.964 -7.271 1.00 22.03 H new ATOM 0 HB2 SER A 139 -23.306 4.465 -6.496 1.00 10.12 H new ATOM 0 HB3 SER A 139 -23.003 5.413 -7.939 1.00 10.12 H new ATOM 0 HG SER A 139 -22.166 2.789 -7.300 1.00 0.12 H new ATOM 2123 N LEU A 140 -22.061 5.930 -4.265 1.00 74.11 N ATOM 2124 CA LEU A 140 -22.554 6.771 -3.180 1.00 1.14 C ATOM 2125 C LEU A 140 -21.504 7.796 -2.764 1.00 41.35 C ATOM 2126 O LEU A 140 -21.789 8.990 -2.673 1.00 43.45 O ATOM 2127 CB LEU A 140 -22.947 5.909 -1.978 1.00 41.20 C ATOM 2128 CG LEU A 140 -23.275 6.665 -0.690 1.00 32.23 C ATOM 2129 CD1 LEU A 140 -24.394 5.967 0.067 1.00 63.50 C ATOM 2130 CD2 LEU A 140 -22.036 6.793 0.184 1.00 34.31 C ATOM 0 H LEU A 140 -21.862 4.967 -3.995 1.00 74.11 H new ATOM 0 HA LEU A 140 -23.433 7.305 -3.539 1.00 1.14 H new ATOM 0 HB2 LEU A 140 -23.814 5.309 -2.254 1.00 41.20 H new ATOM 0 HB3 LEU A 140 -22.132 5.215 -1.771 1.00 41.20 H new ATOM 0 HG LEU A 140 -23.613 7.667 -0.955 1.00 32.23 H new ATOM 0 HD11 LEU A 140 -24.614 6.519 0.981 1.00 63.50 H new ATOM 0 HD12 LEU A 140 -25.287 5.928 -0.557 1.00 63.50 H new ATOM 0 HD13 LEU A 140 -24.084 4.953 0.321 1.00 63.50 H new ATOM 0 HD21 LEU A 140 -22.288 7.334 1.096 1.00 34.31 H new ATOM 0 HD22 LEU A 140 -21.668 5.800 0.441 1.00 34.31 H new ATOM 0 HD23 LEU A 140 -21.263 7.337 -0.358 1.00 34.31 H new ATOM 2142 N VAL A 141 -20.288 7.320 -2.514 1.00 4.24 N ATOM 2143 CA VAL A 141 -19.193 8.196 -2.112 1.00 74.21 C ATOM 2144 C VAL A 141 -18.845 9.185 -3.218 1.00 74.23 C ATOM 2145 O VAL A 141 -18.560 10.354 -2.955 1.00 12.11 O ATOM 2146 CB VAL A 141 -17.934 7.388 -1.745 1.00 52.14 C ATOM 2147 CG1 VAL A 141 -18.184 6.542 -0.506 1.00 13.02 C ATOM 2148 CG2 VAL A 141 -17.501 6.518 -2.916 1.00 41.20 C ATOM 0 H VAL A 141 -20.036 6.334 -2.583 1.00 4.24 H new ATOM 0 HA VAL A 141 -19.533 8.744 -1.233 1.00 74.21 H new ATOM 0 HB VAL A 141 -17.127 8.086 -1.521 1.00 52.14 H new ATOM 0 HG11 VAL A 141 -17.283 5.978 -0.262 1.00 13.02 H new ATOM 0 HG12 VAL A 141 -18.444 7.190 0.331 1.00 13.02 H new ATOM 0 HG13 VAL A 141 -19.004 5.850 -0.697 1.00 13.02 H new ATOM 0 HG21 VAL A 141 -16.610 5.954 -2.640 1.00 41.20 H new ATOM 0 HG22 VAL A 141 -18.304 5.827 -3.172 1.00 41.20 H new ATOM 0 HG23 VAL A 141 -17.278 7.150 -3.776 1.00 41.20 H new ATOM 2158 N THR A 142 -18.869 8.709 -4.459 1.00 74.02 N ATOM 2159 CA THR A 142 -18.556 9.550 -5.607 1.00 24.33 C ATOM 2160 C THR A 142 -19.637 10.602 -5.830 1.00 61.33 C ATOM 2161 O THR A 142 -19.338 11.771 -6.073 1.00 2.20 O ATOM 2162 CB THR A 142 -18.397 8.714 -6.891 1.00 23.22 C ATOM 2163 OG1 THR A 142 -19.529 7.854 -7.057 1.00 51.04 O ATOM 2164 CG2 THR A 142 -17.124 7.883 -6.841 1.00 52.22 C ATOM 0 H THR A 142 -19.102 7.744 -4.694 1.00 74.02 H new ATOM 0 HA THR A 142 -17.611 10.045 -5.386 1.00 24.33 H new ATOM 0 HB THR A 142 -18.332 9.397 -7.738 1.00 23.22 H new ATOM 0 HG1 THR A 142 -19.359 6.999 -6.610 1.00 51.04 H new ATOM 0 HG21 THR A 142 -17.033 7.301 -7.758 1.00 52.22 H new ATOM 0 HG22 THR A 142 -16.262 8.543 -6.743 1.00 52.22 H new ATOM 0 HG23 THR A 142 -17.163 7.208 -5.986 1.00 52.22 H new ATOM 2172 N SER A 143 -20.893 10.179 -5.743 1.00 13.15 N ATOM 2173 CA SER A 143 -22.020 11.085 -5.938 1.00 12.00 C ATOM 2174 C SER A 143 -21.985 12.223 -4.923 1.00 72.24 C ATOM 2175 O SER A 143 -22.325 13.362 -5.240 1.00 43.32 O ATOM 2176 CB SER A 143 -23.342 10.322 -5.820 1.00 60.42 C ATOM 2177 OG SER A 143 -23.557 9.497 -6.951 1.00 12.43 O ATOM 0 H SER A 143 -21.157 9.215 -5.539 1.00 13.15 H new ATOM 0 HA SER A 143 -21.942 11.511 -6.938 1.00 12.00 H new ATOM 0 HB2 SER A 143 -23.334 9.712 -4.917 1.00 60.42 H new ATOM 0 HB3 SER A 143 -24.166 11.029 -5.720 1.00 60.42 H new ATOM 0 HG SER A 143 -23.010 8.687 -6.874 1.00 12.43 H new ATOM 2183 N MET A 144 -21.570 11.905 -3.701 1.00 45.52 N ATOM 2184 CA MET A 144 -21.487 12.901 -2.640 1.00 2.05 C ATOM 2185 C MET A 144 -20.384 13.915 -2.929 1.00 35.20 C ATOM 2186 O MET A 144 -20.523 15.102 -2.630 1.00 31.30 O ATOM 2187 CB MET A 144 -21.232 12.222 -1.293 1.00 62.25 C ATOM 2188 CG MET A 144 -22.348 11.284 -0.863 1.00 23.12 C ATOM 2189 SD MET A 144 -23.355 11.966 0.468 1.00 12.31 S ATOM 2190 CE MET A 144 -22.242 11.788 1.860 1.00 75.01 C ATOM 0 H MET A 144 -21.286 10.966 -3.422 1.00 45.52 H new ATOM 0 HA MET A 144 -22.439 13.430 -2.598 1.00 2.05 H new ATOM 0 HB2 MET A 144 -20.299 11.661 -1.349 1.00 62.25 H new ATOM 0 HB3 MET A 144 -21.098 12.988 -0.529 1.00 62.25 H new ATOM 0 HG2 MET A 144 -22.985 11.067 -1.720 1.00 23.12 H new ATOM 0 HG3 MET A 144 -21.917 10.337 -0.538 1.00 23.12 H new ATOM 0 HE1 MET A 144 -22.770 12.033 2.782 1.00 75.01 H new ATOM 0 HE2 MET A 144 -21.883 10.760 1.910 1.00 75.01 H new ATOM 0 HE3 MET A 144 -21.395 12.462 1.737 1.00 75.01 H new ATOM 2200 N THR A 145 -19.288 13.440 -3.512 1.00 52.40 N ATOM 2201 CA THR A 145 -18.162 14.304 -3.840 1.00 20.20 C ATOM 2202 C THR A 145 -18.458 15.149 -5.074 1.00 42.01 C ATOM 2203 O THR A 145 -17.999 16.286 -5.185 1.00 31.32 O ATOM 2204 CB THR A 145 -16.880 13.486 -4.087 1.00 10.10 C ATOM 2205 OG1 THR A 145 -17.210 12.109 -4.297 1.00 61.45 O ATOM 2206 CG2 THR A 145 -15.923 13.611 -2.910 1.00 15.55 C ATOM 0 H THR A 145 -19.157 12.461 -3.767 1.00 52.40 H new ATOM 0 HA THR A 145 -18.007 14.960 -2.983 1.00 20.20 H new ATOM 0 HB THR A 145 -16.389 13.881 -4.977 1.00 10.10 H new ATOM 0 HG1 THR A 145 -17.534 11.719 -3.458 1.00 61.45 H new ATOM 0 HG21 THR A 145 -15.025 13.025 -3.107 1.00 15.55 H new ATOM 0 HG22 THR A 145 -15.650 14.657 -2.772 1.00 15.55 H new ATOM 0 HG23 THR A 145 -16.407 13.240 -2.007 1.00 15.55 H new ATOM 2214 N SER A 146 -19.227 14.586 -6.000 1.00 11.42 N ATOM 2215 CA SER A 146 -19.582 15.287 -7.228 1.00 42.42 C ATOM 2216 C SER A 146 -20.096 16.691 -6.924 1.00 45.05 C ATOM 2217 O SER A 146 -19.770 17.650 -7.626 1.00 71.43 O ATOM 2218 CB SER A 146 -20.642 14.500 -8.002 1.00 65.01 C ATOM 2219 OG SER A 146 -20.059 13.424 -8.715 1.00 73.25 O ATOM 0 H SER A 146 -19.616 13.646 -5.923 1.00 11.42 H new ATOM 0 HA SER A 146 -18.684 15.373 -7.840 1.00 42.42 H new ATOM 0 HB2 SER A 146 -21.393 14.118 -7.310 1.00 65.01 H new ATOM 0 HB3 SER A 146 -21.157 15.164 -8.696 1.00 65.01 H new ATOM 0 HG SER A 146 -19.726 12.754 -8.082 1.00 73.25 H new ATOM 2225 N THR A 147 -20.900 16.805 -5.872 1.00 64.22 N ATOM 2226 CA THR A 147 -21.460 18.090 -5.474 1.00 4.23 C ATOM 2227 C THR A 147 -20.794 18.611 -4.205 1.00 72.20 C ATOM 2228 O THR A 147 -21.465 18.904 -3.216 1.00 22.20 O ATOM 2229 CB THR A 147 -22.979 17.992 -5.240 1.00 44.13 C ATOM 2230 OG1 THR A 147 -23.296 16.755 -4.592 1.00 1.23 O ATOM 2231 CG2 THR A 147 -23.736 18.092 -6.555 1.00 13.13 C ATOM 0 H THR A 147 -21.178 16.022 -5.280 1.00 64.22 H new ATOM 0 HA THR A 147 -21.270 18.785 -6.292 1.00 4.23 H new ATOM 0 HB THR A 147 -23.281 18.823 -4.602 1.00 44.13 H new ATOM 0 HG1 THR A 147 -24.263 16.701 -4.445 1.00 1.23 H new ATOM 0 HG21 THR A 147 -24.807 18.020 -6.365 1.00 13.13 H new ATOM 0 HG22 THR A 147 -23.515 19.048 -7.030 1.00 13.13 H new ATOM 0 HG23 THR A 147 -23.429 17.280 -7.214 1.00 13.13 H new ATOM 2239 N PHE A 148 -19.471 18.724 -4.241 1.00 70.32 N ATOM 2240 CA PHE A 148 -18.714 19.209 -3.092 1.00 52.45 C ATOM 2241 C PHE A 148 -17.922 20.463 -3.454 1.00 22.35 C ATOM 2242 O PHE A 148 -17.081 20.443 -4.352 1.00 34.03 O ATOM 2243 CB PHE A 148 -17.764 18.122 -2.584 1.00 43.42 C ATOM 2244 CG PHE A 148 -16.800 18.608 -1.540 1.00 1.15 C ATOM 2245 CD1 PHE A 148 -17.233 19.416 -0.501 1.00 1.23 C ATOM 2246 CD2 PHE A 148 -15.461 18.256 -1.597 1.00 4.41 C ATOM 2247 CE1 PHE A 148 -16.348 19.866 0.460 1.00 31.00 C ATOM 2248 CE2 PHE A 148 -14.572 18.703 -0.638 1.00 42.13 C ATOM 2249 CZ PHE A 148 -15.016 19.508 0.393 1.00 42.24 C ATOM 0 H PHE A 148 -18.900 18.487 -5.053 1.00 70.32 H new ATOM 0 HA PHE A 148 -19.422 19.461 -2.302 1.00 52.45 H new ATOM 0 HB2 PHE A 148 -18.351 17.302 -2.171 1.00 43.42 H new ATOM 0 HB3 PHE A 148 -17.202 17.719 -3.427 1.00 43.42 H new ATOM 0 HD1 PHE A 148 -18.274 19.697 -0.442 1.00 1.23 H new ATOM 0 HD2 PHE A 148 -15.108 17.625 -2.400 1.00 4.41 H new ATOM 0 HE1 PHE A 148 -16.698 20.497 1.263 1.00 31.00 H new ATOM 0 HE2 PHE A 148 -13.530 18.423 -0.695 1.00 42.13 H new ATOM 0 HZ PHE A 148 -14.323 19.856 1.145 1.00 42.24 H new