USER MOD reduce.3.24.130724 H: found=0, std=0, add=1012, rem=0, adj=40 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 81:sc=0.000776 USER MOD Set 1.2: A 121 THR OG1 : rot 64:sc= 0.827 USER MOD Set 2.1: A 99 ASN :FLIP amide:sc= -0.0136 F(o=-3.9,f=-2) USER MOD Set 2.2: A 102 ASN : amide:sc= -2.03 K(o=-2,f=-5.1!) USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.0306 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 83:sc= 1.21 USER MOD Single : A 14 SER OG : rot 94:sc= 1.02 USER MOD Single : A 17 THR OG1 : rot 68:sc= 1.17 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot -17:sc= -0.723 USER MOD Single : A 20 ASN :FLIP amide:sc= -1.36 F(o=-2,f=-1.4) USER MOD Single : A 21 THR OG1 : rot 80:sc= -1.91! USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 62:sc= 0.453 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= -0.563 USER MOD Single : A 33 ASN : amide:sc= -0.299 X(o=-0.3,f=-0.79) USER MOD Single : A 40 THR OG1 : rot 31:sc= -0.885 USER MOD Single : A 44 LYS NZ :NH3+ -150:sc= -0.0692 (180deg=-0.639) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -2.1! C(o=-2.1!,f=-4.9!) USER MOD Single : A 57 SER OG : rot -38:sc=-0.000892 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 GLN :FLIP amide:sc= -2.48 F(o=-6.1!,f=-2.5) USER MOD Single : A 61 THR OG1 : rot 71:sc= 0.841 USER MOD Single : A 62 SER OG : rot 73:sc= 0.0144 USER MOD Single : A 65 SER OG : rot -95:sc= 0.722 USER MOD Single : A 66 GLN : amide:sc= -0.242 X(o=-0.24,f=-0.014) USER MOD Single : A 70 ASN : amide:sc= -0.506 K(o=-0.51,f=-1.4!) USER MOD Single : A 75 SER OG : rot 91:sc= 0.789 USER MOD Single : A 76 SER OG : rot 180:sc= -0.73 USER MOD Single : A 80 TYR OH : rot 124:sc= 0.0474 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 116:sc= 1.23 USER MOD Single : A 90 GLN : amide:sc= -1.73 X(o=-1.7,f=-1.4) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot -120:sc= -0.0286 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 100 ASN : amide:sc= -0.45 K(o=-0.45,f=-3!) USER MOD Single : A 101 ASN : amide:sc= -0.0983 X(o=-0.098,f=-0.59) 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 108 SER OG : rot 180:sc= -1.67! USER MOD Single : A 109 THR OG1 : rot 80:sc= 0.955 USER MOD Single : A 111 SER OG : rot 78:sc= -0.0728 USER MOD Single : A 113 ASN : amide:sc= -1.87! C(o=-1.9!,f=-1.6!) USER MOD Single : A 118 MET CE :methyl 133:sc= -4.71! (180deg=-6.75!) USER MOD Single : A 120 ASN : amide:sc= -0.466 K(o=-0.47,f=-1) USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= -2.18 K(o=-2.2,f=-3.8!) USER MOD Single : A 139 SER OG : rot 77:sc= 0.968 USER MOD Single : A 142 THR OG1 : rot -94:sc= 0.0659 USER MOD Single : A 143 SER OG : rot 89:sc= 0.135 USER MOD Single : A 144 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 145 THR OG1 : rot -85:sc= 0.413 USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.00165 USER MOD ----------------------------------------------------------------- ATOM 189 N GLN A 7 -13.961 19.274 6.306 1.00 41.04 N ATOM 190 CA GLN A 7 -14.967 19.035 5.278 1.00 12.00 C ATOM 191 C GLN A 7 -14.791 17.653 4.655 1.00 23.43 C ATOM 192 O GLN A 7 -15.753 16.898 4.512 1.00 24.00 O ATOM 193 CB GLN A 7 -14.885 20.109 4.193 1.00 5.44 C ATOM 194 CG GLN A 7 -14.809 21.525 4.744 1.00 40.10 C ATOM 195 CD GLN A 7 -14.890 22.579 3.658 1.00 43.42 C ATOM 196 OE1 GLN A 7 -13.868 23.053 3.159 1.00 32.44 O ATOM 197 NE2 GLN A 7 -16.108 22.954 3.285 1.00 54.20 N ATOM 0 HA GLN A 7 -15.949 19.080 5.750 1.00 12.00 H new ATOM 0 HB2 GLN A 7 -14.008 19.922 3.573 1.00 5.44 H new ATOM 0 HB3 GLN A 7 -15.757 20.026 3.545 1.00 5.44 H new ATOM 0 HG2 GLN A 7 -15.621 21.678 5.455 1.00 40.10 H new ATOM 0 HG3 GLN A 7 -13.876 21.647 5.294 1.00 40.10 H new ATOM 0 HE21 GLN A 7 -16.928 22.535 3.725 1.00 54.20 H new ATOM 0 HE22 GLN A 7 -16.224 23.661 2.559 1.00 54.20 H new ATOM 206 N LEU A 8 -13.556 17.329 4.286 1.00 1.02 N ATOM 207 CA LEU A 8 -13.253 16.039 3.678 1.00 15.22 C ATOM 208 C LEU A 8 -13.624 14.894 4.617 1.00 51.22 C ATOM 209 O LEU A 8 -14.210 13.897 4.195 1.00 35.31 O ATOM 210 CB LEU A 8 -11.769 15.958 3.318 1.00 0.32 C ATOM 211 CG LEU A 8 -11.419 16.218 1.853 1.00 53.32 C ATOM 212 CD1 LEU A 8 -11.565 14.945 1.035 1.00 73.31 C ATOM 213 CD2 LEU A 8 -12.295 17.323 1.283 1.00 11.02 C ATOM 0 H LEU A 8 -12.749 17.942 4.398 1.00 1.02 H new ATOM 0 HA LEU A 8 -13.846 15.946 2.768 1.00 15.22 H new ATOM 0 HB2 LEU A 8 -11.227 16.676 3.933 1.00 0.32 H new ATOM 0 HB3 LEU A 8 -11.404 14.967 3.588 1.00 0.32 H new ATOM 0 HG LEU A 8 -10.380 16.542 1.800 1.00 53.32 H new ATOM 0 HD11 LEU A 8 -11.312 15.150 -0.005 1.00 73.31 H new ATOM 0 HD12 LEU A 8 -10.894 14.181 1.428 1.00 73.31 H new ATOM 0 HD13 LEU A 8 -12.594 14.590 1.095 1.00 73.31 H new ATOM 0 HD21 LEU A 8 -12.032 17.494 0.239 1.00 11.02 H new ATOM 0 HD22 LEU A 8 -13.342 17.028 1.349 1.00 11.02 H new ATOM 0 HD23 LEU A 8 -12.140 18.240 1.852 1.00 11.02 H new ATOM 225 N THR A 9 -13.280 15.047 5.891 1.00 30.20 N ATOM 226 CA THR A 9 -13.577 14.028 6.890 1.00 35.33 C ATOM 227 C THR A 9 -15.077 13.924 7.140 1.00 75.41 C ATOM 228 O THR A 9 -15.621 12.826 7.263 1.00 34.34 O ATOM 229 CB THR A 9 -12.865 14.324 8.223 1.00 73.53 C ATOM 230 OG1 THR A 9 -12.938 15.722 8.518 1.00 24.13 O ATOM 231 CG2 THR A 9 -11.409 13.886 8.168 1.00 20.12 C ATOM 0 H THR A 9 -12.795 15.867 6.256 1.00 30.20 H new ATOM 0 HA THR A 9 -13.211 13.081 6.494 1.00 35.33 H new ATOM 0 HB THR A 9 -13.367 13.761 9.010 1.00 73.53 H new ATOM 0 HG1 THR A 9 -12.484 15.901 9.368 1.00 24.13 H new ATOM 0 HG21 THR A 9 -10.927 14.105 9.121 1.00 20.12 H new ATOM 0 HG22 THR A 9 -11.358 12.815 7.974 1.00 20.12 H new ATOM 0 HG23 THR A 9 -10.897 14.424 7.370 1.00 20.12 H new ATOM 239 N SER A 10 -15.742 15.072 7.215 1.00 43.55 N ATOM 240 CA SER A 10 -17.180 15.110 7.453 1.00 42.24 C ATOM 241 C SER A 10 -17.933 14.376 6.349 1.00 32.21 C ATOM 242 O SER A 10 -18.862 13.612 6.616 1.00 12.51 O ATOM 243 CB SER A 10 -17.666 16.558 7.541 1.00 63.32 C ATOM 244 OG SER A 10 -17.660 17.017 8.882 1.00 11.12 O ATOM 0 H SER A 10 -15.307 15.989 7.114 1.00 43.55 H new ATOM 0 HA SER A 10 -17.379 14.609 8.400 1.00 42.24 H new ATOM 0 HB2 SER A 10 -17.027 17.197 6.932 1.00 63.32 H new ATOM 0 HB3 SER A 10 -18.674 16.632 7.132 1.00 63.32 H new ATOM 0 HG SER A 10 -17.973 17.945 8.911 1.00 11.12 H new ATOM 250 N THR A 11 -17.526 14.611 5.105 1.00 1.22 N ATOM 251 CA THR A 11 -18.163 13.974 3.959 1.00 43.24 C ATOM 252 C THR A 11 -17.707 12.527 3.813 1.00 13.21 C ATOM 253 O THR A 11 -18.528 11.618 3.678 1.00 22.04 O ATOM 254 CB THR A 11 -17.856 14.732 2.654 1.00 54.42 C ATOM 255 OG1 THR A 11 -17.661 16.124 2.929 1.00 53.02 O ATOM 256 CG2 THR A 11 -18.987 14.562 1.651 1.00 14.00 C ATOM 0 H THR A 11 -16.758 15.238 4.866 1.00 1.22 H new ATOM 0 HA THR A 11 -19.238 13.997 4.139 1.00 43.24 H new ATOM 0 HB THR A 11 -16.944 14.316 2.225 1.00 54.42 H new ATOM 0 HG1 THR A 11 -16.741 16.272 3.232 1.00 53.02 H new ATOM 0 HG21 THR A 11 -18.748 15.106 0.737 1.00 14.00 H new ATOM 0 HG22 THR A 11 -19.113 13.504 1.421 1.00 14.00 H new ATOM 0 HG23 THR A 11 -19.911 14.954 2.075 1.00 14.00 H new ATOM 264 N LEU A 12 -16.396 12.318 3.839 1.00 62.43 N ATOM 265 CA LEU A 12 -15.832 10.979 3.710 1.00 60.43 C ATOM 266 C LEU A 12 -16.391 10.046 4.780 1.00 24.03 C ATOM 267 O LEU A 12 -16.782 8.917 4.490 1.00 75.20 O ATOM 268 CB LEU A 12 -14.306 11.035 3.813 1.00 24.24 C ATOM 269 CG LEU A 12 -13.571 11.577 2.587 1.00 42.04 C ATOM 270 CD1 LEU A 12 -12.084 11.717 2.877 1.00 43.44 C ATOM 271 CD2 LEU A 12 -13.799 10.672 1.385 1.00 63.31 C ATOM 0 H LEU A 12 -15.703 13.059 3.948 1.00 62.43 H new ATOM 0 HA LEU A 12 -16.111 10.587 2.732 1.00 60.43 H new ATOM 0 HB2 LEU A 12 -14.042 11.652 4.672 1.00 24.24 H new ATOM 0 HB3 LEU A 12 -13.938 10.029 4.017 1.00 24.24 H new ATOM 0 HG LEU A 12 -13.970 12.564 2.354 1.00 42.04 H new ATOM 0 HD11 LEU A 12 -11.576 12.104 1.994 1.00 43.44 H new ATOM 0 HD12 LEU A 12 -11.939 12.405 3.710 1.00 43.44 H new ATOM 0 HD13 LEU A 12 -11.670 10.742 3.136 1.00 43.44 H new ATOM 0 HD21 LEU A 12 -13.268 11.073 0.522 1.00 63.31 H new ATOM 0 HD22 LEU A 12 -13.427 9.672 1.607 1.00 63.31 H new ATOM 0 HD23 LEU A 12 -14.865 10.622 1.164 1.00 63.31 H new ATOM 283 N ALA A 13 -16.427 10.529 6.018 1.00 24.33 N ATOM 284 CA ALA A 13 -16.942 9.741 7.131 1.00 15.20 C ATOM 285 C ALA A 13 -18.450 9.551 7.017 1.00 10.44 C ATOM 286 O ALA A 13 -18.974 8.474 7.305 1.00 4.32 O ATOM 287 CB ALA A 13 -16.590 10.402 8.455 1.00 42.30 C ATOM 0 H ALA A 13 -16.106 11.462 6.275 1.00 24.33 H new ATOM 0 HA ALA A 13 -16.474 8.757 7.094 1.00 15.20 H new ATOM 0 HB1 ALA A 13 -16.981 9.802 9.277 1.00 42.30 H new ATOM 0 HB2 ALA A 13 -15.507 10.480 8.546 1.00 42.30 H new ATOM 0 HB3 ALA A 13 -17.030 11.399 8.492 1.00 42.30 H new ATOM 293 N SER A 14 -19.144 10.603 6.595 1.00 2.44 N ATOM 294 CA SER A 14 -20.594 10.553 6.447 1.00 5.13 C ATOM 295 C SER A 14 -21.000 9.519 5.402 1.00 43.45 C ATOM 296 O SER A 14 -21.917 8.729 5.617 1.00 71.41 O ATOM 297 CB SER A 14 -21.135 11.930 6.056 1.00 13.43 C ATOM 298 OG SER A 14 -21.323 12.749 7.197 1.00 42.02 O ATOM 0 H SER A 14 -18.726 11.500 6.350 1.00 2.44 H new ATOM 0 HA SER A 14 -21.022 10.260 7.406 1.00 5.13 H new ATOM 0 HB2 SER A 14 -20.442 12.414 5.368 1.00 13.43 H new ATOM 0 HB3 SER A 14 -22.081 11.815 5.527 1.00 13.43 H new ATOM 0 HG SER A 14 -20.523 13.296 7.342 1.00 42.02 H new ATOM 304 N ALA A 15 -20.306 9.531 4.267 1.00 4.22 N ATOM 305 CA ALA A 15 -20.591 8.594 3.188 1.00 21.01 C ATOM 306 C ALA A 15 -20.222 7.169 3.587 1.00 30.21 C ATOM 307 O ALA A 15 -20.984 6.231 3.351 1.00 53.00 O ATOM 308 CB ALA A 15 -19.845 9.001 1.926 1.00 74.41 C ATOM 0 H ALA A 15 -19.543 10.179 4.072 1.00 4.22 H new ATOM 0 HA ALA A 15 -21.662 8.622 2.989 1.00 21.01 H new ATOM 0 HB1 ALA A 15 -20.067 8.293 1.128 1.00 74.41 H new ATOM 0 HB2 ALA A 15 -20.160 9.999 1.623 1.00 74.41 H new ATOM 0 HB3 ALA A 15 -18.773 9.003 2.122 1.00 74.41 H new ATOM 314 N LEU A 16 -19.050 7.015 4.192 1.00 73.31 N ATOM 315 CA LEU A 16 -18.579 5.703 4.624 1.00 30.21 C ATOM 316 C LEU A 16 -19.454 5.152 5.746 1.00 41.25 C ATOM 317 O LEU A 16 -19.460 3.949 6.011 1.00 62.01 O ATOM 318 CB LEU A 16 -17.125 5.789 5.092 1.00 10.53 C ATOM 319 CG LEU A 16 -16.095 6.144 4.019 1.00 12.40 C ATOM 320 CD1 LEU A 16 -14.820 6.674 4.657 1.00 0.34 C ATOM 321 CD2 LEU A 16 -15.794 4.934 3.147 1.00 62.32 C ATOM 0 H LEU A 16 -18.408 7.781 4.395 1.00 73.31 H new ATOM 0 HA LEU A 16 -18.641 5.025 3.773 1.00 30.21 H new ATOM 0 HB2 LEU A 16 -17.063 6.533 5.887 1.00 10.53 H new ATOM 0 HB3 LEU A 16 -16.848 4.830 5.530 1.00 10.53 H new ATOM 0 HG LEU A 16 -16.513 6.927 3.387 1.00 12.40 H new ATOM 0 HD11 LEU A 16 -14.099 6.921 3.878 1.00 0.34 H new ATOM 0 HD12 LEU A 16 -15.048 7.568 5.237 1.00 0.34 H new ATOM 0 HD13 LEU A 16 -14.398 5.913 5.314 1.00 0.34 H new ATOM 0 HD21 LEU A 16 -15.059 5.205 2.389 1.00 62.32 H new ATOM 0 HD22 LEU A 16 -15.397 4.129 3.766 1.00 62.32 H new ATOM 0 HD23 LEU A 16 -16.710 4.599 2.661 1.00 62.32 H new ATOM 333 N THR A 17 -20.195 6.040 6.403 1.00 40.53 N ATOM 334 CA THR A 17 -21.074 5.643 7.494 1.00 2.33 C ATOM 335 C THR A 17 -22.324 4.947 6.969 1.00 72.03 C ATOM 336 O THR A 17 -22.964 4.176 7.683 1.00 72.12 O ATOM 337 CB THR A 17 -21.496 6.857 8.345 1.00 33.11 C ATOM 338 OG1 THR A 17 -20.377 7.341 9.096 1.00 34.24 O ATOM 339 CG2 THR A 17 -22.628 6.488 9.291 1.00 61.55 C ATOM 0 H THR A 17 -20.203 7.039 6.197 1.00 40.53 H new ATOM 0 HA THR A 17 -20.510 4.949 8.117 1.00 2.33 H new ATOM 0 HB THR A 17 -21.847 7.640 7.673 1.00 33.11 H new ATOM 0 HG1 THR A 17 -19.718 7.733 8.485 1.00 34.24 H new ATOM 0 HG21 THR A 17 -22.908 7.361 9.881 1.00 61.55 H new ATOM 0 HG22 THR A 17 -23.488 6.148 8.714 1.00 61.55 H new ATOM 0 HG23 THR A 17 -22.300 5.690 9.957 1.00 61.55 H new ATOM 347 N LYS A 18 -22.665 5.223 5.714 1.00 33.21 N ATOM 348 CA LYS A 18 -23.838 4.621 5.091 1.00 15.33 C ATOM 349 C LYS A 18 -23.429 3.619 4.015 1.00 44.31 C ATOM 350 O LYS A 18 -24.240 3.228 3.175 1.00 23.24 O ATOM 351 CB LYS A 18 -24.730 5.704 4.481 1.00 24.32 C ATOM 352 CG LYS A 18 -23.964 6.742 3.678 1.00 61.21 C ATOM 353 CD LYS A 18 -24.902 7.633 2.881 1.00 63.42 C ATOM 354 CE LYS A 18 -25.261 8.895 3.652 1.00 52.11 C ATOM 355 NZ LYS A 18 -26.696 8.911 4.051 1.00 53.33 N ATOM 0 H LYS A 18 -22.146 5.859 5.109 1.00 33.21 H new ATOM 0 HA LYS A 18 -24.396 4.091 5.863 1.00 15.33 H new ATOM 0 HB2 LYS A 18 -25.471 5.232 3.836 1.00 24.32 H new ATOM 0 HB3 LYS A 18 -25.276 6.205 5.280 1.00 24.32 H new ATOM 0 HG2 LYS A 18 -23.364 7.354 4.351 1.00 61.21 H new ATOM 0 HG3 LYS A 18 -23.272 6.242 3.000 1.00 61.21 H new ATOM 0 HD2 LYS A 18 -24.432 7.904 1.936 1.00 63.42 H new ATOM 0 HD3 LYS A 18 -25.811 7.082 2.639 1.00 63.42 H new ATOM 0 HE2 LYS A 18 -24.636 8.967 4.542 1.00 52.11 H new ATOM 0 HE3 LYS A 18 -25.045 9.770 3.038 1.00 52.11 H new ATOM 0 HZ1 LYS A 18 -26.901 9.786 4.574 1.00 53.33 H new ATOM 0 HZ2 LYS A 18 -27.293 8.867 3.201 1.00 53.33 H new ATOM 0 HZ3 LYS A 18 -26.897 8.090 4.657 1.00 53.33 H new ATOM 369 N THR A 19 -22.165 3.207 4.047 1.00 35.01 N ATOM 370 CA THR A 19 -21.649 2.252 3.075 1.00 61.42 C ATOM 371 C THR A 19 -21.563 0.852 3.673 1.00 71.12 C ATOM 372 O THR A 19 -20.992 0.658 4.745 1.00 4.44 O ATOM 373 CB THR A 19 -20.256 2.666 2.565 1.00 44.15 C ATOM 374 OG1 THR A 19 -19.372 2.879 3.672 1.00 21.51 O ATOM 375 CG2 THR A 19 -20.341 3.934 1.728 1.00 51.02 C ATOM 0 H THR A 19 -21.481 3.520 4.735 1.00 35.01 H new ATOM 0 HA THR A 19 -22.347 2.245 2.238 1.00 61.42 H new ATOM 0 HB THR A 19 -19.869 1.861 1.940 1.00 44.15 H new ATOM 0 HG1 THR A 19 -19.896 2.984 4.493 1.00 21.51 H new ATOM 0 HG21 THR A 19 -19.345 4.207 1.379 1.00 51.02 H new ATOM 0 HG22 THR A 19 -20.991 3.761 0.871 1.00 51.02 H new ATOM 0 HG23 THR A 19 -20.747 4.744 2.334 1.00 51.02 H new ATOM 383 N ASN A 20 -22.134 -0.122 2.971 1.00 71.05 N ATOM 384 CA ASN A 20 -22.120 -1.506 3.433 1.00 1.43 C ATOM 385 C ASN A 20 -20.698 -1.965 3.731 1.00 72.45 C ATOM 386 O ASN A 20 -20.473 -2.803 4.607 1.00 12.14 O ATOM 387 CB ASN A 20 -22.755 -2.421 2.383 1.00 21.44 C ATOM 388 CG ASN A 20 -22.034 -2.361 1.051 1.00 2.14 C ATOM 389 OD1 ASN A 20 -22.579 -1.588 0.119 1.00 22.53 O flip ATOM 390 ND2 ASN A 20 -21.000 -3.001 0.862 1.00 42.54 N flip ATOM 0 H ASN A 20 -22.612 0.021 2.081 1.00 71.05 H new ATOM 0 HA ASN A 20 -22.701 -1.562 4.354 1.00 1.43 H new ATOM 0 HB2 ASN A 20 -22.750 -3.448 2.749 1.00 21.44 H new ATOM 0 HB3 ASN A 20 -23.798 -2.138 2.241 1.00 21.44 H new ATOM 0 HD21 ASN A 20 -20.617 -3.583 1.607 1.00 42.54 H new ATOM 0 HD22 ASN A 20 -20.526 -2.950 -0.040 1.00 42.54 H new ATOM 397 N THR A 21 -19.736 -1.413 2.998 1.00 52.11 N ATOM 398 CA THR A 21 -18.334 -1.767 3.183 1.00 22.21 C ATOM 399 C THR A 21 -17.862 -1.421 4.590 1.00 64.23 C ATOM 400 O THR A 21 -16.871 -1.969 5.077 1.00 42.51 O ATOM 401 CB THR A 21 -17.434 -1.050 2.160 1.00 43.41 C ATOM 402 OG1 THR A 21 -18.086 -0.996 0.886 1.00 32.42 O ATOM 403 CG2 THR A 21 -16.098 -1.764 2.022 1.00 44.12 C ATOM 0 H THR A 21 -19.903 -0.718 2.270 1.00 52.11 H new ATOM 0 HA THR A 21 -18.256 -2.844 3.031 1.00 22.21 H new ATOM 0 HB THR A 21 -17.252 -0.036 2.517 1.00 43.41 H new ATOM 0 HG1 THR A 21 -18.745 -0.270 0.886 1.00 32.42 H new ATOM 0 HG21 THR A 21 -15.479 -1.240 1.294 1.00 44.12 H new ATOM 0 HG22 THR A 21 -15.591 -1.777 2.987 1.00 44.12 H new ATOM 0 HG23 THR A 21 -16.265 -2.787 1.686 1.00 44.12 H new ATOM 411 N LEU A 22 -18.574 -0.509 5.241 1.00 11.02 N ATOM 412 CA LEU A 22 -18.228 -0.089 6.595 1.00 51.03 C ATOM 413 C LEU A 22 -19.208 -0.665 7.611 1.00 32.31 C ATOM 414 O LEU A 22 -18.829 -1.008 8.731 1.00 54.10 O ATOM 415 CB LEU A 22 -18.215 1.438 6.689 1.00 73.41 C ATOM 416 CG LEU A 22 -16.837 2.093 6.785 1.00 52.12 C ATOM 417 CD1 LEU A 22 -16.305 2.013 8.206 1.00 33.31 C ATOM 418 CD2 LEU A 22 -15.867 1.438 5.812 1.00 52.10 C ATOM 0 H LEU A 22 -19.396 -0.045 4.853 1.00 11.02 H new ATOM 0 HA LEU A 22 -17.232 -0.469 6.824 1.00 51.03 H new ATOM 0 HB2 LEU A 22 -18.726 1.840 5.814 1.00 73.41 H new ATOM 0 HB3 LEU A 22 -18.797 1.733 7.562 1.00 73.41 H new ATOM 0 HG LEU A 22 -16.936 3.145 6.516 1.00 52.12 H new ATOM 0 HD11 LEU A 22 -15.323 2.484 8.254 1.00 33.31 H new ATOM 0 HD12 LEU A 22 -16.989 2.529 8.880 1.00 33.31 H new ATOM 0 HD13 LEU A 22 -16.221 0.968 8.505 1.00 33.31 H new ATOM 0 HD21 LEU A 22 -14.891 1.917 5.894 1.00 52.10 H new ATOM 0 HD22 LEU A 22 -15.773 0.379 6.050 1.00 52.10 H new ATOM 0 HD23 LEU A 22 -16.242 1.549 4.794 1.00 52.10 H new ATOM 430 N LYS A 23 -20.472 -0.769 7.214 1.00 15.21 N ATOM 431 CA LYS A 23 -21.508 -1.307 8.088 1.00 41.42 C ATOM 432 C LYS A 23 -21.357 -2.816 8.246 1.00 53.11 C ATOM 433 O LYS A 23 -21.649 -3.371 9.305 1.00 41.03 O ATOM 434 CB LYS A 23 -22.894 -0.978 7.530 1.00 34.35 C ATOM 435 CG LYS A 23 -23.157 0.511 7.391 1.00 52.22 C ATOM 436 CD LYS A 23 -24.126 0.803 6.257 1.00 32.02 C ATOM 437 CE LYS A 23 -25.546 0.394 6.620 1.00 52.34 C ATOM 438 NZ LYS A 23 -26.551 1.366 6.107 1.00 21.13 N ATOM 0 H LYS A 23 -20.804 -0.487 6.291 1.00 15.21 H new ATOM 0 HA LYS A 23 -21.398 -0.845 9.069 1.00 41.42 H new ATOM 0 HB2 LYS A 23 -23.005 -1.450 6.554 1.00 34.35 H new ATOM 0 HB3 LYS A 23 -23.651 -1.413 8.182 1.00 34.35 H new ATOM 0 HG2 LYS A 23 -23.562 0.899 8.326 1.00 52.22 H new ATOM 0 HG3 LYS A 23 -22.217 1.032 7.211 1.00 52.22 H new ATOM 0 HD2 LYS A 23 -24.101 1.867 6.020 1.00 32.02 H new ATOM 0 HD3 LYS A 23 -23.810 0.270 5.360 1.00 32.02 H new ATOM 0 HE2 LYS A 23 -25.755 -0.595 6.211 1.00 52.34 H new ATOM 0 HE3 LYS A 23 -25.636 0.316 7.704 1.00 52.34 H new ATOM 0 HZ1 LYS A 23 -27.506 1.052 6.375 1.00 21.13 H new ATOM 0 HZ2 LYS A 23 -26.367 2.304 6.517 1.00 21.13 H new ATOM 0 HZ3 LYS A 23 -26.483 1.421 5.071 1.00 21.13 H new ATOM 452 N ALA A 24 -20.897 -3.475 7.187 1.00 3.22 N ATOM 453 CA ALA A 24 -20.704 -4.920 7.211 1.00 2.52 C ATOM 454 C ALA A 24 -19.572 -5.306 8.157 1.00 74.50 C ATOM 455 O ALA A 24 -19.716 -6.215 8.975 1.00 71.13 O ATOM 456 CB ALA A 24 -20.423 -5.438 5.808 1.00 44.02 C ATOM 0 H ALA A 24 -20.651 -3.031 6.302 1.00 3.22 H new ATOM 0 HA ALA A 24 -21.622 -5.379 7.578 1.00 2.52 H new ATOM 0 HB1 ALA A 24 -20.281 -6.518 5.841 1.00 44.02 H new ATOM 0 HB2 ALA A 24 -21.265 -5.202 5.158 1.00 44.02 H new ATOM 0 HB3 ALA A 24 -19.521 -4.965 5.419 1.00 44.02 H new ATOM 462 N VAL A 25 -18.445 -4.611 8.040 1.00 42.11 N ATOM 463 CA VAL A 25 -17.288 -4.882 8.886 1.00 53.52 C ATOM 464 C VAL A 25 -17.549 -4.455 10.326 1.00 43.21 C ATOM 465 O VAL A 25 -17.170 -5.151 11.268 1.00 42.45 O ATOM 466 CB VAL A 25 -16.032 -4.159 8.366 1.00 1.05 C ATOM 467 CG1 VAL A 25 -15.786 -4.498 6.903 1.00 25.44 C ATOM 468 CG2 VAL A 25 -16.166 -2.655 8.557 1.00 23.13 C ATOM 0 H VAL A 25 -18.308 -3.856 7.368 1.00 42.11 H new ATOM 0 HA VAL A 25 -17.117 -5.958 8.855 1.00 53.52 H new ATOM 0 HB VAL A 25 -15.173 -4.501 8.943 1.00 1.05 H new ATOM 0 HG11 VAL A 25 -14.894 -3.978 6.554 1.00 25.44 H new ATOM 0 HG12 VAL A 25 -15.643 -5.573 6.798 1.00 25.44 H new ATOM 0 HG13 VAL A 25 -16.644 -4.186 6.308 1.00 25.44 H new ATOM 0 HG21 VAL A 25 -15.270 -2.160 8.184 1.00 23.13 H new ATOM 0 HG22 VAL A 25 -17.035 -2.294 8.007 1.00 23.13 H new ATOM 0 HG23 VAL A 25 -16.289 -2.432 9.617 1.00 23.13 H new ATOM 478 N SER A 26 -18.198 -3.307 10.489 1.00 42.30 N ATOM 479 CA SER A 26 -18.506 -2.785 11.815 1.00 60.33 C ATOM 480 C SER A 26 -19.471 -3.709 12.552 1.00 35.21 C ATOM 481 O SER A 26 -19.241 -4.071 13.705 1.00 35.12 O ATOM 482 CB SER A 26 -19.108 -1.383 11.707 1.00 43.22 C ATOM 483 OG SER A 26 -19.715 -0.993 12.926 1.00 23.13 O ATOM 0 H SER A 26 -18.521 -2.721 9.719 1.00 42.30 H new ATOM 0 HA SER A 26 -17.577 -2.731 12.382 1.00 60.33 H new ATOM 0 HB2 SER A 26 -18.329 -0.669 11.440 1.00 43.22 H new ATOM 0 HB3 SER A 26 -19.847 -1.362 10.906 1.00 43.22 H new ATOM 0 HG SER A 26 -19.038 -0.966 13.635 1.00 23.13 H new ATOM 489 N ALA A 27 -20.552 -4.086 11.876 1.00 53.14 N ATOM 490 CA ALA A 27 -21.551 -4.970 12.464 1.00 5.15 C ATOM 491 C ALA A 27 -20.989 -6.370 12.675 1.00 73.24 C ATOM 492 O ALA A 27 -21.583 -7.189 13.377 1.00 35.20 O ATOM 493 CB ALA A 27 -22.791 -5.023 11.585 1.00 4.34 C ATOM 0 H ALA A 27 -20.758 -3.793 10.921 1.00 53.14 H new ATOM 0 HA ALA A 27 -21.827 -4.568 13.439 1.00 5.15 H new ATOM 0 HB1 ALA A 27 -23.529 -5.687 12.036 1.00 4.34 H new ATOM 0 HB2 ALA A 27 -23.213 -4.022 11.490 1.00 4.34 H new ATOM 0 HB3 ALA A 27 -22.521 -5.398 10.598 1.00 4.34 H new ATOM 499 N SER A 28 -19.842 -6.642 12.061 1.00 61.41 N ATOM 500 CA SER A 28 -19.201 -7.947 12.178 1.00 34.10 C ATOM 501 C SER A 28 -18.297 -8.000 13.405 1.00 61.42 C ATOM 502 O SER A 28 -18.024 -9.074 13.945 1.00 42.31 O ATOM 503 CB SER A 28 -18.391 -8.256 10.918 1.00 62.13 C ATOM 504 OG SER A 28 -17.698 -9.485 11.046 1.00 65.54 O ATOM 0 H SER A 28 -19.337 -5.976 11.477 1.00 61.41 H new ATOM 0 HA SER A 28 -19.982 -8.699 12.292 1.00 34.10 H new ATOM 0 HB2 SER A 28 -19.056 -8.298 10.056 1.00 62.13 H new ATOM 0 HB3 SER A 28 -17.680 -7.451 10.733 1.00 62.13 H new ATOM 0 HG SER A 28 -17.189 -9.660 10.227 1.00 65.54 H new ATOM 510 N LYS A 29 -17.832 -6.834 13.842 1.00 13.23 N ATOM 511 CA LYS A 29 -16.959 -6.745 15.005 1.00 53.02 C ATOM 512 C LYS A 29 -15.801 -7.731 14.893 1.00 74.35 C ATOM 513 O LYS A 29 -15.626 -8.619 15.729 1.00 11.44 O ATOM 514 CB LYS A 29 -17.751 -7.017 16.285 1.00 23.34 C ATOM 515 CG LYS A 29 -18.989 -6.147 16.431 1.00 62.33 C ATOM 516 CD LYS A 29 -20.229 -6.850 15.907 1.00 20.31 C ATOM 517 CE LYS A 29 -21.083 -7.396 17.043 1.00 24.30 C ATOM 518 NZ LYS A 29 -22.442 -7.785 16.577 1.00 22.42 N ATOM 0 H LYS A 29 -18.046 -5.937 13.407 1.00 13.23 H new ATOM 0 HA LYS A 29 -16.551 -5.735 15.045 1.00 53.02 H new ATOM 0 HB2 LYS A 29 -18.050 -8.065 16.302 1.00 23.34 H new ATOM 0 HB3 LYS A 29 -17.101 -6.857 17.145 1.00 23.34 H new ATOM 0 HG2 LYS A 29 -19.132 -5.889 17.480 1.00 62.33 H new ATOM 0 HG3 LYS A 29 -18.844 -5.212 15.890 1.00 62.33 H new ATOM 0 HD2 LYS A 29 -20.818 -6.154 15.310 1.00 20.31 H new ATOM 0 HD3 LYS A 29 -19.934 -7.666 15.247 1.00 20.31 H new ATOM 0 HE2 LYS A 29 -20.589 -8.261 17.485 1.00 24.30 H new ATOM 0 HE3 LYS A 29 -21.169 -6.643 17.827 1.00 24.30 H new ATOM 0 HZ1 LYS A 29 -22.992 -8.152 17.380 1.00 22.42 H new ATOM 0 HZ2 LYS A 29 -22.923 -6.954 16.178 1.00 22.42 H new ATOM 0 HZ3 LYS A 29 -22.361 -8.522 15.847 1.00 22.42 H new ATOM 532 N PRO A 30 -14.988 -7.573 13.837 1.00 33.41 N ATOM 533 CA PRO A 30 -13.831 -8.439 13.593 1.00 55.40 C ATOM 534 C PRO A 30 -12.716 -8.218 14.609 1.00 55.12 C ATOM 535 O PRO A 30 -12.666 -8.881 15.644 1.00 23.14 O ATOM 536 CB PRO A 30 -13.369 -8.027 12.192 1.00 32.54 C ATOM 537 CG PRO A 30 -13.846 -6.625 12.035 1.00 51.41 C ATOM 538 CD PRO A 30 -15.136 -6.537 12.802 1.00 51.30 C ATOM 0 HA PRO A 30 -14.087 -9.495 13.679 1.00 55.40 H new ATOM 0 HB2 PRO A 30 -12.285 -8.090 12.098 1.00 32.54 H new ATOM 0 HB3 PRO A 30 -13.793 -8.678 11.428 1.00 32.54 H new ATOM 0 HG2 PRO A 30 -13.113 -5.918 12.423 1.00 51.41 H new ATOM 0 HG3 PRO A 30 -14.000 -6.381 10.984 1.00 51.41 H new ATOM 0 HD2 PRO A 30 -15.277 -5.549 13.240 1.00 51.30 H new ATOM 0 HD3 PRO A 30 -15.998 -6.728 12.162 1.00 51.30 H new ATOM 546 N SER A 31 -11.822 -7.282 14.304 1.00 24.45 N ATOM 547 CA SER A 31 -10.705 -6.976 15.190 1.00 42.22 C ATOM 548 C SER A 31 -9.795 -5.919 14.571 1.00 73.24 C ATOM 549 O SER A 31 -9.709 -5.796 13.349 1.00 14.05 O ATOM 550 CB SER A 31 -9.903 -8.243 15.491 1.00 31.43 C ATOM 551 OG SER A 31 -10.141 -9.241 14.514 1.00 44.14 O ATOM 0 H SER A 31 -11.850 -6.723 13.451 1.00 24.45 H new ATOM 0 HA SER A 31 -11.110 -6.582 16.122 1.00 42.22 H new ATOM 0 HB2 SER A 31 -8.840 -8.005 15.521 1.00 31.43 H new ATOM 0 HB3 SER A 31 -10.173 -8.623 16.476 1.00 31.43 H new ATOM 0 HG SER A 31 -9.616 -10.040 14.728 1.00 44.14 H new ATOM 557 N ALA A 32 -9.116 -5.159 15.423 1.00 24.33 N ATOM 558 CA ALA A 32 -8.211 -4.114 14.961 1.00 64.32 C ATOM 559 C ALA A 32 -7.064 -4.703 14.146 1.00 12.45 C ATOM 560 O ALA A 32 -6.373 -3.987 13.421 1.00 22.54 O ATOM 561 CB ALA A 32 -7.668 -3.325 16.144 1.00 12.53 C ATOM 0 H ALA A 32 -9.175 -5.247 16.437 1.00 24.33 H new ATOM 0 HA ALA A 32 -8.774 -3.440 14.315 1.00 64.32 H new ATOM 0 HB1 ALA A 32 -6.994 -2.548 15.784 1.00 12.53 H new ATOM 0 HB2 ALA A 32 -8.495 -2.866 16.685 1.00 12.53 H new ATOM 0 HB3 ALA A 32 -7.126 -3.996 16.811 1.00 12.53 H new ATOM 567 N ASN A 33 -6.867 -6.012 14.269 1.00 0.41 N ATOM 568 CA ASN A 33 -5.804 -6.697 13.543 1.00 44.21 C ATOM 569 C ASN A 33 -6.136 -6.797 12.057 1.00 64.53 C ATOM 570 O ASN A 33 -5.319 -6.451 11.203 1.00 22.34 O ATOM 571 CB ASN A 33 -5.580 -8.094 14.123 1.00 75.25 C ATOM 572 CG ASN A 33 -5.772 -8.134 15.627 1.00 70.23 C ATOM 573 OD1 ASN A 33 -5.432 -7.184 16.332 1.00 72.34 O ATOM 574 ND2 ASN A 33 -6.319 -9.237 16.125 1.00 44.04 N ATOM 0 H ASN A 33 -7.430 -6.619 14.865 1.00 0.41 H new ATOM 0 HA ASN A 33 -4.889 -6.115 13.654 1.00 44.21 H new ATOM 0 HB2 ASN A 33 -6.270 -8.794 13.653 1.00 75.25 H new ATOM 0 HB3 ASN A 33 -4.571 -8.428 13.879 1.00 75.25 H new ATOM 0 HD21 ASN A 33 -6.473 -9.321 17.130 1.00 44.04 H new ATOM 0 HD22 ASN A 33 -6.586 -10.000 15.503 1.00 44.04 H new ATOM 581 N VAL A 34 -7.339 -7.273 11.756 1.00 71.11 N ATOM 582 CA VAL A 34 -7.781 -7.417 10.374 1.00 71.21 C ATOM 583 C VAL A 34 -8.253 -6.084 9.806 1.00 20.34 C ATOM 584 O VAL A 34 -8.098 -5.816 8.614 1.00 24.52 O ATOM 585 CB VAL A 34 -8.920 -8.447 10.253 1.00 63.31 C ATOM 586 CG1 VAL A 34 -8.627 -9.671 11.108 1.00 45.05 C ATOM 587 CG2 VAL A 34 -10.248 -7.819 10.646 1.00 33.23 C ATOM 0 H VAL A 34 -8.026 -7.566 12.451 1.00 71.11 H new ATOM 0 HA VAL A 34 -6.922 -7.768 9.802 1.00 71.21 H new ATOM 0 HB VAL A 34 -8.988 -8.768 9.213 1.00 63.31 H new ATOM 0 HG11 VAL A 34 -9.443 -10.387 11.010 1.00 45.05 H new ATOM 0 HG12 VAL A 34 -7.697 -10.132 10.776 1.00 45.05 H new ATOM 0 HG13 VAL A 34 -8.531 -9.371 12.152 1.00 45.05 H new ATOM 0 HG21 VAL A 34 -11.042 -8.560 10.555 1.00 33.23 H new ATOM 0 HG22 VAL A 34 -10.194 -7.470 11.677 1.00 33.23 H new ATOM 0 HG23 VAL A 34 -10.461 -6.976 9.988 1.00 33.23 H new ATOM 597 N ALA A 35 -8.830 -5.252 10.666 1.00 10.22 N ATOM 598 CA ALA A 35 -9.323 -3.944 10.250 1.00 62.33 C ATOM 599 C ALA A 35 -8.202 -3.098 9.657 1.00 1.24 C ATOM 600 O ALA A 35 -8.395 -2.409 8.655 1.00 45.22 O ATOM 601 CB ALA A 35 -9.965 -3.224 11.427 1.00 64.03 C ATOM 0 H ALA A 35 -8.968 -5.460 11.655 1.00 10.22 H new ATOM 0 HA ALA A 35 -10.076 -4.096 9.476 1.00 62.33 H new ATOM 0 HB1 ALA A 35 -10.329 -2.249 11.103 1.00 64.03 H new ATOM 0 HB2 ALA A 35 -10.799 -3.815 11.804 1.00 64.03 H new ATOM 0 HB3 ALA A 35 -9.227 -3.091 12.218 1.00 64.03 H new ATOM 607 N VAL A 36 -7.030 -3.154 10.282 1.00 43.12 N ATOM 608 CA VAL A 36 -5.877 -2.393 9.815 1.00 10.31 C ATOM 609 C VAL A 36 -5.393 -2.903 8.463 1.00 15.40 C ATOM 610 O VAL A 36 -5.014 -2.120 7.591 1.00 24.50 O ATOM 611 CB VAL A 36 -4.715 -2.460 10.823 1.00 43.23 C ATOM 612 CG1 VAL A 36 -3.455 -1.851 10.227 1.00 52.50 C ATOM 613 CG2 VAL A 36 -5.093 -1.760 12.119 1.00 72.31 C ATOM 0 H VAL A 36 -6.854 -3.719 11.113 1.00 43.12 H new ATOM 0 HA VAL A 36 -6.201 -1.357 9.714 1.00 10.31 H new ATOM 0 HB VAL A 36 -4.512 -3.507 11.048 1.00 43.23 H new ATOM 0 HG11 VAL A 36 -2.645 -1.907 10.954 1.00 52.50 H new ATOM 0 HG12 VAL A 36 -3.175 -2.401 9.328 1.00 52.50 H new ATOM 0 HG13 VAL A 36 -3.641 -0.808 9.971 1.00 52.50 H new ATOM 0 HG21 VAL A 36 -4.260 -1.817 12.820 1.00 72.31 H new ATOM 0 HG22 VAL A 36 -5.324 -0.715 11.914 1.00 72.31 H new ATOM 0 HG23 VAL A 36 -5.967 -2.246 12.554 1.00 72.31 H new ATOM 623 N ALA A 37 -5.409 -4.222 8.294 1.00 3.42 N ATOM 624 CA ALA A 37 -4.974 -4.836 7.046 1.00 51.03 C ATOM 625 C ALA A 37 -5.966 -4.559 5.922 1.00 42.04 C ATOM 626 O ALA A 37 -5.577 -4.383 4.767 1.00 51.03 O ATOM 627 CB ALA A 37 -4.789 -6.335 7.232 1.00 22.23 C ATOM 0 H ALA A 37 -5.718 -4.884 9.005 1.00 3.42 H new ATOM 0 HA ALA A 37 -4.017 -4.394 6.767 1.00 51.03 H new ATOM 0 HB1 ALA A 37 -4.464 -6.781 6.292 1.00 22.23 H new ATOM 0 HB2 ALA A 37 -4.036 -6.516 7.999 1.00 22.23 H new ATOM 0 HB3 ALA A 37 -5.734 -6.783 7.538 1.00 22.23 H new ATOM 633 N ILE A 38 -7.249 -4.522 6.266 1.00 73.45 N ATOM 634 CA ILE A 38 -8.296 -4.266 5.286 1.00 52.44 C ATOM 635 C ILE A 38 -8.262 -2.818 4.812 1.00 51.53 C ATOM 636 O ILE A 38 -8.351 -2.542 3.614 1.00 73.42 O ATOM 637 CB ILE A 38 -9.692 -4.575 5.859 1.00 45.13 C ATOM 638 CG1 ILE A 38 -9.798 -6.055 6.232 1.00 63.22 C ATOM 639 CG2 ILE A 38 -10.772 -4.197 4.856 1.00 51.04 C ATOM 640 CD1 ILE A 38 -10.763 -6.324 7.367 1.00 51.02 C ATOM 0 H ILE A 38 -7.588 -4.666 7.217 1.00 73.45 H new ATOM 0 HA ILE A 38 -8.106 -4.927 4.441 1.00 52.44 H new ATOM 0 HB ILE A 38 -9.838 -3.981 6.761 1.00 45.13 H new ATOM 0 HG12 ILE A 38 -10.114 -6.621 5.355 1.00 63.22 H new ATOM 0 HG13 ILE A 38 -8.810 -6.423 6.510 1.00 63.22 H new ATOM 0 HG21 ILE A 38 -11.753 -4.421 5.275 1.00 51.04 H new ATOM 0 HG22 ILE A 38 -10.707 -3.132 4.635 1.00 51.04 H new ATOM 0 HG23 ILE A 38 -10.631 -4.767 3.938 1.00 51.04 H new ATOM 0 HD11 ILE A 38 -10.788 -7.393 7.578 1.00 51.02 H new ATOM 0 HD12 ILE A 38 -10.437 -5.786 8.257 1.00 51.02 H new ATOM 0 HD13 ILE A 38 -11.760 -5.987 7.084 1.00 51.02 H new ATOM 652 N VAL A 39 -8.131 -1.893 5.758 1.00 52.21 N ATOM 653 CA VAL A 39 -8.083 -0.472 5.437 1.00 75.24 C ATOM 654 C VAL A 39 -6.813 -0.126 4.668 1.00 45.31 C ATOM 655 O VAL A 39 -6.830 0.703 3.757 1.00 15.42 O ATOM 656 CB VAL A 39 -8.152 0.393 6.709 1.00 70.01 C ATOM 657 CG1 VAL A 39 -6.957 0.116 7.609 1.00 4.35 C ATOM 658 CG2 VAL A 39 -8.226 1.868 6.346 1.00 10.55 C ATOM 0 H VAL A 39 -8.056 -2.103 6.753 1.00 52.21 H new ATOM 0 HA VAL A 39 -8.951 -0.258 4.814 1.00 75.24 H new ATOM 0 HB VAL A 39 -9.057 0.131 7.257 1.00 70.01 H new ATOM 0 HG11 VAL A 39 -7.023 0.736 8.503 1.00 4.35 H new ATOM 0 HG12 VAL A 39 -6.954 -0.935 7.896 1.00 4.35 H new ATOM 0 HG13 VAL A 39 -6.037 0.348 7.073 1.00 4.35 H new ATOM 0 HG21 VAL A 39 -8.274 2.465 7.257 1.00 10.55 H new ATOM 0 HG22 VAL A 39 -7.340 2.147 5.776 1.00 10.55 H new ATOM 0 HG23 VAL A 39 -9.117 2.051 5.745 1.00 10.55 H new ATOM 668 N THR A 40 -5.708 -0.765 5.040 1.00 35.43 N ATOM 669 CA THR A 40 -4.428 -0.525 4.387 1.00 32.23 C ATOM 670 C THR A 40 -4.495 -0.868 2.903 1.00 21.31 C ATOM 671 O THR A 40 -3.943 -0.155 2.066 1.00 0.50 O ATOM 672 CB THR A 40 -3.300 -1.346 5.042 1.00 13.23 C ATOM 673 OG1 THR A 40 -3.786 -2.643 5.406 1.00 22.23 O ATOM 674 CG2 THR A 40 -2.760 -0.636 6.274 1.00 10.23 C ATOM 0 H THR A 40 -5.675 -1.454 5.792 1.00 35.43 H new ATOM 0 HA THR A 40 -4.209 0.536 4.502 1.00 32.23 H new ATOM 0 HB THR A 40 -2.491 -1.452 4.320 1.00 13.23 H new ATOM 0 HG1 THR A 40 -4.482 -2.920 4.775 1.00 22.23 H new ATOM 0 HG21 THR A 40 -1.965 -1.234 6.719 1.00 10.23 H new ATOM 0 HG22 THR A 40 -2.364 0.339 5.988 1.00 10.23 H new ATOM 0 HG23 THR A 40 -3.563 -0.503 6.999 1.00 10.23 H new ATOM 682 N SER A 41 -5.176 -1.964 2.584 1.00 32.22 N ATOM 683 CA SER A 41 -5.313 -2.403 1.200 1.00 53.02 C ATOM 684 C SER A 41 -5.996 -1.332 0.355 1.00 40.02 C ATOM 685 O SER A 41 -5.568 -1.039 -0.761 1.00 22.21 O ATOM 686 CB SER A 41 -6.110 -3.707 1.133 1.00 13.04 C ATOM 687 OG SER A 41 -5.301 -4.818 1.477 1.00 63.20 O ATOM 0 H SER A 41 -5.641 -2.564 3.265 1.00 32.22 H new ATOM 0 HA SER A 41 -4.314 -2.575 0.799 1.00 53.02 H new ATOM 0 HB2 SER A 41 -6.963 -3.651 1.810 1.00 13.04 H new ATOM 0 HB3 SER A 41 -6.509 -3.841 0.128 1.00 13.04 H new ATOM 0 HG SER A 41 -5.237 -4.887 2.453 1.00 63.20 H new ATOM 693 N GLY A 42 -7.061 -0.750 0.897 1.00 73.12 N ATOM 694 CA GLY A 42 -7.788 0.282 0.180 1.00 63.23 C ATOM 695 C GLY A 42 -7.022 1.589 0.113 1.00 61.02 C ATOM 696 O GLY A 42 -7.125 2.327 -0.868 1.00 32.11 O ATOM 0 H GLY A 42 -7.434 -0.974 1.820 1.00 73.12 H new ATOM 0 HA2 GLY A 42 -8.001 -0.064 -0.832 1.00 63.23 H new ATOM 0 HA3 GLY A 42 -8.748 0.451 0.667 1.00 63.23 H new ATOM 700 N LEU A 43 -6.254 1.877 1.157 1.00 5.21 N ATOM 701 CA LEU A 43 -5.468 3.105 1.213 1.00 21.41 C ATOM 702 C LEU A 43 -4.372 3.100 0.153 1.00 54.14 C ATOM 703 O LEU A 43 -4.135 4.107 -0.515 1.00 60.24 O ATOM 704 CB LEU A 43 -4.850 3.275 2.603 1.00 52.33 C ATOM 705 CG LEU A 43 -5.791 3.769 3.701 1.00 24.22 C ATOM 706 CD1 LEU A 43 -5.132 3.639 5.066 1.00 11.45 C ATOM 707 CD2 LEU A 43 -6.204 5.210 3.441 1.00 1.13 C ATOM 0 H LEU A 43 -6.158 1.277 1.977 1.00 5.21 H new ATOM 0 HA LEU A 43 -6.135 3.944 1.014 1.00 21.41 H new ATOM 0 HB2 LEU A 43 -4.434 2.316 2.913 1.00 52.33 H new ATOM 0 HB3 LEU A 43 -4.017 3.974 2.525 1.00 52.33 H new ATOM 0 HG LEU A 43 -6.687 3.148 3.692 1.00 24.22 H new ATOM 0 HD11 LEU A 43 -5.816 3.995 5.836 1.00 11.45 H new ATOM 0 HD12 LEU A 43 -4.887 2.594 5.254 1.00 11.45 H new ATOM 0 HD13 LEU A 43 -4.219 4.235 5.088 1.00 11.45 H new ATOM 0 HD21 LEU A 43 -6.874 5.545 4.233 1.00 1.13 H new ATOM 0 HD22 LEU A 43 -5.318 5.845 3.423 1.00 1.13 H new ATOM 0 HD23 LEU A 43 -6.716 5.274 2.481 1.00 1.13 H new ATOM 719 N LYS A 44 -3.709 1.959 0.001 1.00 73.43 N ATOM 720 CA LYS A 44 -2.640 1.820 -0.981 1.00 22.00 C ATOM 721 C LYS A 44 -3.184 1.946 -2.400 1.00 11.43 C ATOM 722 O LYS A 44 -2.579 2.594 -3.254 1.00 61.32 O ATOM 723 CB LYS A 44 -1.936 0.471 -0.812 1.00 43.01 C ATOM 724 CG LYS A 44 -1.390 0.242 0.586 1.00 63.42 C ATOM 725 CD LYS A 44 -1.406 -1.232 0.957 1.00 23.41 C ATOM 726 CE LYS A 44 -0.001 -1.759 1.206 1.00 72.33 C ATOM 727 NZ LYS A 44 0.907 -1.480 0.061 1.00 41.44 N ATOM 0 H LYS A 44 -3.893 1.116 0.546 1.00 73.43 H new ATOM 0 HA LYS A 44 -1.921 2.622 -0.814 1.00 22.00 H new ATOM 0 HB2 LYS A 44 -2.636 -0.328 -1.055 1.00 43.01 H new ATOM 0 HB3 LYS A 44 -1.117 0.406 -1.528 1.00 43.01 H new ATOM 0 HG2 LYS A 44 -0.370 0.622 0.646 1.00 63.42 H new ATOM 0 HG3 LYS A 44 -1.983 0.806 1.306 1.00 63.42 H new ATOM 0 HD2 LYS A 44 -2.014 -1.377 1.850 1.00 23.41 H new ATOM 0 HD3 LYS A 44 -1.874 -1.805 0.156 1.00 23.41 H new ATOM 0 HE2 LYS A 44 0.403 -1.302 2.109 1.00 72.33 H new ATOM 0 HE3 LYS A 44 -0.042 -2.834 1.383 1.00 72.33 H new ATOM 0 HZ1 LYS A 44 1.631 -2.224 0.003 1.00 41.44 H new ATOM 0 HZ2 LYS A 44 0.357 -1.462 -0.822 1.00 41.44 H new ATOM 0 HZ3 LYS A 44 1.368 -0.558 0.200 1.00 41.44 H new ATOM 741 N LYS A 45 -4.333 1.324 -2.645 1.00 42.32 N ATOM 742 CA LYS A 45 -4.962 1.368 -3.960 1.00 4.51 C ATOM 743 C LYS A 45 -5.469 2.773 -4.273 1.00 3.13 C ATOM 744 O LYS A 45 -5.268 3.284 -5.374 1.00 20.14 O ATOM 745 CB LYS A 45 -6.119 0.370 -4.029 1.00 24.11 C ATOM 746 CG LYS A 45 -6.832 0.356 -5.370 1.00 3.00 C ATOM 747 CD LYS A 45 -6.267 -0.714 -6.290 1.00 64.21 C ATOM 748 CE LYS A 45 -7.218 -1.021 -7.436 1.00 53.41 C ATOM 749 NZ LYS A 45 -6.930 -0.188 -8.636 1.00 21.40 N ATOM 0 H LYS A 45 -4.847 0.783 -1.950 1.00 42.32 H new ATOM 0 HA LYS A 45 -4.212 1.097 -4.703 1.00 4.51 H new ATOM 0 HB2 LYS A 45 -5.738 -0.630 -3.819 1.00 24.11 H new ATOM 0 HB3 LYS A 45 -6.840 0.608 -3.246 1.00 24.11 H new ATOM 0 HG2 LYS A 45 -7.896 0.179 -5.215 1.00 3.00 H new ATOM 0 HG3 LYS A 45 -6.736 1.333 -5.844 1.00 3.00 H new ATOM 0 HD2 LYS A 45 -5.309 -0.383 -6.690 1.00 64.21 H new ATOM 0 HD3 LYS A 45 -6.077 -1.623 -5.719 1.00 64.21 H new ATOM 0 HE2 LYS A 45 -7.140 -2.076 -7.699 1.00 53.41 H new ATOM 0 HE3 LYS A 45 -8.244 -0.848 -7.112 1.00 53.41 H new ATOM 0 HZ1 LYS A 45 -7.600 -0.428 -9.394 1.00 21.40 H new ATOM 0 HZ2 LYS A 45 -7.029 0.818 -8.392 1.00 21.40 H new ATOM 0 HZ3 LYS A 45 -5.959 -0.371 -8.961 1.00 21.40 H new ATOM 763 N ALA A 46 -6.126 3.391 -3.297 1.00 3.23 N ATOM 764 CA ALA A 46 -6.658 4.738 -3.468 1.00 73.44 C ATOM 765 C ALA A 46 -5.546 5.732 -3.782 1.00 53.11 C ATOM 766 O ALA A 46 -5.647 6.514 -4.728 1.00 23.25 O ATOM 767 CB ALA A 46 -7.417 5.167 -2.221 1.00 3.11 C ATOM 0 H ALA A 46 -6.303 2.981 -2.380 1.00 3.23 H new ATOM 0 HA ALA A 46 -7.347 4.726 -4.313 1.00 73.44 H new ATOM 0 HB1 ALA A 46 -7.809 6.174 -2.362 1.00 3.11 H new ATOM 0 HB2 ALA A 46 -8.243 4.478 -2.043 1.00 3.11 H new ATOM 0 HB3 ALA A 46 -6.744 5.156 -1.364 1.00 3.11 H new ATOM 773 N LEU A 47 -4.485 5.698 -2.982 1.00 12.20 N ATOM 774 CA LEU A 47 -3.353 6.598 -3.175 1.00 72.43 C ATOM 775 C LEU A 47 -2.595 6.253 -4.454 1.00 3.54 C ATOM 776 O LEU A 47 -2.085 7.137 -5.141 1.00 40.24 O ATOM 777 CB LEU A 47 -2.408 6.524 -1.974 1.00 13.43 C ATOM 778 CG LEU A 47 -3.041 6.781 -0.606 1.00 53.15 C ATOM 779 CD1 LEU A 47 -2.256 6.072 0.487 1.00 44.33 C ATOM 780 CD2 LEU A 47 -3.119 8.274 -0.326 1.00 60.23 C ATOM 0 H LEU A 47 -4.385 5.058 -2.194 1.00 12.20 H new ATOM 0 HA LEU A 47 -3.739 7.614 -3.265 1.00 72.43 H new ATOM 0 HB2 LEU A 47 -1.948 5.536 -1.959 1.00 13.43 H new ATOM 0 HB3 LEU A 47 -1.606 7.247 -2.123 1.00 13.43 H new ATOM 0 HG LEU A 47 -4.055 6.380 -0.615 1.00 53.15 H new ATOM 0 HD11 LEU A 47 -2.721 6.266 1.453 1.00 44.33 H new ATOM 0 HD12 LEU A 47 -2.253 4.999 0.295 1.00 44.33 H new ATOM 0 HD13 LEU A 47 -1.231 6.442 0.497 1.00 44.33 H new ATOM 0 HD21 LEU A 47 -3.572 8.438 0.652 1.00 60.23 H new ATOM 0 HD22 LEU A 47 -2.115 8.699 -0.337 1.00 60.23 H new ATOM 0 HD23 LEU A 47 -3.725 8.757 -1.092 1.00 60.23 H new ATOM 792 N GLY A 48 -2.530 4.963 -4.768 1.00 63.34 N ATOM 793 CA GLY A 48 -1.835 4.526 -5.965 1.00 43.11 C ATOM 794 C GLY A 48 -2.541 4.956 -7.235 1.00 4.51 C ATOM 795 O GLY A 48 -1.901 5.202 -8.256 1.00 40.20 O ATOM 0 H GLY A 48 -2.946 4.213 -4.216 1.00 63.34 H new ATOM 0 HA2 GLY A 48 -0.823 4.930 -5.961 1.00 43.11 H new ATOM 0 HA3 GLY A 48 -1.745 3.440 -5.953 1.00 43.11 H new ATOM 799 N ALA A 49 -3.865 5.046 -7.172 1.00 31.02 N ATOM 800 CA ALA A 49 -4.660 5.450 -8.326 1.00 53.35 C ATOM 801 C ALA A 49 -4.649 6.966 -8.497 1.00 35.12 C ATOM 802 O ALA A 49 -4.966 7.482 -9.569 1.00 35.35 O ATOM 803 CB ALA A 49 -6.087 4.941 -8.189 1.00 4.45 C ATOM 0 H ALA A 49 -4.410 4.845 -6.334 1.00 31.02 H new ATOM 0 HA ALA A 49 -4.213 5.008 -9.217 1.00 53.35 H new ATOM 0 HB1 ALA A 49 -6.669 5.250 -9.058 1.00 4.45 H new ATOM 0 HB2 ALA A 49 -6.081 3.853 -8.125 1.00 4.45 H new ATOM 0 HB3 ALA A 49 -6.536 5.355 -7.286 1.00 4.45 H new ATOM 809 N LEU A 50 -4.283 7.673 -7.434 1.00 32.41 N ATOM 810 CA LEU A 50 -4.232 9.131 -7.465 1.00 54.34 C ATOM 811 C LEU A 50 -2.805 9.620 -7.688 1.00 24.44 C ATOM 812 O LEU A 50 -2.504 10.797 -7.488 1.00 21.25 O ATOM 813 CB LEU A 50 -4.785 9.708 -6.162 1.00 22.44 C ATOM 814 CG LEU A 50 -6.288 9.990 -6.135 1.00 52.43 C ATOM 815 CD1 LEU A 50 -6.879 9.611 -4.786 1.00 44.33 C ATOM 816 CD2 LEU A 50 -6.562 11.453 -6.449 1.00 65.42 C ATOM 0 H LEU A 50 -4.017 7.261 -6.540 1.00 32.41 H new ATOM 0 HA LEU A 50 -4.848 9.475 -8.296 1.00 54.34 H new ATOM 0 HB2 LEU A 50 -4.551 9.015 -5.354 1.00 22.44 H new ATOM 0 HB3 LEU A 50 -4.258 10.638 -5.947 1.00 22.44 H new ATOM 0 HG LEU A 50 -6.766 9.380 -6.901 1.00 52.43 H new ATOM 0 HD11 LEU A 50 -7.949 9.819 -4.786 1.00 44.33 H new ATOM 0 HD12 LEU A 50 -6.716 8.549 -4.603 1.00 44.33 H new ATOM 0 HD13 LEU A 50 -6.396 10.193 -4.001 1.00 44.33 H new ATOM 0 HD21 LEU A 50 -7.636 11.635 -6.425 1.00 65.42 H new ATOM 0 HD22 LEU A 50 -6.071 12.083 -5.707 1.00 65.42 H new ATOM 0 HD23 LEU A 50 -6.175 11.691 -7.440 1.00 65.42 H new ATOM 828 N ARG A 51 -1.931 8.711 -8.104 1.00 62.43 N ATOM 829 CA ARG A 51 -0.535 9.051 -8.354 1.00 62.33 C ATOM 830 C ARG A 51 0.079 9.752 -7.146 1.00 73.14 C ATOM 831 O ARG A 51 0.828 10.719 -7.291 1.00 13.05 O ATOM 832 CB ARG A 51 -0.420 9.946 -9.589 1.00 71.05 C ATOM 833 CG ARG A 51 -0.698 9.220 -10.896 1.00 64.32 C ATOM 834 CD ARG A 51 -2.176 9.258 -11.250 1.00 34.33 C ATOM 835 NE ARG A 51 -2.449 8.603 -12.526 1.00 14.32 N ATOM 836 CZ ARG A 51 -3.547 8.818 -13.243 1.00 11.25 C ATOM 837 NH1 ARG A 51 -4.469 9.667 -12.810 1.00 4.31 N ATOM 838 NH2 ARG A 51 -3.724 8.185 -14.395 1.00 33.41 N ATOM 0 H ARG A 51 -2.164 7.733 -8.275 1.00 62.43 H new ATOM 0 HA ARG A 51 0.012 8.125 -8.532 1.00 62.33 H new ATOM 0 HB2 ARG A 51 -1.117 10.778 -9.490 1.00 71.05 H new ATOM 0 HB3 ARG A 51 0.582 10.372 -9.626 1.00 71.05 H new ATOM 0 HG2 ARG A 51 -0.119 9.677 -11.698 1.00 64.32 H new ATOM 0 HG3 ARG A 51 -0.368 8.184 -10.815 1.00 64.32 H new ATOM 0 HD2 ARG A 51 -2.750 8.771 -10.462 1.00 34.33 H new ATOM 0 HD3 ARG A 51 -2.512 10.294 -11.295 1.00 34.33 H new ATOM 0 HE ARG A 51 -1.759 7.944 -12.887 1.00 14.32 H new ATOM 0 HH11 ARG A 51 -4.336 10.156 -11.925 1.00 4.31 H new ATOM 0 HH12 ARG A 51 -5.311 9.831 -13.362 1.00 4.31 H new ATOM 0 HH21 ARG A 51 -3.017 7.532 -14.732 1.00 33.41 H new ATOM 0 HH22 ARG A 51 -4.567 8.351 -14.944 1.00 33.41 H new ATOM 852 N ILE A 52 -0.244 9.259 -5.955 1.00 60.32 N ATOM 853 CA ILE A 52 0.276 9.838 -4.723 1.00 71.45 C ATOM 854 C ILE A 52 1.684 9.329 -4.427 1.00 50.13 C ATOM 855 O ILE A 52 1.961 8.136 -4.546 1.00 11.51 O ATOM 856 CB ILE A 52 -0.634 9.518 -3.523 1.00 33.24 C ATOM 857 CG1 ILE A 52 -2.050 10.038 -3.777 1.00 15.43 C ATOM 858 CG2 ILE A 52 -0.064 10.123 -2.249 1.00 44.13 C ATOM 859 CD1 ILE A 52 -2.107 11.519 -4.074 1.00 24.13 C ATOM 0 H ILE A 52 -0.863 8.460 -5.817 1.00 60.32 H new ATOM 0 HA ILE A 52 0.305 10.918 -4.870 1.00 71.45 H new ATOM 0 HB ILE A 52 -0.680 8.436 -3.399 1.00 33.24 H new ATOM 0 HG12 ILE A 52 -2.484 9.491 -4.614 1.00 15.43 H new ATOM 0 HG13 ILE A 52 -2.668 9.827 -2.904 1.00 15.43 H new ATOM 0 HG21 ILE A 52 -0.719 9.888 -1.410 1.00 44.13 H new ATOM 0 HG22 ILE A 52 0.927 9.710 -2.062 1.00 44.13 H new ATOM 0 HG23 ILE A 52 0.008 11.205 -2.361 1.00 44.13 H new ATOM 0 HD11 ILE A 52 -3.142 11.817 -4.243 1.00 24.13 H new ATOM 0 HD12 ILE A 52 -1.703 12.076 -3.228 1.00 24.13 H new ATOM 0 HD13 ILE A 52 -1.517 11.734 -4.965 1.00 24.13 H new ATOM 871 N ASN A 53 2.568 10.242 -4.040 1.00 43.30 N ATOM 872 CA ASN A 53 3.947 9.886 -3.726 1.00 11.51 C ATOM 873 C ASN A 53 3.998 8.730 -2.732 1.00 1.44 C ATOM 874 O ASN A 53 3.218 8.682 -1.780 1.00 52.21 O ATOM 875 CB ASN A 53 4.691 11.096 -3.158 1.00 63.11 C ATOM 876 CG ASN A 53 5.844 10.695 -2.257 1.00 35.25 C ATOM 877 OD1 ASN A 53 6.681 9.874 -2.630 1.00 74.52 O ATOM 878 ND2 ASN A 53 5.890 11.273 -1.062 1.00 10.33 N ATOM 0 H ASN A 53 2.354 11.234 -3.936 1.00 43.30 H new ATOM 0 HA ASN A 53 4.433 9.569 -4.649 1.00 11.51 H new ATOM 0 HB2 ASN A 53 5.070 11.705 -3.979 1.00 63.11 H new ATOM 0 HB3 ASN A 53 3.993 11.717 -2.596 1.00 63.11 H new ATOM 0 HD21 ASN A 53 6.641 11.041 -0.412 1.00 10.33 H new ATOM 0 HD22 ASN A 53 5.174 11.949 -0.794 1.00 10.33 H new ATOM 885 N ALA A 54 4.921 7.801 -2.959 1.00 25.10 N ATOM 886 CA ALA A 54 5.075 6.647 -2.081 1.00 1.42 C ATOM 887 C ALA A 54 5.438 7.079 -0.664 1.00 12.45 C ATOM 888 O ALA A 54 4.980 6.486 0.311 1.00 32.33 O ATOM 889 CB ALA A 54 6.133 5.703 -2.633 1.00 13.41 C ATOM 0 H ALA A 54 5.573 7.825 -3.743 1.00 25.10 H new ATOM 0 HA ALA A 54 4.120 6.123 -2.040 1.00 1.42 H new ATOM 0 HB1 ALA A 54 6.238 4.846 -1.968 1.00 13.41 H new ATOM 0 HB2 ALA A 54 5.833 5.360 -3.623 1.00 13.41 H new ATOM 0 HB3 ALA A 54 7.086 6.226 -2.704 1.00 13.41 H new ATOM 895 N GLY A 55 6.262 8.116 -0.559 1.00 44.32 N ATOM 896 CA GLY A 55 6.673 8.610 0.742 1.00 75.41 C ATOM 897 C GLY A 55 5.494 8.994 1.614 1.00 65.23 C ATOM 898 O GLY A 55 5.392 8.557 2.761 1.00 13.43 O ATOM 0 H GLY A 55 6.653 8.624 -1.353 1.00 44.32 H new ATOM 0 HA2 GLY A 55 7.262 7.845 1.248 1.00 75.41 H new ATOM 0 HA3 GLY A 55 7.321 9.476 0.610 1.00 75.41 H new ATOM 902 N VAL A 56 4.601 9.816 1.071 1.00 51.11 N ATOM 903 CA VAL A 56 3.424 10.260 1.808 1.00 11.41 C ATOM 904 C VAL A 56 2.411 9.131 1.956 1.00 31.40 C ATOM 905 O VAL A 56 1.745 9.013 2.985 1.00 51.13 O ATOM 906 CB VAL A 56 2.746 11.456 1.112 1.00 51.22 C ATOM 907 CG1 VAL A 56 2.358 11.095 -0.314 1.00 30.42 C ATOM 908 CG2 VAL A 56 1.530 11.913 1.904 1.00 23.51 C ATOM 0 H VAL A 56 4.671 10.188 0.124 1.00 51.11 H new ATOM 0 HA VAL A 56 3.766 10.569 2.796 1.00 11.41 H new ATOM 0 HB VAL A 56 3.457 12.281 1.072 1.00 51.22 H new ATOM 0 HG11 VAL A 56 1.881 11.952 -0.789 1.00 30.42 H new ATOM 0 HG12 VAL A 56 3.251 10.819 -0.875 1.00 30.42 H new ATOM 0 HG13 VAL A 56 1.664 10.255 -0.301 1.00 30.42 H new ATOM 0 HG21 VAL A 56 1.063 12.758 1.398 1.00 23.51 H new ATOM 0 HG22 VAL A 56 0.815 11.094 1.977 1.00 23.51 H new ATOM 0 HG23 VAL A 56 1.840 12.215 2.905 1.00 23.51 H new ATOM 918 N SER A 57 2.299 8.302 0.923 1.00 4.15 N ATOM 919 CA SER A 57 1.363 7.184 0.938 1.00 44.44 C ATOM 920 C SER A 57 1.787 6.136 1.962 1.00 12.12 C ATOM 921 O SER A 57 0.995 5.277 2.352 1.00 44.24 O ATOM 922 CB SER A 57 1.274 6.549 -0.452 1.00 0.52 C ATOM 923 OG SER A 57 2.306 5.598 -0.645 1.00 52.34 O ATOM 0 H SER A 57 2.845 8.384 0.065 1.00 4.15 H new ATOM 0 HA SER A 57 0.382 7.566 1.219 1.00 44.44 H new ATOM 0 HB2 SER A 57 0.304 6.067 -0.574 1.00 0.52 H new ATOM 0 HB3 SER A 57 1.343 7.325 -1.215 1.00 0.52 H new ATOM 0 HG SER A 57 3.130 5.920 -0.224 1.00 52.34 H new ATOM 929 N SER A 58 3.042 6.212 2.393 1.00 33.23 N ATOM 930 CA SER A 58 3.573 5.268 3.370 1.00 51.25 C ATOM 931 C SER A 58 3.183 5.674 4.787 1.00 5.03 C ATOM 932 O SER A 58 2.757 4.843 5.587 1.00 32.11 O ATOM 933 CB SER A 58 5.096 5.183 3.251 1.00 64.33 C ATOM 934 OG SER A 58 5.700 5.060 4.528 1.00 44.05 O ATOM 0 H SER A 58 3.710 6.917 2.081 1.00 33.23 H new ATOM 0 HA SER A 58 3.144 4.288 3.162 1.00 51.25 H new ATOM 0 HB2 SER A 58 5.369 4.328 2.632 1.00 64.33 H new ATOM 0 HB3 SER A 58 5.475 6.073 2.750 1.00 64.33 H new ATOM 0 HG SER A 58 6.673 5.006 4.426 1.00 44.05 H new ATOM 940 N GLN A 59 3.332 6.960 5.089 1.00 44.20 N ATOM 941 CA GLN A 59 2.997 7.479 6.410 1.00 51.14 C ATOM 942 C GLN A 59 1.488 7.483 6.626 1.00 13.13 C ATOM 943 O GLN A 59 1.007 7.268 7.740 1.00 40.35 O ATOM 944 CB GLN A 59 3.553 8.893 6.582 1.00 22.10 C ATOM 945 CG GLN A 59 3.092 9.863 5.507 1.00 31.25 C ATOM 946 CD GLN A 59 3.385 11.308 5.859 1.00 32.12 C ATOM 947 OE1 GLN A 59 2.832 12.232 5.082 1.00 62.40 O flip ATOM 948 NE2 GLN A 59 4.101 11.592 6.819 1.00 12.24 N flip ATOM 0 H GLN A 59 3.682 7.662 4.437 1.00 44.20 H new ATOM 0 HA GLN A 59 3.451 6.825 7.155 1.00 51.14 H new ATOM 0 HB2 GLN A 59 3.254 9.276 7.558 1.00 22.10 H new ATOM 0 HB3 GLN A 59 4.642 8.849 6.577 1.00 22.10 H new ATOM 0 HG2 GLN A 59 3.583 9.616 4.566 1.00 31.25 H new ATOM 0 HG3 GLN A 59 2.020 9.742 5.349 1.00 31.25 H new ATOM 0 HE21 GLN A 59 4.506 10.850 7.390 1.00 12.24 H new ATOM 0 HE22 GLN A 59 4.289 12.569 7.043 1.00 12.24 H new ATOM 957 N LEU A 60 0.742 7.728 5.554 1.00 42.34 N ATOM 958 CA LEU A 60 -0.714 7.761 5.625 1.00 13.10 C ATOM 959 C LEU A 60 -1.265 6.425 6.113 1.00 12.32 C ATOM 960 O LEU A 60 -2.241 6.379 6.863 1.00 24.01 O ATOM 961 CB LEU A 60 -1.305 8.100 4.255 1.00 51.03 C ATOM 962 CG LEU A 60 -2.808 8.375 4.221 1.00 34.12 C ATOM 963 CD1 LEU A 60 -3.100 9.654 3.451 1.00 55.43 C ATOM 964 CD2 LEU A 60 -3.552 7.198 3.606 1.00 20.13 C ATOM 0 H LEU A 60 1.122 7.907 4.625 1.00 42.34 H new ATOM 0 HA LEU A 60 -1.001 8.534 6.338 1.00 13.10 H new ATOM 0 HB2 LEU A 60 -0.787 8.976 3.865 1.00 51.03 H new ATOM 0 HB3 LEU A 60 -1.092 7.275 3.576 1.00 51.03 H new ATOM 0 HG LEU A 60 -3.157 8.505 5.245 1.00 34.12 H new ATOM 0 HD11 LEU A 60 -4.175 9.833 3.438 1.00 55.43 H new ATOM 0 HD12 LEU A 60 -2.598 10.492 3.934 1.00 55.43 H new ATOM 0 HD13 LEU A 60 -2.736 9.554 2.428 1.00 55.43 H new ATOM 0 HD21 LEU A 60 -4.621 7.411 3.590 1.00 20.13 H new ATOM 0 HD22 LEU A 60 -3.199 7.036 2.588 1.00 20.13 H new ATOM 0 HD23 LEU A 60 -3.370 6.302 4.200 1.00 20.13 H new ATOM 976 N THR A 61 -0.634 5.338 5.682 1.00 72.32 N ATOM 977 CA THR A 61 -1.059 4.000 6.076 1.00 14.12 C ATOM 978 C THR A 61 -0.758 3.737 7.547 1.00 51.45 C ATOM 979 O THR A 61 -1.530 3.077 8.240 1.00 34.52 O ATOM 980 CB THR A 61 -0.374 2.918 5.221 1.00 42.33 C ATOM 981 OG1 THR A 61 0.573 3.522 4.331 1.00 23.23 O ATOM 982 CG2 THR A 61 -1.398 2.131 4.419 1.00 14.30 C ATOM 0 H THR A 61 0.174 5.357 5.060 1.00 72.32 H new ATOM 0 HA THR A 61 -2.136 3.951 5.915 1.00 14.12 H new ATOM 0 HB THR A 61 0.143 2.232 5.892 1.00 42.33 H new ATOM 0 HG1 THR A 61 1.339 3.853 4.844 1.00 23.23 H new ATOM 0 HG21 THR A 61 -0.889 1.373 3.823 1.00 14.30 H new ATOM 0 HG22 THR A 61 -2.099 1.648 5.099 1.00 14.30 H new ATOM 0 HG23 THR A 61 -1.941 2.807 3.759 1.00 14.30 H new ATOM 990 N SER A 62 0.372 4.258 8.016 1.00 23.35 N ATOM 991 CA SER A 62 0.777 4.077 9.405 1.00 64.32 C ATOM 992 C SER A 62 -0.160 4.826 10.347 1.00 12.22 C ATOM 993 O SER A 62 -0.474 4.349 11.438 1.00 41.50 O ATOM 994 CB SER A 62 2.215 4.560 9.606 1.00 13.25 C ATOM 995 OG SER A 62 3.106 3.886 8.735 1.00 21.33 O ATOM 0 H SER A 62 1.022 4.808 7.455 1.00 23.35 H new ATOM 0 HA SER A 62 0.723 3.014 9.638 1.00 64.32 H new ATOM 0 HB2 SER A 62 2.270 5.634 9.427 1.00 13.25 H new ATOM 0 HB3 SER A 62 2.517 4.393 10.640 1.00 13.25 H new ATOM 0 HG SER A 62 2.977 4.211 7.819 1.00 21.33 H new ATOM 1001 N ALA A 63 -0.603 6.004 9.918 1.00 14.22 N ATOM 1002 CA ALA A 63 -1.506 6.819 10.721 1.00 32.21 C ATOM 1003 C ALA A 63 -2.911 6.227 10.739 1.00 4.15 C ATOM 1004 O ALA A 63 -3.473 5.968 11.803 1.00 40.14 O ATOM 1005 CB ALA A 63 -1.538 8.245 10.193 1.00 2.05 C ATOM 0 H ALA A 63 -0.351 6.415 9.019 1.00 14.22 H new ATOM 0 HA ALA A 63 -1.133 6.830 11.745 1.00 32.21 H new ATOM 0 HB1 ALA A 63 -2.216 8.843 10.802 1.00 2.05 H new ATOM 0 HB2 ALA A 63 -0.536 8.673 10.239 1.00 2.05 H new ATOM 0 HB3 ALA A 63 -1.884 8.243 9.160 1.00 2.05 H new ATOM 1011 N VAL A 64 -3.475 6.016 9.553 1.00 62.21 N ATOM 1012 CA VAL A 64 -4.815 5.454 9.433 1.00 21.31 C ATOM 1013 C VAL A 64 -4.934 4.147 10.209 1.00 40.54 C ATOM 1014 O VAL A 64 -5.961 3.872 10.829 1.00 41.52 O ATOM 1015 CB VAL A 64 -5.188 5.200 7.961 1.00 44.44 C ATOM 1016 CG1 VAL A 64 -6.517 4.468 7.864 1.00 45.22 C ATOM 1017 CG2 VAL A 64 -5.234 6.511 7.191 1.00 12.40 C ATOM 0 H VAL A 64 -3.024 6.226 8.662 1.00 62.21 H new ATOM 0 HA VAL A 64 -5.504 6.187 9.853 1.00 21.31 H new ATOM 0 HB VAL A 64 -4.421 4.568 7.514 1.00 44.44 H new ATOM 0 HG11 VAL A 64 -6.763 4.298 6.816 1.00 45.22 H new ATOM 0 HG12 VAL A 64 -6.443 3.510 8.380 1.00 45.22 H new ATOM 0 HG13 VAL A 64 -7.299 5.070 8.327 1.00 45.22 H new ATOM 0 HG21 VAL A 64 -5.499 6.314 6.152 1.00 12.40 H new ATOM 0 HG22 VAL A 64 -5.980 7.169 7.637 1.00 12.40 H new ATOM 0 HG23 VAL A 64 -4.256 6.991 7.231 1.00 12.40 H new ATOM 1027 N SER A 65 -3.876 3.343 10.170 1.00 44.40 N ATOM 1028 CA SER A 65 -3.863 2.062 10.865 1.00 62.44 C ATOM 1029 C SER A 65 -3.905 2.265 12.377 1.00 21.22 C ATOM 1030 O SER A 65 -4.537 1.495 13.099 1.00 31.04 O ATOM 1031 CB SER A 65 -2.617 1.262 10.482 1.00 72.00 C ATOM 1032 OG SER A 65 -1.444 2.046 10.618 1.00 32.25 O ATOM 0 H SER A 65 -3.017 3.557 9.664 1.00 44.40 H new ATOM 0 HA SER A 65 -4.750 1.505 10.565 1.00 62.44 H new ATOM 0 HB2 SER A 65 -2.541 0.377 11.113 1.00 72.00 H new ATOM 0 HB3 SER A 65 -2.707 0.913 9.453 1.00 72.00 H new ATOM 0 HG SER A 65 -1.212 2.441 9.752 1.00 32.25 H new ATOM 1038 N GLN A 66 -3.226 3.306 12.847 1.00 34.14 N ATOM 1039 CA GLN A 66 -3.185 3.611 14.273 1.00 54.34 C ATOM 1040 C GLN A 66 -4.570 3.989 14.789 1.00 71.22 C ATOM 1041 O GLN A 66 -5.029 3.465 15.803 1.00 21.40 O ATOM 1042 CB GLN A 66 -2.198 4.747 14.545 1.00 30.10 C ATOM 1043 CG GLN A 66 -1.823 4.888 16.011 1.00 24.41 C ATOM 1044 CD GLN A 66 -0.343 4.669 16.259 1.00 14.33 C ATOM 1045 OE1 GLN A 66 0.293 5.423 16.997 1.00 12.41 O ATOM 1046 NE2 GLN A 66 0.214 3.634 15.642 1.00 13.35 N ATOM 0 H GLN A 66 -2.697 3.953 12.262 1.00 34.14 H new ATOM 0 HA GLN A 66 -2.853 2.717 14.801 1.00 54.34 H new ATOM 0 HB2 GLN A 66 -1.293 4.578 13.962 1.00 30.10 H new ATOM 0 HB3 GLN A 66 -2.631 5.685 14.197 1.00 30.10 H new ATOM 0 HG2 GLN A 66 -2.103 5.882 16.360 1.00 24.41 H new ATOM 0 HG3 GLN A 66 -2.396 4.171 16.599 1.00 24.41 H new ATOM 0 HE21 GLN A 66 -0.351 3.035 15.039 1.00 13.35 H new ATOM 0 HE22 GLN A 66 1.207 3.437 15.770 1.00 13.35 H new ATOM 1055 N ALA A 67 -5.230 4.902 14.083 1.00 61.11 N ATOM 1056 CA ALA A 67 -6.563 5.348 14.470 1.00 45.44 C ATOM 1057 C ALA A 67 -7.566 4.203 14.402 1.00 71.01 C ATOM 1058 O ALA A 67 -8.410 4.052 15.286 1.00 71.34 O ATOM 1059 CB ALA A 67 -7.011 6.499 13.581 1.00 53.20 C ATOM 0 H ALA A 67 -4.864 5.347 13.241 1.00 61.11 H new ATOM 0 HA ALA A 67 -6.519 5.695 15.502 1.00 45.44 H new ATOM 0 HB1 ALA A 67 -8.008 6.823 13.880 1.00 53.20 H new ATOM 0 HB2 ALA A 67 -6.313 7.330 13.683 1.00 53.20 H new ATOM 0 HB3 ALA A 67 -7.033 6.169 12.542 1.00 53.20 H new ATOM 1065 N VAL A 68 -7.471 3.399 13.348 1.00 41.04 N ATOM 1066 CA VAL A 68 -8.370 2.266 13.166 1.00 13.34 C ATOM 1067 C VAL A 68 -8.083 1.167 14.183 1.00 2.14 C ATOM 1068 O VAL A 68 -8.981 0.423 14.578 1.00 51.34 O ATOM 1069 CB VAL A 68 -8.254 1.680 11.746 1.00 61.33 C ATOM 1070 CG1 VAL A 68 -9.143 0.454 11.601 1.00 11.42 C ATOM 1071 CG2 VAL A 68 -8.606 2.732 10.706 1.00 52.20 C ATOM 0 H VAL A 68 -6.780 3.512 12.607 1.00 41.04 H new ATOM 0 HA VAL A 68 -9.383 2.639 13.315 1.00 13.34 H new ATOM 0 HB VAL A 68 -7.222 1.371 11.581 1.00 61.33 H new ATOM 0 HG11 VAL A 68 -9.048 0.053 10.592 1.00 11.42 H new ATOM 0 HG12 VAL A 68 -8.838 -0.304 12.322 1.00 11.42 H new ATOM 0 HG13 VAL A 68 -10.181 0.733 11.785 1.00 11.42 H new ATOM 0 HG21 VAL A 68 -8.519 2.301 9.709 1.00 52.20 H new ATOM 0 HG22 VAL A 68 -9.629 3.073 10.866 1.00 52.20 H new ATOM 0 HG23 VAL A 68 -7.923 3.577 10.797 1.00 52.20 H new ATOM 1081 N ALA A 69 -6.827 1.073 14.605 1.00 75.23 N ATOM 1082 CA ALA A 69 -6.422 0.066 15.578 1.00 24.41 C ATOM 1083 C ALA A 69 -6.663 0.552 17.004 1.00 15.24 C ATOM 1084 O ALA A 69 -6.358 -0.148 17.968 1.00 23.12 O ATOM 1085 CB ALA A 69 -4.957 -0.297 15.384 1.00 75.32 C ATOM 0 H ALA A 69 -6.072 1.682 14.289 1.00 75.23 H new ATOM 0 HA ALA A 69 -7.030 -0.824 15.417 1.00 24.41 H new ATOM 0 HB1 ALA A 69 -4.669 -1.050 16.117 1.00 75.32 H new ATOM 0 HB2 ALA A 69 -4.810 -0.694 14.380 1.00 75.32 H new ATOM 0 HB3 ALA A 69 -4.341 0.593 15.516 1.00 75.32 H new ATOM 1091 N ASN A 70 -7.215 1.755 17.128 1.00 44.13 N ATOM 1092 CA ASN A 70 -7.496 2.335 18.436 1.00 24.01 C ATOM 1093 C ASN A 70 -8.990 2.291 18.741 1.00 41.52 C ATOM 1094 O ASN A 70 -9.397 2.247 19.902 1.00 1.43 O ATOM 1095 CB ASN A 70 -6.995 3.779 18.495 1.00 3.24 C ATOM 1096 CG ASN A 70 -5.499 3.864 18.727 1.00 61.05 C ATOM 1097 OD1 ASN A 70 -4.914 3.010 19.395 1.00 2.32 O ATOM 1098 ND2 ASN A 70 -4.871 4.895 18.174 1.00 14.02 N ATOM 0 H ASN A 70 -7.476 2.346 16.339 1.00 44.13 H new ATOM 0 HA ASN A 70 -6.972 1.744 19.188 1.00 24.01 H new ATOM 0 HB2 ASN A 70 -7.244 4.285 17.563 1.00 3.24 H new ATOM 0 HB3 ASN A 70 -7.514 4.308 19.294 1.00 3.24 H new ATOM 0 HD21 ASN A 70 -3.864 5.003 18.295 1.00 14.02 H new ATOM 0 HD22 ASN A 70 -5.396 5.579 17.628 1.00 14.02 H new ATOM 1105 N VAL A 71 -9.803 2.301 17.689 1.00 51.42 N ATOM 1106 CA VAL A 71 -11.253 2.260 17.843 1.00 45.14 C ATOM 1107 C VAL A 71 -11.707 0.919 18.407 1.00 30.42 C ATOM 1108 O VAL A 71 -12.755 0.826 19.046 1.00 14.34 O ATOM 1109 CB VAL A 71 -11.966 2.509 16.501 1.00 12.33 C ATOM 1110 CG1 VAL A 71 -11.528 1.486 15.465 1.00 5.32 C ATOM 1111 CG2 VAL A 71 -13.476 2.478 16.687 1.00 33.34 C ATOM 0 H VAL A 71 -9.482 2.337 16.721 1.00 51.42 H new ATOM 0 HA VAL A 71 -11.521 3.053 18.541 1.00 45.14 H new ATOM 0 HB VAL A 71 -11.687 3.499 16.139 1.00 12.33 H new ATOM 0 HG11 VAL A 71 -12.043 1.678 14.524 1.00 5.32 H new ATOM 0 HG12 VAL A 71 -10.451 1.561 15.312 1.00 5.32 H new ATOM 0 HG13 VAL A 71 -11.776 0.484 15.816 1.00 5.32 H new ATOM 0 HG21 VAL A 71 -13.964 2.656 15.729 1.00 33.34 H new ATOM 0 HG22 VAL A 71 -13.775 1.503 17.071 1.00 33.34 H new ATOM 0 HG23 VAL A 71 -13.771 3.253 17.394 1.00 33.34 H new ATOM 1121 N ARG A 72 -10.913 -0.119 18.167 1.00 43.43 N ATOM 1122 CA ARG A 72 -11.234 -1.456 18.650 1.00 24.13 C ATOM 1123 C ARG A 72 -12.535 -1.960 18.033 1.00 1.41 C ATOM 1124 O ARG A 72 -13.352 -1.187 17.531 1.00 22.21 O ATOM 1125 CB ARG A 72 -11.347 -1.456 20.176 1.00 1.14 C ATOM 1126 CG ARG A 72 -12.758 -1.710 20.682 1.00 52.32 C ATOM 1127 CD ARG A 72 -12.846 -1.550 22.191 1.00 14.22 C ATOM 1128 NE ARG A 72 -14.212 -1.284 22.634 1.00 10.24 N ATOM 1129 CZ ARG A 72 -14.511 -0.758 23.817 1.00 11.55 C ATOM 1130 NH1 ARG A 72 -13.546 -0.444 24.670 1.00 10.12 N ATOM 1131 NH2 ARG A 72 -15.779 -0.544 24.148 1.00 11.30 N ATOM 0 H ARG A 72 -10.042 -0.059 17.640 1.00 43.43 H new ATOM 0 HA ARG A 72 -10.428 -2.126 18.352 1.00 24.13 H new ATOM 0 HB2 ARG A 72 -10.682 -2.219 20.581 1.00 1.14 H new ATOM 0 HB3 ARG A 72 -11.001 -0.496 20.558 1.00 1.14 H new ATOM 0 HG2 ARG A 72 -13.448 -1.017 20.201 1.00 52.32 H new ATOM 0 HG3 ARG A 72 -13.070 -2.716 20.403 1.00 52.32 H new ATOM 0 HD2 ARG A 72 -12.478 -2.455 22.674 1.00 14.22 H new ATOM 0 HD3 ARG A 72 -12.197 -0.734 22.508 1.00 14.22 H new ATOM 0 HE ARG A 72 -14.978 -1.514 22.001 1.00 10.24 H new ATOM 0 HH11 ARG A 72 -12.571 -0.606 24.419 1.00 10.12 H new ATOM 0 HH12 ARG A 72 -13.779 -0.040 25.577 1.00 10.12 H new ATOM 0 HH21 ARG A 72 -16.524 -0.783 23.494 1.00 11.30 H new ATOM 0 HH22 ARG A 72 -16.008 -0.140 25.056 1.00 11.30 H new ATOM 1145 N PRO A 73 -12.733 -3.285 18.067 1.00 71.24 N ATOM 1146 CA PRO A 73 -13.932 -3.922 17.515 1.00 45.30 C ATOM 1147 C PRO A 73 -15.180 -3.616 18.335 1.00 23.22 C ATOM 1148 O PRO A 73 -15.090 -3.218 19.496 1.00 24.14 O ATOM 1149 CB PRO A 73 -13.602 -5.415 17.580 1.00 15.32 C ATOM 1150 CG PRO A 73 -12.604 -5.537 18.679 1.00 3.33 C ATOM 1151 CD PRO A 73 -11.800 -4.266 18.649 1.00 42.51 C ATOM 0 HA PRO A 73 -14.158 -3.565 16.510 1.00 45.30 H new ATOM 0 HB2 PRO A 73 -14.493 -6.008 17.787 1.00 15.32 H new ATOM 0 HB3 PRO A 73 -13.194 -5.771 16.634 1.00 15.32 H new ATOM 0 HG2 PRO A 73 -13.098 -5.664 19.642 1.00 3.33 H new ATOM 0 HG3 PRO A 73 -11.965 -6.407 18.531 1.00 3.33 H new ATOM 0 HD2 PRO A 73 -11.478 -3.971 19.648 1.00 42.51 H new ATOM 0 HD3 PRO A 73 -10.901 -4.374 18.043 1.00 42.51 H new ATOM 1159 N GLY A 74 -16.345 -3.804 17.724 1.00 33.13 N ATOM 1160 CA GLY A 74 -17.596 -3.544 18.414 1.00 40.44 C ATOM 1161 C GLY A 74 -17.999 -2.084 18.352 1.00 3.00 C ATOM 1162 O GLY A 74 -18.837 -1.630 19.130 1.00 33.15 O ATOM 0 H GLY A 74 -16.446 -4.132 16.763 1.00 33.13 H new ATOM 0 HA2 GLY A 74 -18.384 -4.154 17.973 1.00 40.44 H new ATOM 0 HA3 GLY A 74 -17.503 -3.848 19.457 1.00 40.44 H new ATOM 1166 N SER A 75 -17.398 -1.345 17.425 1.00 10.32 N ATOM 1167 CA SER A 75 -17.695 0.075 17.267 1.00 22.32 C ATOM 1168 C SER A 75 -18.412 0.337 15.947 1.00 40.22 C ATOM 1169 O SER A 75 -18.085 -0.259 14.921 1.00 52.04 O ATOM 1170 CB SER A 75 -16.406 0.897 17.334 1.00 2.22 C ATOM 1171 OG SER A 75 -15.423 0.242 18.115 1.00 63.54 O ATOM 0 H SER A 75 -16.702 -1.705 16.772 1.00 10.32 H new ATOM 0 HA SER A 75 -18.353 0.377 18.082 1.00 22.32 H new ATOM 0 HB2 SER A 75 -16.024 1.062 16.327 1.00 2.22 H new ATOM 0 HB3 SER A 75 -16.618 1.878 17.759 1.00 2.22 H new ATOM 0 HG SER A 75 -14.871 -0.325 17.537 1.00 63.54 H new ATOM 1177 N SER A 76 -19.392 1.234 15.980 1.00 63.50 N ATOM 1178 CA SER A 76 -20.159 1.574 14.788 1.00 61.34 C ATOM 1179 C SER A 76 -19.233 1.950 13.635 1.00 25.04 C ATOM 1180 O SER A 76 -18.061 2.275 13.828 1.00 60.40 O ATOM 1181 CB SER A 76 -21.118 2.728 15.084 1.00 23.32 C ATOM 1182 OG SER A 76 -22.466 2.332 14.897 1.00 1.11 O ATOM 0 H SER A 76 -19.674 1.739 16.820 1.00 63.50 H new ATOM 0 HA SER A 76 -20.737 0.697 14.496 1.00 61.34 H new ATOM 0 HB2 SER A 76 -20.975 3.070 16.109 1.00 23.32 H new ATOM 0 HB3 SER A 76 -20.890 3.571 14.432 1.00 23.32 H new ATOM 0 HG SER A 76 -23.059 3.087 15.094 1.00 1.11 H new ATOM 1188 N PRO A 77 -19.770 1.906 12.408 1.00 44.53 N ATOM 1189 CA PRO A 77 -19.011 2.241 11.199 1.00 42.05 C ATOM 1190 C PRO A 77 -18.686 3.728 11.110 1.00 21.21 C ATOM 1191 O PRO A 77 -17.927 4.157 10.241 1.00 70.01 O ATOM 1192 CB PRO A 77 -19.952 1.830 10.063 1.00 22.43 C ATOM 1193 CG PRO A 77 -21.316 1.907 10.657 1.00 15.31 C ATOM 1194 CD PRO A 77 -21.160 1.529 12.104 1.00 20.31 C ATOM 0 HA PRO A 77 -18.044 1.738 11.173 1.00 42.05 H new ATOM 0 HB2 PRO A 77 -19.854 2.497 9.207 1.00 22.43 H new ATOM 0 HB3 PRO A 77 -19.730 0.823 9.709 1.00 22.43 H new ATOM 0 HG2 PRO A 77 -21.728 2.911 10.558 1.00 15.31 H new ATOM 0 HG3 PRO A 77 -22.002 1.229 10.148 1.00 15.31 H new ATOM 0 HD2 PRO A 77 -21.869 2.063 12.737 1.00 20.31 H new ATOM 0 HD3 PRO A 77 -21.331 0.464 12.262 1.00 20.31 H new ATOM 1202 N ALA A 78 -19.265 4.510 12.016 1.00 55.13 N ATOM 1203 CA ALA A 78 -19.034 5.949 12.041 1.00 34.13 C ATOM 1204 C ALA A 78 -17.634 6.272 12.551 1.00 33.22 C ATOM 1205 O ALA A 78 -16.950 7.141 12.010 1.00 51.34 O ATOM 1206 CB ALA A 78 -20.083 6.636 12.902 1.00 13.14 C ATOM 0 H ALA A 78 -19.897 4.171 12.742 1.00 55.13 H new ATOM 0 HA ALA A 78 -19.115 6.323 11.020 1.00 34.13 H new ATOM 0 HB1 ALA A 78 -19.899 7.710 12.912 1.00 13.14 H new ATOM 0 HB2 ALA A 78 -21.074 6.442 12.492 1.00 13.14 H new ATOM 0 HB3 ALA A 78 -20.029 6.249 13.920 1.00 13.14 H new ATOM 1212 N VAL A 79 -17.214 5.568 13.598 1.00 41.52 N ATOM 1213 CA VAL A 79 -15.894 5.781 14.181 1.00 35.01 C ATOM 1214 C VAL A 79 -14.798 5.230 13.275 1.00 43.01 C ATOM 1215 O VAL A 79 -13.733 5.832 13.138 1.00 53.44 O ATOM 1216 CB VAL A 79 -15.781 5.118 15.567 1.00 40.33 C ATOM 1217 CG1 VAL A 79 -16.520 5.938 16.613 1.00 35.10 C ATOM 1218 CG2 VAL A 79 -16.311 3.693 15.521 1.00 53.33 C ATOM 0 H VAL A 79 -17.768 4.846 14.059 1.00 41.52 H new ATOM 0 HA VAL A 79 -15.764 6.858 14.289 1.00 35.01 H new ATOM 0 HB VAL A 79 -14.728 5.080 15.848 1.00 40.33 H new ATOM 0 HG11 VAL A 79 -16.429 5.454 17.585 1.00 35.10 H new ATOM 0 HG12 VAL A 79 -16.088 6.938 16.663 1.00 35.10 H new ATOM 0 HG13 VAL A 79 -17.573 6.011 16.341 1.00 35.10 H new ATOM 0 HG21 VAL A 79 -16.223 3.240 16.509 1.00 53.33 H new ATOM 0 HG22 VAL A 79 -17.358 3.704 15.218 1.00 53.33 H new ATOM 0 HG23 VAL A 79 -15.732 3.112 14.803 1.00 53.33 H new ATOM 1228 N TYR A 80 -15.067 4.085 12.659 1.00 61.52 N ATOM 1229 CA TYR A 80 -14.102 3.452 11.768 1.00 54.14 C ATOM 1230 C TYR A 80 -13.828 4.330 10.550 1.00 72.54 C ATOM 1231 O TYR A 80 -12.677 4.540 10.170 1.00 24.02 O ATOM 1232 CB TYR A 80 -14.615 2.082 11.317 1.00 65.52 C ATOM 1233 CG TYR A 80 -14.293 0.967 12.287 1.00 51.12 C ATOM 1234 CD1 TYR A 80 -13.058 0.329 12.258 1.00 10.23 C ATOM 1235 CD2 TYR A 80 -15.223 0.551 13.231 1.00 14.35 C ATOM 1236 CE1 TYR A 80 -12.761 -0.690 13.141 1.00 73.32 C ATOM 1237 CE2 TYR A 80 -14.934 -0.467 14.118 1.00 30.41 C ATOM 1238 CZ TYR A 80 -13.701 -1.084 14.070 1.00 53.12 C ATOM 1239 OH TYR A 80 -13.409 -2.100 14.951 1.00 24.13 O ATOM 0 H TYR A 80 -15.945 3.576 12.760 1.00 61.52 H new ATOM 0 HA TYR A 80 -13.170 3.321 12.317 1.00 54.14 H new ATOM 0 HB2 TYR A 80 -15.695 2.134 11.182 1.00 65.52 H new ATOM 0 HB3 TYR A 80 -14.183 1.843 10.345 1.00 65.52 H new ATOM 0 HD1 TYR A 80 -12.319 0.636 11.533 1.00 10.23 H new ATOM 0 HD2 TYR A 80 -16.189 1.032 13.272 1.00 14.35 H new ATOM 0 HE1 TYR A 80 -11.797 -1.176 13.104 1.00 73.32 H new ATOM 0 HE2 TYR A 80 -15.669 -0.778 14.845 1.00 30.41 H new ATOM 0 HH TYR A 80 -13.534 -1.782 15.870 1.00 24.13 H new ATOM 1249 N ALA A 81 -14.895 4.840 9.945 1.00 21.42 N ATOM 1250 CA ALA A 81 -14.771 5.698 8.773 1.00 31.33 C ATOM 1251 C ALA A 81 -14.033 6.989 9.112 1.00 34.53 C ATOM 1252 O ALA A 81 -13.283 7.521 8.295 1.00 53.50 O ATOM 1253 CB ALA A 81 -16.145 6.008 8.199 1.00 14.31 C ATOM 0 H ALA A 81 -15.855 4.674 10.247 1.00 21.42 H new ATOM 0 HA ALA A 81 -14.188 5.164 8.023 1.00 31.33 H new ATOM 0 HB1 ALA A 81 -16.038 6.650 7.324 1.00 14.31 H new ATOM 0 HB2 ALA A 81 -16.636 5.079 7.910 1.00 14.31 H new ATOM 0 HB3 ALA A 81 -16.747 6.518 8.951 1.00 14.31 H new ATOM 1259 N LYS A 82 -14.252 7.488 10.324 1.00 31.22 N ATOM 1260 CA LYS A 82 -13.609 8.717 10.774 1.00 61.12 C ATOM 1261 C LYS A 82 -12.139 8.473 11.099 1.00 63.35 C ATOM 1262 O LYS A 82 -11.290 9.330 10.858 1.00 44.41 O ATOM 1263 CB LYS A 82 -14.328 9.274 12.003 1.00 33.34 C ATOM 1264 CG LYS A 82 -13.623 10.461 12.636 1.00 14.21 C ATOM 1265 CD LYS A 82 -14.615 11.504 13.124 1.00 52.53 C ATOM 1266 CE LYS A 82 -14.604 11.618 14.640 1.00 1.12 C ATOM 1267 NZ LYS A 82 -15.170 12.915 15.103 1.00 33.33 N ATOM 0 H LYS A 82 -14.870 7.060 11.013 1.00 31.22 H new ATOM 0 HA LYS A 82 -13.669 9.446 9.966 1.00 61.12 H new ATOM 0 HB2 LYS A 82 -15.337 9.571 11.719 1.00 33.34 H new ATOM 0 HB3 LYS A 82 -14.426 8.482 12.746 1.00 33.34 H new ATOM 0 HG2 LYS A 82 -13.012 10.119 13.472 1.00 14.21 H new ATOM 0 HG3 LYS A 82 -12.946 10.913 11.911 1.00 14.21 H new ATOM 0 HD2 LYS A 82 -14.373 12.471 12.684 1.00 52.53 H new ATOM 0 HD3 LYS A 82 -15.617 11.241 12.785 1.00 52.53 H new ATOM 0 HE2 LYS A 82 -15.178 10.797 15.070 1.00 1.12 H new ATOM 0 HE3 LYS A 82 -13.582 11.517 15.004 1.00 1.12 H new ATOM 0 HZ1 LYS A 82 -15.145 12.954 16.142 1.00 33.33 H new ATOM 0 HZ2 LYS A 82 -14.607 13.698 14.714 1.00 33.33 H new ATOM 0 HZ3 LYS A 82 -16.154 13.000 14.777 1.00 33.33 H new ATOM 1281 N ALA A 83 -11.845 7.298 11.647 1.00 11.43 N ATOM 1282 CA ALA A 83 -10.478 6.941 12.001 1.00 43.05 C ATOM 1283 C ALA A 83 -9.641 6.667 10.756 1.00 54.30 C ATOM 1284 O ALA A 83 -8.432 6.451 10.844 1.00 64.32 O ATOM 1285 CB ALA A 83 -10.470 5.729 12.921 1.00 41.22 C ATOM 0 H ALA A 83 -12.536 6.577 11.855 1.00 11.43 H new ATOM 0 HA ALA A 83 -10.034 7.786 12.527 1.00 43.05 H new ATOM 0 HB1 ALA A 83 -9.442 5.474 13.177 1.00 41.22 H new ATOM 0 HB2 ALA A 83 -11.024 5.959 13.831 1.00 41.22 H new ATOM 0 HB3 ALA A 83 -10.938 4.885 12.415 1.00 41.22 H new ATOM 1291 N ILE A 84 -10.291 6.677 9.598 1.00 13.54 N ATOM 1292 CA ILE A 84 -9.607 6.430 8.334 1.00 23.41 C ATOM 1293 C ILE A 84 -9.544 7.696 7.488 1.00 2.52 C ATOM 1294 O ILE A 84 -8.679 7.834 6.623 1.00 41.12 O ATOM 1295 CB ILE A 84 -10.301 5.319 7.526 1.00 74.23 C ATOM 1296 CG1 ILE A 84 -10.297 4.007 8.313 1.00 72.22 C ATOM 1297 CG2 ILE A 84 -9.616 5.137 6.180 1.00 42.33 C ATOM 1298 CD1 ILE A 84 -11.270 2.978 7.780 1.00 44.22 C ATOM 0 H ILE A 84 -11.292 6.854 9.508 1.00 13.54 H new ATOM 0 HA ILE A 84 -8.595 6.109 8.580 1.00 23.41 H new ATOM 0 HB ILE A 84 -11.336 5.611 7.349 1.00 74.23 H new ATOM 0 HG12 ILE A 84 -9.291 3.587 8.297 1.00 72.22 H new ATOM 0 HG13 ILE A 84 -10.538 4.217 9.355 1.00 72.22 H new ATOM 0 HG21 ILE A 84 -10.118 4.348 5.620 1.00 42.33 H new ATOM 0 HG22 ILE A 84 -9.666 6.069 5.617 1.00 42.33 H new ATOM 0 HG23 ILE A 84 -8.573 4.863 6.337 1.00 42.33 H new ATOM 0 HD11 ILE A 84 -11.212 2.074 8.387 1.00 44.22 H new ATOM 0 HD12 ILE A 84 -12.283 3.379 7.822 1.00 44.22 H new ATOM 0 HD13 ILE A 84 -11.017 2.738 6.747 1.00 44.22 H new ATOM 1310 N ALA A 85 -10.464 8.620 7.743 1.00 11.33 N ATOM 1311 CA ALA A 85 -10.511 9.876 7.006 1.00 5.05 C ATOM 1312 C ALA A 85 -9.711 10.961 7.719 1.00 32.44 C ATOM 1313 O ALA A 85 -9.038 11.769 7.081 1.00 24.11 O ATOM 1314 CB ALA A 85 -11.954 10.322 6.814 1.00 45.05 C ATOM 0 H ALA A 85 -11.188 8.522 8.455 1.00 11.33 H new ATOM 0 HA ALA A 85 -10.060 9.712 6.028 1.00 5.05 H new ATOM 0 HB1 ALA A 85 -11.974 11.262 6.262 1.00 45.05 H new ATOM 0 HB2 ALA A 85 -12.499 9.561 6.255 1.00 45.05 H new ATOM 0 HB3 ALA A 85 -12.424 10.463 7.787 1.00 45.05 H new ATOM 1320 N ALA A 86 -9.791 10.973 9.046 1.00 1.21 N ATOM 1321 CA ALA A 86 -9.072 11.957 9.845 1.00 22.22 C ATOM 1322 C ALA A 86 -7.579 11.932 9.537 1.00 35.32 C ATOM 1323 O ALA A 86 -6.991 12.929 9.116 1.00 74.34 O ATOM 1324 CB ALA A 86 -9.311 11.709 11.328 1.00 11.12 C ATOM 0 H ALA A 86 -10.346 10.312 9.590 1.00 1.21 H new ATOM 0 HA ALA A 86 -9.452 12.945 9.586 1.00 22.22 H new ATOM 0 HB1 ALA A 86 -8.768 12.451 11.913 1.00 11.12 H new ATOM 0 HB2 ALA A 86 -10.377 11.787 11.543 1.00 11.12 H new ATOM 0 HB3 ALA A 86 -8.959 10.711 11.591 1.00 11.12 H new ATOM 1330 N PRO A 87 -6.950 10.767 9.751 1.00 51.40 N ATOM 1331 CA PRO A 87 -5.517 10.584 9.501 1.00 64.14 C ATOM 1332 C PRO A 87 -5.179 10.606 8.015 1.00 4.44 C ATOM 1333 O PRO A 87 -4.014 10.720 7.634 1.00 12.31 O ATOM 1334 CB PRO A 87 -5.227 9.203 10.095 1.00 45.43 C ATOM 1335 CG PRO A 87 -6.532 8.488 10.045 1.00 21.12 C ATOM 1336 CD PRO A 87 -7.588 9.539 10.252 1.00 15.33 C ATOM 0 HA PRO A 87 -4.922 11.386 9.939 1.00 64.14 H new ATOM 0 HB2 PRO A 87 -4.465 8.677 9.520 1.00 45.43 H new ATOM 0 HB3 PRO A 87 -4.857 9.281 11.117 1.00 45.43 H new ATOM 0 HG2 PRO A 87 -6.665 7.985 9.087 1.00 21.12 H new ATOM 0 HG3 PRO A 87 -6.587 7.722 10.818 1.00 21.12 H new ATOM 0 HD2 PRO A 87 -8.500 9.307 9.702 1.00 15.33 H new ATOM 0 HD3 PRO A 87 -7.864 9.630 11.303 1.00 15.33 H new ATOM 1344 N SER A 88 -6.206 10.497 7.178 1.00 2.34 N ATOM 1345 CA SER A 88 -6.018 10.501 5.732 1.00 2.24 C ATOM 1346 C SER A 88 -5.957 11.929 5.195 1.00 72.42 C ATOM 1347 O SER A 88 -5.095 12.262 4.382 1.00 11.21 O ATOM 1348 CB SER A 88 -7.152 9.735 5.046 1.00 51.04 C ATOM 1349 OG SER A 88 -6.820 8.366 4.891 1.00 71.14 O ATOM 0 H SER A 88 -7.177 10.405 7.477 1.00 2.34 H new ATOM 0 HA SER A 88 -5.071 10.008 5.513 1.00 2.24 H new ATOM 0 HB2 SER A 88 -8.065 9.827 5.634 1.00 51.04 H new ATOM 0 HB3 SER A 88 -7.355 10.176 4.070 1.00 51.04 H new ATOM 0 HG SER A 88 -7.437 7.818 5.420 1.00 71.14 H new ATOM 1355 N VAL A 89 -6.879 12.768 5.658 1.00 73.52 N ATOM 1356 CA VAL A 89 -6.931 14.159 5.227 1.00 60.03 C ATOM 1357 C VAL A 89 -5.748 14.949 5.776 1.00 32.41 C ATOM 1358 O VAL A 89 -5.185 15.801 5.089 1.00 35.40 O ATOM 1359 CB VAL A 89 -8.239 14.837 5.675 1.00 52.43 C ATOM 1360 CG1 VAL A 89 -9.440 14.155 5.037 1.00 71.45 C ATOM 1361 CG2 VAL A 89 -8.352 14.826 7.192 1.00 52.14 C ATOM 0 H VAL A 89 -7.600 12.508 6.331 1.00 73.52 H new ATOM 0 HA VAL A 89 -6.887 14.155 4.138 1.00 60.03 H new ATOM 0 HB VAL A 89 -8.222 15.875 5.343 1.00 52.43 H new ATOM 0 HG11 VAL A 89 -10.355 14.648 5.365 1.00 71.45 H new ATOM 0 HG12 VAL A 89 -9.362 14.221 3.952 1.00 71.45 H new ATOM 0 HG13 VAL A 89 -9.465 13.107 5.336 1.00 71.45 H new ATOM 0 HG21 VAL A 89 -9.282 15.309 7.491 1.00 52.14 H new ATOM 0 HG22 VAL A 89 -8.346 13.796 7.550 1.00 52.14 H new ATOM 0 HG23 VAL A 89 -7.508 15.365 7.624 1.00 52.14 H new ATOM 1371 N GLN A 90 -5.376 14.659 7.019 1.00 43.11 N ATOM 1372 CA GLN A 90 -4.260 15.343 7.661 1.00 44.13 C ATOM 1373 C GLN A 90 -2.958 15.083 6.910 1.00 63.31 C ATOM 1374 O GLN A 90 -2.100 15.961 6.812 1.00 62.40 O ATOM 1375 CB GLN A 90 -4.123 14.888 9.115 1.00 1.32 C ATOM 1376 CG GLN A 90 -3.530 13.496 9.264 1.00 10.12 C ATOM 1377 CD GLN A 90 -3.332 13.099 10.714 1.00 54.31 C ATOM 1378 OE1 GLN A 90 -2.239 12.702 11.117 1.00 71.23 O ATOM 1379 NE2 GLN A 90 -4.393 13.202 11.506 1.00 24.11 N ATOM 0 H GLN A 90 -5.831 13.956 7.601 1.00 43.11 H new ATOM 0 HA GLN A 90 -4.463 16.414 7.641 1.00 44.13 H new ATOM 0 HB2 GLN A 90 -3.497 15.600 9.652 1.00 1.32 H new ATOM 0 HB3 GLN A 90 -5.105 14.908 9.587 1.00 1.32 H new ATOM 0 HG2 GLN A 90 -4.185 12.772 8.779 1.00 10.12 H new ATOM 0 HG3 GLN A 90 -2.572 13.456 8.746 1.00 10.12 H new ATOM 0 HE21 GLN A 90 -5.280 13.536 11.129 1.00 24.11 H new ATOM 0 HE22 GLN A 90 -4.321 12.947 12.491 1.00 24.11 H new ATOM 1388 N ILE A 91 -2.816 13.872 6.382 1.00 33.04 N ATOM 1389 CA ILE A 91 -1.620 13.497 5.640 1.00 1.34 C ATOM 1390 C ILE A 91 -1.667 14.035 4.214 1.00 41.21 C ATOM 1391 O ILE A 91 -0.661 14.509 3.683 1.00 20.02 O ATOM 1392 CB ILE A 91 -1.441 11.968 5.594 1.00 43.10 C ATOM 1393 CG1 ILE A 91 -1.291 11.408 7.010 1.00 33.14 C ATOM 1394 CG2 ILE A 91 -0.234 11.602 4.743 1.00 33.45 C ATOM 1395 CD1 ILE A 91 0.071 11.657 7.618 1.00 50.13 C ATOM 0 H ILE A 91 -3.516 13.133 6.455 1.00 33.04 H new ATOM 0 HA ILE A 91 -0.772 13.938 6.165 1.00 1.34 H new ATOM 0 HB ILE A 91 -2.328 11.526 5.141 1.00 43.10 H new ATOM 0 HG12 ILE A 91 -2.052 11.853 7.650 1.00 33.14 H new ATOM 0 HG13 ILE A 91 -1.480 10.335 6.989 1.00 33.14 H new ATOM 0 HG21 ILE A 91 -0.120 10.518 4.720 1.00 33.45 H new ATOM 0 HG22 ILE A 91 -0.378 11.973 3.728 1.00 33.45 H new ATOM 0 HG23 ILE A 91 0.662 12.052 5.170 1.00 33.45 H new ATOM 0 HD11 ILE A 91 0.105 11.233 8.621 1.00 50.13 H new ATOM 0 HD12 ILE A 91 0.837 11.188 7.000 1.00 50.13 H new ATOM 0 HD13 ILE A 91 0.255 12.730 7.671 1.00 50.13 H new ATOM 1407 N LEU A 92 -2.841 13.961 3.598 1.00 54.45 N ATOM 1408 CA LEU A 92 -3.020 14.441 2.232 1.00 10.43 C ATOM 1409 C LEU A 92 -2.819 15.952 2.155 1.00 32.32 C ATOM 1410 O LEU A 92 -2.164 16.456 1.243 1.00 74.34 O ATOM 1411 CB LEU A 92 -4.415 14.076 1.721 1.00 40.21 C ATOM 1412 CG LEU A 92 -4.691 12.583 1.533 1.00 21.52 C ATOM 1413 CD1 LEU A 92 -6.175 12.291 1.693 1.00 55.42 C ATOM 1414 CD2 LEU A 92 -4.197 12.116 0.173 1.00 70.14 C ATOM 0 H LEU A 92 -3.684 13.573 4.022 1.00 54.45 H new ATOM 0 HA LEU A 92 -2.271 13.960 1.603 1.00 10.43 H new ATOM 0 HB2 LEU A 92 -5.152 14.477 2.417 1.00 40.21 H new ATOM 0 HB3 LEU A 92 -4.573 14.578 0.766 1.00 40.21 H new ATOM 0 HG LEU A 92 -4.148 12.033 2.302 1.00 21.52 H new ATOM 0 HD11 LEU A 92 -6.353 11.224 1.556 1.00 55.42 H new ATOM 0 HD12 LEU A 92 -6.499 12.588 2.691 1.00 55.42 H new ATOM 0 HD13 LEU A 92 -6.739 12.851 0.947 1.00 55.42 H new ATOM 0 HD21 LEU A 92 -4.402 11.052 0.057 1.00 70.14 H new ATOM 0 HD22 LEU A 92 -4.711 12.672 -0.611 1.00 70.14 H new ATOM 0 HD23 LEU A 92 -3.124 12.289 0.097 1.00 70.14 H new ATOM 1426 N VAL A 93 -3.383 16.669 3.122 1.00 14.53 N ATOM 1427 CA VAL A 93 -3.263 18.121 3.166 1.00 24.14 C ATOM 1428 C VAL A 93 -1.831 18.545 3.474 1.00 73.04 C ATOM 1429 O VAL A 93 -1.366 19.585 3.008 1.00 32.43 O ATOM 1430 CB VAL A 93 -4.205 18.730 4.222 1.00 33.22 C ATOM 1431 CG1 VAL A 93 -3.764 18.334 5.623 1.00 70.20 C ATOM 1432 CG2 VAL A 93 -4.257 20.244 4.079 1.00 0.14 C ATOM 0 H VAL A 93 -3.928 16.268 3.885 1.00 14.53 H new ATOM 0 HA VAL A 93 -3.545 18.492 2.181 1.00 24.14 H new ATOM 0 HB VAL A 93 -5.209 18.337 4.058 1.00 33.22 H new ATOM 0 HG11 VAL A 93 -4.441 18.773 6.355 1.00 70.20 H new ATOM 0 HG12 VAL A 93 -3.783 17.248 5.717 1.00 70.20 H new ATOM 0 HG13 VAL A 93 -2.752 18.696 5.802 1.00 70.20 H new ATOM 0 HG21 VAL A 93 -4.927 20.658 4.833 1.00 0.14 H new ATOM 0 HG22 VAL A 93 -3.258 20.657 4.216 1.00 0.14 H new ATOM 0 HG23 VAL A 93 -4.624 20.503 3.086 1.00 0.14 H new ATOM 1442 N SER A 94 -1.135 17.730 4.262 1.00 1.11 N ATOM 1443 CA SER A 94 0.244 18.021 4.635 1.00 3.23 C ATOM 1444 C SER A 94 1.191 17.749 3.470 1.00 33.22 C ATOM 1445 O SER A 94 2.354 18.154 3.493 1.00 32.34 O ATOM 1446 CB SER A 94 0.654 17.184 5.847 1.00 23.21 C ATOM 1447 OG SER A 94 0.538 17.931 7.046 1.00 3.44 O ATOM 0 H SER A 94 -1.504 16.864 4.654 1.00 1.11 H new ATOM 0 HA SER A 94 0.309 19.078 4.894 1.00 3.23 H new ATOM 0 HB2 SER A 94 0.027 16.294 5.907 1.00 23.21 H new ATOM 0 HB3 SER A 94 1.682 16.842 5.726 1.00 23.21 H new ATOM 0 HG SER A 94 0.804 17.373 7.806 1.00 3.44 H new ATOM 1453 N SER A 95 0.684 17.061 2.452 1.00 30.32 N ATOM 1454 CA SER A 95 1.485 16.730 1.279 1.00 73.33 C ATOM 1455 C SER A 95 0.933 17.417 0.034 1.00 44.21 C ATOM 1456 O SER A 95 1.505 17.313 -1.051 1.00 73.12 O ATOM 1457 CB SER A 95 1.516 15.215 1.068 1.00 10.20 C ATOM 1458 OG SER A 95 2.842 14.719 1.132 1.00 54.43 O ATOM 0 H SER A 95 -0.277 16.722 2.416 1.00 30.32 H new ATOM 0 HA SER A 95 2.501 17.087 1.450 1.00 73.33 H new ATOM 0 HB2 SER A 95 0.904 14.726 1.826 1.00 10.20 H new ATOM 0 HB3 SER A 95 1.079 14.970 0.100 1.00 10.20 H new ATOM 0 HG SER A 95 3.071 14.287 0.283 1.00 54.43 H new ATOM 1464 N GLY A 96 -0.182 18.121 0.199 1.00 3.12 N ATOM 1465 CA GLY A 96 -0.794 18.816 -0.920 1.00 24.50 C ATOM 1466 C GLY A 96 -1.610 17.891 -1.800 1.00 22.31 C ATOM 1467 O GLY A 96 -2.179 18.321 -2.803 1.00 72.12 O ATOM 0 H GLY A 96 -0.673 18.223 1.087 1.00 3.12 H new ATOM 0 HA2 GLY A 96 -1.435 19.613 -0.542 1.00 24.50 H new ATOM 0 HA3 GLY A 96 -0.016 19.290 -1.519 1.00 24.50 H new ATOM 1471 N SER A 97 -1.667 16.617 -1.426 1.00 64.12 N ATOM 1472 CA SER A 97 -2.415 15.628 -2.191 1.00 11.52 C ATOM 1473 C SER A 97 -3.866 16.065 -2.373 1.00 52.10 C ATOM 1474 O SER A 97 -4.544 15.634 -3.306 1.00 62.10 O ATOM 1475 CB SER A 97 -2.364 14.266 -1.496 1.00 24.04 C ATOM 1476 OG SER A 97 -1.033 13.787 -1.412 1.00 61.21 O ATOM 0 H SER A 97 -1.203 16.246 -0.597 1.00 64.12 H new ATOM 0 HA SER A 97 -1.953 15.542 -3.175 1.00 11.52 H new ATOM 0 HB2 SER A 97 -2.788 14.349 -0.495 1.00 24.04 H new ATOM 0 HB3 SER A 97 -2.977 13.551 -2.044 1.00 24.04 H new ATOM 0 HG SER A 97 -1.026 12.916 -0.962 1.00 61.21 H new ATOM 1482 N VAL A 98 -4.335 16.923 -1.474 1.00 31.44 N ATOM 1483 CA VAL A 98 -5.705 17.421 -1.532 1.00 54.02 C ATOM 1484 C VAL A 98 -5.748 18.935 -1.363 1.00 71.53 C ATOM 1485 O VAL A 98 -5.246 19.473 -0.376 1.00 41.42 O ATOM 1486 CB VAL A 98 -6.586 16.768 -0.451 1.00 13.03 C ATOM 1487 CG1 VAL A 98 -6.616 15.257 -0.627 1.00 20.42 C ATOM 1488 CG2 VAL A 98 -6.090 17.142 0.937 1.00 2.00 C ATOM 0 H VAL A 98 -3.786 17.289 -0.696 1.00 31.44 H new ATOM 0 HA VAL A 98 -6.096 17.158 -2.515 1.00 54.02 H new ATOM 0 HB VAL A 98 -7.604 17.142 -0.561 1.00 13.03 H new ATOM 0 HG11 VAL A 98 -7.243 14.813 0.146 1.00 20.42 H new ATOM 0 HG12 VAL A 98 -7.022 15.013 -1.609 1.00 20.42 H new ATOM 0 HG13 VAL A 98 -5.604 14.861 -0.545 1.00 20.42 H new ATOM 0 HG21 VAL A 98 -6.724 16.672 1.689 1.00 2.00 H new ATOM 0 HG22 VAL A 98 -5.063 16.798 1.061 1.00 2.00 H new ATOM 0 HG23 VAL A 98 -6.127 18.225 1.057 1.00 2.00 H new ATOM 1498 N ASN A 99 -6.351 19.617 -2.330 1.00 32.22 N ATOM 1499 CA ASN A 99 -6.461 21.070 -2.287 1.00 42.31 C ATOM 1500 C ASN A 99 -7.910 21.513 -2.463 1.00 51.11 C ATOM 1501 O ASN A 99 -8.817 20.685 -2.541 1.00 43.45 O ATOM 1502 CB ASN A 99 -5.588 21.700 -3.374 1.00 55.44 C ATOM 1503 CG ASN A 99 -5.705 20.974 -4.701 1.00 4.40 C ATOM 1504 OD1 ASN A 99 -4.964 19.882 -4.845 1.00 14.20 O flip ATOM 1505 ND2 ASN A 99 -6.452 21.392 -5.586 1.00 3.21 N flip ATOM 0 H ASN A 99 -6.771 19.187 -3.154 1.00 32.22 H new ATOM 0 HA ASN A 99 -6.114 21.406 -1.310 1.00 42.31 H new ATOM 0 HB2 ASN A 99 -5.874 22.743 -3.507 1.00 55.44 H new ATOM 0 HB3 ASN A 99 -4.547 21.694 -3.050 1.00 55.44 H new ATOM 0 HD21 ASN A 99 -7.003 22.236 -5.431 1.00 3.21 H new ATOM 0 HD22 ASN A 99 -6.519 20.894 -6.474 1.00 3.21 H new ATOM 1512 N ASN A 100 -8.120 22.824 -2.523 1.00 42.42 N ATOM 1513 CA ASN A 100 -9.458 23.378 -2.690 1.00 74.52 C ATOM 1514 C ASN A 100 -9.847 23.427 -4.164 1.00 1.21 C ATOM 1515 O ASN A 100 -10.124 24.496 -4.707 1.00 11.33 O ATOM 1516 CB ASN A 100 -9.533 24.780 -2.083 1.00 52.33 C ATOM 1517 CG ASN A 100 -9.138 24.798 -0.619 1.00 4.21 C ATOM 1518 OD1 ASN A 100 -8.070 24.310 -0.247 1.00 33.52 O ATOM 1519 ND2 ASN A 100 -9.999 25.363 0.219 1.00 54.03 N ATOM 0 H ASN A 100 -7.380 23.523 -2.458 1.00 42.42 H new ATOM 0 HA ASN A 100 -10.160 22.727 -2.169 1.00 74.52 H new ATOM 0 HB2 ASN A 100 -8.879 25.450 -2.641 1.00 52.33 H new ATOM 0 HB3 ASN A 100 -10.548 25.164 -2.188 1.00 52.33 H new ATOM 0 HD21 ASN A 100 -9.787 25.405 1.216 1.00 54.03 H new ATOM 0 HD22 ASN A 100 -10.872 25.755 -0.134 1.00 54.03 H new ATOM 1526 N ASN A 101 -9.865 22.264 -4.806 1.00 61.34 N ATOM 1527 CA ASN A 101 -10.220 22.175 -6.218 1.00 60.04 C ATOM 1528 C ASN A 101 -10.288 20.719 -6.671 1.00 0.14 C ATOM 1529 O ASN A 101 -11.098 20.363 -7.526 1.00 61.52 O ATOM 1530 CB ASN A 101 -9.203 22.938 -7.069 1.00 61.15 C ATOM 1531 CG ASN A 101 -9.847 24.036 -7.894 1.00 34.51 C ATOM 1532 OD1 ASN A 101 -10.969 23.887 -8.379 1.00 74.31 O ATOM 1533 ND2 ASN A 101 -9.139 25.148 -8.055 1.00 74.20 N ATOM 0 H ASN A 101 -9.638 21.370 -4.371 1.00 61.34 H new ATOM 0 HA ASN A 101 -11.204 22.624 -6.349 1.00 60.04 H new ATOM 0 HB2 ASN A 101 -8.444 23.373 -6.419 1.00 61.15 H new ATOM 0 HB3 ASN A 101 -8.693 22.240 -7.733 1.00 61.15 H new ATOM 0 HD21 ASN A 101 -9.521 25.922 -8.599 1.00 74.20 H new ATOM 0 HD22 ASN A 101 -8.213 25.228 -7.635 1.00 74.20 H new ATOM 1540 N ASN A 102 -9.433 19.884 -6.090 1.00 1.40 N ATOM 1541 CA ASN A 102 -9.397 18.467 -6.435 1.00 72.33 C ATOM 1542 C ASN A 102 -9.887 17.612 -5.270 1.00 61.00 C ATOM 1543 O ASN A 102 -10.039 16.398 -5.399 1.00 11.04 O ATOM 1544 CB ASN A 102 -7.976 18.051 -6.824 1.00 21.33 C ATOM 1545 CG ASN A 102 -7.446 16.925 -5.958 1.00 63.15 C ATOM 1546 OD1 ASN A 102 -7.699 15.750 -6.224 1.00 14.50 O ATOM 1547 ND2 ASN A 102 -6.706 17.280 -4.915 1.00 64.55 N ATOM 0 H ASN A 102 -8.757 20.163 -5.379 1.00 1.40 H new ATOM 0 HA ASN A 102 -10.061 18.308 -7.285 1.00 72.33 H new ATOM 0 HB2 ASN A 102 -7.965 17.739 -7.868 1.00 21.33 H new ATOM 0 HB3 ASN A 102 -7.313 18.912 -6.742 1.00 21.33 H new ATOM 0 HD21 ASN A 102 -6.322 16.566 -4.296 1.00 64.55 H new ATOM 0 HD22 ASN A 102 -6.522 18.266 -4.733 1.00 64.55 H new ATOM 1554 N ALA A 103 -10.134 18.255 -4.134 1.00 33.42 N ATOM 1555 CA ALA A 103 -10.610 17.554 -2.947 1.00 1.53 C ATOM 1556 C ALA A 103 -11.819 16.684 -3.272 1.00 71.02 C ATOM 1557 O ALA A 103 -11.959 15.578 -2.751 1.00 23.31 O ATOM 1558 CB ALA A 103 -10.954 18.550 -1.850 1.00 20.34 C ATOM 0 H ALA A 103 -10.013 19.260 -4.010 1.00 33.42 H new ATOM 0 HA ALA A 103 -9.811 16.902 -2.594 1.00 1.53 H new ATOM 0 HB1 ALA A 103 -11.308 18.014 -0.970 1.00 20.34 H new ATOM 0 HB2 ALA A 103 -10.066 19.127 -1.591 1.00 20.34 H new ATOM 0 HB3 ALA A 103 -11.735 19.224 -2.202 1.00 20.34 H new ATOM 1564 N LYS A 104 -12.692 17.190 -4.137 1.00 62.43 N ATOM 1565 CA LYS A 104 -13.890 16.459 -4.532 1.00 63.04 C ATOM 1566 C LYS A 104 -13.532 15.264 -5.410 1.00 12.52 C ATOM 1567 O LYS A 104 -14.152 14.205 -5.314 1.00 5.41 O ATOM 1568 CB LYS A 104 -14.854 17.384 -5.279 1.00 63.24 C ATOM 1569 CG LYS A 104 -14.177 18.248 -6.329 1.00 23.34 C ATOM 1570 CD LYS A 104 -15.148 18.659 -7.423 1.00 3.45 C ATOM 1571 CE LYS A 104 -15.961 19.879 -7.018 1.00 21.53 C ATOM 1572 NZ LYS A 104 -16.145 20.825 -8.152 1.00 53.41 N ATOM 0 H LYS A 104 -12.592 18.104 -4.578 1.00 62.43 H new ATOM 0 HA LYS A 104 -14.376 16.092 -3.628 1.00 63.04 H new ATOM 0 HB2 LYS A 104 -15.625 16.781 -5.759 1.00 63.24 H new ATOM 0 HB3 LYS A 104 -15.357 18.029 -4.559 1.00 63.24 H new ATOM 0 HG2 LYS A 104 -13.762 19.138 -5.857 1.00 23.34 H new ATOM 0 HG3 LYS A 104 -13.342 17.702 -6.768 1.00 23.34 H new ATOM 0 HD2 LYS A 104 -14.596 18.876 -8.338 1.00 3.45 H new ATOM 0 HD3 LYS A 104 -15.820 17.830 -7.645 1.00 3.45 H new ATOM 0 HE2 LYS A 104 -16.936 19.560 -6.650 1.00 21.53 H new ATOM 0 HE3 LYS A 104 -15.462 20.391 -6.195 1.00 21.53 H new ATOM 0 HZ1 LYS A 104 -16.704 21.643 -7.835 1.00 53.41 H new ATOM 0 HZ2 LYS A 104 -15.216 21.150 -8.487 1.00 53.41 H new ATOM 0 HZ3 LYS A 104 -16.644 20.344 -8.928 1.00 53.41 H new ATOM 1586 N GLN A 105 -12.530 15.442 -6.265 1.00 24.04 N ATOM 1587 CA GLN A 105 -12.091 14.378 -7.159 1.00 71.12 C ATOM 1588 C GLN A 105 -11.346 13.293 -6.389 1.00 42.13 C ATOM 1589 O GLN A 105 -11.635 12.105 -6.532 1.00 55.44 O ATOM 1590 CB GLN A 105 -11.194 14.945 -8.261 1.00 1.14 C ATOM 1591 CG GLN A 105 -10.492 13.878 -9.084 1.00 61.03 C ATOM 1592 CD GLN A 105 -10.172 14.342 -10.491 1.00 51.14 C ATOM 1593 OE1 GLN A 105 -9.028 14.678 -10.801 1.00 12.21 O ATOM 1594 NE2 GLN A 105 -11.182 14.363 -11.352 1.00 1.11 N ATOM 0 H GLN A 105 -12.007 16.313 -6.357 1.00 24.04 H new ATOM 0 HA GLN A 105 -12.976 13.933 -7.614 1.00 71.12 H new ATOM 0 HB2 GLN A 105 -11.796 15.566 -8.924 1.00 1.14 H new ATOM 0 HB3 GLN A 105 -10.445 15.595 -7.809 1.00 1.14 H new ATOM 0 HG2 GLN A 105 -9.569 13.587 -8.583 1.00 61.03 H new ATOM 0 HG3 GLN A 105 -11.122 12.990 -9.133 1.00 61.03 H new ATOM 0 HE21 GLN A 105 -12.114 14.076 -11.052 1.00 1.11 H new ATOM 0 HE22 GLN A 105 -11.026 14.666 -12.313 1.00 1.11 H new ATOM 1603 N VAL A 106 -10.384 13.710 -5.571 1.00 73.24 N ATOM 1604 CA VAL A 106 -9.597 12.773 -4.778 1.00 22.53 C ATOM 1605 C VAL A 106 -10.472 12.037 -3.769 1.00 53.05 C ATOM 1606 O VAL A 106 -10.276 10.849 -3.514 1.00 74.22 O ATOM 1607 CB VAL A 106 -8.460 13.492 -4.026 1.00 34.11 C ATOM 1608 CG1 VAL A 106 -9.022 14.579 -3.122 1.00 40.33 C ATOM 1609 CG2 VAL A 106 -7.637 12.494 -3.227 1.00 20.31 C ATOM 0 H VAL A 106 -10.131 14.690 -5.440 1.00 73.24 H new ATOM 0 HA VAL A 106 -9.165 12.053 -5.474 1.00 22.53 H new ATOM 0 HB VAL A 106 -7.805 13.965 -4.758 1.00 34.11 H new ATOM 0 HG11 VAL A 106 -8.205 15.076 -2.599 1.00 40.33 H new ATOM 0 HG12 VAL A 106 -9.564 15.308 -3.724 1.00 40.33 H new ATOM 0 HG13 VAL A 106 -9.700 14.133 -2.395 1.00 40.33 H new ATOM 0 HG21 VAL A 106 -6.838 13.018 -2.702 1.00 20.31 H new ATOM 0 HG22 VAL A 106 -8.278 11.991 -2.503 1.00 20.31 H new ATOM 0 HG23 VAL A 106 -7.204 11.756 -3.902 1.00 20.31 H new ATOM 1619 N ALA A 107 -11.437 12.750 -3.200 1.00 71.52 N ATOM 1620 CA ALA A 107 -12.344 12.163 -2.221 1.00 14.24 C ATOM 1621 C ALA A 107 -13.207 11.078 -2.854 1.00 15.14 C ATOM 1622 O ALA A 107 -13.508 10.063 -2.225 1.00 40.23 O ATOM 1623 CB ALA A 107 -13.219 13.241 -1.599 1.00 14.52 C ATOM 0 H ALA A 107 -11.611 13.735 -3.400 1.00 71.52 H new ATOM 0 HA ALA A 107 -11.744 11.701 -1.437 1.00 14.24 H new ATOM 0 HB1 ALA A 107 -13.891 12.788 -0.870 1.00 14.52 H new ATOM 0 HB2 ALA A 107 -12.589 13.979 -1.102 1.00 14.52 H new ATOM 0 HB3 ALA A 107 -13.804 13.729 -2.378 1.00 14.52 H new ATOM 1629 N SER A 108 -13.606 11.298 -4.104 1.00 0.13 N ATOM 1630 CA SER A 108 -14.440 10.341 -4.821 1.00 60.02 C ATOM 1631 C SER A 108 -13.644 9.090 -5.182 1.00 64.14 C ATOM 1632 O SER A 108 -14.116 7.966 -5.009 1.00 45.32 O ATOM 1633 CB SER A 108 -15.011 10.978 -6.088 1.00 1.02 C ATOM 1634 OG SER A 108 -14.886 10.108 -7.199 1.00 31.02 O ATOM 0 H SER A 108 -13.364 12.131 -4.640 1.00 0.13 H new ATOM 0 HA SER A 108 -15.262 10.052 -4.166 1.00 60.02 H new ATOM 0 HB2 SER A 108 -16.061 11.225 -5.933 1.00 1.02 H new ATOM 0 HB3 SER A 108 -14.491 11.913 -6.295 1.00 1.02 H new ATOM 0 HG SER A 108 -15.260 10.539 -7.996 1.00 31.02 H new ATOM 1640 N THR A 109 -12.430 9.294 -5.685 1.00 43.20 N ATOM 1641 CA THR A 109 -11.567 8.186 -6.072 1.00 42.05 C ATOM 1642 C THR A 109 -11.032 7.451 -4.848 1.00 32.15 C ATOM 1643 O THR A 109 -10.868 6.230 -4.867 1.00 61.21 O ATOM 1644 CB THR A 109 -10.378 8.670 -6.924 1.00 45.44 C ATOM 1645 OG1 THR A 109 -10.725 9.881 -7.605 1.00 43.24 O ATOM 1646 CG2 THR A 109 -9.971 7.611 -7.937 1.00 72.10 C ATOM 0 H THR A 109 -12.023 10.217 -5.834 1.00 43.20 H new ATOM 0 HA THR A 109 -12.177 7.504 -6.665 1.00 42.05 H new ATOM 0 HB THR A 109 -9.535 8.856 -6.259 1.00 45.44 H new ATOM 0 HG1 THR A 109 -10.649 10.637 -6.986 1.00 43.24 H new ATOM 0 HG21 THR A 109 -9.130 7.976 -8.527 1.00 72.10 H new ATOM 0 HG22 THR A 109 -9.680 6.700 -7.414 1.00 72.10 H new ATOM 0 HG23 THR A 109 -10.811 7.397 -8.597 1.00 72.10 H new ATOM 1654 N LEU A 110 -10.766 8.200 -3.784 1.00 70.41 N ATOM 1655 CA LEU A 110 -10.252 7.619 -2.548 1.00 54.43 C ATOM 1656 C LEU A 110 -11.211 6.567 -2.001 1.00 71.34 C ATOM 1657 O LEU A 110 -10.859 5.394 -1.881 1.00 34.10 O ATOM 1658 CB LEU A 110 -10.024 8.712 -1.503 1.00 52.02 C ATOM 1659 CG LEU A 110 -9.499 8.243 -0.146 1.00 43.22 C ATOM 1660 CD1 LEU A 110 -7.981 8.317 -0.106 1.00 43.42 C ATOM 1661 CD2 LEU A 110 -10.104 9.074 0.976 1.00 24.23 C ATOM 0 H LEU A 110 -10.898 9.211 -3.752 1.00 70.41 H new ATOM 0 HA LEU A 110 -9.301 7.135 -2.771 1.00 54.43 H new ATOM 0 HB2 LEU A 110 -9.320 9.437 -1.912 1.00 52.02 H new ATOM 0 HB3 LEU A 110 -10.966 9.237 -1.344 1.00 52.02 H new ATOM 0 HG LEU A 110 -9.796 7.204 -0.003 1.00 43.22 H new ATOM 0 HD11 LEU A 110 -7.626 7.979 0.868 1.00 43.42 H new ATOM 0 HD12 LEU A 110 -7.565 7.679 -0.885 1.00 43.42 H new ATOM 0 HD13 LEU A 110 -7.662 9.346 -0.271 1.00 43.42 H new ATOM 0 HD21 LEU A 110 -9.719 8.726 1.935 1.00 24.23 H new ATOM 0 HD22 LEU A 110 -9.838 10.122 0.837 1.00 24.23 H new ATOM 0 HD23 LEU A 110 -11.189 8.970 0.961 1.00 24.23 H new ATOM 1673 N SER A 111 -12.426 6.995 -1.672 1.00 62.42 N ATOM 1674 CA SER A 111 -13.436 6.091 -1.136 1.00 44.21 C ATOM 1675 C SER A 111 -13.783 5.003 -2.147 1.00 14.31 C ATOM 1676 O SER A 111 -14.100 3.873 -1.775 1.00 5.50 O ATOM 1677 CB SER A 111 -14.697 6.870 -0.754 1.00 61.23 C ATOM 1678 OG SER A 111 -14.385 7.956 0.101 1.00 2.05 O ATOM 0 H SER A 111 -12.734 7.963 -1.767 1.00 62.42 H new ATOM 0 HA SER A 111 -13.027 5.616 -0.244 1.00 44.21 H new ATOM 0 HB2 SER A 111 -15.186 7.241 -1.655 1.00 61.23 H new ATOM 0 HB3 SER A 111 -15.404 6.204 -0.259 1.00 61.23 H new ATOM 0 HG SER A 111 -14.011 8.692 -0.428 1.00 2.05 H new ATOM 1684 N GLU A 112 -13.722 5.353 -3.428 1.00 50.53 N ATOM 1685 CA GLU A 112 -14.030 4.407 -4.494 1.00 22.44 C ATOM 1686 C GLU A 112 -13.060 3.230 -4.475 1.00 43.13 C ATOM 1687 O GLU A 112 -13.470 2.074 -4.383 1.00 1.15 O ATOM 1688 CB GLU A 112 -13.978 5.104 -5.855 1.00 35.34 C ATOM 1689 CG GLU A 112 -13.904 4.141 -7.028 1.00 14.23 C ATOM 1690 CD GLU A 112 -14.207 4.812 -8.354 1.00 43.01 C ATOM 1691 OE1 GLU A 112 -13.935 6.025 -8.480 1.00 70.03 O ATOM 1692 OE2 GLU A 112 -14.715 4.127 -9.266 1.00 22.53 O ATOM 0 H GLU A 112 -13.462 6.284 -3.753 1.00 50.53 H new ATOM 0 HA GLU A 112 -15.038 4.027 -4.327 1.00 22.44 H new ATOM 0 HB2 GLU A 112 -14.862 5.732 -5.966 1.00 35.34 H new ATOM 0 HB3 GLU A 112 -13.112 5.765 -5.883 1.00 35.34 H new ATOM 0 HG2 GLU A 112 -12.909 3.699 -7.068 1.00 14.23 H new ATOM 0 HG3 GLU A 112 -14.609 3.325 -6.868 1.00 14.23 H new ATOM 1699 N ASN A 113 -11.768 3.534 -4.563 1.00 31.04 N ATOM 1700 CA ASN A 113 -10.738 2.502 -4.557 1.00 4.35 C ATOM 1701 C ASN A 113 -10.596 1.882 -3.170 1.00 5.33 C ATOM 1702 O ASN A 113 -10.360 0.681 -3.036 1.00 35.04 O ATOM 1703 CB ASN A 113 -9.398 3.089 -5.005 1.00 62.33 C ATOM 1704 CG ASN A 113 -9.375 3.414 -6.486 1.00 0.42 C ATOM 1705 OD1 ASN A 113 -9.033 2.570 -7.313 1.00 52.40 O ATOM 1706 ND2 ASN A 113 -9.740 4.645 -6.826 1.00 3.42 N ATOM 0 H ASN A 113 -11.411 4.486 -4.639 1.00 31.04 H new ATOM 0 HA ASN A 113 -11.037 1.720 -5.255 1.00 4.35 H new ATOM 0 HB2 ASN A 113 -9.192 3.994 -4.434 1.00 62.33 H new ATOM 0 HB3 ASN A 113 -8.601 2.381 -4.779 1.00 62.33 H new ATOM 0 HD21 ASN A 113 -9.744 4.923 -7.807 1.00 3.42 H new ATOM 0 HD22 ASN A 113 -10.016 5.312 -6.106 1.00 3.42 H new ATOM 1713 N LEU A 114 -10.743 2.710 -2.141 1.00 63.51 N ATOM 1714 CA LEU A 114 -10.633 2.243 -0.763 1.00 45.32 C ATOM 1715 C LEU A 114 -11.737 1.243 -0.436 1.00 44.40 C ATOM 1716 O LEU A 114 -11.482 0.190 0.147 1.00 21.22 O ATOM 1717 CB LEU A 114 -10.699 3.427 0.204 1.00 73.12 C ATOM 1718 CG LEU A 114 -10.898 3.079 1.679 1.00 34.44 C ATOM 1719 CD1 LEU A 114 -10.203 4.099 2.567 1.00 52.21 C ATOM 1720 CD2 LEU A 114 -12.382 3.000 2.013 1.00 45.44 C ATOM 0 H LEU A 114 -10.938 3.707 -2.235 1.00 63.51 H new ATOM 0 HA LEU A 114 -9.671 1.743 -0.651 1.00 45.32 H new ATOM 0 HB2 LEU A 114 -9.777 4.000 0.108 1.00 73.12 H new ATOM 0 HB3 LEU A 114 -11.514 4.080 -0.108 1.00 73.12 H new ATOM 0 HG LEU A 114 -10.452 2.102 1.866 1.00 34.44 H new ATOM 0 HD11 LEU A 114 -10.356 3.835 3.613 1.00 52.21 H new ATOM 0 HD12 LEU A 114 -9.136 4.106 2.347 1.00 52.21 H new ATOM 0 HD13 LEU A 114 -10.619 5.089 2.378 1.00 52.21 H new ATOM 0 HD21 LEU A 114 -12.505 2.751 3.067 1.00 45.44 H new ATOM 0 HD22 LEU A 114 -12.852 3.962 1.810 1.00 45.44 H new ATOM 0 HD23 LEU A 114 -12.852 2.230 1.401 1.00 45.44 H new ATOM 1732 N VAL A 115 -12.965 1.579 -0.819 1.00 45.44 N ATOM 1733 CA VAL A 115 -14.108 0.709 -0.570 1.00 4.33 C ATOM 1734 C VAL A 115 -13.991 -0.591 -1.358 1.00 40.40 C ATOM 1735 O VAL A 115 -14.230 -1.675 -0.826 1.00 64.13 O ATOM 1736 CB VAL A 115 -15.432 1.403 -0.940 1.00 30.13 C ATOM 1737 CG1 VAL A 115 -16.544 0.379 -1.109 1.00 70.32 C ATOM 1738 CG2 VAL A 115 -15.804 2.436 0.114 1.00 3.34 C ATOM 0 H VAL A 115 -13.193 2.447 -1.303 1.00 45.44 H new ATOM 0 HA VAL A 115 -14.109 0.485 0.497 1.00 4.33 H new ATOM 0 HB VAL A 115 -15.298 1.918 -1.891 1.00 30.13 H new ATOM 0 HG11 VAL A 115 -17.471 0.889 -1.370 1.00 70.32 H new ATOM 0 HG12 VAL A 115 -16.278 -0.319 -1.902 1.00 70.32 H new ATOM 0 HG13 VAL A 115 -16.681 -0.167 -0.176 1.00 70.32 H new ATOM 0 HG21 VAL A 115 -16.742 2.917 -0.163 1.00 3.34 H new ATOM 0 HG22 VAL A 115 -15.920 1.945 1.080 1.00 3.34 H new ATOM 0 HG23 VAL A 115 -15.017 3.187 0.181 1.00 3.34 H new ATOM 1748 N ARG A 116 -13.623 -0.475 -2.630 1.00 64.52 N ATOM 1749 CA ARG A 116 -13.474 -1.641 -3.492 1.00 3.53 C ATOM 1750 C ARG A 116 -12.469 -2.627 -2.904 1.00 74.12 C ATOM 1751 O ARG A 116 -12.744 -3.822 -2.805 1.00 54.52 O ATOM 1752 CB ARG A 116 -13.028 -1.214 -4.891 1.00 64.34 C ATOM 1753 CG ARG A 116 -12.505 -2.361 -5.741 1.00 71.43 C ATOM 1754 CD ARG A 116 -12.086 -1.885 -7.123 1.00 71.32 C ATOM 1755 NE ARG A 116 -11.731 -2.997 -8.001 1.00 31.33 N ATOM 1756 CZ ARG A 116 -12.619 -3.849 -8.502 1.00 34.34 C ATOM 1757 NH1 ARG A 116 -13.907 -3.716 -8.214 1.00 40.40 N ATOM 1758 NH2 ARG A 116 -12.220 -4.836 -9.293 1.00 42.45 N ATOM 0 H ARG A 116 -13.423 0.415 -3.086 1.00 64.52 H new ATOM 0 HA ARG A 116 -14.443 -2.136 -3.563 1.00 3.53 H new ATOM 0 HB2 ARG A 116 -13.869 -0.747 -5.404 1.00 64.34 H new ATOM 0 HB3 ARG A 116 -12.249 -0.457 -4.799 1.00 64.34 H new ATOM 0 HG2 ARG A 116 -11.655 -2.827 -5.242 1.00 71.43 H new ATOM 0 HG3 ARG A 116 -13.276 -3.125 -5.837 1.00 71.43 H new ATOM 0 HD2 ARG A 116 -12.899 -1.314 -7.572 1.00 71.32 H new ATOM 0 HD3 ARG A 116 -11.235 -1.210 -7.031 1.00 71.32 H new ATOM 0 HE ARG A 116 -10.749 -3.126 -8.243 1.00 31.33 H new ATOM 0 HH11 ARG A 116 -14.218 -2.958 -7.606 1.00 40.40 H new ATOM 0 HH12 ARG A 116 -14.586 -4.372 -8.600 1.00 40.40 H new ATOM 0 HH21 ARG A 116 -11.231 -4.942 -9.517 1.00 42.45 H new ATOM 0 HH22 ARG A 116 -12.903 -5.489 -9.677 1.00 42.45 H new ATOM 1772 N GLU A 117 -11.304 -2.117 -2.517 1.00 31.44 N ATOM 1773 CA GLU A 117 -10.259 -2.954 -1.941 1.00 73.11 C ATOM 1774 C GLU A 117 -10.656 -3.442 -0.551 1.00 71.30 C ATOM 1775 O GLU A 117 -10.471 -4.611 -0.215 1.00 74.13 O ATOM 1776 CB GLU A 117 -8.940 -2.182 -1.864 1.00 10.14 C ATOM 1777 CG GLU A 117 -7.835 -2.778 -2.720 1.00 50.20 C ATOM 1778 CD GLU A 117 -8.306 -3.136 -4.116 1.00 25.34 C ATOM 1779 OE1 GLU A 117 -8.738 -2.221 -4.849 1.00 63.20 O ATOM 1780 OE2 GLU A 117 -8.245 -4.329 -4.475 1.00 54.45 O ATOM 0 H GLU A 117 -11.061 -1.129 -2.592 1.00 31.44 H new ATOM 0 HA GLU A 117 -10.127 -3.821 -2.588 1.00 73.11 H new ATOM 0 HB2 GLU A 117 -9.113 -1.152 -2.175 1.00 10.14 H new ATOM 0 HB3 GLU A 117 -8.607 -2.150 -0.826 1.00 10.14 H new ATOM 0 HG2 GLU A 117 -7.012 -2.067 -2.790 1.00 50.20 H new ATOM 0 HG3 GLU A 117 -7.445 -3.671 -2.232 1.00 50.20 H new ATOM 1787 N MET A 118 -11.203 -2.536 0.254 1.00 10.11 N ATOM 1788 CA MET A 118 -11.627 -2.874 1.608 1.00 1.21 C ATOM 1789 C MET A 118 -12.580 -4.065 1.597 1.00 21.32 C ATOM 1790 O MET A 118 -12.451 -4.980 2.411 1.00 15.52 O ATOM 1791 CB MET A 118 -12.303 -1.670 2.268 1.00 32.22 C ATOM 1792 CG MET A 118 -11.332 -0.740 2.976 1.00 4.21 C ATOM 1793 SD MET A 118 -11.720 -0.531 4.724 1.00 64.12 S ATOM 1794 CE MET A 118 -12.973 0.746 4.644 1.00 55.44 C ATOM 0 H MET A 118 -11.363 -1.563 -0.008 1.00 10.11 H new ATOM 0 HA MET A 118 -10.742 -3.145 2.183 1.00 1.21 H new ATOM 0 HB2 MET A 118 -12.845 -1.106 1.508 1.00 32.22 H new ATOM 0 HB3 MET A 118 -13.041 -2.027 2.987 1.00 32.22 H new ATOM 0 HG2 MET A 118 -10.320 -1.134 2.877 1.00 4.21 H new ATOM 0 HG3 MET A 118 -11.345 0.234 2.486 1.00 4.21 H new ATOM 0 HE1 MET A 118 -13.820 0.465 5.271 1.00 55.44 H new ATOM 0 HE2 MET A 118 -12.556 1.688 4.999 1.00 55.44 H new ATOM 0 HE3 MET A 118 -13.308 0.863 3.613 1.00 55.44 H new ATOM 1804 N ALA A 119 -13.534 -4.046 0.674 1.00 14.32 N ATOM 1805 CA ALA A 119 -14.507 -5.125 0.557 1.00 74.51 C ATOM 1806 C ALA A 119 -13.846 -6.409 0.066 1.00 40.21 C ATOM 1807 O ALA A 119 -14.234 -7.508 0.459 1.00 63.21 O ATOM 1808 CB ALA A 119 -15.637 -4.720 -0.377 1.00 44.45 C ATOM 0 H ALA A 119 -13.655 -3.294 -0.005 1.00 14.32 H new ATOM 0 HA ALA A 119 -14.921 -5.316 1.547 1.00 74.51 H new ATOM 0 HB1 ALA A 119 -16.355 -5.536 -0.454 1.00 44.45 H new ATOM 0 HB2 ALA A 119 -16.135 -3.834 0.017 1.00 44.45 H new ATOM 0 HB3 ALA A 119 -15.231 -4.499 -1.364 1.00 44.45 H new ATOM 1814 N ASN A 120 -12.847 -6.262 -0.798 1.00 45.21 N ATOM 1815 CA ASN A 120 -12.133 -7.410 -1.344 1.00 42.43 C ATOM 1816 C ASN A 120 -11.315 -8.107 -0.262 1.00 70.12 C ATOM 1817 O ASN A 120 -11.077 -9.314 -0.328 1.00 25.52 O ATOM 1818 CB ASN A 120 -11.217 -6.970 -2.488 1.00 3.53 C ATOM 1819 CG ASN A 120 -11.989 -6.619 -3.745 1.00 1.21 C ATOM 1820 OD1 ASN A 120 -13.009 -7.236 -4.053 1.00 43.44 O ATOM 1821 ND2 ASN A 120 -11.506 -5.622 -4.478 1.00 72.23 N ATOM 0 H ASN A 120 -12.514 -5.359 -1.135 1.00 45.21 H new ATOM 0 HA ASN A 120 -12.870 -8.115 -1.728 1.00 42.43 H new ATOM 0 HB2 ASN A 120 -10.633 -6.106 -2.170 1.00 3.53 H new ATOM 0 HB3 ASN A 120 -10.509 -7.769 -2.711 1.00 3.53 H new ATOM 0 HD21 ASN A 120 -11.984 -5.340 -5.334 1.00 72.23 H new ATOM 0 HD22 ASN A 120 -10.657 -5.138 -4.185 1.00 72.23 H new ATOM 1828 N THR A 121 -10.885 -7.339 0.735 1.00 34.00 N ATOM 1829 CA THR A 121 -10.094 -7.882 1.832 1.00 51.34 C ATOM 1830 C THR A 121 -10.984 -8.316 2.990 1.00 65.50 C ATOM 1831 O THR A 121 -10.713 -9.317 3.652 1.00 33.21 O ATOM 1832 CB THR A 121 -9.066 -6.855 2.344 1.00 11.12 C ATOM 1833 OG1 THR A 121 -8.666 -5.988 1.277 1.00 61.42 O ATOM 1834 CG2 THR A 121 -7.844 -7.555 2.921 1.00 25.05 C ATOM 0 H THR A 121 -11.072 -6.339 0.805 1.00 34.00 H new ATOM 0 HA THR A 121 -9.565 -8.751 1.441 1.00 51.34 H new ATOM 0 HB THR A 121 -9.535 -6.267 3.133 1.00 11.12 H new ATOM 0 HG1 THR A 121 -9.439 -5.469 0.970 1.00 61.42 H new ATOM 0 HG21 THR A 121 -7.132 -6.810 3.276 1.00 25.05 H new ATOM 0 HG22 THR A 121 -8.148 -8.192 3.752 1.00 25.05 H new ATOM 0 HG23 THR A 121 -7.376 -8.165 2.149 1.00 25.05 H new ATOM 1842 N ALA A 122 -12.046 -7.555 3.231 1.00 3.24 N ATOM 1843 CA ALA A 122 -12.977 -7.862 4.309 1.00 20.34 C ATOM 1844 C ALA A 122 -13.630 -9.224 4.100 1.00 55.15 C ATOM 1845 O ALA A 122 -13.842 -9.975 5.052 1.00 61.20 O ATOM 1846 CB ALA A 122 -14.040 -6.777 4.415 1.00 72.24 C ATOM 0 H ALA A 122 -12.283 -6.721 2.694 1.00 3.24 H new ATOM 0 HA ALA A 122 -12.414 -7.897 5.242 1.00 20.34 H new ATOM 0 HB1 ALA A 122 -14.728 -7.020 5.224 1.00 72.24 H new ATOM 0 HB2 ALA A 122 -13.563 -5.819 4.620 1.00 72.24 H new ATOM 0 HB3 ALA A 122 -14.591 -6.715 3.477 1.00 72.24 H new ATOM 1852 N ARG A 123 -13.946 -9.538 2.848 1.00 1.20 N ATOM 1853 CA ARG A 123 -14.575 -10.810 2.514 1.00 52.43 C ATOM 1854 C ARG A 123 -13.729 -11.981 3.004 1.00 61.04 C ATOM 1855 O ARG A 123 -14.256 -13.034 3.362 1.00 34.24 O ATOM 1856 CB ARG A 123 -14.787 -10.917 1.002 1.00 73.34 C ATOM 1857 CG ARG A 123 -13.542 -10.602 0.189 1.00 32.04 C ATOM 1858 CD ARG A 123 -13.799 -10.751 -1.303 1.00 21.40 C ATOM 1859 NE ARG A 123 -14.222 -12.105 -1.652 1.00 45.41 N ATOM 1860 CZ ARG A 123 -14.661 -12.449 -2.858 1.00 5.22 C ATOM 1861 NH1 ARG A 123 -14.733 -11.543 -3.824 1.00 34.44 N ATOM 1862 NH2 ARG A 123 -15.028 -13.701 -3.099 1.00 43.10 N ATOM 0 H ARG A 123 -13.777 -8.929 2.048 1.00 1.20 H new ATOM 0 HA ARG A 123 -15.543 -10.850 3.014 1.00 52.43 H new ATOM 0 HB2 ARG A 123 -15.122 -11.926 0.761 1.00 73.34 H new ATOM 0 HB3 ARG A 123 -15.586 -10.236 0.706 1.00 73.34 H new ATOM 0 HG2 ARG A 123 -13.214 -9.585 0.403 1.00 32.04 H new ATOM 0 HG3 ARG A 123 -12.732 -11.268 0.488 1.00 32.04 H new ATOM 0 HD2 ARG A 123 -14.566 -10.041 -1.612 1.00 21.40 H new ATOM 0 HD3 ARG A 123 -12.892 -10.501 -1.854 1.00 21.40 H new ATOM 0 HE ARG A 123 -14.178 -12.825 -0.931 1.00 45.41 H new ATOM 0 HH11 ARG A 123 -14.451 -10.580 -3.642 1.00 34.44 H new ATOM 0 HH12 ARG A 123 -15.070 -11.809 -4.749 1.00 34.44 H new ATOM 0 HH21 ARG A 123 -14.973 -14.400 -2.358 1.00 43.10 H new ATOM 0 HH22 ARG A 123 -15.365 -13.964 -4.025 1.00 43.10 H new ATOM 1876 N ARG A 124 -12.413 -11.789 3.016 1.00 14.22 N ATOM 1877 CA ARG A 124 -11.494 -12.830 3.461 1.00 0.34 C ATOM 1878 C ARG A 124 -11.456 -12.907 4.984 1.00 64.44 C ATOM 1879 O ARG A 124 -10.883 -13.835 5.554 1.00 61.12 O ATOM 1880 CB ARG A 124 -10.089 -12.564 2.917 1.00 30.23 C ATOM 1881 CG ARG A 124 -10.073 -12.107 1.468 1.00 43.13 C ATOM 1882 CD ARG A 124 -8.692 -11.622 1.052 1.00 13.01 C ATOM 1883 NE ARG A 124 -8.685 -11.096 -0.310 1.00 53.20 N ATOM 1884 CZ ARG A 124 -7.592 -10.651 -0.921 1.00 21.54 C ATOM 1885 NH1 ARG A 124 -6.425 -10.668 -0.292 1.00 61.22 N ATOM 1886 NH2 ARG A 124 -7.665 -10.187 -2.162 1.00 34.43 N ATOM 0 H ARG A 124 -11.960 -10.923 2.723 1.00 14.22 H new ATOM 0 HA ARG A 124 -11.851 -13.785 3.076 1.00 0.34 H new ATOM 0 HB2 ARG A 124 -9.608 -11.805 3.534 1.00 30.23 H new ATOM 0 HB3 ARG A 124 -9.495 -13.473 3.009 1.00 30.23 H new ATOM 0 HG2 ARG A 124 -10.381 -12.930 0.822 1.00 43.13 H new ATOM 0 HG3 ARG A 124 -10.798 -11.305 1.330 1.00 43.13 H new ATOM 0 HD2 ARG A 124 -8.357 -10.847 1.742 1.00 13.01 H new ATOM 0 HD3 ARG A 124 -7.981 -12.445 1.127 1.00 13.01 H new ATOM 0 HE ARG A 124 -9.568 -11.069 -0.821 1.00 53.20 H new ATOM 0 HH11 ARG A 124 -6.365 -11.023 0.662 1.00 61.22 H new ATOM 0 HH12 ARG A 124 -5.587 -10.326 -0.762 1.00 61.22 H new ATOM 0 HH21 ARG A 124 -8.561 -10.171 -2.649 1.00 34.43 H new ATOM 0 HH22 ARG A 124 -6.825 -9.846 -2.629 1.00 34.43 H new ATOM 1900 N TYR A 125 -12.069 -11.925 5.636 1.00 61.45 N ATOM 1901 CA TYR A 125 -12.101 -11.880 7.093 1.00 61.21 C ATOM 1902 C TYR A 125 -13.503 -12.179 7.616 1.00 74.14 C ATOM 1903 O TYR A 125 -13.914 -11.662 8.654 1.00 72.42 O ATOM 1904 CB TYR A 125 -11.641 -10.510 7.593 1.00 11.02 C ATOM 1905 CG TYR A 125 -10.186 -10.217 7.302 1.00 42.23 C ATOM 1906 CD1 TYR A 125 -9.174 -10.915 7.948 1.00 74.11 C ATOM 1907 CD2 TYR A 125 -9.824 -9.241 6.381 1.00 54.33 C ATOM 1908 CE1 TYR A 125 -7.844 -10.650 7.686 1.00 23.43 C ATOM 1909 CE2 TYR A 125 -8.497 -8.971 6.111 1.00 1.10 C ATOM 1910 CZ TYR A 125 -7.511 -9.678 6.767 1.00 65.03 C ATOM 1911 OH TYR A 125 -6.186 -9.411 6.503 1.00 34.10 O ATOM 0 H TYR A 125 -12.550 -11.150 5.179 1.00 61.45 H new ATOM 0 HA TYR A 125 -11.421 -12.644 7.469 1.00 61.21 H new ATOM 0 HB2 TYR A 125 -12.258 -9.738 7.132 1.00 11.02 H new ATOM 0 HB3 TYR A 125 -11.807 -10.450 8.669 1.00 11.02 H new ATOM 0 HD1 TYR A 125 -9.431 -11.678 8.668 1.00 74.11 H new ATOM 0 HD2 TYR A 125 -10.594 -8.684 5.868 1.00 54.33 H new ATOM 0 HE1 TYR A 125 -7.069 -11.201 8.198 1.00 23.43 H new ATOM 0 HE2 TYR A 125 -8.233 -8.211 5.391 1.00 1.10 H new ATOM 0 HH TYR A 125 -6.123 -8.700 5.831 1.00 34.10 H new ATOM 1921 N ARG A 126 -14.232 -13.019 6.888 1.00 40.15 N ATOM 1922 CA ARG A 126 -15.588 -13.387 7.276 1.00 54.41 C ATOM 1923 C ARG A 126 -16.568 -12.260 6.965 1.00 72.12 C ATOM 1924 O ARG A 126 -17.754 -12.349 7.284 1.00 44.51 O ATOM 1925 CB ARG A 126 -15.639 -13.727 8.766 1.00 35.24 C ATOM 1926 CG ARG A 126 -16.711 -14.746 9.123 1.00 42.32 C ATOM 1927 CD ARG A 126 -17.794 -14.133 9.997 1.00 60.33 C ATOM 1928 NE ARG A 126 -17.263 -13.656 11.272 1.00 55.24 N ATOM 1929 CZ ARG A 126 -18.022 -13.172 12.248 1.00 63.02 C ATOM 1930 NH1 ARG A 126 -19.337 -13.101 12.098 1.00 42.21 N ATOM 1931 NH2 ARG A 126 -17.465 -12.758 13.379 1.00 20.20 N ATOM 0 H ARG A 126 -13.906 -13.457 6.027 1.00 40.15 H new ATOM 0 HA ARG A 126 -15.879 -14.265 6.700 1.00 54.41 H new ATOM 0 HB2 ARG A 126 -14.667 -14.111 9.076 1.00 35.24 H new ATOM 0 HB3 ARG A 126 -15.816 -12.813 9.333 1.00 35.24 H new ATOM 0 HG2 ARG A 126 -17.158 -15.140 8.210 1.00 42.32 H new ATOM 0 HG3 ARG A 126 -16.255 -15.588 9.644 1.00 42.32 H new ATOM 0 HD2 ARG A 126 -18.262 -13.304 9.466 1.00 60.33 H new ATOM 0 HD3 ARG A 126 -18.572 -14.873 10.182 1.00 60.33 H new ATOM 0 HE ARG A 126 -16.255 -13.697 11.420 1.00 55.24 H new ATOM 0 HH11 ARG A 126 -19.769 -13.419 11.230 1.00 42.21 H new ATOM 0 HH12 ARG A 126 -19.917 -12.729 12.850 1.00 42.21 H new ATOM 0 HH21 ARG A 126 -16.453 -12.812 13.499 1.00 20.20 H new ATOM 0 HH22 ARG A 126 -18.048 -12.386 14.129 1.00 20.20 H new ATOM 2041 N VAL A 134 -20.946 -3.298 -3.113 1.00 55.54 N ATOM 2042 CA VAL A 134 -19.753 -2.462 -3.183 1.00 33.23 C ATOM 2043 C VAL A 134 -19.906 -1.373 -4.238 1.00 2.22 C ATOM 2044 O VAL A 134 -19.587 -0.210 -3.994 1.00 70.42 O ATOM 2045 CB VAL A 134 -18.500 -3.298 -3.500 1.00 43.45 C ATOM 2046 CG1 VAL A 134 -17.245 -2.448 -3.374 1.00 10.50 C ATOM 2047 CG2 VAL A 134 -18.424 -4.513 -2.588 1.00 14.20 C ATOM 0 HA VAL A 134 -19.633 -1.999 -2.203 1.00 33.23 H new ATOM 0 HB VAL A 134 -18.571 -3.649 -4.529 1.00 43.45 H new ATOM 0 HG11 VAL A 134 -16.369 -3.056 -3.602 1.00 10.50 H new ATOM 0 HG12 VAL A 134 -17.299 -1.613 -4.073 1.00 10.50 H new ATOM 0 HG13 VAL A 134 -17.166 -2.065 -2.357 1.00 10.50 H new ATOM 0 HG21 VAL A 134 -17.532 -5.092 -2.827 1.00 14.20 H new ATOM 0 HG22 VAL A 134 -18.377 -4.186 -1.549 1.00 14.20 H new ATOM 0 HG23 VAL A 134 -19.309 -5.133 -2.734 1.00 14.20 H new ATOM 2057 N GLN A 135 -20.397 -1.759 -5.412 1.00 31.54 N ATOM 2058 CA GLN A 135 -20.593 -0.814 -6.505 1.00 54.24 C ATOM 2059 C GLN A 135 -21.481 0.346 -6.070 1.00 2.31 C ATOM 2060 O GLN A 135 -21.248 1.494 -6.447 1.00 4.42 O ATOM 2061 CB GLN A 135 -21.211 -1.520 -7.713 1.00 32.41 C ATOM 2062 CG GLN A 135 -22.513 -2.238 -7.397 1.00 72.23 C ATOM 2063 CD GLN A 135 -23.731 -1.369 -7.634 1.00 22.13 C ATOM 2064 OE1 GLN A 135 -24.559 -1.182 -6.742 1.00 34.54 O ATOM 2065 NE2 GLN A 135 -23.848 -0.829 -8.842 1.00 31.40 N ATOM 0 H GLN A 135 -20.666 -2.718 -5.630 1.00 31.54 H new ATOM 0 HA GLN A 135 -19.618 -0.415 -6.786 1.00 54.24 H new ATOM 0 HB2 GLN A 135 -21.392 -0.787 -8.499 1.00 32.41 H new ATOM 0 HB3 GLN A 135 -20.495 -2.241 -8.108 1.00 32.41 H new ATOM 0 HG2 GLN A 135 -22.587 -3.135 -8.011 1.00 72.23 H new ATOM 0 HG3 GLN A 135 -22.501 -2.564 -6.357 1.00 72.23 H new ATOM 0 HE21 GLN A 135 -23.139 -1.010 -9.552 1.00 31.40 H new ATOM 0 HE22 GLN A 135 -24.647 -0.233 -9.059 1.00 31.40 H new ATOM 2074 N ALA A 136 -22.500 0.040 -5.274 1.00 60.34 N ATOM 2075 CA ALA A 136 -23.422 1.057 -4.786 1.00 51.42 C ATOM 2076 C ALA A 136 -22.722 2.023 -3.837 1.00 24.53 C ATOM 2077 O ALA A 136 -23.032 3.214 -3.806 1.00 14.51 O ATOM 2078 CB ALA A 136 -24.611 0.405 -4.097 1.00 53.31 C ATOM 0 H ALA A 136 -22.708 -0.906 -4.953 1.00 60.34 H new ATOM 0 HA ALA A 136 -23.781 1.627 -5.643 1.00 51.42 H new ATOM 0 HB1 ALA A 136 -25.291 1.177 -3.737 1.00 53.31 H new ATOM 0 HB2 ALA A 136 -25.134 -0.239 -4.805 1.00 53.31 H new ATOM 0 HB3 ALA A 136 -24.261 -0.191 -3.254 1.00 53.31 H new ATOM 2084 N ASP A 137 -21.777 1.502 -3.063 1.00 64.54 N ATOM 2085 CA ASP A 137 -21.031 2.318 -2.111 1.00 44.11 C ATOM 2086 C ASP A 137 -20.113 3.297 -2.837 1.00 11.11 C ATOM 2087 O ASP A 137 -19.940 4.438 -2.407 1.00 73.13 O ATOM 2088 CB ASP A 137 -20.210 1.429 -1.176 1.00 35.22 C ATOM 2089 CG ASP A 137 -21.030 0.899 -0.015 1.00 22.11 C ATOM 2090 OD1 ASP A 137 -22.193 1.327 0.134 1.00 54.31 O ATOM 2091 OD2 ASP A 137 -20.506 0.058 0.746 1.00 2.10 O ATOM 0 H ASP A 137 -21.509 0.518 -3.076 1.00 64.54 H new ATOM 0 HA ASP A 137 -21.748 2.888 -1.520 1.00 44.11 H new ATOM 0 HB2 ASP A 137 -19.802 0.591 -1.741 1.00 35.22 H new ATOM 0 HB3 ASP A 137 -19.363 1.996 -0.790 1.00 35.22 H new ATOM 2096 N VAL A 138 -19.527 2.844 -3.940 1.00 53.13 N ATOM 2097 CA VAL A 138 -18.626 3.679 -4.726 1.00 35.13 C ATOM 2098 C VAL A 138 -19.386 4.806 -5.416 1.00 45.43 C ATOM 2099 O VAL A 138 -18.913 5.942 -5.475 1.00 54.15 O ATOM 2100 CB VAL A 138 -17.878 2.852 -5.788 1.00 11.24 C ATOM 2101 CG1 VAL A 138 -17.163 3.767 -6.771 1.00 25.41 C ATOM 2102 CG2 VAL A 138 -16.897 1.897 -5.126 1.00 62.54 C ATOM 0 H VAL A 138 -19.660 1.903 -4.310 1.00 53.13 H new ATOM 0 HA VAL A 138 -17.901 4.105 -4.032 1.00 35.13 H new ATOM 0 HB VAL A 138 -18.607 2.261 -6.343 1.00 11.24 H new ATOM 0 HG11 VAL A 138 -16.640 3.165 -7.514 1.00 25.41 H new ATOM 0 HG12 VAL A 138 -17.892 4.406 -7.269 1.00 25.41 H new ATOM 0 HG13 VAL A 138 -16.444 4.386 -6.235 1.00 25.41 H new ATOM 0 HG21 VAL A 138 -16.377 1.321 -5.892 1.00 62.54 H new ATOM 0 HG22 VAL A 138 -16.171 2.466 -4.545 1.00 62.54 H new ATOM 0 HG23 VAL A 138 -17.438 1.219 -4.466 1.00 62.54 H new ATOM 2112 N SER A 139 -20.564 4.485 -5.937 1.00 12.34 N ATOM 2113 CA SER A 139 -21.389 5.470 -6.628 1.00 5.02 C ATOM 2114 C SER A 139 -21.945 6.498 -5.646 1.00 1.11 C ATOM 2115 O SER A 139 -22.155 7.659 -5.997 1.00 44.12 O ATOM 2116 CB SER A 139 -22.537 4.780 -7.365 1.00 15.22 C ATOM 2117 OG SER A 139 -22.084 3.622 -8.045 1.00 41.25 O ATOM 0 H SER A 139 -20.970 3.550 -5.894 1.00 12.34 H new ATOM 0 HA SER A 139 -20.761 5.988 -7.353 1.00 5.02 H new ATOM 0 HB2 SER A 139 -23.317 4.506 -6.655 1.00 15.22 H new ATOM 0 HB3 SER A 139 -22.984 5.473 -8.078 1.00 15.22 H new ATOM 0 HG SER A 139 -21.952 2.895 -7.401 1.00 41.25 H new ATOM 2123 N LEU A 140 -22.181 6.061 -4.414 1.00 34.51 N ATOM 2124 CA LEU A 140 -22.714 6.941 -3.379 1.00 65.40 C ATOM 2125 C LEU A 140 -21.666 7.959 -2.938 1.00 75.14 C ATOM 2126 O LEU A 140 -21.935 9.159 -2.884 1.00 74.24 O ATOM 2127 CB LEU A 140 -23.182 6.120 -2.176 1.00 42.03 C ATOM 2128 CG LEU A 140 -23.425 6.902 -0.884 1.00 53.44 C ATOM 2129 CD1 LEU A 140 -24.616 6.331 -0.132 1.00 20.55 C ATOM 2130 CD2 LEU A 140 -22.181 6.885 -0.009 1.00 21.43 C ATOM 0 H LEU A 140 -22.012 5.103 -4.107 1.00 34.51 H new ATOM 0 HA LEU A 140 -23.565 7.480 -3.796 1.00 65.40 H new ATOM 0 HB2 LEU A 140 -24.106 5.609 -2.447 1.00 42.03 H new ATOM 0 HB3 LEU A 140 -22.438 5.349 -1.976 1.00 42.03 H new ATOM 0 HG LEU A 140 -23.648 7.937 -1.144 1.00 53.44 H new ATOM 0 HD11 LEU A 140 -24.774 6.899 0.784 1.00 20.55 H new ATOM 0 HD12 LEU A 140 -25.506 6.396 -0.757 1.00 20.55 H new ATOM 0 HD13 LEU A 140 -24.423 5.288 0.117 1.00 20.55 H new ATOM 0 HD21 LEU A 140 -22.372 7.446 0.906 1.00 21.43 H new ATOM 0 HD22 LEU A 140 -21.927 5.855 0.243 1.00 21.43 H new ATOM 0 HD23 LEU A 140 -21.351 7.341 -0.548 1.00 21.43 H new ATOM 2142 N VAL A 141 -20.470 7.471 -2.626 1.00 72.34 N ATOM 2143 CA VAL A 141 -19.380 8.338 -2.193 1.00 52.51 C ATOM 2144 C VAL A 141 -18.960 9.289 -3.307 1.00 4.10 C ATOM 2145 O VAL A 141 -18.654 10.457 -3.060 1.00 60.13 O ATOM 2146 CB VAL A 141 -18.155 7.519 -1.744 1.00 74.25 C ATOM 2147 CG1 VAL A 141 -18.483 6.707 -0.499 1.00 53.53 C ATOM 2148 CG2 VAL A 141 -17.678 6.614 -2.870 1.00 70.01 C ATOM 0 H VAL A 141 -20.231 6.480 -2.665 1.00 72.34 H new ATOM 0 HA VAL A 141 -19.752 8.915 -1.346 1.00 52.51 H new ATOM 0 HB VAL A 141 -17.348 8.209 -1.497 1.00 74.25 H new ATOM 0 HG11 VAL A 141 -17.606 6.135 -0.196 1.00 53.53 H new ATOM 0 HG12 VAL A 141 -18.774 7.380 0.308 1.00 53.53 H new ATOM 0 HG13 VAL A 141 -19.305 6.024 -0.716 1.00 53.53 H new ATOM 0 HG21 VAL A 141 -16.812 6.043 -2.536 1.00 70.01 H new ATOM 0 HG22 VAL A 141 -18.478 5.929 -3.150 1.00 70.01 H new ATOM 0 HG23 VAL A 141 -17.401 7.221 -3.732 1.00 70.01 H new ATOM 2158 N THR A 142 -18.948 8.784 -4.537 1.00 64.33 N ATOM 2159 CA THR A 142 -18.564 9.589 -5.690 1.00 3.21 C ATOM 2160 C THR A 142 -19.617 10.648 -5.995 1.00 50.40 C ATOM 2161 O THR A 142 -19.291 11.813 -6.227 1.00 64.14 O ATOM 2162 CB THR A 142 -18.355 8.715 -6.941 1.00 52.14 C ATOM 2163 OG1 THR A 142 -19.483 7.853 -7.132 1.00 24.51 O ATOM 2164 CG2 THR A 142 -17.090 7.880 -6.812 1.00 62.44 C ATOM 0 H THR A 142 -19.200 7.821 -4.760 1.00 64.33 H new ATOM 0 HA THR A 142 -17.623 10.077 -5.436 1.00 3.21 H new ATOM 0 HB THR A 142 -18.252 9.374 -7.803 1.00 52.14 H new ATOM 0 HG1 THR A 142 -19.309 6.988 -6.706 1.00 24.51 H new ATOM 0 HG21 THR A 142 -16.963 7.271 -7.707 1.00 62.44 H new ATOM 0 HG22 THR A 142 -16.229 8.539 -6.696 1.00 62.44 H new ATOM 0 HG23 THR A 142 -17.170 7.231 -5.940 1.00 62.44 H new ATOM 2172 N SER A 143 -20.881 10.238 -5.994 1.00 63.23 N ATOM 2173 CA SER A 143 -21.982 11.152 -6.273 1.00 11.34 C ATOM 2174 C SER A 143 -22.021 12.284 -5.252 1.00 65.30 C ATOM 2175 O SER A 143 -22.331 13.427 -5.587 1.00 73.30 O ATOM 2176 CB SER A 143 -23.313 10.398 -6.267 1.00 2.40 C ATOM 2177 OG SER A 143 -23.555 9.779 -7.519 1.00 42.34 O ATOM 0 H SER A 143 -21.168 9.278 -5.803 1.00 63.23 H new ATOM 0 HA SER A 143 -21.822 11.583 -7.261 1.00 11.34 H new ATOM 0 HB2 SER A 143 -23.303 9.643 -5.481 1.00 2.40 H new ATOM 0 HB3 SER A 143 -24.124 11.088 -6.036 1.00 2.40 H new ATOM 0 HG SER A 143 -23.169 8.878 -7.518 1.00 42.34 H new ATOM 2183 N MET A 144 -21.704 11.958 -4.004 1.00 62.42 N ATOM 2184 CA MET A 144 -21.702 12.947 -2.932 1.00 64.34 C ATOM 2185 C MET A 144 -20.573 13.955 -3.126 1.00 21.34 C ATOM 2186 O MET A 144 -20.795 15.166 -3.088 1.00 33.05 O ATOM 2187 CB MET A 144 -21.558 12.258 -1.573 1.00 13.21 C ATOM 2188 CG MET A 144 -22.747 11.385 -1.206 1.00 74.30 C ATOM 2189 SD MET A 144 -23.714 12.064 0.156 1.00 25.11 S ATOM 2190 CE MET A 144 -22.805 11.430 1.565 1.00 51.30 C ATOM 0 H MET A 144 -21.445 11.016 -3.709 1.00 62.42 H new ATOM 0 HA MET A 144 -22.652 13.481 -2.961 1.00 64.34 H new ATOM 0 HB2 MET A 144 -20.656 11.646 -1.579 1.00 13.21 H new ATOM 0 HB3 MET A 144 -21.423 13.017 -0.802 1.00 13.21 H new ATOM 0 HG2 MET A 144 -23.389 11.267 -2.079 1.00 74.30 H new ATOM 0 HG3 MET A 144 -22.393 10.391 -0.934 1.00 74.30 H new ATOM 0 HE1 MET A 144 -23.282 11.765 2.486 1.00 51.30 H new ATOM 0 HE2 MET A 144 -22.800 10.340 1.534 1.00 51.30 H new ATOM 0 HE3 MET A 144 -21.780 11.798 1.532 1.00 51.30 H new ATOM 2200 N THR A 145 -19.362 13.448 -3.332 1.00 43.11 N ATOM 2201 CA THR A 145 -18.199 14.305 -3.530 1.00 31.00 C ATOM 2202 C THR A 145 -18.317 15.101 -4.824 1.00 54.44 C ATOM 2203 O THR A 145 -17.777 16.201 -4.939 1.00 41.11 O ATOM 2204 CB THR A 145 -16.897 13.484 -3.561 1.00 45.43 C ATOM 2205 OG1 THR A 145 -17.127 12.223 -4.200 1.00 44.10 O ATOM 2206 CG2 THR A 145 -16.366 13.257 -2.154 1.00 71.02 C ATOM 0 H THR A 145 -19.161 12.449 -3.366 1.00 43.11 H new ATOM 0 HA THR A 145 -18.165 14.994 -2.686 1.00 31.00 H new ATOM 0 HB THR A 145 -16.153 14.046 -4.126 1.00 45.43 H new ATOM 0 HG1 THR A 145 -17.466 11.580 -3.543 1.00 44.10 H new ATOM 0 HG21 THR A 145 -15.446 12.675 -2.202 1.00 71.02 H new ATOM 0 HG22 THR A 145 -16.163 14.218 -1.682 1.00 71.02 H new ATOM 0 HG23 THR A 145 -17.108 12.715 -1.568 1.00 71.02 H new ATOM 2214 N SER A 146 -19.025 14.538 -5.798 1.00 30.13 N ATOM 2215 CA SER A 146 -19.211 15.195 -7.087 1.00 73.44 C ATOM 2216 C SER A 146 -19.694 16.630 -6.901 1.00 54.00 C ATOM 2217 O SER A 146 -19.315 17.528 -7.653 1.00 1.10 O ATOM 2218 CB SER A 146 -20.212 14.414 -7.942 1.00 24.41 C ATOM 2219 OG SER A 146 -20.236 14.901 -9.272 1.00 60.31 O ATOM 0 H SER A 146 -19.479 13.628 -5.719 1.00 30.13 H new ATOM 0 HA SER A 146 -18.248 15.218 -7.598 1.00 73.44 H new ATOM 0 HB2 SER A 146 -19.947 13.357 -7.943 1.00 24.41 H new ATOM 0 HB3 SER A 146 -21.207 14.492 -7.505 1.00 24.41 H new ATOM 0 HG SER A 146 -20.882 14.385 -9.798 1.00 60.31 H new ATOM 2225 N THR A 147 -20.537 16.838 -5.893 1.00 64.35 N ATOM 2226 CA THR A 147 -21.073 18.163 -5.607 1.00 53.45 C ATOM 2227 C THR A 147 -20.501 18.719 -4.309 1.00 60.11 C ATOM 2228 O THR A 147 -21.243 19.160 -3.431 1.00 40.23 O ATOM 2229 CB THR A 147 -22.610 18.135 -5.508 1.00 4.33 C ATOM 2230 OG1 THR A 147 -23.036 16.956 -4.817 1.00 22.04 O ATOM 2231 CG2 THR A 147 -23.243 18.175 -6.891 1.00 41.13 C ATOM 0 H THR A 147 -20.863 16.106 -5.262 1.00 64.35 H new ATOM 0 HA THR A 147 -20.780 18.809 -6.435 1.00 53.45 H new ATOM 0 HB THR A 147 -22.931 19.016 -4.953 1.00 4.33 H new ATOM 0 HG1 THR A 147 -24.014 16.947 -4.757 1.00 22.04 H new ATOM 0 HG21 THR A 147 -24.329 18.154 -6.795 1.00 41.13 H new ATOM 0 HG22 THR A 147 -22.941 19.089 -7.403 1.00 41.13 H new ATOM 0 HG23 THR A 147 -22.913 17.311 -7.467 1.00 41.13 H new ATOM 2239 N PHE A 148 -19.177 18.697 -4.193 1.00 31.12 N ATOM 2240 CA PHE A 148 -18.506 19.200 -3.001 1.00 2.33 C ATOM 2241 C PHE A 148 -17.619 20.395 -3.340 1.00 75.54 C ATOM 2242 O PHE A 148 -16.688 20.284 -4.137 1.00 43.40 O ATOM 2243 CB PHE A 148 -17.667 18.094 -2.357 1.00 11.33 C ATOM 2244 CG PHE A 148 -16.783 18.582 -1.245 1.00 42.24 C ATOM 2245 CD1 PHE A 148 -17.329 19.045 -0.059 1.00 14.40 C ATOM 2246 CD2 PHE A 148 -15.404 18.578 -1.387 1.00 4.34 C ATOM 2247 CE1 PHE A 148 -16.518 19.495 0.964 1.00 71.02 C ATOM 2248 CE2 PHE A 148 -14.587 19.027 -0.366 1.00 22.13 C ATOM 2249 CZ PHE A 148 -15.145 19.486 0.811 1.00 72.14 C ATOM 0 H PHE A 148 -18.548 18.336 -4.910 1.00 31.12 H new ATOM 0 HA PHE A 148 -19.270 19.525 -2.294 1.00 2.33 H new ATOM 0 HB2 PHE A 148 -18.333 17.323 -1.969 1.00 11.33 H new ATOM 0 HB3 PHE A 148 -17.049 17.625 -3.123 1.00 11.33 H new ATOM 0 HD1 PHE A 148 -18.402 19.054 0.067 1.00 14.40 H new ATOM 0 HD2 PHE A 148 -14.963 18.220 -2.306 1.00 4.34 H new ATOM 0 HE1 PHE A 148 -16.957 19.854 1.883 1.00 71.02 H new ATOM 0 HE2 PHE A 148 -13.514 19.019 -0.489 1.00 22.13 H new ATOM 0 HZ PHE A 148 -14.509 19.837 1.610 1.00 72.14 H new