USER MOD reduce.3.24.130724 H: found=0, std=0, add=1012, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1014 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 95 SER OG : rot -30:sc= 0.738! USER MOD Set 1.2: A 97 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 66 GLN : amide:sc= -0.315 K(o=-1.7,f=-2.2) USER MOD Set 2.2: A 70 ASN : amide:sc= -1.35 X(o=-1.7,f=-2) USER MOD Set 3.1: A 41 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 121 THR OG1 : rot 73:sc= 1.17 USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.0459 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 87:sc= 1.2 USER MOD Single : A 14 SER OG : rot 91:sc= 1.24 USER MOD Single : A 17 THR OG1 : rot 55:sc= 1.3 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot 160:sc= -1.43 USER MOD Single : A 20 ASN : amide:sc= -1.45 K(o=-1.5,f=-2.4) USER MOD Single : A 21 THR OG1 : rot 71:sc= 0.816 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 71:sc= 0.29 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= -1.63 USER MOD Single : A 33 ASN : amide:sc= -0.144 X(o=-0.14,f=-0.18) USER MOD Single : A 40 THR OG1 : rot 32:sc= -0.987 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -1.93! C(o=-1.9!,f=-4.9!) USER MOD Single : A 57 SER OG : rot 180:sc= -1.55! USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 GLN :FLIP amide:sc= -0.828 F(o=-3.1!,f=-0.83) USER MOD Single : A 61 THR OG1 : rot 180:sc= -0.398 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot -20:sc= 0.505 USER MOD Single : A 75 SER OG : rot 102:sc= 0.0176 USER MOD Single : A 76 SER OG : rot -130:sc= -0.689 USER MOD Single : A 80 TYR OH : rot 180:sc= -0.882 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -1.98 X(o=-2,f=-1.5) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 99 ASN :FLIP amide:sc= -0.0753 F(o=-0.98,f=-0.075) USER MOD Single : A 100 ASN : amide:sc= 0.141 K(o=0.14,f=-2.1!) USER MOD Single : A 101 ASN : amide:sc=-0.00521 X(o=-0.0052,f=-0.047) USER MOD Single : A 102 ASN : amide:sc= -0.721 X(o=-0.72,f=-0.84) 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=-0.0023) USER MOD Single : A 108 SER OG : rot 180:sc= -0.0361 USER MOD Single : A 109 THR OG1 : rot 78:sc= 0.129 USER MOD Single : A 111 SER OG : rot 101:sc= 0.946 USER MOD Single : A 113 ASN : amide:sc= -1.11 K(o=-1.1,f=-3.8!) USER MOD Single : A 118 MET CE :methyl -105:sc= -4.11! (180deg=-6.31!) USER MOD Single : A 120 ASN : amide:sc= -0.748 K(o=-0.75,f=-1.6) USER MOD Single : A 125 TYR OH : rot 180:sc= -0.0274 USER MOD Single : A 135 GLN : amide:sc= -0.19 K(o=-0.19,f=-1!) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 142 THR OG1 : rot -83:sc= -0.0466 USER MOD Single : A 143 SER OG : rot 90:sc= 0.465 USER MOD Single : A 144 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 145 THR OG1 : rot -61:sc= 0.0476 USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 189 N GLN A 7 -14.384 19.451 6.237 1.00 71.31 N ATOM 190 CA GLN A 7 -15.420 19.042 5.296 1.00 43.11 C ATOM 191 C GLN A 7 -15.116 17.665 4.716 1.00 72.44 C ATOM 192 O GLN A 7 -15.996 16.807 4.631 1.00 30.03 O ATOM 193 CB GLN A 7 -15.546 20.067 4.167 1.00 21.42 C ATOM 194 CG GLN A 7 -15.562 21.508 4.652 1.00 40.14 C ATOM 195 CD GLN A 7 -16.039 22.476 3.588 1.00 63.41 C ATOM 196 OE1 GLN A 7 -17.239 22.701 3.430 1.00 25.51 O ATOM 197 NE2 GLN A 7 -15.099 23.057 2.851 1.00 52.05 N ATOM 0 HA GLN A 7 -16.365 18.988 5.836 1.00 43.11 H new ATOM 0 HB2 GLN A 7 -14.716 19.935 3.473 1.00 21.42 H new ATOM 0 HB3 GLN A 7 -16.461 19.870 3.609 1.00 21.42 H new ATOM 0 HG2 GLN A 7 -16.209 21.586 5.526 1.00 40.14 H new ATOM 0 HG3 GLN A 7 -14.559 21.791 4.972 1.00 40.14 H new ATOM 0 HE21 GLN A 7 -14.116 22.841 3.016 1.00 52.05 H new ATOM 0 HE22 GLN A 7 -15.360 23.719 2.120 1.00 52.05 H new ATOM 206 N LEU A 8 -13.865 17.458 4.319 1.00 0.43 N ATOM 207 CA LEU A 8 -13.445 16.184 3.747 1.00 42.24 C ATOM 208 C LEU A 8 -13.736 15.034 4.705 1.00 24.31 C ATOM 209 O LEU A 8 -14.231 13.982 4.300 1.00 53.04 O ATOM 210 CB LEU A 8 -11.953 16.220 3.413 1.00 62.45 C ATOM 211 CG LEU A 8 -11.600 16.387 1.934 1.00 65.14 C ATOM 212 CD1 LEU A 8 -11.711 15.057 1.205 1.00 64.41 C ATOM 213 CD2 LEU A 8 -12.498 17.430 1.286 1.00 32.32 C ATOM 0 H LEU A 8 -13.124 18.156 4.383 1.00 0.43 H new ATOM 0 HA LEU A 8 -14.012 16.021 2.831 1.00 42.24 H new ATOM 0 HB2 LEU A 8 -11.496 17.038 3.970 1.00 62.45 H new ATOM 0 HB3 LEU A 8 -11.498 15.297 3.773 1.00 62.45 H new ATOM 0 HG LEU A 8 -10.568 16.731 1.863 1.00 65.14 H new ATOM 0 HD11 LEU A 8 -11.456 15.196 0.154 1.00 64.41 H new ATOM 0 HD12 LEU A 8 -11.025 14.338 1.653 1.00 64.41 H new ATOM 0 HD13 LEU A 8 -12.732 14.683 1.284 1.00 64.41 H new ATOM 0 HD21 LEU A 8 -12.233 17.536 0.234 1.00 32.32 H new ATOM 0 HD22 LEU A 8 -13.538 17.116 1.368 1.00 32.32 H new ATOM 0 HD23 LEU A 8 -12.367 18.387 1.791 1.00 32.32 H new ATOM 225 N THR A 9 -13.426 15.242 5.981 1.00 21.40 N ATOM 226 CA THR A 9 -13.655 14.223 6.999 1.00 24.12 C ATOM 227 C THR A 9 -15.146 14.012 7.239 1.00 50.05 C ATOM 228 O THR A 9 -15.600 12.882 7.422 1.00 24.52 O ATOM 229 CB THR A 9 -12.981 14.600 8.332 1.00 45.34 C ATOM 230 OG1 THR A 9 -13.083 16.011 8.551 1.00 22.41 O ATOM 231 CG2 THR A 9 -11.516 14.186 8.333 1.00 31.12 C ATOM 0 H THR A 9 -13.016 16.107 6.334 1.00 21.40 H new ATOM 0 HA THR A 9 -13.215 13.298 6.626 1.00 24.12 H new ATOM 0 HB THR A 9 -13.493 14.071 9.135 1.00 45.34 H new ATOM 0 HG1 THR A 9 -12.654 16.242 9.401 1.00 22.41 H new ATOM 0 HG21 THR A 9 -11.061 14.462 9.284 1.00 31.12 H new ATOM 0 HG22 THR A 9 -11.443 13.107 8.195 1.00 31.12 H new ATOM 0 HG23 THR A 9 -10.994 14.692 7.520 1.00 31.12 H new ATOM 239 N SER A 10 -15.902 15.104 7.236 1.00 65.51 N ATOM 240 CA SER A 10 -17.342 15.037 7.458 1.00 43.23 C ATOM 241 C SER A 10 -18.036 14.327 6.299 1.00 33.35 C ATOM 242 O SER A 10 -18.963 13.540 6.503 1.00 64.30 O ATOM 243 CB SER A 10 -17.919 16.444 7.628 1.00 42.50 C ATOM 244 OG SER A 10 -17.793 16.888 8.968 1.00 10.32 O ATOM 0 H SER A 10 -15.542 16.046 7.082 1.00 65.51 H new ATOM 0 HA SER A 10 -17.519 14.467 8.370 1.00 43.23 H new ATOM 0 HB2 SER A 10 -17.402 17.135 6.962 1.00 42.50 H new ATOM 0 HB3 SER A 10 -18.970 16.447 7.338 1.00 42.50 H new ATOM 0 HG SER A 10 -18.167 17.790 9.050 1.00 10.32 H new ATOM 250 N THR A 11 -17.583 14.609 5.082 1.00 5.33 N ATOM 251 CA THR A 11 -18.161 14.000 3.891 1.00 63.11 C ATOM 252 C THR A 11 -17.677 12.565 3.719 1.00 41.13 C ATOM 253 O THR A 11 -18.479 11.646 3.543 1.00 23.21 O ATOM 254 CB THR A 11 -17.810 14.803 2.624 1.00 54.20 C ATOM 255 OG1 THR A 11 -17.839 16.206 2.910 1.00 13.44 O ATOM 256 CG2 THR A 11 -18.785 14.489 1.499 1.00 1.10 C ATOM 0 H THR A 11 -16.817 15.256 4.895 1.00 5.33 H new ATOM 0 HA THR A 11 -19.243 14.003 4.026 1.00 63.11 H new ATOM 0 HB THR A 11 -16.807 14.519 2.305 1.00 54.20 H new ATOM 0 HG1 THR A 11 -16.963 16.489 3.246 1.00 13.44 H new ATOM 0 HG21 THR A 11 -18.518 15.067 0.614 1.00 1.10 H new ATOM 0 HG22 THR A 11 -18.740 13.425 1.265 1.00 1.10 H new ATOM 0 HG23 THR A 11 -19.796 14.749 1.811 1.00 1.10 H new ATOM 264 N LEU A 12 -16.363 12.378 3.771 1.00 53.25 N ATOM 265 CA LEU A 12 -15.772 11.052 3.621 1.00 54.22 C ATOM 266 C LEU A 12 -16.335 10.085 4.658 1.00 44.33 C ATOM 267 O LEU A 12 -16.683 8.949 4.338 1.00 43.32 O ATOM 268 CB LEU A 12 -14.251 11.132 3.754 1.00 43.42 C ATOM 269 CG LEU A 12 -13.503 11.729 2.561 1.00 0.31 C ATOM 270 CD1 LEU A 12 -12.006 11.748 2.824 1.00 63.24 C ATOM 271 CD2 LEU A 12 -13.814 10.949 1.292 1.00 62.21 C ATOM 0 H LEU A 12 -15.686 13.127 3.916 1.00 53.25 H new ATOM 0 HA LEU A 12 -16.024 10.679 2.628 1.00 54.22 H new ATOM 0 HB2 LEU A 12 -14.014 11.723 4.638 1.00 43.42 H new ATOM 0 HB3 LEU A 12 -13.868 10.127 3.931 1.00 43.42 H new ATOM 0 HG LEU A 12 -13.839 12.757 2.424 1.00 0.31 H new ATOM 0 HD11 LEU A 12 -11.491 12.176 1.964 1.00 63.24 H new ATOM 0 HD12 LEU A 12 -11.800 12.351 3.708 1.00 63.24 H new ATOM 0 HD13 LEU A 12 -11.653 10.730 2.989 1.00 63.24 H new ATOM 0 HD21 LEU A 12 -13.273 11.388 0.453 1.00 62.21 H new ATOM 0 HD22 LEU A 12 -13.507 9.911 1.419 1.00 62.21 H new ATOM 0 HD23 LEU A 12 -14.885 10.989 1.094 1.00 62.21 H new ATOM 283 N ALA A 13 -16.424 10.545 5.901 1.00 43.02 N ATOM 284 CA ALA A 13 -16.948 9.723 6.985 1.00 44.23 C ATOM 285 C ALA A 13 -18.448 9.499 6.828 1.00 45.10 C ATOM 286 O ALA A 13 -18.953 8.407 7.085 1.00 53.31 O ATOM 287 CB ALA A 13 -16.646 10.366 8.330 1.00 5.25 C ATOM 0 H ALA A 13 -16.140 11.483 6.183 1.00 43.02 H new ATOM 0 HA ALA A 13 -16.455 8.752 6.941 1.00 44.23 H new ATOM 0 HB1 ALA A 13 -17.043 9.741 9.130 1.00 5.25 H new ATOM 0 HB2 ALA A 13 -15.567 10.468 8.451 1.00 5.25 H new ATOM 0 HB3 ALA A 13 -17.110 11.351 8.375 1.00 5.25 H new ATOM 293 N SER A 14 -19.156 10.542 6.404 1.00 11.10 N ATOM 294 CA SER A 14 -20.599 10.460 6.217 1.00 34.25 C ATOM 295 C SER A 14 -20.955 9.387 5.192 1.00 2.34 C ATOM 296 O SER A 14 -21.865 8.587 5.404 1.00 61.20 O ATOM 297 CB SER A 14 -21.155 11.813 5.770 1.00 43.50 C ATOM 298 OG SER A 14 -21.392 12.660 6.881 1.00 73.40 O ATOM 0 H SER A 14 -18.753 11.453 6.184 1.00 11.10 H new ATOM 0 HA SER A 14 -21.049 10.188 7.172 1.00 34.25 H new ATOM 0 HB2 SER A 14 -20.452 12.291 5.088 1.00 43.50 H new ATOM 0 HB3 SER A 14 -22.083 11.664 5.218 1.00 43.50 H new ATOM 0 HG SER A 14 -20.590 13.192 7.064 1.00 73.40 H new ATOM 304 N ALA A 15 -20.229 9.379 4.078 1.00 41.20 N ATOM 305 CA ALA A 15 -20.465 8.405 3.020 1.00 2.03 C ATOM 306 C ALA A 15 -20.079 7.001 3.470 1.00 51.30 C ATOM 307 O ALA A 15 -20.817 6.041 3.245 1.00 72.31 O ATOM 308 CB ALA A 15 -19.694 8.791 1.766 1.00 62.33 C ATOM 0 H ALA A 15 -19.473 10.036 3.886 1.00 41.20 H new ATOM 0 HA ALA A 15 -21.531 8.404 2.792 1.00 2.03 H new ATOM 0 HB1 ALA A 15 -19.879 8.055 0.984 1.00 62.33 H new ATOM 0 HB2 ALA A 15 -20.022 9.773 1.425 1.00 62.33 H new ATOM 0 HB3 ALA A 15 -18.628 8.822 1.990 1.00 62.33 H new ATOM 314 N LEU A 16 -18.918 6.887 4.106 1.00 42.30 N ATOM 315 CA LEU A 16 -18.433 5.598 4.588 1.00 24.24 C ATOM 316 C LEU A 16 -19.307 5.078 5.724 1.00 32.43 C ATOM 317 O LEU A 16 -19.261 3.895 6.066 1.00 15.35 O ATOM 318 CB LEU A 16 -16.984 5.721 5.061 1.00 45.44 C ATOM 319 CG LEU A 16 -15.941 5.971 3.970 1.00 51.21 C ATOM 320 CD1 LEU A 16 -14.557 6.127 4.581 1.00 44.30 C ATOM 321 CD2 LEU A 16 -15.952 4.839 2.953 1.00 1.11 C ATOM 0 H LEU A 16 -18.295 7.671 4.300 1.00 42.30 H new ATOM 0 HA LEU A 16 -18.481 4.888 3.762 1.00 24.24 H new ATOM 0 HB2 LEU A 16 -16.927 6.535 5.784 1.00 45.44 H new ATOM 0 HB3 LEU A 16 -16.716 4.806 5.589 1.00 45.44 H new ATOM 0 HG LEU A 16 -16.196 6.898 3.456 1.00 51.21 H new ATOM 0 HD11 LEU A 16 -13.828 6.304 3.790 1.00 44.30 H new ATOM 0 HD12 LEU A 16 -14.557 6.971 5.271 1.00 44.30 H new ATOM 0 HD13 LEU A 16 -14.293 5.218 5.121 1.00 44.30 H new ATOM 0 HD21 LEU A 16 -15.204 5.033 2.184 1.00 1.11 H new ATOM 0 HD22 LEU A 16 -15.722 3.898 3.453 1.00 1.11 H new ATOM 0 HD23 LEU A 16 -16.938 4.774 2.492 1.00 1.11 H new ATOM 333 N THR A 17 -20.106 5.967 6.305 1.00 11.34 N ATOM 334 CA THR A 17 -20.992 5.598 7.402 1.00 10.43 C ATOM 335 C THR A 17 -22.229 4.869 6.888 1.00 51.32 C ATOM 336 O THR A 17 -22.865 4.111 7.620 1.00 21.32 O ATOM 337 CB THR A 17 -21.436 6.834 8.206 1.00 2.24 C ATOM 338 OG1 THR A 17 -20.331 7.359 8.948 1.00 72.14 O ATOM 339 CG2 THR A 17 -22.571 6.482 9.157 1.00 0.01 C ATOM 0 H THR A 17 -20.158 6.949 6.034 1.00 11.34 H new ATOM 0 HA THR A 17 -20.426 4.933 8.055 1.00 10.43 H new ATOM 0 HB THR A 17 -21.792 7.588 7.504 1.00 2.24 H new ATOM 0 HG1 THR A 17 -19.584 7.538 8.340 1.00 72.14 H new ATOM 0 HG21 THR A 17 -22.868 7.371 9.714 1.00 0.01 H new ATOM 0 HG22 THR A 17 -23.422 6.111 8.586 1.00 0.01 H new ATOM 0 HG23 THR A 17 -22.237 5.712 9.853 1.00 0.01 H new ATOM 347 N LYS A 18 -22.565 5.103 5.624 1.00 71.24 N ATOM 348 CA LYS A 18 -23.724 4.468 5.009 1.00 34.51 C ATOM 349 C LYS A 18 -23.294 3.454 3.954 1.00 55.52 C ATOM 350 O LYS A 18 -24.099 3.022 3.128 1.00 74.34 O ATOM 351 CB LYS A 18 -24.635 5.522 4.378 1.00 31.52 C ATOM 352 CG LYS A 18 -23.883 6.592 3.605 1.00 34.12 C ATOM 353 CD LYS A 18 -24.832 7.489 2.827 1.00 61.32 C ATOM 354 CE LYS A 18 -25.212 8.724 3.628 1.00 31.32 C ATOM 355 NZ LYS A 18 -26.550 9.248 3.236 1.00 10.11 N ATOM 0 H LYS A 18 -22.050 5.729 5.005 1.00 71.24 H new ATOM 0 HA LYS A 18 -24.274 3.942 5.789 1.00 34.51 H new ATOM 0 HB2 LYS A 18 -25.338 5.028 3.708 1.00 31.52 H new ATOM 0 HB3 LYS A 18 -25.223 5.998 5.162 1.00 31.52 H new ATOM 0 HG2 LYS A 18 -23.295 7.196 4.296 1.00 34.12 H new ATOM 0 HG3 LYS A 18 -23.181 6.120 2.917 1.00 34.12 H new ATOM 0 HD2 LYS A 18 -24.363 7.791 1.890 1.00 61.32 H new ATOM 0 HD3 LYS A 18 -25.732 6.931 2.568 1.00 61.32 H new ATOM 0 HE2 LYS A 18 -25.214 8.482 4.691 1.00 31.32 H new ATOM 0 HE3 LYS A 18 -24.460 9.499 3.479 1.00 31.32 H new ATOM 0 HZ1 LYS A 18 -26.773 10.090 3.804 1.00 10.11 H new ATOM 0 HZ2 LYS A 18 -26.541 9.503 2.228 1.00 10.11 H new ATOM 0 HZ3 LYS A 18 -27.271 8.517 3.402 1.00 10.11 H new ATOM 369 N THR A 19 -22.020 3.078 3.986 1.00 55.44 N ATOM 370 CA THR A 19 -21.483 2.115 3.032 1.00 45.41 C ATOM 371 C THR A 19 -21.481 0.706 3.614 1.00 51.40 C ATOM 372 O THR A 19 -20.969 0.477 4.708 1.00 24.25 O ATOM 373 CB THR A 19 -20.049 2.485 2.608 1.00 61.42 C ATOM 374 OG1 THR A 19 -19.246 2.740 3.766 1.00 53.32 O ATOM 375 CG2 THR A 19 -20.049 3.710 1.706 1.00 53.40 C ATOM 0 H THR A 19 -21.340 3.426 4.662 1.00 55.44 H new ATOM 0 HA THR A 19 -22.132 2.142 2.157 1.00 45.41 H new ATOM 0 HB THR A 19 -19.631 1.645 2.053 1.00 61.42 H new ATOM 0 HG1 THR A 19 -18.298 2.658 3.531 1.00 53.32 H new ATOM 0 HG21 THR A 19 -19.025 3.951 1.420 1.00 53.40 H new ATOM 0 HG22 THR A 19 -20.636 3.503 0.811 1.00 53.40 H new ATOM 0 HG23 THR A 19 -20.485 4.555 2.239 1.00 53.40 H new ATOM 383 N ASN A 20 -22.058 -0.235 2.874 1.00 43.31 N ATOM 384 CA ASN A 20 -22.122 -1.623 3.317 1.00 20.51 C ATOM 385 C ASN A 20 -20.737 -2.138 3.697 1.00 0.14 C ATOM 386 O ASN A 20 -20.597 -2.985 4.579 1.00 60.14 O ATOM 387 CB ASN A 20 -22.723 -2.503 2.220 1.00 34.30 C ATOM 388 CG ASN A 20 -22.316 -2.054 0.831 1.00 51.34 C ATOM 389 OD1 ASN A 20 -23.023 -1.281 0.183 1.00 31.52 O ATOM 390 ND2 ASN A 20 -21.170 -2.537 0.364 1.00 61.20 N ATOM 0 H ASN A 20 -22.488 -0.062 1.965 1.00 43.31 H new ATOM 0 HA ASN A 20 -22.761 -1.667 4.199 1.00 20.51 H new ATOM 0 HB2 ASN A 20 -22.407 -3.535 2.372 1.00 34.30 H new ATOM 0 HB3 ASN A 20 -23.810 -2.487 2.300 1.00 34.30 H new ATOM 0 HD21 ASN A 20 -20.845 -2.270 -0.565 1.00 61.20 H new ATOM 0 HD22 ASN A 20 -20.615 -3.175 0.935 1.00 61.20 H new ATOM 397 N THR A 21 -19.714 -1.620 3.024 1.00 14.04 N ATOM 398 CA THR A 21 -18.341 -2.027 3.289 1.00 64.14 C ATOM 399 C THR A 21 -17.928 -1.676 4.714 1.00 53.42 C ATOM 400 O THR A 21 -17.029 -2.297 5.282 1.00 11.30 O ATOM 401 CB THR A 21 -17.358 -1.364 2.305 1.00 54.20 C ATOM 402 OG1 THR A 21 -17.719 -1.691 0.958 1.00 31.41 O ATOM 403 CG2 THR A 21 -15.931 -1.817 2.577 1.00 2.44 C ATOM 0 H THR A 21 -19.811 -0.917 2.291 1.00 14.04 H new ATOM 0 HA THR A 21 -18.302 -3.108 3.158 1.00 64.14 H new ATOM 0 HB THR A 21 -17.412 -0.284 2.444 1.00 54.20 H new ATOM 0 HG1 THR A 21 -18.546 -1.223 0.718 1.00 31.41 H new ATOM 0 HG21 THR A 21 -15.255 -1.336 1.870 1.00 2.44 H new ATOM 0 HG22 THR A 21 -15.649 -1.541 3.593 1.00 2.44 H new ATOM 0 HG23 THR A 21 -15.865 -2.899 2.463 1.00 2.44 H new ATOM 411 N LEU A 22 -18.590 -0.678 5.287 1.00 1.44 N ATOM 412 CA LEU A 22 -18.293 -0.244 6.648 1.00 11.20 C ATOM 413 C LEU A 22 -19.305 -0.817 7.635 1.00 62.22 C ATOM 414 O LEU A 22 -18.948 -1.221 8.742 1.00 71.11 O ATOM 415 CB LEU A 22 -18.293 1.284 6.729 1.00 11.11 C ATOM 416 CG LEU A 22 -16.926 1.961 6.634 1.00 51.31 C ATOM 417 CD1 LEU A 22 -16.236 1.964 7.989 1.00 60.41 C ATOM 418 CD2 LEU A 22 -16.058 1.268 5.594 1.00 55.43 C ATOM 0 H LEU A 22 -19.336 -0.153 4.831 1.00 1.44 H new ATOM 0 HA LEU A 22 -17.303 -0.616 6.914 1.00 11.20 H new ATOM 0 HB2 LEU A 22 -18.924 1.670 5.928 1.00 11.11 H new ATOM 0 HB3 LEU A 22 -18.757 1.578 7.670 1.00 11.11 H new ATOM 0 HG LEU A 22 -17.076 2.995 6.323 1.00 51.31 H new ATOM 0 HD11 LEU A 22 -15.264 2.450 7.901 1.00 60.41 H new ATOM 0 HD12 LEU A 22 -16.849 2.506 8.708 1.00 60.41 H new ATOM 0 HD13 LEU A 22 -16.099 0.938 8.330 1.00 60.41 H new ATOM 0 HD21 LEU A 22 -15.089 1.764 5.540 1.00 55.43 H new ATOM 0 HD22 LEU A 22 -15.917 0.224 5.875 1.00 55.43 H new ATOM 0 HD23 LEU A 22 -16.546 1.319 4.621 1.00 55.43 H new ATOM 430 N LYS A 23 -20.569 -0.849 7.227 1.00 32.40 N ATOM 431 CA LYS A 23 -21.633 -1.376 8.073 1.00 71.22 C ATOM 432 C LYS A 23 -21.483 -2.881 8.263 1.00 74.23 C ATOM 433 O LYS A 23 -21.803 -3.418 9.323 1.00 60.10 O ATOM 434 CB LYS A 23 -23.001 -1.062 7.462 1.00 71.20 C ATOM 435 CG LYS A 23 -23.570 0.276 7.900 1.00 12.51 C ATOM 436 CD LYS A 23 -24.887 0.575 7.204 1.00 33.04 C ATOM 437 CE LYS A 23 -24.672 0.998 5.760 1.00 11.52 C ATOM 438 NZ LYS A 23 -25.217 -0.003 4.802 1.00 73.04 N ATOM 0 H LYS A 23 -20.882 -0.516 6.315 1.00 32.40 H new ATOM 0 HA LYS A 23 -21.558 -0.896 9.049 1.00 71.22 H new ATOM 0 HB2 LYS A 23 -22.915 -1.073 6.375 1.00 71.20 H new ATOM 0 HB3 LYS A 23 -23.701 -1.852 7.734 1.00 71.20 H new ATOM 0 HG2 LYS A 23 -23.720 0.273 8.980 1.00 12.51 H new ATOM 0 HG3 LYS A 23 -22.853 1.067 7.680 1.00 12.51 H new ATOM 0 HD2 LYS A 23 -25.524 -0.309 7.234 1.00 33.04 H new ATOM 0 HD3 LYS A 23 -25.412 1.365 7.741 1.00 33.04 H new ATOM 0 HE2 LYS A 23 -25.150 1.962 5.589 1.00 11.52 H new ATOM 0 HE3 LYS A 23 -23.606 1.134 5.576 1.00 11.52 H new ATOM 0 HZ1 LYS A 23 -25.051 0.322 3.828 1.00 73.04 H new ATOM 0 HZ2 LYS A 23 -24.743 -0.917 4.948 1.00 73.04 H new ATOM 0 HZ3 LYS A 23 -26.239 -0.114 4.960 1.00 73.04 H new ATOM 452 N ALA A 24 -20.992 -3.558 7.230 1.00 54.10 N ATOM 453 CA ALA A 24 -20.796 -5.001 7.284 1.00 61.51 C ATOM 454 C ALA A 24 -19.631 -5.362 8.198 1.00 63.34 C ATOM 455 O ALA A 24 -19.743 -6.250 9.045 1.00 2.30 O ATOM 456 CB ALA A 24 -20.564 -5.557 5.887 1.00 5.24 C ATOM 0 H ALA A 24 -20.722 -3.129 6.345 1.00 54.10 H new ATOM 0 HA ALA A 24 -21.700 -5.449 7.695 1.00 61.51 H new ATOM 0 HB1 ALA A 24 -20.419 -6.636 5.944 1.00 5.24 H new ATOM 0 HB2 ALA A 24 -21.429 -5.340 5.261 1.00 5.24 H new ATOM 0 HB3 ALA A 24 -19.677 -5.094 5.454 1.00 5.24 H new ATOM 462 N VAL A 25 -18.510 -4.670 8.023 1.00 65.21 N ATOM 463 CA VAL A 25 -17.323 -4.917 8.833 1.00 44.12 C ATOM 464 C VAL A 25 -17.530 -4.451 10.269 1.00 21.45 C ATOM 465 O VAL A 25 -17.101 -5.110 11.215 1.00 75.23 O ATOM 466 CB VAL A 25 -16.086 -4.208 8.248 1.00 54.23 C ATOM 467 CG1 VAL A 25 -15.918 -4.554 6.776 1.00 72.31 C ATOM 468 CG2 VAL A 25 -16.194 -2.703 8.441 1.00 11.34 C ATOM 0 H VAL A 25 -18.399 -3.933 7.327 1.00 65.21 H new ATOM 0 HA VAL A 25 -17.153 -5.994 8.825 1.00 44.12 H new ATOM 0 HB VAL A 25 -15.202 -4.558 8.782 1.00 54.23 H new ATOM 0 HG11 VAL A 25 -15.040 -4.044 6.380 1.00 72.31 H new ATOM 0 HG12 VAL A 25 -15.792 -5.631 6.668 1.00 72.31 H new ATOM 0 HG13 VAL A 25 -16.802 -4.235 6.224 1.00 72.31 H new ATOM 0 HG21 VAL A 25 -15.312 -2.218 8.022 1.00 11.34 H new ATOM 0 HG22 VAL A 25 -17.086 -2.334 7.934 1.00 11.34 H new ATOM 0 HG23 VAL A 25 -16.261 -2.477 9.505 1.00 11.34 H new ATOM 478 N SER A 26 -18.191 -3.308 10.425 1.00 54.43 N ATOM 479 CA SER A 26 -18.454 -2.751 11.746 1.00 64.43 C ATOM 480 C SER A 26 -19.359 -3.674 12.555 1.00 32.34 C ATOM 481 O SER A 26 -19.073 -3.987 13.711 1.00 4.32 O ATOM 482 CB SER A 26 -19.097 -1.368 11.621 1.00 65.32 C ATOM 483 OG SER A 26 -19.703 -0.976 12.841 1.00 13.44 O ATOM 0 H SER A 26 -18.554 -2.750 9.652 1.00 54.43 H new ATOM 0 HA SER A 26 -17.502 -2.655 12.269 1.00 64.43 H new ATOM 0 HB2 SER A 26 -18.341 -0.636 11.335 1.00 65.32 H new ATOM 0 HB3 SER A 26 -19.844 -1.381 10.828 1.00 65.32 H new ATOM 0 HG SER A 26 -19.008 -0.780 13.503 1.00 13.44 H new ATOM 489 N ALA A 27 -20.454 -4.108 11.940 1.00 53.35 N ATOM 490 CA ALA A 27 -21.400 -4.997 12.600 1.00 34.43 C ATOM 491 C ALA A 27 -20.782 -6.367 12.855 1.00 71.32 C ATOM 492 O ALA A 27 -21.187 -7.082 13.772 1.00 14.02 O ATOM 493 CB ALA A 27 -22.666 -5.134 11.766 1.00 74.34 C ATOM 0 H ALA A 27 -20.708 -3.858 10.984 1.00 53.35 H new ATOM 0 HA ALA A 27 -21.658 -4.560 13.564 1.00 34.43 H new ATOM 0 HB1 ALA A 27 -23.364 -5.801 12.271 1.00 74.34 H new ATOM 0 HB2 ALA A 27 -23.127 -4.154 11.640 1.00 74.34 H new ATOM 0 HB3 ALA A 27 -22.415 -5.545 10.788 1.00 74.34 H new ATOM 499 N SER A 28 -19.797 -6.728 12.037 1.00 30.22 N ATOM 500 CA SER A 28 -19.125 -8.016 12.172 1.00 22.03 C ATOM 501 C SER A 28 -18.223 -8.031 13.402 1.00 1.01 C ATOM 502 O SER A 28 -17.951 -9.087 13.974 1.00 51.24 O ATOM 503 CB SER A 28 -18.303 -8.318 10.918 1.00 64.21 C ATOM 504 OG SER A 28 -17.525 -9.490 11.089 1.00 72.40 O ATOM 0 H SER A 28 -19.447 -6.147 11.275 1.00 30.22 H new ATOM 0 HA SER A 28 -19.887 -8.786 12.293 1.00 22.03 H new ATOM 0 HB2 SER A 28 -18.969 -8.441 10.064 1.00 64.21 H new ATOM 0 HB3 SER A 28 -17.651 -7.474 10.695 1.00 64.21 H new ATOM 0 HG SER A 28 -17.010 -9.663 10.273 1.00 72.40 H new ATOM 510 N LYS A 29 -17.762 -6.851 13.805 1.00 54.54 N ATOM 511 CA LYS A 29 -16.891 -6.727 14.967 1.00 71.31 C ATOM 512 C LYS A 29 -15.709 -7.686 14.868 1.00 74.21 C ATOM 513 O LYS A 29 -15.534 -8.582 15.695 1.00 60.21 O ATOM 514 CB LYS A 29 -17.676 -7.000 16.251 1.00 35.23 C ATOM 515 CG LYS A 29 -16.871 -6.772 17.519 1.00 41.22 C ATOM 516 CD LYS A 29 -16.684 -8.061 18.300 1.00 73.32 C ATOM 517 CE LYS A 29 -16.719 -7.814 19.801 1.00 54.24 C ATOM 518 NZ LYS A 29 -15.362 -7.894 20.407 1.00 30.30 N ATOM 0 H LYS A 29 -17.978 -5.967 13.343 1.00 54.54 H new ATOM 0 HA LYS A 29 -16.507 -5.707 14.993 1.00 71.31 H new ATOM 0 HB2 LYS A 29 -18.557 -6.359 16.271 1.00 35.23 H new ATOM 0 HB3 LYS A 29 -18.031 -8.030 16.237 1.00 35.23 H new ATOM 0 HG2 LYS A 29 -15.897 -6.356 17.263 1.00 41.22 H new ATOM 0 HG3 LYS A 29 -17.377 -6.037 18.145 1.00 41.22 H new ATOM 0 HD2 LYS A 29 -17.467 -8.769 18.028 1.00 73.32 H new ATOM 0 HD3 LYS A 29 -15.733 -8.518 18.028 1.00 73.32 H new ATOM 0 HE2 LYS A 29 -17.147 -6.831 19.998 1.00 54.24 H new ATOM 0 HE3 LYS A 29 -17.372 -8.547 20.275 1.00 54.24 H new ATOM 0 HZ1 LYS A 29 -15.428 -7.720 21.430 1.00 30.30 H new ATOM 0 HZ2 LYS A 29 -14.963 -8.840 20.242 1.00 30.30 H new ATOM 0 HZ3 LYS A 29 -14.745 -7.178 19.973 1.00 30.30 H new ATOM 532 N PRO A 30 -14.877 -7.498 13.833 1.00 11.44 N ATOM 533 CA PRO A 30 -13.697 -8.336 13.603 1.00 52.23 C ATOM 534 C PRO A 30 -12.609 -8.104 14.645 1.00 34.13 C ATOM 535 O PRO A 30 -12.586 -8.759 15.688 1.00 40.53 O ATOM 536 CB PRO A 30 -13.214 -7.895 12.219 1.00 42.42 C ATOM 537 CG PRO A 30 -13.717 -6.501 12.067 1.00 33.50 C ATOM 538 CD PRO A 30 -15.025 -6.451 12.808 1.00 24.23 C ATOM 0 HA PRO A 30 -13.932 -9.398 13.670 1.00 52.23 H new ATOM 0 HB2 PRO A 30 -12.127 -7.933 12.149 1.00 42.42 H new ATOM 0 HB3 PRO A 30 -13.607 -8.545 11.437 1.00 42.42 H new ATOM 0 HG2 PRO A 30 -13.008 -5.783 12.478 1.00 33.50 H new ATOM 0 HG3 PRO A 30 -13.854 -6.248 11.016 1.00 33.50 H new ATOM 0 HD2 PRO A 30 -15.196 -5.472 13.256 1.00 24.23 H new ATOM 0 HD3 PRO A 30 -15.869 -6.652 12.148 1.00 24.23 H new ATOM 546 N SER A 31 -11.709 -7.169 14.358 1.00 11.31 N ATOM 547 CA SER A 31 -10.616 -6.854 15.271 1.00 11.32 C ATOM 548 C SER A 31 -9.657 -5.849 14.641 1.00 63.05 C ATOM 549 O SER A 31 -9.618 -5.690 13.421 1.00 33.33 O ATOM 550 CB SER A 31 -9.861 -8.127 15.654 1.00 71.11 C ATOM 551 OG SER A 31 -10.072 -9.153 14.700 1.00 35.21 O ATOM 0 H SER A 31 -11.715 -6.616 13.501 1.00 11.31 H new ATOM 0 HA SER A 31 -11.042 -6.409 16.171 1.00 11.32 H new ATOM 0 HB2 SER A 31 -8.795 -7.912 15.731 1.00 71.11 H new ATOM 0 HB3 SER A 31 -10.190 -8.467 16.636 1.00 71.11 H new ATOM 0 HG SER A 31 -9.577 -9.955 14.968 1.00 35.21 H new ATOM 557 N ALA A 32 -8.881 -5.174 15.482 1.00 5.13 N ATOM 558 CA ALA A 32 -7.918 -4.187 15.009 1.00 25.15 C ATOM 559 C ALA A 32 -6.853 -4.834 14.132 1.00 72.12 C ATOM 560 O ALA A 32 -6.226 -4.170 13.307 1.00 34.51 O ATOM 561 CB ALA A 32 -7.272 -3.474 16.188 1.00 24.43 C ATOM 0 H ALA A 32 -8.900 -5.293 16.495 1.00 5.13 H new ATOM 0 HA ALA A 32 -8.453 -3.455 14.404 1.00 25.15 H new ATOM 0 HB1 ALA A 32 -6.555 -2.740 15.821 1.00 24.43 H new ATOM 0 HB2 ALA A 32 -8.041 -2.969 16.774 1.00 24.43 H new ATOM 0 HB3 ALA A 32 -6.757 -4.202 16.815 1.00 24.43 H new ATOM 567 N ASN A 33 -6.653 -6.135 14.316 1.00 54.43 N ATOM 568 CA ASN A 33 -5.661 -6.873 13.541 1.00 2.24 C ATOM 569 C ASN A 33 -6.099 -7.007 12.085 1.00 73.43 C ATOM 570 O ASN A 33 -5.327 -6.733 11.166 1.00 5.45 O ATOM 571 CB ASN A 33 -5.437 -8.259 14.148 1.00 54.30 C ATOM 572 CG ASN A 33 -5.488 -8.242 15.663 1.00 63.04 C ATOM 573 OD1 ASN A 33 -4.826 -7.429 16.308 1.00 1.15 O ATOM 574 ND2 ASN A 33 -6.276 -9.143 16.239 1.00 64.53 N ATOM 0 H ASN A 33 -7.164 -6.700 14.994 1.00 54.43 H new ATOM 0 HA ASN A 33 -4.725 -6.316 13.571 1.00 2.24 H new ATOM 0 HB2 ASN A 33 -6.195 -8.945 13.769 1.00 54.30 H new ATOM 0 HB3 ASN A 33 -4.469 -8.642 13.824 1.00 54.30 H new ATOM 0 HD21 ASN A 33 -6.350 -9.180 17.256 1.00 64.53 H new ATOM 0 HD22 ASN A 33 -6.807 -9.798 15.665 1.00 64.53 H new ATOM 581 N VAL A 34 -7.342 -7.431 11.884 1.00 34.12 N ATOM 582 CA VAL A 34 -7.884 -7.600 10.540 1.00 61.25 C ATOM 583 C VAL A 34 -8.339 -6.267 9.959 1.00 22.54 C ATOM 584 O VAL A 34 -8.193 -6.017 8.764 1.00 14.24 O ATOM 585 CB VAL A 34 -9.070 -8.583 10.533 1.00 51.20 C ATOM 586 CG1 VAL A 34 -9.712 -8.657 11.911 1.00 4.51 C ATOM 587 CG2 VAL A 34 -10.090 -8.177 9.481 1.00 33.24 C ATOM 0 H VAL A 34 -7.993 -7.664 12.634 1.00 34.12 H new ATOM 0 HA VAL A 34 -7.082 -8.006 9.924 1.00 61.25 H new ATOM 0 HB VAL A 34 -8.696 -9.575 10.280 1.00 51.20 H new ATOM 0 HG11 VAL A 34 -10.548 -9.356 11.886 1.00 4.51 H new ATOM 0 HG12 VAL A 34 -8.975 -8.998 12.638 1.00 4.51 H new ATOM 0 HG13 VAL A 34 -10.074 -7.669 12.197 1.00 4.51 H new ATOM 0 HG21 VAL A 34 -10.921 -8.882 9.489 1.00 33.24 H new ATOM 0 HG22 VAL A 34 -10.461 -7.176 9.701 1.00 33.24 H new ATOM 0 HG23 VAL A 34 -9.620 -8.182 8.498 1.00 33.24 H new ATOM 597 N ALA A 35 -8.892 -5.413 10.815 1.00 40.20 N ATOM 598 CA ALA A 35 -9.367 -4.102 10.387 1.00 75.21 C ATOM 599 C ALA A 35 -8.258 -3.314 9.701 1.00 64.43 C ATOM 600 O ALA A 35 -8.489 -2.645 8.693 1.00 61.45 O ATOM 601 CB ALA A 35 -9.913 -3.326 11.576 1.00 63.33 C ATOM 0 H ALA A 35 -9.022 -5.605 11.808 1.00 40.20 H new ATOM 0 HA ALA A 35 -10.170 -4.251 9.665 1.00 75.21 H new ATOM 0 HB1 ALA A 35 -10.264 -2.349 11.243 1.00 63.33 H new ATOM 0 HB2 ALA A 35 -10.742 -3.877 12.021 1.00 63.33 H new ATOM 0 HB3 ALA A 35 -9.125 -3.195 12.318 1.00 63.33 H new ATOM 607 N VAL A 36 -7.051 -3.395 10.254 1.00 11.30 N ATOM 608 CA VAL A 36 -5.905 -2.688 9.695 1.00 54.14 C ATOM 609 C VAL A 36 -5.530 -3.245 8.325 1.00 33.14 C ATOM 610 O VAL A 36 -5.156 -2.499 7.421 1.00 2.14 O ATOM 611 CB VAL A 36 -4.681 -2.779 10.625 1.00 64.30 C ATOM 612 CG1 VAL A 36 -3.440 -2.242 9.929 1.00 44.34 C ATOM 613 CG2 VAL A 36 -4.942 -2.028 11.921 1.00 23.32 C ATOM 0 H VAL A 36 -6.842 -3.943 11.088 1.00 11.30 H new ATOM 0 HA VAL A 36 -6.198 -1.643 9.592 1.00 54.14 H new ATOM 0 HB VAL A 36 -4.507 -3.827 10.867 1.00 64.30 H new ATOM 0 HG11 VAL A 36 -2.585 -2.315 10.602 1.00 44.34 H new ATOM 0 HG12 VAL A 36 -3.245 -2.827 9.030 1.00 44.34 H new ATOM 0 HG13 VAL A 36 -3.599 -1.199 9.655 1.00 44.34 H new ATOM 0 HG21 VAL A 36 -4.067 -2.102 12.567 1.00 23.32 H new ATOM 0 HG22 VAL A 36 -5.142 -0.980 11.700 1.00 23.32 H new ATOM 0 HG23 VAL A 36 -5.804 -2.463 12.426 1.00 23.32 H new ATOM 623 N ALA A 37 -5.635 -4.562 8.179 1.00 21.20 N ATOM 624 CA ALA A 37 -5.310 -5.219 6.920 1.00 54.24 C ATOM 625 C ALA A 37 -6.325 -4.866 5.838 1.00 63.53 C ATOM 626 O ALA A 37 -5.974 -4.726 4.666 1.00 74.55 O ATOM 627 CB ALA A 37 -5.244 -6.727 7.112 1.00 22.43 C ATOM 0 H ALA A 37 -5.943 -5.194 8.918 1.00 21.20 H new ATOM 0 HA ALA A 37 -4.333 -4.862 6.595 1.00 54.24 H new ATOM 0 HB1 ALA A 37 -5.000 -7.204 6.163 1.00 22.43 H new ATOM 0 HB2 ALA A 37 -4.475 -6.967 7.847 1.00 22.43 H new ATOM 0 HB3 ALA A 37 -6.209 -7.092 7.464 1.00 22.43 H new ATOM 633 N ILE A 38 -7.584 -4.723 6.239 1.00 71.22 N ATOM 634 CA ILE A 38 -8.649 -4.385 5.304 1.00 51.33 C ATOM 635 C ILE A 38 -8.519 -2.946 4.818 1.00 22.12 C ATOM 636 O ILE A 38 -8.680 -2.662 3.631 1.00 22.41 O ATOM 637 CB ILE A 38 -10.039 -4.578 5.939 1.00 40.32 C ATOM 638 CG1 ILE A 38 -10.257 -6.047 6.304 1.00 14.44 C ATOM 639 CG2 ILE A 38 -11.126 -4.093 4.992 1.00 61.11 C ATOM 640 CD1 ILE A 38 -11.494 -6.283 7.143 1.00 74.23 C ATOM 0 H ILE A 38 -7.891 -4.836 7.205 1.00 71.22 H new ATOM 0 HA ILE A 38 -8.550 -5.062 4.456 1.00 51.33 H new ATOM 0 HB ILE A 38 -10.091 -3.986 6.852 1.00 40.32 H new ATOM 0 HG12 ILE A 38 -10.331 -6.634 5.388 1.00 14.44 H new ATOM 0 HG13 ILE A 38 -9.385 -6.412 6.846 1.00 14.44 H new ATOM 0 HG21 ILE A 38 -12.102 -4.236 5.455 1.00 61.11 H new ATOM 0 HG22 ILE A 38 -10.977 -3.034 4.779 1.00 61.11 H new ATOM 0 HG23 ILE A 38 -11.079 -4.660 4.063 1.00 61.11 H new ATOM 0 HD11 ILE A 38 -11.586 -7.346 7.364 1.00 74.23 H new ATOM 0 HD12 ILE A 38 -11.414 -5.724 8.075 1.00 74.23 H new ATOM 0 HD13 ILE A 38 -12.375 -5.949 6.595 1.00 74.23 H new ATOM 652 N VAL A 39 -8.225 -2.039 5.745 1.00 22.21 N ATOM 653 CA VAL A 39 -8.070 -0.628 5.412 1.00 41.40 C ATOM 654 C VAL A 39 -6.799 -0.390 4.604 1.00 54.43 C ATOM 655 O VAL A 39 -6.776 0.434 3.689 1.00 52.45 O ATOM 656 CB VAL A 39 -8.031 0.247 6.679 1.00 51.14 C ATOM 657 CG1 VAL A 39 -6.881 -0.173 7.583 1.00 54.23 C ATOM 658 CG2 VAL A 39 -7.917 1.717 6.307 1.00 64.32 C ATOM 0 H VAL A 39 -8.089 -2.257 6.732 1.00 22.21 H new ATOM 0 HA VAL A 39 -8.936 -0.348 4.812 1.00 41.40 H new ATOM 0 HB VAL A 39 -8.963 0.105 7.227 1.00 51.14 H new ATOM 0 HG11 VAL A 39 -6.869 0.456 8.473 1.00 54.23 H new ATOM 0 HG12 VAL A 39 -7.011 -1.215 7.877 1.00 54.23 H new ATOM 0 HG13 VAL A 39 -5.938 -0.062 7.048 1.00 54.23 H new ATOM 0 HG21 VAL A 39 -7.891 2.321 7.214 1.00 64.32 H new ATOM 0 HG22 VAL A 39 -7.002 1.878 5.737 1.00 64.32 H new ATOM 0 HG23 VAL A 39 -8.777 2.007 5.703 1.00 64.32 H new ATOM 668 N THR A 40 -5.741 -1.119 4.947 1.00 22.02 N ATOM 669 CA THR A 40 -4.465 -0.988 4.255 1.00 2.25 C ATOM 670 C THR A 40 -4.611 -1.301 2.770 1.00 21.11 C ATOM 671 O THR A 40 -4.024 -0.627 1.923 1.00 33.31 O ATOM 672 CB THR A 40 -3.398 -1.917 4.862 1.00 73.34 C ATOM 673 OG1 THR A 40 -3.987 -3.172 5.220 1.00 33.43 O ATOM 674 CG2 THR A 40 -2.762 -1.282 6.090 1.00 60.04 C ATOM 0 H THR A 40 -5.743 -1.807 5.700 1.00 22.02 H new ATOM 0 HA THR A 40 -4.145 0.047 4.376 1.00 2.25 H new ATOM 0 HB THR A 40 -2.623 -2.080 4.113 1.00 73.34 H new ATOM 0 HG1 THR A 40 -4.715 -3.381 4.598 1.00 33.43 H new ATOM 0 HG21 THR A 40 -2.011 -1.957 6.501 1.00 60.04 H new ATOM 0 HG22 THR A 40 -2.289 -0.341 5.809 1.00 60.04 H new ATOM 0 HG23 THR A 40 -3.530 -1.092 6.840 1.00 60.04 H new ATOM 682 N SER A 41 -5.396 -2.328 2.461 1.00 74.30 N ATOM 683 CA SER A 41 -5.616 -2.733 1.078 1.00 13.11 C ATOM 684 C SER A 41 -6.206 -1.586 0.263 1.00 72.44 C ATOM 685 O SER A 41 -5.755 -1.301 -0.845 1.00 4.21 O ATOM 686 CB SER A 41 -6.548 -3.946 1.021 1.00 62.34 C ATOM 687 OG SER A 41 -5.810 -5.156 1.019 1.00 40.40 O ATOM 0 H SER A 41 -5.890 -2.895 3.150 1.00 74.30 H new ATOM 0 HA SER A 41 -4.652 -3.004 0.647 1.00 13.11 H new ATOM 0 HB2 SER A 41 -7.224 -3.930 1.876 1.00 62.34 H new ATOM 0 HB3 SER A 41 -7.166 -3.892 0.125 1.00 62.34 H new ATOM 0 HG SER A 41 -6.428 -5.916 0.984 1.00 40.40 H new ATOM 693 N GLY A 42 -7.219 -0.931 0.823 1.00 51.33 N ATOM 694 CA GLY A 42 -7.856 0.177 0.135 1.00 44.50 C ATOM 695 C GLY A 42 -6.987 1.419 0.109 1.00 32.13 C ATOM 696 O GLY A 42 -6.999 2.174 -0.863 1.00 22.11 O ATOM 0 H GLY A 42 -7.609 -1.148 1.740 1.00 51.33 H new ATOM 0 HA2 GLY A 42 -8.090 -0.120 -0.887 1.00 44.50 H new ATOM 0 HA3 GLY A 42 -8.802 0.409 0.624 1.00 44.50 H new ATOM 700 N LEU A 43 -6.232 1.633 1.181 1.00 64.43 N ATOM 701 CA LEU A 43 -5.353 2.794 1.279 1.00 12.02 C ATOM 702 C LEU A 43 -4.286 2.762 0.190 1.00 61.12 C ATOM 703 O LEU A 43 -3.979 3.785 -0.423 1.00 54.04 O ATOM 704 CB LEU A 43 -4.692 2.843 2.658 1.00 52.42 C ATOM 705 CG LEU A 43 -5.118 3.996 3.566 1.00 72.43 C ATOM 706 CD1 LEU A 43 -6.620 3.961 3.804 1.00 2.41 C ATOM 707 CD2 LEU A 43 -4.366 3.939 4.889 1.00 53.52 C ATOM 0 H LEU A 43 -6.211 1.018 1.995 1.00 64.43 H new ATOM 0 HA LEU A 43 -5.958 3.690 1.142 1.00 12.02 H new ATOM 0 HB2 LEU A 43 -4.902 1.905 3.173 1.00 52.42 H new ATOM 0 HB3 LEU A 43 -3.612 2.896 2.519 1.00 52.42 H new ATOM 0 HG LEU A 43 -4.871 4.934 3.070 1.00 72.43 H new ATOM 0 HD11 LEU A 43 -6.905 4.789 4.453 1.00 2.41 H new ATOM 0 HD12 LEU A 43 -7.142 4.050 2.851 1.00 2.41 H new ATOM 0 HD13 LEU A 43 -6.891 3.018 4.279 1.00 2.41 H new ATOM 0 HD21 LEU A 43 -4.682 4.767 5.523 1.00 53.52 H new ATOM 0 HD22 LEU A 43 -4.582 2.996 5.390 1.00 53.52 H new ATOM 0 HD23 LEU A 43 -3.295 4.013 4.702 1.00 53.52 H new ATOM 719 N LYS A 44 -3.725 1.581 -0.046 1.00 43.42 N ATOM 720 CA LYS A 44 -2.693 1.414 -1.063 1.00 14.31 C ATOM 721 C LYS A 44 -3.269 1.622 -2.460 1.00 73.35 C ATOM 722 O LYS A 44 -2.646 2.257 -3.311 1.00 5.40 O ATOM 723 CB LYS A 44 -2.067 0.021 -0.960 1.00 12.11 C ATOM 724 CG LYS A 44 -1.486 -0.284 0.410 1.00 31.11 C ATOM 725 CD LYS A 44 -1.553 -1.769 0.726 1.00 60.11 C ATOM 726 CE LYS A 44 -0.166 -2.360 0.926 1.00 3.15 C ATOM 727 NZ LYS A 44 -0.049 -3.718 0.327 1.00 12.44 N ATOM 0 H LYS A 44 -3.968 0.725 0.453 1.00 43.42 H new ATOM 0 HA LYS A 44 -1.922 2.165 -0.891 1.00 14.31 H new ATOM 0 HB2 LYS A 44 -2.823 -0.727 -1.200 1.00 12.11 H new ATOM 0 HB3 LYS A 44 -1.280 -0.071 -1.708 1.00 12.11 H new ATOM 0 HG2 LYS A 44 -0.449 0.051 0.449 1.00 31.11 H new ATOM 0 HG3 LYS A 44 -2.031 0.276 1.170 1.00 31.11 H new ATOM 0 HD2 LYS A 44 -2.149 -1.924 1.626 1.00 60.11 H new ATOM 0 HD3 LYS A 44 -2.059 -2.292 -0.085 1.00 60.11 H new ATOM 0 HE2 LYS A 44 0.578 -1.701 0.478 1.00 3.15 H new ATOM 0 HE3 LYS A 44 0.056 -2.413 1.992 1.00 3.15 H new ATOM 0 HZ1 LYS A 44 0.911 -4.086 0.485 1.00 12.44 H new ATOM 0 HZ2 LYS A 44 -0.741 -4.354 0.772 1.00 12.44 H new ATOM 0 HZ3 LYS A 44 -0.235 -3.664 -0.695 1.00 12.44 H new ATOM 741 N LYS A 45 -4.461 1.084 -2.691 1.00 74.32 N ATOM 742 CA LYS A 45 -5.123 1.211 -3.984 1.00 24.22 C ATOM 743 C LYS A 45 -5.545 2.655 -4.237 1.00 12.43 C ATOM 744 O LYS A 45 -5.362 3.182 -5.335 1.00 14.10 O ATOM 745 CB LYS A 45 -6.345 0.293 -4.047 1.00 53.44 C ATOM 746 CG LYS A 45 -7.096 0.372 -5.365 1.00 74.03 C ATOM 747 CD LYS A 45 -6.674 -0.738 -6.315 1.00 30.52 C ATOM 748 CE LYS A 45 -7.728 -0.987 -7.383 1.00 73.24 C ATOM 749 NZ LYS A 45 -7.502 -0.148 -8.592 1.00 10.14 N ATOM 0 H LYS A 45 -4.990 0.554 -1.998 1.00 74.32 H new ATOM 0 HA LYS A 45 -4.415 0.916 -4.758 1.00 24.22 H new ATOM 0 HB2 LYS A 45 -6.025 -0.736 -3.881 1.00 53.44 H new ATOM 0 HB3 LYS A 45 -7.025 0.550 -3.235 1.00 53.44 H new ATOM 0 HG2 LYS A 45 -8.168 0.305 -5.179 1.00 74.03 H new ATOM 0 HG3 LYS A 45 -6.914 1.340 -5.831 1.00 74.03 H new ATOM 0 HD2 LYS A 45 -5.729 -0.473 -6.789 1.00 30.52 H new ATOM 0 HD3 LYS A 45 -6.502 -1.655 -5.751 1.00 30.52 H new ATOM 0 HE2 LYS A 45 -7.718 -2.040 -7.665 1.00 73.24 H new ATOM 0 HE3 LYS A 45 -8.716 -0.776 -6.974 1.00 73.24 H new ATOM 0 HZ1 LYS A 45 -8.241 -0.347 -9.296 1.00 10.14 H new ATOM 0 HZ2 LYS A 45 -7.537 0.857 -8.328 1.00 10.14 H new ATOM 0 HZ3 LYS A 45 -6.570 -0.367 -8.997 1.00 10.14 H new ATOM 763 N ALA A 46 -6.110 3.290 -3.216 1.00 5.31 N ATOM 764 CA ALA A 46 -6.554 4.674 -3.328 1.00 42.01 C ATOM 765 C ALA A 46 -5.394 5.596 -3.684 1.00 45.23 C ATOM 766 O ALA A 46 -5.495 6.412 -4.602 1.00 5.11 O ATOM 767 CB ALA A 46 -7.210 5.124 -2.031 1.00 44.21 C ATOM 0 H ALA A 46 -6.271 2.868 -2.301 1.00 5.31 H new ATOM 0 HA ALA A 46 -7.288 4.730 -4.132 1.00 42.01 H new ATOM 0 HB1 ALA A 46 -7.537 6.159 -2.129 1.00 44.21 H new ATOM 0 HB2 ALA A 46 -8.071 4.490 -1.820 1.00 44.21 H new ATOM 0 HB3 ALA A 46 -6.493 5.046 -1.214 1.00 44.21 H new ATOM 773 N LEU A 47 -4.292 5.464 -2.954 1.00 54.33 N ATOM 774 CA LEU A 47 -3.111 6.286 -3.193 1.00 55.41 C ATOM 775 C LEU A 47 -2.463 5.933 -4.528 1.00 10.43 C ATOM 776 O LEU A 47 -1.928 6.800 -5.218 1.00 62.20 O ATOM 777 CB LEU A 47 -2.101 6.104 -2.059 1.00 2.42 C ATOM 778 CG LEU A 47 -2.625 6.356 -0.646 1.00 21.15 C ATOM 779 CD1 LEU A 47 -1.828 5.553 0.371 1.00 14.53 C ATOM 780 CD2 LEU A 47 -2.574 7.840 -0.314 1.00 4.33 C ATOM 0 H LEU A 47 -4.192 4.795 -2.191 1.00 54.33 H new ATOM 0 HA LEU A 47 -3.425 7.329 -3.227 1.00 55.41 H new ATOM 0 HB2 LEU A 47 -1.713 5.086 -2.105 1.00 2.42 H new ATOM 0 HB3 LEU A 47 -1.260 6.774 -2.238 1.00 2.42 H new ATOM 0 HG LEU A 47 -3.664 6.030 -0.602 1.00 21.15 H new ATOM 0 HD11 LEU A 47 -2.216 5.746 1.371 1.00 14.53 H new ATOM 0 HD12 LEU A 47 -1.917 4.490 0.146 1.00 14.53 H new ATOM 0 HD13 LEU A 47 -0.779 5.847 0.326 1.00 14.53 H new ATOM 0 HD21 LEU A 47 -2.951 8.000 0.696 1.00 4.33 H new ATOM 0 HD22 LEU A 47 -1.544 8.192 -0.377 1.00 4.33 H new ATOM 0 HD23 LEU A 47 -3.190 8.393 -1.023 1.00 4.33 H new ATOM 792 N GLY A 48 -2.519 4.655 -4.888 1.00 41.02 N ATOM 793 CA GLY A 48 -1.936 4.211 -6.141 1.00 54.22 C ATOM 794 C GLY A 48 -2.699 4.720 -7.348 1.00 44.22 C ATOM 795 O GLY A 48 -2.110 4.981 -8.397 1.00 53.55 O ATOM 0 H GLY A 48 -2.958 3.919 -4.335 1.00 41.02 H new ATOM 0 HA2 GLY A 48 -0.902 4.552 -6.198 1.00 54.22 H new ATOM 0 HA3 GLY A 48 -1.914 3.121 -6.162 1.00 54.22 H new ATOM 799 N ALA A 49 -4.012 4.860 -7.201 1.00 63.33 N ATOM 800 CA ALA A 49 -4.855 5.342 -8.288 1.00 34.53 C ATOM 801 C ALA A 49 -4.792 6.860 -8.400 1.00 22.34 C ATOM 802 O ALA A 49 -5.137 7.432 -9.435 1.00 1.53 O ATOM 803 CB ALA A 49 -6.292 4.884 -8.082 1.00 72.01 C ATOM 0 H ALA A 49 -4.515 4.646 -6.340 1.00 63.33 H new ATOM 0 HA ALA A 49 -4.480 4.921 -9.221 1.00 34.53 H new ATOM 0 HB1 ALA A 49 -6.912 5.250 -8.901 1.00 72.01 H new ATOM 0 HB2 ALA A 49 -6.327 3.795 -8.060 1.00 72.01 H new ATOM 0 HB3 ALA A 49 -6.668 5.278 -7.138 1.00 72.01 H new ATOM 809 N LEU A 50 -4.351 7.510 -7.329 1.00 64.43 N ATOM 810 CA LEU A 50 -4.244 8.965 -7.306 1.00 44.13 C ATOM 811 C LEU A 50 -2.805 9.409 -7.554 1.00 74.42 C ATOM 812 O LEU A 50 -2.467 10.580 -7.379 1.00 50.11 O ATOM 813 CB LEU A 50 -4.734 9.512 -5.965 1.00 30.53 C ATOM 814 CG LEU A 50 -6.230 9.813 -5.869 1.00 52.30 C ATOM 815 CD1 LEU A 50 -6.741 9.541 -4.463 1.00 70.13 C ATOM 816 CD2 LEU A 50 -6.512 11.253 -6.272 1.00 54.14 C ATOM 0 H LEU A 50 -4.062 7.053 -6.465 1.00 64.43 H new ATOM 0 HA LEU A 50 -4.871 9.363 -8.104 1.00 44.13 H new ATOM 0 HB2 LEU A 50 -4.478 8.793 -5.187 1.00 30.53 H new ATOM 0 HB3 LEU A 50 -4.185 10.428 -5.746 1.00 30.53 H new ATOM 0 HG LEU A 50 -6.758 9.154 -6.558 1.00 52.30 H new ATOM 0 HD11 LEU A 50 -7.807 9.761 -4.415 1.00 70.13 H new ATOM 0 HD12 LEU A 50 -6.575 8.493 -4.212 1.00 70.13 H new ATOM 0 HD13 LEU A 50 -6.207 10.173 -3.753 1.00 70.13 H new ATOM 0 HD21 LEU A 50 -7.582 11.449 -6.197 1.00 54.14 H new ATOM 0 HD22 LEU A 50 -5.972 11.929 -5.609 1.00 54.14 H new ATOM 0 HD23 LEU A 50 -6.184 11.414 -7.299 1.00 54.14 H new ATOM 828 N ARG A 51 -1.962 8.465 -7.963 1.00 23.11 N ATOM 829 CA ARG A 51 -0.560 8.759 -8.235 1.00 21.04 C ATOM 830 C ARG A 51 0.084 9.478 -7.053 1.00 10.31 C ATOM 831 O ARG A 51 1.010 10.271 -7.227 1.00 61.43 O ATOM 832 CB ARG A 51 -0.432 9.615 -9.497 1.00 21.34 C ATOM 833 CG ARG A 51 -1.261 9.105 -10.665 1.00 2.02 C ATOM 834 CD ARG A 51 -0.804 7.726 -11.111 1.00 53.33 C ATOM 835 NE ARG A 51 -0.221 7.748 -12.450 1.00 42.13 N ATOM 836 CZ ARG A 51 -0.940 7.812 -13.564 1.00 54.34 C ATOM 837 NH1 ARG A 51 -2.263 7.859 -13.501 1.00 73.03 N ATOM 838 NH2 ARG A 51 -0.336 7.829 -14.746 1.00 52.24 N ATOM 0 H ARG A 51 -2.226 7.491 -8.113 1.00 23.11 H new ATOM 0 HA ARG A 51 -0.040 7.814 -8.391 1.00 21.04 H new ATOM 0 HB2 ARG A 51 -0.735 10.636 -9.266 1.00 21.34 H new ATOM 0 HB3 ARG A 51 0.616 9.653 -9.795 1.00 21.34 H new ATOM 0 HG2 ARG A 51 -2.312 9.066 -10.377 1.00 2.02 H new ATOM 0 HG3 ARG A 51 -1.184 9.802 -11.499 1.00 2.02 H new ATOM 0 HD2 ARG A 51 -0.070 7.341 -10.403 1.00 53.33 H new ATOM 0 HD3 ARG A 51 -1.652 7.041 -11.096 1.00 53.33 H new ATOM 0 HE ARG A 51 0.795 7.712 -12.534 1.00 42.13 H new ATOM 0 HH11 ARG A 51 -2.731 7.846 -12.595 1.00 73.03 H new ATOM 0 HH12 ARG A 51 -2.813 7.908 -14.359 1.00 73.03 H new ATOM 0 HH21 ARG A 51 0.682 7.793 -14.799 1.00 52.24 H new ATOM 0 HH22 ARG A 51 -0.890 7.878 -15.601 1.00 52.24 H new ATOM 852 N ILE A 52 -0.413 9.195 -5.854 1.00 45.13 N ATOM 853 CA ILE A 52 0.116 9.814 -4.644 1.00 74.00 C ATOM 854 C ILE A 52 1.554 9.377 -4.386 1.00 32.13 C ATOM 855 O ILE A 52 1.887 8.199 -4.509 1.00 41.21 O ATOM 856 CB ILE A 52 -0.743 9.466 -3.414 1.00 25.44 C ATOM 857 CG1 ILE A 52 -2.190 9.915 -3.631 1.00 75.21 C ATOM 858 CG2 ILE A 52 -0.164 10.113 -2.164 1.00 24.11 C ATOM 859 CD1 ILE A 52 -2.327 11.393 -3.921 1.00 51.24 C ATOM 0 H ILE A 52 -1.180 8.542 -5.694 1.00 45.13 H new ATOM 0 HA ILE A 52 0.090 10.892 -4.803 1.00 74.00 H new ATOM 0 HB ILE A 52 -0.735 8.385 -3.278 1.00 25.44 H new ATOM 0 HG12 ILE A 52 -2.617 9.349 -4.459 1.00 75.21 H new ATOM 0 HG13 ILE A 52 -2.774 9.671 -2.744 1.00 75.21 H new ATOM 0 HG21 ILE A 52 -0.782 9.858 -1.303 1.00 24.11 H new ATOM 0 HG22 ILE A 52 0.851 9.749 -2.003 1.00 24.11 H new ATOM 0 HG23 ILE A 52 -0.146 11.196 -2.290 1.00 24.11 H new ATOM 0 HD11 ILE A 52 -3.379 11.640 -4.064 1.00 51.24 H new ATOM 0 HD12 ILE A 52 -1.930 11.966 -3.083 1.00 51.24 H new ATOM 0 HD13 ILE A 52 -1.771 11.639 -4.825 1.00 51.24 H new ATOM 871 N ASN A 53 2.402 10.335 -4.027 1.00 33.44 N ATOM 872 CA ASN A 53 3.805 10.049 -3.749 1.00 11.32 C ATOM 873 C ASN A 53 3.940 8.896 -2.760 1.00 1.20 C ATOM 874 O ASN A 53 3.205 8.819 -1.776 1.00 0.01 O ATOM 875 CB ASN A 53 4.501 11.295 -3.196 1.00 30.34 C ATOM 876 CG ASN A 53 5.693 10.952 -2.323 1.00 35.23 C ATOM 877 OD1 ASN A 53 6.553 10.160 -2.711 1.00 23.14 O ATOM 878 ND2 ASN A 53 5.748 11.546 -1.137 1.00 11.04 N ATOM 0 H ASN A 53 2.142 11.316 -3.922 1.00 33.44 H new ATOM 0 HA ASN A 53 4.283 9.759 -4.685 1.00 11.32 H new ATOM 0 HB2 ASN A 53 4.830 11.922 -4.025 1.00 30.34 H new ATOM 0 HB3 ASN A 53 3.786 11.880 -2.617 1.00 30.34 H new ATOM 0 HD21 ASN A 53 6.525 11.353 -0.506 1.00 11.04 H new ATOM 0 HD22 ASN A 53 5.013 12.195 -0.857 1.00 11.04 H new ATOM 885 N ALA A 54 4.885 8.000 -3.029 1.00 2.51 N ATOM 886 CA ALA A 54 5.119 6.853 -2.162 1.00 53.24 C ATOM 887 C ALA A 54 5.488 7.297 -0.750 1.00 14.52 C ATOM 888 O ALA A 54 5.073 6.683 0.232 1.00 1.53 O ATOM 889 CB ALA A 54 6.213 5.967 -2.742 1.00 5.54 C ATOM 0 H ALA A 54 5.501 8.047 -3.841 1.00 2.51 H new ATOM 0 HA ALA A 54 4.194 6.279 -2.104 1.00 53.24 H new ATOM 0 HB1 ALA A 54 6.377 5.114 -2.084 1.00 5.54 H new ATOM 0 HB2 ALA A 54 5.910 5.612 -3.727 1.00 5.54 H new ATOM 0 HB3 ALA A 54 7.136 6.540 -2.831 1.00 5.54 H new ATOM 895 N GLY A 55 6.270 8.367 -0.658 1.00 45.23 N ATOM 896 CA GLY A 55 6.683 8.875 0.638 1.00 12.20 C ATOM 897 C GLY A 55 5.504 9.212 1.530 1.00 73.32 C ATOM 898 O GLY A 55 5.435 8.764 2.675 1.00 73.04 O ATOM 0 H GLY A 55 6.625 8.892 -1.457 1.00 45.23 H new ATOM 0 HA2 GLY A 55 7.309 8.133 1.133 1.00 12.20 H new ATOM 0 HA3 GLY A 55 7.295 9.766 0.498 1.00 12.20 H new ATOM 902 N VAL A 56 4.575 10.005 1.006 1.00 73.44 N ATOM 903 CA VAL A 56 3.394 10.402 1.764 1.00 52.04 C ATOM 904 C VAL A 56 2.419 9.240 1.910 1.00 13.13 C ATOM 905 O VAL A 56 1.741 9.109 2.929 1.00 22.14 O ATOM 906 CB VAL A 56 2.670 11.585 1.093 1.00 32.53 C ATOM 907 CG1 VAL A 56 2.291 11.238 -0.338 1.00 43.42 C ATOM 908 CG2 VAL A 56 1.441 11.981 1.898 1.00 72.11 C ATOM 0 H VAL A 56 4.617 10.385 0.060 1.00 73.44 H new ATOM 0 HA VAL A 56 3.739 10.709 2.752 1.00 52.04 H new ATOM 0 HB VAL A 56 3.350 12.437 1.066 1.00 32.53 H new ATOM 0 HG11 VAL A 56 1.781 12.086 -0.795 1.00 43.42 H new ATOM 0 HG12 VAL A 56 3.191 11.007 -0.907 1.00 43.42 H new ATOM 0 HG13 VAL A 56 1.629 10.372 -0.339 1.00 43.42 H new ATOM 0 HG21 VAL A 56 0.941 12.818 1.411 1.00 72.11 H new ATOM 0 HG22 VAL A 56 0.757 11.135 1.958 1.00 72.11 H new ATOM 0 HG23 VAL A 56 1.744 12.275 2.903 1.00 72.11 H new ATOM 918 N SER A 57 2.352 8.397 0.883 1.00 60.51 N ATOM 919 CA SER A 57 1.456 7.246 0.897 1.00 43.33 C ATOM 920 C SER A 57 1.908 6.218 1.929 1.00 52.32 C ATOM 921 O SER A 57 1.135 5.351 2.337 1.00 41.31 O ATOM 922 CB SER A 57 1.399 6.603 -0.491 1.00 3.33 C ATOM 923 OG SER A 57 1.081 5.225 -0.401 1.00 63.11 O ATOM 0 H SER A 57 2.907 8.490 0.032 1.00 60.51 H new ATOM 0 HA SER A 57 0.460 7.594 1.170 1.00 43.33 H new ATOM 0 HB2 SER A 57 0.653 7.113 -1.101 1.00 3.33 H new ATOM 0 HB3 SER A 57 2.359 6.726 -0.992 1.00 3.33 H new ATOM 0 HG SER A 57 1.049 4.837 -1.300 1.00 63.11 H new ATOM 929 N SER A 58 3.166 6.320 2.346 1.00 54.22 N ATOM 930 CA SER A 58 3.723 5.397 3.327 1.00 51.31 C ATOM 931 C SER A 58 3.311 5.793 4.741 1.00 31.34 C ATOM 932 O SER A 58 2.903 4.949 5.538 1.00 24.32 O ATOM 933 CB SER A 58 5.249 5.364 3.219 1.00 2.41 C ATOM 934 OG SER A 58 5.718 4.042 3.020 1.00 42.32 O ATOM 0 H SER A 58 3.819 7.033 2.020 1.00 54.22 H new ATOM 0 HA SER A 58 3.329 4.402 3.118 1.00 51.31 H new ATOM 0 HB2 SER A 58 5.572 5.996 2.392 1.00 2.41 H new ATOM 0 HB3 SER A 58 5.690 5.777 4.126 1.00 2.41 H new ATOM 0 HG SER A 58 6.696 4.048 2.953 1.00 42.32 H new ATOM 940 N GLN A 59 3.421 7.083 5.044 1.00 11.21 N ATOM 941 CA GLN A 59 3.060 7.591 6.362 1.00 50.23 C ATOM 942 C GLN A 59 1.550 7.542 6.570 1.00 14.23 C ATOM 943 O GLN A 59 1.073 7.302 7.680 1.00 44.11 O ATOM 944 CB GLN A 59 3.563 9.025 6.534 1.00 43.34 C ATOM 945 CG GLN A 59 3.056 9.981 5.465 1.00 53.32 C ATOM 946 CD GLN A 59 3.624 11.378 5.614 1.00 53.11 C ATOM 947 OE1 GLN A 59 2.862 12.376 5.182 1.00 53.43 O flip ATOM 948 NE2 GLN A 59 4.736 11.559 6.112 1.00 63.30 N flip ATOM 0 H GLN A 59 3.757 7.794 4.395 1.00 11.21 H new ATOM 0 HA GLN A 59 3.532 6.955 7.110 1.00 50.23 H new ATOM 0 HB2 GLN A 59 3.257 9.393 7.513 1.00 43.34 H new ATOM 0 HB3 GLN A 59 4.653 9.023 6.520 1.00 43.34 H new ATOM 0 HG2 GLN A 59 3.316 9.590 4.481 1.00 53.32 H new ATOM 0 HG3 GLN A 59 1.968 10.028 5.512 1.00 53.32 H new ATOM 0 HE21 GLN A 59 5.288 10.763 6.431 1.00 63.30 H new ATOM 0 HE22 GLN A 59 5.105 12.505 6.206 1.00 63.30 H new ATOM 957 N LEU A 60 0.802 7.770 5.495 1.00 34.21 N ATOM 958 CA LEU A 60 -0.655 7.751 5.560 1.00 10.20 C ATOM 959 C LEU A 60 -1.163 6.394 6.039 1.00 64.41 C ATOM 960 O LEU A 60 -2.128 6.312 6.799 1.00 4.23 O ATOM 961 CB LEU A 60 -1.250 8.074 4.189 1.00 13.51 C ATOM 962 CG LEU A 60 -2.725 8.480 4.175 1.00 20.11 C ATOM 963 CD1 LEU A 60 -2.899 9.836 3.510 1.00 1.35 C ATOM 964 CD2 LEU A 60 -3.562 7.425 3.466 1.00 21.42 C ATOM 0 H LEU A 60 1.180 7.970 4.569 1.00 34.21 H new ATOM 0 HA LEU A 60 -0.971 8.510 6.276 1.00 10.20 H new ATOM 0 HB2 LEU A 60 -0.668 8.881 3.744 1.00 13.51 H new ATOM 0 HB3 LEU A 60 -1.128 7.201 3.548 1.00 13.51 H new ATOM 0 HG LEU A 60 -3.071 8.557 5.206 1.00 20.11 H new ATOM 0 HD11 LEU A 60 -3.954 10.108 3.509 1.00 1.35 H new ATOM 0 HD12 LEU A 60 -2.331 10.586 4.060 1.00 1.35 H new ATOM 0 HD13 LEU A 60 -2.536 9.787 2.483 1.00 1.35 H new ATOM 0 HD21 LEU A 60 -4.608 7.730 3.466 1.00 21.42 H new ATOM 0 HD22 LEU A 60 -3.215 7.316 2.438 1.00 21.42 H new ATOM 0 HD23 LEU A 60 -3.462 6.472 3.986 1.00 21.42 H new ATOM 976 N THR A 61 -0.502 5.330 5.593 1.00 10.12 N ATOM 977 CA THR A 61 -0.885 3.977 5.977 1.00 31.04 C ATOM 978 C THR A 61 -0.566 3.711 7.444 1.00 52.24 C ATOM 979 O THR A 61 -1.321 3.032 8.140 1.00 10.35 O ATOM 980 CB THR A 61 -0.171 2.924 5.108 1.00 63.45 C ATOM 981 OG1 THR A 61 0.135 3.475 3.823 1.00 71.21 O ATOM 982 CG2 THR A 61 -1.035 1.684 4.942 1.00 35.24 C ATOM 0 H THR A 61 0.301 5.379 4.966 1.00 10.12 H new ATOM 0 HA THR A 61 -1.961 3.896 5.822 1.00 31.04 H new ATOM 0 HB THR A 61 0.754 2.638 5.609 1.00 63.45 H new ATOM 0 HG1 THR A 61 0.590 2.800 3.278 1.00 71.21 H new ATOM 0 HG21 THR A 61 -0.510 0.955 4.325 1.00 35.24 H new ATOM 0 HG22 THR A 61 -1.241 1.250 5.921 1.00 35.24 H new ATOM 0 HG23 THR A 61 -1.974 1.957 4.461 1.00 35.24 H new ATOM 990 N SER A 62 0.556 4.250 7.907 1.00 64.51 N ATOM 991 CA SER A 62 0.977 4.068 9.292 1.00 33.41 C ATOM 992 C SER A 62 0.023 4.778 10.247 1.00 22.14 C ATOM 993 O SER A 62 -0.269 4.281 11.334 1.00 4.44 O ATOM 994 CB SER A 62 2.400 4.595 9.488 1.00 72.44 C ATOM 995 OG SER A 62 3.341 3.789 8.801 1.00 44.25 O ATOM 0 H SER A 62 1.191 4.816 7.344 1.00 64.51 H new ATOM 0 HA SER A 62 0.959 3.001 9.515 1.00 33.41 H new ATOM 0 HB2 SER A 62 2.464 5.622 9.127 1.00 72.44 H new ATOM 0 HB3 SER A 62 2.641 4.615 10.551 1.00 72.44 H new ATOM 0 HG SER A 62 4.242 4.147 8.940 1.00 44.25 H new ATOM 1001 N ALA A 63 -0.460 5.945 9.832 1.00 64.03 N ATOM 1002 CA ALA A 63 -1.382 6.725 10.649 1.00 63.13 C ATOM 1003 C ALA A 63 -2.770 6.094 10.662 1.00 50.01 C ATOM 1004 O ALA A 63 -3.299 5.755 11.721 1.00 41.10 O ATOM 1005 CB ALA A 63 -1.455 8.157 10.141 1.00 35.22 C ATOM 0 H ALA A 63 -0.228 6.371 8.935 1.00 64.03 H new ATOM 0 HA ALA A 63 -1.006 6.734 11.672 1.00 63.13 H new ATOM 0 HB1 ALA A 63 -2.147 8.728 10.760 1.00 35.22 H new ATOM 0 HB2 ALA A 63 -0.465 8.611 10.189 1.00 35.22 H new ATOM 0 HB3 ALA A 63 -1.805 8.159 9.109 1.00 35.22 H new ATOM 1011 N VAL A 64 -3.357 5.940 9.479 1.00 44.21 N ATOM 1012 CA VAL A 64 -4.685 5.350 9.355 1.00 42.25 C ATOM 1013 C VAL A 64 -4.771 4.028 10.107 1.00 61.54 C ATOM 1014 O VAL A 64 -5.786 3.722 10.732 1.00 74.15 O ATOM 1015 CB VAL A 64 -5.057 5.114 7.879 1.00 12.41 C ATOM 1016 CG1 VAL A 64 -6.387 4.384 7.775 1.00 14.24 C ATOM 1017 CG2 VAL A 64 -5.102 6.434 7.124 1.00 54.43 C ATOM 0 H VAL A 64 -2.934 6.216 8.593 1.00 44.21 H new ATOM 0 HA VAL A 64 -5.389 6.059 9.791 1.00 42.25 H new ATOM 0 HB VAL A 64 -4.290 4.488 7.423 1.00 12.41 H new ATOM 0 HG11 VAL A 64 -6.634 4.226 6.725 1.00 14.24 H new ATOM 0 HG12 VAL A 64 -6.314 3.421 8.280 1.00 14.24 H new ATOM 0 HG13 VAL A 64 -7.168 4.982 8.245 1.00 14.24 H new ATOM 0 HG21 VAL A 64 -5.366 6.249 6.083 1.00 54.43 H new ATOM 0 HG22 VAL A 64 -5.848 7.087 7.577 1.00 54.43 H new ATOM 0 HG23 VAL A 64 -4.124 6.913 7.170 1.00 54.43 H new ATOM 1027 N SER A 65 -3.697 3.247 10.044 1.00 73.04 N ATOM 1028 CA SER A 65 -3.652 1.953 10.718 1.00 43.43 C ATOM 1029 C SER A 65 -3.722 2.127 12.232 1.00 2.12 C ATOM 1030 O SER A 65 -4.334 1.319 12.931 1.00 24.20 O ATOM 1031 CB SER A 65 -2.375 1.202 10.338 1.00 74.01 C ATOM 1032 OG SER A 65 -1.221 1.927 10.725 1.00 25.01 O ATOM 0 H SER A 65 -2.847 3.487 9.534 1.00 73.04 H new ATOM 0 HA SER A 65 -4.516 1.372 10.396 1.00 43.43 H new ATOM 0 HB2 SER A 65 -2.370 0.222 10.816 1.00 74.01 H new ATOM 0 HB3 SER A 65 -2.357 1.031 9.262 1.00 74.01 H new ATOM 0 HG SER A 65 -1.456 2.869 10.858 1.00 25.01 H new ATOM 1038 N GLN A 66 -3.093 3.186 12.730 1.00 64.05 N ATOM 1039 CA GLN A 66 -3.083 3.465 14.161 1.00 41.53 C ATOM 1040 C GLN A 66 -4.479 3.835 14.652 1.00 22.41 C ATOM 1041 O GLN A 66 -4.959 3.296 15.649 1.00 4.31 O ATOM 1042 CB GLN A 66 -2.102 4.597 14.474 1.00 12.11 C ATOM 1043 CG GLN A 66 -2.040 4.956 15.950 1.00 10.44 C ATOM 1044 CD GLN A 66 -1.125 4.038 16.737 1.00 13.32 C ATOM 1045 OE1 GLN A 66 -1.517 3.485 17.765 1.00 53.14 O ATOM 1046 NE2 GLN A 66 0.101 3.870 16.255 1.00 32.53 N ATOM 0 H GLN A 66 -2.584 3.865 12.164 1.00 64.05 H new ATOM 0 HA GLN A 66 -2.762 2.562 14.681 1.00 41.53 H new ATOM 0 HB2 GLN A 66 -1.107 4.308 14.137 1.00 12.11 H new ATOM 0 HB3 GLN A 66 -2.387 5.482 13.905 1.00 12.11 H new ATOM 0 HG2 GLN A 66 -1.694 5.984 16.055 1.00 10.44 H new ATOM 0 HG3 GLN A 66 -3.044 4.912 16.373 1.00 10.44 H new ATOM 0 HE21 GLN A 66 0.383 4.349 15.399 1.00 32.53 H new ATOM 0 HE22 GLN A 66 0.761 3.262 16.740 1.00 32.53 H new ATOM 1055 N ALA A 67 -5.123 4.759 13.947 1.00 14.52 N ATOM 1056 CA ALA A 67 -6.465 5.199 14.310 1.00 31.00 C ATOM 1057 C ALA A 67 -7.464 4.051 14.219 1.00 52.43 C ATOM 1058 O ALA A 67 -8.314 3.883 15.093 1.00 72.24 O ATOM 1059 CB ALA A 67 -6.900 6.354 13.421 1.00 54.32 C ATOM 0 H ALA A 67 -4.738 5.217 13.121 1.00 14.52 H new ATOM 0 HA ALA A 67 -6.441 5.541 15.345 1.00 31.00 H new ATOM 0 HB1 ALA A 67 -7.904 6.672 13.703 1.00 54.32 H new ATOM 0 HB2 ALA A 67 -6.208 7.187 13.542 1.00 54.32 H new ATOM 0 HB3 ALA A 67 -6.901 6.031 12.380 1.00 54.32 H new ATOM 1065 N VAL A 68 -7.357 3.264 13.152 1.00 31.31 N ATOM 1066 CA VAL A 68 -8.252 2.131 12.946 1.00 64.12 C ATOM 1067 C VAL A 68 -7.966 1.017 13.947 1.00 32.33 C ATOM 1068 O VAL A 68 -8.819 0.166 14.204 1.00 45.53 O ATOM 1069 CB VAL A 68 -8.124 1.568 11.517 1.00 22.54 C ATOM 1070 CG1 VAL A 68 -9.029 0.360 11.337 1.00 35.52 C ATOM 1071 CG2 VAL A 68 -8.445 2.643 10.491 1.00 2.04 C ATOM 0 H VAL A 68 -6.660 3.390 12.418 1.00 31.31 H new ATOM 0 HA VAL A 68 -9.268 2.498 13.095 1.00 64.12 H new ATOM 0 HB VAL A 68 -7.094 1.246 11.362 1.00 22.54 H new ATOM 0 HG11 VAL A 68 -8.925 -0.024 10.322 1.00 35.52 H new ATOM 0 HG12 VAL A 68 -8.747 -0.415 12.049 1.00 35.52 H new ATOM 0 HG13 VAL A 68 -10.065 0.652 11.510 1.00 35.52 H new ATOM 0 HG21 VAL A 68 -8.350 2.228 9.488 1.00 2.04 H new ATOM 0 HG22 VAL A 68 -9.465 2.997 10.642 1.00 2.04 H new ATOM 0 HG23 VAL A 68 -7.751 3.475 10.607 1.00 2.04 H new ATOM 1081 N ALA A 69 -6.763 1.028 14.510 1.00 22.31 N ATOM 1082 CA ALA A 69 -6.367 0.020 15.486 1.00 43.53 C ATOM 1083 C ALA A 69 -6.685 0.475 16.906 1.00 74.20 C ATOM 1084 O ALA A 69 -6.573 -0.300 17.855 1.00 2.11 O ATOM 1085 CB ALA A 69 -4.884 -0.291 15.350 1.00 40.34 C ATOM 0 H ALA A 69 -6.045 1.724 14.307 1.00 22.31 H new ATOM 0 HA ALA A 69 -6.938 -0.887 15.287 1.00 43.53 H new ATOM 0 HB1 ALA A 69 -4.602 -1.045 16.085 1.00 40.34 H new ATOM 0 HB2 ALA A 69 -4.682 -0.667 14.347 1.00 40.34 H new ATOM 0 HB3 ALA A 69 -4.305 0.616 15.521 1.00 40.34 H new ATOM 1091 N ASN A 70 -7.083 1.736 17.044 1.00 40.32 N ATOM 1092 CA ASN A 70 -7.416 2.294 18.349 1.00 40.13 C ATOM 1093 C ASN A 70 -8.926 2.446 18.505 1.00 3.14 C ATOM 1094 O ASN A 70 -9.438 2.549 19.620 1.00 1.43 O ATOM 1095 CB ASN A 70 -6.733 3.650 18.537 1.00 54.02 C ATOM 1096 CG ASN A 70 -5.220 3.543 18.518 1.00 54.31 C ATOM 1097 OD1 ASN A 70 -4.661 2.465 18.719 1.00 70.33 O ATOM 1098 ND2 ASN A 70 -4.551 4.664 18.276 1.00 40.32 N ATOM 0 H ASN A 70 -7.183 2.390 16.268 1.00 40.32 H new ATOM 0 HA ASN A 70 -7.057 1.605 19.114 1.00 40.13 H new ATOM 0 HB2 ASN A 70 -7.056 4.329 17.748 1.00 54.02 H new ATOM 0 HB3 ASN A 70 -7.052 4.086 19.484 1.00 54.02 H new ATOM 0 HD21 ASN A 70 -3.531 4.654 18.251 1.00 40.32 H new ATOM 0 HD22 ASN A 70 -5.057 5.535 18.115 1.00 40.32 H new ATOM 1105 N VAL A 71 -9.634 2.460 17.380 1.00 44.13 N ATOM 1106 CA VAL A 71 -11.086 2.598 17.391 1.00 64.34 C ATOM 1107 C VAL A 71 -11.738 1.477 18.192 1.00 10.30 C ATOM 1108 O VAL A 71 -12.883 1.596 18.626 1.00 13.14 O ATOM 1109 CB VAL A 71 -11.660 2.596 15.962 1.00 64.41 C ATOM 1110 CG1 VAL A 71 -11.233 1.341 15.217 1.00 53.03 C ATOM 1111 CG2 VAL A 71 -13.177 2.715 15.998 1.00 65.23 C ATOM 0 H VAL A 71 -9.226 2.377 16.449 1.00 44.13 H new ATOM 0 HA VAL A 71 -11.310 3.555 17.863 1.00 64.34 H new ATOM 0 HB VAL A 71 -11.263 3.459 15.428 1.00 64.41 H new ATOM 0 HG11 VAL A 71 -11.648 1.357 14.209 1.00 53.03 H new ATOM 0 HG12 VAL A 71 -10.145 1.304 15.161 1.00 53.03 H new ATOM 0 HG13 VAL A 71 -11.599 0.461 15.746 1.00 53.03 H new ATOM 0 HG21 VAL A 71 -13.566 2.712 14.980 1.00 65.23 H new ATOM 0 HG22 VAL A 71 -13.595 1.872 16.549 1.00 65.23 H new ATOM 0 HG23 VAL A 71 -13.457 3.646 16.491 1.00 65.23 H new ATOM 1121 N ARG A 72 -11.001 0.388 18.383 1.00 31.34 N ATOM 1122 CA ARG A 72 -11.509 -0.757 19.131 1.00 25.01 C ATOM 1123 C ARG A 72 -12.687 -1.400 18.407 1.00 71.04 C ATOM 1124 O ARG A 72 -13.581 -0.722 17.899 1.00 21.24 O ATOM 1125 CB ARG A 72 -11.933 -0.325 20.536 1.00 73.15 C ATOM 1126 CG ARG A 72 -12.491 -1.462 21.378 1.00 3.32 C ATOM 1127 CD ARG A 72 -11.409 -2.108 22.229 1.00 11.41 C ATOM 1128 NE ARG A 72 -11.295 -1.476 23.541 1.00 44.45 N ATOM 1129 CZ ARG A 72 -10.534 -1.951 24.521 1.00 64.52 C ATOM 1130 NH1 ARG A 72 -9.825 -3.057 24.339 1.00 14.22 N ATOM 1131 NH2 ARG A 72 -10.481 -1.319 25.687 1.00 75.51 N ATOM 0 H ARG A 72 -10.051 0.274 18.031 1.00 31.34 H new ATOM 0 HA ARG A 72 -10.709 -1.493 19.210 1.00 25.01 H new ATOM 0 HB2 ARG A 72 -11.074 0.109 21.049 1.00 73.15 H new ATOM 0 HB3 ARG A 72 -12.685 0.459 20.455 1.00 73.15 H new ATOM 0 HG2 ARG A 72 -13.285 -1.084 22.022 1.00 3.32 H new ATOM 0 HG3 ARG A 72 -12.940 -2.212 20.727 1.00 3.32 H new ATOM 0 HD2 ARG A 72 -11.631 -3.168 22.355 1.00 11.41 H new ATOM 0 HD3 ARG A 72 -10.452 -2.042 21.711 1.00 11.41 H new ATOM 0 HE ARG A 72 -11.828 -0.624 23.714 1.00 44.45 H new ATOM 0 HH11 ARG A 72 -9.863 -3.546 23.444 1.00 14.22 H new ATOM 0 HH12 ARG A 72 -9.242 -3.419 25.094 1.00 14.22 H new ATOM 0 HH21 ARG A 72 -11.025 -0.468 25.831 1.00 75.51 H new ATOM 0 HH22 ARG A 72 -9.897 -1.684 26.439 1.00 75.51 H new ATOM 1145 N PRO A 73 -12.690 -2.740 18.355 1.00 41.22 N ATOM 1146 CA PRO A 73 -13.752 -3.505 17.696 1.00 51.24 C ATOM 1147 C PRO A 73 -15.074 -3.434 18.452 1.00 62.02 C ATOM 1148 O PRO A 73 -15.093 -3.300 19.675 1.00 11.31 O ATOM 1149 CB PRO A 73 -13.211 -4.937 17.696 1.00 32.23 C ATOM 1150 CG PRO A 73 -12.265 -4.984 18.846 1.00 33.54 C ATOM 1151 CD PRO A 73 -11.656 -3.612 18.938 1.00 71.20 C ATOM 0 HA PRO A 73 -13.974 -3.119 16.701 1.00 51.24 H new ATOM 0 HB2 PRO A 73 -14.015 -5.664 17.814 1.00 32.23 H new ATOM 0 HB3 PRO A 73 -12.706 -5.170 16.758 1.00 32.23 H new ATOM 0 HG2 PRO A 73 -12.785 -5.243 19.768 1.00 33.54 H new ATOM 0 HG3 PRO A 73 -11.497 -5.742 18.689 1.00 33.54 H new ATOM 0 HD2 PRO A 73 -11.435 -3.339 19.970 1.00 71.20 H new ATOM 0 HD3 PRO A 73 -10.719 -3.550 18.384 1.00 71.20 H new ATOM 1159 N GLY A 74 -16.178 -3.525 17.718 1.00 55.31 N ATOM 1160 CA GLY A 74 -17.488 -3.469 18.337 1.00 14.24 C ATOM 1161 C GLY A 74 -18.100 -2.083 18.277 1.00 31.30 C ATOM 1162 O GLY A 74 -19.147 -1.834 18.873 1.00 22.24 O ATOM 0 H GLY A 74 -16.188 -3.637 16.704 1.00 55.31 H new ATOM 0 HA2 GLY A 74 -18.151 -4.177 17.841 1.00 14.24 H new ATOM 0 HA3 GLY A 74 -17.408 -3.783 19.378 1.00 14.24 H new ATOM 1166 N SER A 75 -17.444 -1.180 17.557 1.00 65.03 N ATOM 1167 CA SER A 75 -17.925 0.191 17.426 1.00 34.42 C ATOM 1168 C SER A 75 -18.602 0.402 16.075 1.00 62.13 C ATOM 1169 O SER A 75 -18.296 -0.286 15.102 1.00 51.02 O ATOM 1170 CB SER A 75 -16.769 1.178 17.591 1.00 42.14 C ATOM 1171 OG SER A 75 -16.164 1.049 18.866 1.00 72.23 O ATOM 0 H SER A 75 -16.577 -1.372 17.055 1.00 65.03 H new ATOM 0 HA SER A 75 -18.659 0.369 18.212 1.00 34.42 H new ATOM 0 HB2 SER A 75 -16.025 1.005 16.813 1.00 42.14 H new ATOM 0 HB3 SER A 75 -17.135 2.196 17.460 1.00 42.14 H new ATOM 0 HG SER A 75 -15.331 0.539 18.783 1.00 72.23 H new ATOM 1177 N SER A 76 -19.523 1.358 16.026 1.00 1.43 N ATOM 1178 CA SER A 76 -20.247 1.658 14.796 1.00 11.41 C ATOM 1179 C SER A 76 -19.279 1.939 13.651 1.00 41.11 C ATOM 1180 O SER A 76 -18.100 2.226 13.856 1.00 63.54 O ATOM 1181 CB SER A 76 -21.172 2.860 15.003 1.00 63.52 C ATOM 1182 OG SER A 76 -22.528 2.498 14.815 1.00 53.30 O ATOM 0 H SER A 76 -19.786 1.938 16.823 1.00 1.43 H new ATOM 0 HA SER A 76 -20.848 0.787 14.536 1.00 11.41 H new ATOM 0 HB2 SER A 76 -21.035 3.259 16.008 1.00 63.52 H new ATOM 0 HB3 SER A 76 -20.904 3.653 14.305 1.00 63.52 H new ATOM 0 HG SER A 76 -22.954 3.133 14.202 1.00 53.30 H new ATOM 1188 N PRO A 77 -19.788 1.855 12.412 1.00 20.44 N ATOM 1189 CA PRO A 77 -18.987 2.097 11.209 1.00 4.52 C ATOM 1190 C PRO A 77 -18.600 3.564 11.055 1.00 23.51 C ATOM 1191 O PRO A 77 -17.819 3.921 10.174 1.00 60.15 O ATOM 1192 CB PRO A 77 -19.918 1.669 10.072 1.00 71.03 C ATOM 1193 CG PRO A 77 -21.291 1.829 10.625 1.00 51.41 C ATOM 1194 CD PRO A 77 -21.186 1.518 12.092 1.00 41.11 C ATOM 0 HA PRO A 77 -18.042 1.555 11.233 1.00 4.52 H new ATOM 0 HB2 PRO A 77 -19.773 2.289 9.187 1.00 71.03 H new ATOM 0 HB3 PRO A 77 -19.729 0.638 9.773 1.00 71.03 H new ATOM 0 HG2 PRO A 77 -21.660 2.842 10.466 1.00 51.41 H new ATOM 0 HG3 PRO A 77 -21.991 1.154 10.132 1.00 51.41 H new ATOM 0 HD2 PRO A 77 -21.887 2.111 12.680 1.00 41.11 H new ATOM 0 HD3 PRO A 77 -21.404 0.470 12.297 1.00 41.11 H new ATOM 1202 N ALA A 78 -19.151 4.410 11.920 1.00 45.44 N ATOM 1203 CA ALA A 78 -18.859 5.838 11.881 1.00 32.35 C ATOM 1204 C ALA A 78 -17.455 6.127 12.401 1.00 74.11 C ATOM 1205 O ALA A 78 -16.728 6.941 11.833 1.00 71.34 O ATOM 1206 CB ALA A 78 -19.892 6.609 12.690 1.00 33.32 C ATOM 0 H ALA A 78 -19.801 4.132 12.655 1.00 45.44 H new ATOM 0 HA ALA A 78 -18.907 6.165 10.842 1.00 32.35 H new ATOM 0 HB1 ALA A 78 -19.662 7.674 12.653 1.00 33.32 H new ATOM 0 HB2 ALA A 78 -20.884 6.437 12.272 1.00 33.32 H new ATOM 0 HB3 ALA A 78 -19.871 6.269 13.725 1.00 33.32 H new ATOM 1212 N VAL A 79 -17.081 5.455 13.485 1.00 42.33 N ATOM 1213 CA VAL A 79 -15.763 5.639 14.081 1.00 22.41 C ATOM 1214 C VAL A 79 -14.666 5.109 13.165 1.00 23.01 C ATOM 1215 O VAL A 79 -13.584 5.690 13.074 1.00 55.33 O ATOM 1216 CB VAL A 79 -15.662 4.933 15.447 1.00 64.15 C ATOM 1217 CG1 VAL A 79 -16.380 5.738 16.519 1.00 44.12 C ATOM 1218 CG2 VAL A 79 -16.225 3.523 15.360 1.00 71.04 C ATOM 0 H VAL A 79 -17.672 4.778 13.968 1.00 42.33 H new ATOM 0 HA VAL A 79 -15.627 6.711 14.223 1.00 22.41 H new ATOM 0 HB VAL A 79 -14.610 4.863 15.724 1.00 64.15 H new ATOM 0 HG11 VAL A 79 -16.298 5.224 17.476 1.00 44.12 H new ATOM 0 HG12 VAL A 79 -15.926 6.726 16.598 1.00 44.12 H new ATOM 0 HG13 VAL A 79 -17.432 5.842 16.252 1.00 44.12 H new ATOM 0 HG21 VAL A 79 -16.146 3.039 16.333 1.00 71.04 H new ATOM 0 HG22 VAL A 79 -17.272 3.567 15.061 1.00 71.04 H new ATOM 0 HG23 VAL A 79 -15.661 2.951 14.623 1.00 71.04 H new ATOM 1228 N TYR A 80 -14.953 4.004 12.486 1.00 72.51 N ATOM 1229 CA TYR A 80 -13.990 3.393 11.578 1.00 40.23 C ATOM 1230 C TYR A 80 -13.703 4.310 10.392 1.00 75.41 C ATOM 1231 O TYR A 80 -12.551 4.497 10.003 1.00 51.42 O ATOM 1232 CB TYR A 80 -14.512 2.044 11.079 1.00 44.41 C ATOM 1233 CG TYR A 80 -14.253 0.904 12.038 1.00 55.14 C ATOM 1234 CD1 TYR A 80 -15.156 0.603 13.050 1.00 51.32 C ATOM 1235 CD2 TYR A 80 -13.105 0.127 11.931 1.00 22.13 C ATOM 1236 CE1 TYR A 80 -14.923 -0.438 13.929 1.00 13.33 C ATOM 1237 CE2 TYR A 80 -12.866 -0.916 12.804 1.00 65.31 C ATOM 1238 CZ TYR A 80 -13.777 -1.194 13.801 1.00 51.03 C ATOM 1239 OH TYR A 80 -13.541 -2.233 14.673 1.00 24.53 O ATOM 0 H TYR A 80 -15.845 3.513 12.547 1.00 72.51 H new ATOM 0 HA TYR A 80 -13.061 3.235 12.126 1.00 40.23 H new ATOM 0 HB2 TYR A 80 -15.585 2.122 10.901 1.00 44.41 H new ATOM 0 HB3 TYR A 80 -14.046 1.815 10.121 1.00 44.41 H new ATOM 0 HD1 TYR A 80 -16.055 1.192 13.152 1.00 51.32 H new ATOM 0 HD2 TYR A 80 -12.388 0.343 11.152 1.00 22.13 H new ATOM 0 HE1 TYR A 80 -15.634 -0.658 14.711 1.00 13.33 H new ATOM 0 HE2 TYR A 80 -11.970 -1.511 12.706 1.00 65.31 H new ATOM 0 HH TYR A 80 -12.691 -2.665 14.445 1.00 24.53 H new ATOM 1249 N ALA A 81 -14.761 4.879 9.823 1.00 33.14 N ATOM 1250 CA ALA A 81 -14.625 5.779 8.684 1.00 74.42 C ATOM 1251 C ALA A 81 -13.868 7.044 9.072 1.00 64.32 C ATOM 1252 O ALA A 81 -13.121 7.604 8.269 1.00 15.32 O ATOM 1253 CB ALA A 81 -15.994 6.130 8.123 1.00 23.23 C ATOM 0 H ALA A 81 -15.722 4.733 10.132 1.00 33.14 H new ATOM 0 HA ALA A 81 -14.050 5.266 7.913 1.00 74.42 H new ATOM 0 HB1 ALA A 81 -15.877 6.803 7.273 1.00 23.23 H new ATOM 0 HB2 ALA A 81 -16.499 5.220 7.799 1.00 23.23 H new ATOM 0 HB3 ALA A 81 -16.589 6.620 8.894 1.00 23.23 H new ATOM 1259 N LYS A 82 -14.066 7.491 10.308 1.00 2.11 N ATOM 1260 CA LYS A 82 -13.401 8.691 10.803 1.00 33.12 C ATOM 1261 C LYS A 82 -11.937 8.410 11.123 1.00 34.12 C ATOM 1262 O LYS A 82 -11.072 9.257 10.905 1.00 62.24 O ATOM 1263 CB LYS A 82 -14.116 9.216 12.051 1.00 61.41 C ATOM 1264 CG LYS A 82 -13.566 10.539 12.554 1.00 32.44 C ATOM 1265 CD LYS A 82 -12.529 10.334 13.645 1.00 72.25 C ATOM 1266 CE LYS A 82 -13.157 9.782 14.916 1.00 42.04 C ATOM 1267 NZ LYS A 82 -13.246 10.815 15.984 1.00 34.15 N ATOM 0 H LYS A 82 -14.682 7.040 10.985 1.00 2.11 H new ATOM 0 HA LYS A 82 -13.444 9.449 10.021 1.00 33.12 H new ATOM 0 HB2 LYS A 82 -15.177 9.333 11.830 1.00 61.41 H new ATOM 0 HB3 LYS A 82 -14.036 8.473 12.845 1.00 61.41 H new ATOM 0 HG2 LYS A 82 -13.119 11.087 11.725 1.00 32.44 H new ATOM 0 HG3 LYS A 82 -14.382 11.151 12.937 1.00 32.44 H new ATOM 0 HD2 LYS A 82 -11.758 9.649 13.292 1.00 72.25 H new ATOM 0 HD3 LYS A 82 -12.037 11.282 13.863 1.00 72.25 H new ATOM 0 HE2 LYS A 82 -14.154 9.403 14.693 1.00 42.04 H new ATOM 0 HE3 LYS A 82 -12.568 8.938 15.275 1.00 42.04 H new ATOM 0 HZ1 LYS A 82 -13.679 10.400 16.833 1.00 34.15 H new ATOM 0 HZ2 LYS A 82 -12.292 11.159 16.215 1.00 34.15 H new ATOM 0 HZ3 LYS A 82 -13.829 11.609 15.651 1.00 34.15 H new ATOM 1281 N ALA A 83 -11.668 7.215 11.638 1.00 61.13 N ATOM 1282 CA ALA A 83 -10.307 6.822 11.984 1.00 72.25 C ATOM 1283 C ALA A 83 -9.459 6.622 10.733 1.00 5.42 C ATOM 1284 O ALA A 83 -8.241 6.461 10.817 1.00 51.43 O ATOM 1285 CB ALA A 83 -10.321 5.552 12.821 1.00 35.13 C ATOM 0 H ALA A 83 -12.374 6.503 11.825 1.00 61.13 H new ATOM 0 HA ALA A 83 -9.861 7.626 12.570 1.00 72.25 H new ATOM 0 HB1 ALA A 83 -9.298 5.270 13.072 1.00 35.13 H new ATOM 0 HB2 ALA A 83 -10.885 5.726 13.738 1.00 35.13 H new ATOM 0 HB3 ALA A 83 -10.790 4.748 12.254 1.00 35.13 H new ATOM 1291 N ILE A 84 -10.108 6.635 9.574 1.00 12.24 N ATOM 1292 CA ILE A 84 -9.413 6.456 8.306 1.00 73.10 C ATOM 1293 C ILE A 84 -9.358 7.762 7.520 1.00 64.12 C ATOM 1294 O ILE A 84 -8.484 7.953 6.674 1.00 32.42 O ATOM 1295 CB ILE A 84 -10.090 5.377 7.439 1.00 22.31 C ATOM 1296 CG1 ILE A 84 -10.140 4.046 8.191 1.00 52.12 C ATOM 1297 CG2 ILE A 84 -9.352 5.218 6.118 1.00 64.31 C ATOM 1298 CD1 ILE A 84 -11.144 3.067 7.622 1.00 3.25 C ATOM 0 H ILE A 84 -11.116 6.768 9.487 1.00 12.24 H new ATOM 0 HA ILE A 84 -8.399 6.135 8.545 1.00 73.10 H new ATOM 0 HB ILE A 84 -11.112 5.691 7.226 1.00 22.31 H new ATOM 0 HG12 ILE A 84 -9.150 3.590 8.173 1.00 52.12 H new ATOM 0 HG13 ILE A 84 -10.384 4.237 9.236 1.00 52.12 H new ATOM 0 HG21 ILE A 84 -9.843 4.452 5.517 1.00 64.31 H new ATOM 0 HG22 ILE A 84 -9.363 6.165 5.579 1.00 64.31 H new ATOM 0 HG23 ILE A 84 -8.321 4.923 6.311 1.00 64.31 H new ATOM 0 HD11 ILE A 84 -11.125 2.146 8.205 1.00 3.25 H new ATOM 0 HD12 ILE A 84 -12.142 3.503 7.665 1.00 3.25 H new ATOM 0 HD13 ILE A 84 -10.889 2.846 6.586 1.00 3.25 H new ATOM 1310 N ALA A 85 -10.294 8.659 7.808 1.00 54.21 N ATOM 1311 CA ALA A 85 -10.350 9.948 7.131 1.00 2.24 C ATOM 1312 C ALA A 85 -9.538 10.998 7.882 1.00 2.22 C ATOM 1313 O ALA A 85 -8.880 11.841 7.273 1.00 61.14 O ATOM 1314 CB ALA A 85 -11.794 10.404 6.980 1.00 22.43 C ATOM 0 H ALA A 85 -11.024 8.517 8.506 1.00 54.21 H new ATOM 0 HA ALA A 85 -9.913 9.828 6.140 1.00 2.24 H new ATOM 0 HB1 ALA A 85 -11.820 11.368 6.473 1.00 22.43 H new ATOM 0 HB2 ALA A 85 -12.348 9.671 6.394 1.00 22.43 H new ATOM 0 HB3 ALA A 85 -12.250 10.500 7.965 1.00 22.43 H new ATOM 1320 N ALA A 86 -9.589 10.941 9.209 1.00 23.51 N ATOM 1321 CA ALA A 86 -8.857 11.887 10.043 1.00 72.51 C ATOM 1322 C ALA A 86 -7.374 11.895 9.690 1.00 42.01 C ATOM 1323 O ALA A 86 -6.807 12.921 9.313 1.00 52.44 O ATOM 1324 CB ALA A 86 -9.050 11.551 11.514 1.00 61.31 C ATOM 0 H ALA A 86 -10.129 10.250 9.729 1.00 23.51 H new ATOM 0 HA ALA A 86 -9.254 12.884 9.854 1.00 72.51 H new ATOM 0 HB1 ALA A 86 -8.498 12.265 12.126 1.00 61.31 H new ATOM 0 HB2 ALA A 86 -10.110 11.603 11.763 1.00 61.31 H new ATOM 0 HB3 ALA A 86 -8.680 10.544 11.709 1.00 61.31 H new ATOM 1330 N PRO A 87 -6.728 10.726 9.816 1.00 54.40 N ATOM 1331 CA PRO A 87 -5.301 10.574 9.514 1.00 62.51 C ATOM 1332 C PRO A 87 -5.008 10.688 8.022 1.00 34.30 C ATOM 1333 O PRO A 87 -3.855 10.829 7.616 1.00 4.33 O ATOM 1334 CB PRO A 87 -4.981 9.163 10.016 1.00 10.25 C ATOM 1335 CG PRO A 87 -6.282 8.438 9.962 1.00 2.35 C ATOM 1336 CD PRO A 87 -7.340 9.463 10.260 1.00 21.24 C ATOM 0 HA PRO A 87 -4.700 11.354 9.981 1.00 62.51 H new ATOM 0 HB2 PRO A 87 -4.232 8.680 9.388 1.00 10.25 H new ATOM 0 HB3 PRO A 87 -4.581 9.185 11.030 1.00 10.25 H new ATOM 0 HG2 PRO A 87 -6.438 7.990 8.981 1.00 2.35 H new ATOM 0 HG3 PRO A 87 -6.308 7.628 10.690 1.00 2.35 H new ATOM 0 HD2 PRO A 87 -8.265 9.254 9.722 1.00 21.24 H new ATOM 0 HD3 PRO A 87 -7.587 9.488 11.321 1.00 21.24 H new ATOM 1344 N SER A 88 -6.059 10.625 7.211 1.00 23.12 N ATOM 1345 CA SER A 88 -5.913 10.718 5.763 1.00 50.00 C ATOM 1346 C SER A 88 -5.904 12.175 5.311 1.00 44.23 C ATOM 1347 O SER A 88 -5.086 12.574 4.481 1.00 61.32 O ATOM 1348 CB SER A 88 -7.047 9.964 5.066 1.00 35.31 C ATOM 1349 OG SER A 88 -7.270 10.470 3.761 1.00 73.31 O ATOM 0 H SER A 88 -7.020 10.510 7.532 1.00 23.12 H new ATOM 0 HA SER A 88 -4.961 10.264 5.488 1.00 50.00 H new ATOM 0 HB2 SER A 88 -6.803 8.903 5.011 1.00 35.31 H new ATOM 0 HB3 SER A 88 -7.961 10.051 5.654 1.00 35.31 H new ATOM 0 HG SER A 88 -7.998 9.970 3.336 1.00 73.31 H new ATOM 1355 N VAL A 89 -6.819 12.966 5.862 1.00 62.35 N ATOM 1356 CA VAL A 89 -6.915 14.379 5.517 1.00 33.33 C ATOM 1357 C VAL A 89 -5.726 15.161 6.063 1.00 44.21 C ATOM 1358 O VAL A 89 -5.210 16.063 5.405 1.00 45.05 O ATOM 1359 CB VAL A 89 -8.217 15.001 6.059 1.00 62.34 C ATOM 1360 CG1 VAL A 89 -9.430 14.329 5.436 1.00 55.12 C ATOM 1361 CG2 VAL A 89 -8.263 14.901 7.577 1.00 45.42 C ATOM 0 H VAL A 89 -7.504 12.652 6.549 1.00 62.35 H new ATOM 0 HA VAL A 89 -6.916 14.440 4.429 1.00 33.33 H new ATOM 0 HB VAL A 89 -8.236 16.056 5.786 1.00 62.34 H new ATOM 0 HG11 VAL A 89 -10.340 14.782 5.831 1.00 55.12 H new ATOM 0 HG12 VAL A 89 -9.401 14.457 4.354 1.00 55.12 H new ATOM 0 HG13 VAL A 89 -9.420 13.266 5.676 1.00 55.12 H new ATOM 0 HG21 VAL A 89 -9.189 15.345 7.943 1.00 45.42 H new ATOM 0 HG22 VAL A 89 -8.221 13.853 7.874 1.00 45.42 H new ATOM 0 HG23 VAL A 89 -7.412 15.433 8.003 1.00 45.42 H new ATOM 1371 N GLN A 90 -5.296 14.808 7.270 1.00 14.01 N ATOM 1372 CA GLN A 90 -4.167 15.477 7.905 1.00 42.34 C ATOM 1373 C GLN A 90 -2.894 15.292 7.084 1.00 23.20 C ATOM 1374 O GLN A 90 -2.078 16.208 6.973 1.00 73.23 O ATOM 1375 CB GLN A 90 -3.957 14.938 9.321 1.00 2.31 C ATOM 1376 CG GLN A 90 -3.340 13.550 9.360 1.00 52.41 C ATOM 1377 CD GLN A 90 -3.114 13.050 10.773 1.00 35.11 C ATOM 1378 OE1 GLN A 90 -2.031 12.571 11.108 1.00 65.14 O ATOM 1379 NE2 GLN A 90 -4.139 13.159 11.610 1.00 70.42 N ATOM 0 H GLN A 90 -5.712 14.062 7.828 1.00 14.01 H new ATOM 0 HA GLN A 90 -4.392 16.542 7.960 1.00 42.34 H new ATOM 0 HB2 GLN A 90 -3.316 15.627 9.871 1.00 2.31 H new ATOM 0 HB3 GLN A 90 -4.917 14.914 9.837 1.00 2.31 H new ATOM 0 HG2 GLN A 90 -3.990 12.853 8.832 1.00 52.41 H new ATOM 0 HG3 GLN A 90 -2.389 13.564 8.828 1.00 52.41 H new ATOM 0 HE21 GLN A 90 -5.019 13.563 11.289 1.00 70.42 H new ATOM 0 HE22 GLN A 90 -4.046 12.839 12.574 1.00 70.42 H new ATOM 1388 N ILE A 91 -2.731 14.103 6.515 1.00 51.44 N ATOM 1389 CA ILE A 91 -1.557 13.800 5.704 1.00 14.15 C ATOM 1390 C ILE A 91 -1.739 14.285 4.270 1.00 22.41 C ATOM 1391 O ILE A 91 -0.797 14.770 3.644 1.00 52.45 O ATOM 1392 CB ILE A 91 -1.259 12.289 5.689 1.00 33.41 C ATOM 1393 CG1 ILE A 91 -0.448 11.894 6.925 1.00 1.22 C ATOM 1394 CG2 ILE A 91 -0.516 11.908 4.417 1.00 21.31 C ATOM 1395 CD1 ILE A 91 -0.994 10.680 7.644 1.00 42.43 C ATOM 0 H ILE A 91 -3.396 13.334 6.600 1.00 51.44 H new ATOM 0 HA ILE A 91 -0.716 14.324 6.158 1.00 14.15 H new ATOM 0 HB ILE A 91 -2.205 11.747 5.710 1.00 33.41 H new ATOM 0 HG12 ILE A 91 0.581 11.697 6.626 1.00 1.22 H new ATOM 0 HG13 ILE A 91 -0.423 12.736 7.617 1.00 1.22 H new ATOM 0 HG21 ILE A 91 -0.313 10.837 4.421 1.00 21.31 H new ATOM 0 HG22 ILE A 91 -1.127 12.158 3.550 1.00 21.31 H new ATOM 0 HG23 ILE A 91 0.425 12.456 4.367 1.00 21.31 H new ATOM 0 HD11 ILE A 91 -0.369 10.458 8.509 1.00 42.43 H new ATOM 0 HD12 ILE A 91 -2.013 10.880 7.974 1.00 42.43 H new ATOM 0 HD13 ILE A 91 -0.993 9.825 6.967 1.00 42.43 H new ATOM 1407 N LEU A 92 -2.958 14.152 3.757 1.00 44.24 N ATOM 1408 CA LEU A 92 -3.264 14.579 2.395 1.00 73.32 C ATOM 1409 C LEU A 92 -3.114 16.090 2.252 1.00 41.24 C ATOM 1410 O LEU A 92 -2.705 16.586 1.202 1.00 44.21 O ATOM 1411 CB LEU A 92 -4.685 14.157 2.016 1.00 21.15 C ATOM 1412 CG LEU A 92 -4.838 12.746 1.448 1.00 3.11 C ATOM 1413 CD1 LEU A 92 -6.300 12.439 1.166 1.00 32.25 C ATOM 1414 CD2 LEU A 92 -4.005 12.587 0.184 1.00 71.31 C ATOM 0 H LEU A 92 -3.749 13.753 4.262 1.00 44.24 H new ATOM 0 HA LEU A 92 -2.556 14.097 1.720 1.00 73.32 H new ATOM 0 HB2 LEU A 92 -5.316 14.241 2.901 1.00 21.15 H new ATOM 0 HB3 LEU A 92 -5.069 14.866 1.283 1.00 21.15 H new ATOM 0 HG LEU A 92 -4.476 12.035 2.191 1.00 3.11 H new ATOM 0 HD11 LEU A 92 -6.389 11.430 0.762 1.00 32.25 H new ATOM 0 HD12 LEU A 92 -6.872 12.511 2.091 1.00 32.25 H new ATOM 0 HD13 LEU A 92 -6.689 13.155 0.442 1.00 32.25 H new ATOM 0 HD21 LEU A 92 -4.126 11.577 -0.207 1.00 71.31 H new ATOM 0 HD22 LEU A 92 -4.337 13.307 -0.564 1.00 71.31 H new ATOM 0 HD23 LEU A 92 -2.955 12.763 0.416 1.00 71.31 H new ATOM 1426 N VAL A 93 -3.446 16.817 3.314 1.00 35.41 N ATOM 1427 CA VAL A 93 -3.344 18.271 3.308 1.00 34.25 C ATOM 1428 C VAL A 93 -1.916 18.724 3.587 1.00 32.21 C ATOM 1429 O VAL A 93 -1.465 19.744 3.068 1.00 0.34 O ATOM 1430 CB VAL A 93 -4.285 18.903 4.351 1.00 15.05 C ATOM 1431 CG1 VAL A 93 -3.791 18.616 5.760 1.00 63.34 C ATOM 1432 CG2 VAL A 93 -4.410 20.401 4.115 1.00 32.44 C ATOM 0 H VAL A 93 -3.788 16.422 4.190 1.00 35.41 H new ATOM 0 HA VAL A 93 -3.639 18.605 2.313 1.00 34.25 H new ATOM 0 HB VAL A 93 -5.273 18.457 4.242 1.00 15.05 H new ATOM 0 HG11 VAL A 93 -4.469 19.070 6.483 1.00 63.34 H new ATOM 0 HG12 VAL A 93 -3.758 17.539 5.921 1.00 63.34 H new ATOM 0 HG13 VAL A 93 -2.792 19.033 5.887 1.00 63.34 H new ATOM 0 HG21 VAL A 93 -5.078 20.832 4.860 1.00 32.44 H new ATOM 0 HG22 VAL A 93 -3.427 20.865 4.197 1.00 32.44 H new ATOM 0 HG23 VAL A 93 -4.814 20.580 3.119 1.00 32.44 H new ATOM 1442 N SER A 94 -1.209 17.957 4.410 1.00 71.22 N ATOM 1443 CA SER A 94 0.169 18.281 4.762 1.00 54.45 C ATOM 1444 C SER A 94 1.102 18.040 3.579 1.00 43.44 C ATOM 1445 O SER A 94 2.158 18.663 3.470 1.00 4.32 O ATOM 1446 CB SER A 94 0.622 17.446 5.961 1.00 32.15 C ATOM 1447 OG SER A 94 2.009 17.164 5.892 1.00 22.20 O ATOM 0 H SER A 94 -1.567 17.107 4.846 1.00 71.22 H new ATOM 0 HA SER A 94 0.211 19.337 5.028 1.00 54.45 H new ATOM 0 HB2 SER A 94 0.402 17.981 6.885 1.00 32.15 H new ATOM 0 HB3 SER A 94 0.059 16.513 5.992 1.00 32.15 H new ATOM 0 HG SER A 94 2.274 16.631 6.670 1.00 22.20 H new ATOM 1453 N SER A 95 0.705 17.131 2.695 1.00 51.10 N ATOM 1454 CA SER A 95 1.507 16.804 1.521 1.00 14.43 C ATOM 1455 C SER A 95 0.992 17.543 0.289 1.00 15.33 C ATOM 1456 O SER A 95 1.564 17.438 -0.795 1.00 1.44 O ATOM 1457 CB SER A 95 1.489 15.296 1.269 1.00 34.33 C ATOM 1458 OG SER A 95 2.135 14.974 0.051 1.00 52.51 O ATOM 0 H SER A 95 -0.167 16.607 2.769 1.00 51.10 H new ATOM 0 HA SER A 95 2.532 17.121 1.712 1.00 14.43 H new ATOM 0 HB2 SER A 95 1.983 14.781 2.093 1.00 34.33 H new ATOM 0 HB3 SER A 95 0.459 14.941 1.242 1.00 34.33 H new ATOM 0 HG SER A 95 2.031 15.716 -0.581 1.00 52.51 H new ATOM 1464 N GLY A 96 -0.094 18.291 0.465 1.00 41.24 N ATOM 1465 CA GLY A 96 -0.668 19.036 -0.639 1.00 43.34 C ATOM 1466 C GLY A 96 -1.390 18.144 -1.629 1.00 75.32 C ATOM 1467 O GLY A 96 -1.839 18.603 -2.678 1.00 11.24 O ATOM 0 H GLY A 96 -0.586 18.394 1.353 1.00 41.24 H new ATOM 0 HA2 GLY A 96 -1.364 19.778 -0.249 1.00 43.34 H new ATOM 0 HA3 GLY A 96 0.122 19.581 -1.155 1.00 43.34 H new ATOM 1471 N SER A 97 -1.500 16.862 -1.295 1.00 55.25 N ATOM 1472 CA SER A 97 -2.167 15.900 -2.165 1.00 33.11 C ATOM 1473 C SER A 97 -3.618 16.305 -2.410 1.00 40.21 C ATOM 1474 O SER A 97 -4.240 15.869 -3.379 1.00 35.04 O ATOM 1475 CB SER A 97 -2.115 14.500 -1.548 1.00 52.42 C ATOM 1476 OG SER A 97 -0.822 13.935 -1.677 1.00 71.02 O ATOM 0 H SER A 97 -1.136 16.466 -0.429 1.00 55.25 H new ATOM 0 HA SER A 97 -1.644 15.888 -3.121 1.00 33.11 H new ATOM 0 HB2 SER A 97 -2.389 14.553 -0.494 1.00 52.42 H new ATOM 0 HB3 SER A 97 -2.847 13.856 -2.036 1.00 52.42 H new ATOM 0 HG SER A 97 -0.814 13.042 -1.274 1.00 71.02 H new ATOM 1482 N VAL A 98 -4.149 17.143 -1.527 1.00 22.43 N ATOM 1483 CA VAL A 98 -5.526 17.610 -1.646 1.00 51.34 C ATOM 1484 C VAL A 98 -5.623 19.108 -1.384 1.00 42.13 C ATOM 1485 O VAL A 98 -5.140 19.602 -0.366 1.00 4.15 O ATOM 1486 CB VAL A 98 -6.457 16.867 -0.671 1.00 34.10 C ATOM 1487 CG1 VAL A 98 -6.372 15.364 -0.890 1.00 14.14 C ATOM 1488 CG2 VAL A 98 -6.114 17.224 0.768 1.00 14.05 C ATOM 0 H VAL A 98 -3.647 17.513 -0.720 1.00 22.43 H new ATOM 0 HA VAL A 98 -5.843 17.402 -2.668 1.00 51.34 H new ATOM 0 HB VAL A 98 -7.483 17.180 -0.866 1.00 34.10 H new ATOM 0 HG11 VAL A 98 -7.037 14.856 -0.191 1.00 14.14 H new ATOM 0 HG12 VAL A 98 -6.670 15.128 -1.912 1.00 14.14 H new ATOM 0 HG13 VAL A 98 -5.348 15.029 -0.724 1.00 14.14 H new ATOM 0 HG21 VAL A 98 -6.782 16.690 1.444 1.00 14.05 H new ATOM 0 HG22 VAL A 98 -5.083 16.940 0.977 1.00 14.05 H new ATOM 0 HG23 VAL A 98 -6.232 18.298 0.914 1.00 14.05 H new ATOM 1498 N ASN A 99 -6.251 19.826 -2.309 1.00 41.33 N ATOM 1499 CA ASN A 99 -6.412 21.269 -2.178 1.00 5.44 C ATOM 1500 C ASN A 99 -7.878 21.669 -2.318 1.00 50.43 C ATOM 1501 O ASN A 99 -8.764 20.816 -2.338 1.00 11.33 O ATOM 1502 CB ASN A 99 -5.572 21.996 -3.231 1.00 71.11 C ATOM 1503 CG ASN A 99 -4.757 21.039 -4.081 1.00 71.02 C ATOM 1504 OD1 ASN A 99 -5.428 20.334 -4.984 1.00 31.24 O flip ATOM 1505 ND2 ASN A 99 -3.540 20.936 -3.927 1.00 51.13 N flip ATOM 0 H ASN A 99 -6.657 19.432 -3.158 1.00 41.33 H new ATOM 0 HA ASN A 99 -6.068 21.558 -1.185 1.00 5.44 H new ATOM 0 HB2 ASN A 99 -6.228 22.581 -3.875 1.00 71.11 H new ATOM 0 HB3 ASN A 99 -4.902 22.699 -2.736 1.00 71.11 H new ATOM 0 HD21 ASN A 99 -3.066 21.498 -3.220 1.00 51.13 H new ATOM 0 HD22 ASN A 99 -3.006 20.288 -4.506 1.00 51.13 H new ATOM 1512 N ASN A 100 -8.124 22.971 -2.415 1.00 75.02 N ATOM 1513 CA ASN A 100 -9.483 23.484 -2.554 1.00 21.41 C ATOM 1514 C ASN A 100 -9.912 23.500 -4.018 1.00 65.20 C ATOM 1515 O ASN A 100 -10.202 24.557 -4.578 1.00 25.53 O ATOM 1516 CB ASN A 100 -9.580 24.892 -1.965 1.00 14.14 C ATOM 1517 CG ASN A 100 -8.692 25.074 -0.750 1.00 25.04 C ATOM 1518 OD1 ASN A 100 -7.469 25.150 -0.867 1.00 54.41 O ATOM 1519 ND2 ASN A 100 -9.306 25.146 0.426 1.00 42.42 N ATOM 0 H ASN A 100 -7.401 23.690 -2.400 1.00 75.02 H new ATOM 0 HA ASN A 100 -10.153 22.822 -2.006 1.00 21.41 H new ATOM 0 HB2 ASN A 100 -9.303 25.621 -2.726 1.00 14.14 H new ATOM 0 HB3 ASN A 100 -10.614 25.097 -1.689 1.00 14.14 H new ATOM 0 HD21 ASN A 100 -8.761 25.269 1.279 1.00 42.42 H new ATOM 0 HD22 ASN A 100 -10.323 25.078 0.476 1.00 42.42 H new ATOM 1526 N ASN A 101 -9.949 22.323 -4.631 1.00 53.40 N ATOM 1527 CA ASN A 101 -10.342 22.202 -6.031 1.00 65.31 C ATOM 1528 C ASN A 101 -10.318 20.743 -6.479 1.00 22.14 C ATOM 1529 O ASN A 101 -11.109 20.331 -7.326 1.00 34.02 O ATOM 1530 CB ASN A 101 -9.414 23.035 -6.916 1.00 40.04 C ATOM 1531 CG ASN A 101 -10.145 24.156 -7.628 1.00 24.50 C ATOM 1532 OD1 ASN A 101 -11.117 23.922 -8.345 1.00 32.14 O ATOM 1533 ND2 ASN A 101 -9.678 25.384 -7.431 1.00 52.41 N ATOM 0 H ASN A 101 -9.712 21.439 -4.181 1.00 53.40 H new ATOM 0 HA ASN A 101 -11.361 22.577 -6.131 1.00 65.31 H new ATOM 0 HB2 ASN A 101 -8.616 23.456 -6.305 1.00 40.04 H new ATOM 0 HB3 ASN A 101 -8.942 22.387 -7.654 1.00 40.04 H new ATOM 0 HD21 ASN A 101 -10.129 26.180 -7.883 1.00 52.41 H new ATOM 0 HD22 ASN A 101 -8.869 25.531 -6.828 1.00 52.41 H new ATOM 1540 N ASN A 102 -9.405 19.969 -5.902 1.00 72.13 N ATOM 1541 CA ASN A 102 -9.278 18.555 -6.242 1.00 24.14 C ATOM 1542 C ASN A 102 -9.758 17.675 -5.093 1.00 71.01 C ATOM 1543 O ASN A 102 -9.904 16.463 -5.246 1.00 34.52 O ATOM 1544 CB ASN A 102 -7.825 18.220 -6.584 1.00 65.13 C ATOM 1545 CG ASN A 102 -7.483 16.771 -6.297 1.00 2.43 C ATOM 1546 OD1 ASN A 102 -7.900 15.868 -7.022 1.00 1.51 O ATOM 1547 ND2 ASN A 102 -6.720 16.543 -5.234 1.00 52.53 N ATOM 0 H ASN A 102 -8.743 20.295 -5.198 1.00 72.13 H new ATOM 0 HA ASN A 102 -9.903 18.358 -7.113 1.00 24.14 H new ATOM 0 HB2 ASN A 102 -7.645 18.431 -7.638 1.00 65.13 H new ATOM 0 HB3 ASN A 102 -7.161 18.868 -6.011 1.00 65.13 H new ATOM 0 HD21 ASN A 102 -6.457 15.588 -4.990 1.00 52.53 H new ATOM 0 HD22 ASN A 102 -6.397 17.323 -4.661 1.00 52.53 H new ATOM 1554 N ALA A 103 -10.002 18.293 -3.943 1.00 21.33 N ATOM 1555 CA ALA A 103 -10.469 17.566 -2.768 1.00 41.04 C ATOM 1556 C ALA A 103 -11.684 16.708 -3.101 1.00 20.42 C ATOM 1557 O ALA A 103 -11.830 15.596 -2.594 1.00 62.33 O ATOM 1558 CB ALA A 103 -10.796 18.536 -1.642 1.00 42.13 C ATOM 0 H ALA A 103 -9.884 19.296 -3.799 1.00 21.33 H new ATOM 0 HA ALA A 103 -9.669 16.903 -2.439 1.00 41.04 H new ATOM 0 HB1 ALA A 103 -11.143 17.979 -0.772 1.00 42.13 H new ATOM 0 HB2 ALA A 103 -9.902 19.102 -1.378 1.00 42.13 H new ATOM 0 HB3 ALA A 103 -11.577 19.223 -1.969 1.00 42.13 H new ATOM 1564 N LYS A 104 -12.557 17.232 -3.955 1.00 22.32 N ATOM 1565 CA LYS A 104 -13.761 16.515 -4.356 1.00 71.41 C ATOM 1566 C LYS A 104 -13.417 15.339 -5.264 1.00 50.13 C ATOM 1567 O LYS A 104 -14.047 14.284 -5.194 1.00 12.34 O ATOM 1568 CB LYS A 104 -14.728 17.460 -5.072 1.00 42.41 C ATOM 1569 CG LYS A 104 -14.073 18.285 -6.167 1.00 21.31 C ATOM 1570 CD LYS A 104 -14.766 18.086 -7.505 1.00 25.30 C ATOM 1571 CE LYS A 104 -16.009 18.955 -7.622 1.00 4.40 C ATOM 1572 NZ LYS A 104 -16.342 19.257 -9.041 1.00 1.50 N ATOM 0 H LYS A 104 -12.453 18.152 -4.383 1.00 22.32 H new ATOM 0 HA LYS A 104 -14.240 16.129 -3.456 1.00 71.41 H new ATOM 0 HB2 LYS A 104 -15.540 16.876 -5.505 1.00 42.41 H new ATOM 0 HB3 LYS A 104 -15.175 18.133 -4.340 1.00 42.41 H new ATOM 0 HG2 LYS A 104 -14.101 19.340 -5.895 1.00 21.31 H new ATOM 0 HG3 LYS A 104 -13.023 18.006 -6.255 1.00 21.31 H new ATOM 0 HD2 LYS A 104 -14.075 18.326 -8.313 1.00 25.30 H new ATOM 0 HD3 LYS A 104 -15.041 17.038 -7.621 1.00 25.30 H new ATOM 0 HE2 LYS A 104 -16.852 18.449 -7.151 1.00 4.40 H new ATOM 0 HE3 LYS A 104 -15.853 19.887 -7.079 1.00 4.40 H new ATOM 0 HZ1 LYS A 104 -17.195 19.851 -9.079 1.00 1.50 H new ATOM 0 HZ2 LYS A 104 -15.548 19.762 -9.484 1.00 1.50 H new ATOM 0 HZ3 LYS A 104 -16.516 18.369 -9.553 1.00 1.50 H new ATOM 1586 N GLN A 105 -12.412 15.528 -6.114 1.00 33.42 N ATOM 1587 CA GLN A 105 -11.984 14.481 -7.034 1.00 73.02 C ATOM 1588 C GLN A 105 -11.238 13.376 -6.294 1.00 40.02 C ATOM 1589 O GLN A 105 -11.528 12.192 -6.468 1.00 43.22 O ATOM 1590 CB GLN A 105 -11.093 15.070 -8.130 1.00 72.42 C ATOM 1591 CG GLN A 105 -11.506 14.662 -9.535 1.00 64.21 C ATOM 1592 CD GLN A 105 -12.012 15.831 -10.356 1.00 1.20 C ATOM 1593 OE1 GLN A 105 -12.973 16.502 -9.977 1.00 50.32 O ATOM 1594 NE2 GLN A 105 -11.367 16.082 -11.489 1.00 53.32 N ATOM 0 H GLN A 105 -11.880 16.395 -6.184 1.00 33.42 H new ATOM 0 HA GLN A 105 -12.874 14.048 -7.492 1.00 73.02 H new ATOM 0 HB2 GLN A 105 -11.111 16.157 -8.056 1.00 72.42 H new ATOM 0 HB3 GLN A 105 -10.064 14.756 -7.957 1.00 72.42 H new ATOM 0 HG2 GLN A 105 -10.655 14.208 -10.042 1.00 64.21 H new ATOM 0 HG3 GLN A 105 -12.284 13.901 -9.475 1.00 64.21 H new ATOM 0 HE21 GLN A 105 -10.576 15.501 -11.765 1.00 53.32 H new ATOM 0 HE22 GLN A 105 -11.663 16.856 -12.083 1.00 53.32 H new ATOM 1603 N VAL A 106 -10.275 13.770 -5.467 1.00 44.44 N ATOM 1604 CA VAL A 106 -9.487 12.813 -4.700 1.00 64.01 C ATOM 1605 C VAL A 106 -10.354 12.072 -3.689 1.00 1.35 C ATOM 1606 O VAL A 106 -10.161 10.882 -3.444 1.00 4.21 O ATOM 1607 CB VAL A 106 -8.331 13.507 -3.955 1.00 4.01 C ATOM 1608 CG1 VAL A 106 -8.864 14.597 -3.037 1.00 54.20 C ATOM 1609 CG2 VAL A 106 -7.515 12.490 -3.171 1.00 32.23 C ATOM 0 H VAL A 106 -10.022 14.746 -5.311 1.00 44.44 H new ATOM 0 HA VAL A 106 -9.074 12.100 -5.413 1.00 64.01 H new ATOM 0 HB VAL A 106 -7.677 13.974 -4.691 1.00 4.01 H new ATOM 0 HG11 VAL A 106 -8.033 15.076 -2.520 1.00 54.20 H new ATOM 0 HG12 VAL A 106 -9.400 15.340 -3.627 1.00 54.20 H new ATOM 0 HG13 VAL A 106 -9.542 14.157 -2.305 1.00 54.20 H new ATOM 0 HG21 VAL A 106 -6.703 12.998 -2.651 1.00 32.23 H new ATOM 0 HG22 VAL A 106 -8.156 11.992 -2.444 1.00 32.23 H new ATOM 0 HG23 VAL A 106 -7.101 11.750 -3.856 1.00 32.23 H new ATOM 1619 N ALA A 107 -11.314 12.784 -3.105 1.00 41.33 N ATOM 1620 CA ALA A 107 -12.214 12.194 -2.123 1.00 74.24 C ATOM 1621 C ALA A 107 -13.073 11.103 -2.753 1.00 34.11 C ATOM 1622 O ALA A 107 -13.363 10.085 -2.122 1.00 12.53 O ATOM 1623 CB ALA A 107 -13.093 13.267 -1.500 1.00 30.11 C ATOM 0 H ALA A 107 -11.487 13.771 -3.296 1.00 41.33 H new ATOM 0 HA ALA A 107 -11.609 11.737 -1.340 1.00 74.24 H new ATOM 0 HB1 ALA A 107 -13.760 12.811 -0.768 1.00 30.11 H new ATOM 0 HB2 ALA A 107 -12.466 14.010 -1.006 1.00 30.11 H new ATOM 0 HB3 ALA A 107 -13.684 13.750 -2.278 1.00 30.11 H new ATOM 1629 N SER A 108 -13.480 11.321 -4.000 1.00 61.13 N ATOM 1630 CA SER A 108 -14.311 10.358 -4.714 1.00 22.21 C ATOM 1631 C SER A 108 -13.492 9.142 -5.136 1.00 2.40 C ATOM 1632 O SER A 108 -13.924 8.001 -4.974 1.00 23.52 O ATOM 1633 CB SER A 108 -14.946 11.013 -5.942 1.00 61.25 C ATOM 1634 OG SER A 108 -14.482 10.409 -7.137 1.00 41.21 O ATOM 0 H SER A 108 -13.248 12.157 -4.537 1.00 61.13 H new ATOM 0 HA SER A 108 -15.101 10.025 -4.040 1.00 22.21 H new ATOM 0 HB2 SER A 108 -16.031 10.927 -5.884 1.00 61.25 H new ATOM 0 HB3 SER A 108 -14.711 12.077 -5.953 1.00 61.25 H new ATOM 0 HG SER A 108 -14.903 10.843 -7.908 1.00 41.21 H new ATOM 1640 N THR A 109 -12.305 9.395 -5.680 1.00 2.13 N ATOM 1641 CA THR A 109 -11.426 8.324 -6.128 1.00 74.54 C ATOM 1642 C THR A 109 -10.894 7.520 -4.947 1.00 51.14 C ATOM 1643 O THR A 109 -10.924 6.288 -4.958 1.00 60.12 O ATOM 1644 CB THR A 109 -10.237 8.874 -6.937 1.00 40.44 C ATOM 1645 OG1 THR A 109 -10.713 9.610 -8.069 1.00 32.24 O ATOM 1646 CG2 THR A 109 -9.331 7.744 -7.405 1.00 13.32 C ATOM 0 H THR A 109 -11.931 10.334 -5.820 1.00 2.13 H new ATOM 0 HA THR A 109 -12.021 7.674 -6.769 1.00 74.54 H new ATOM 0 HB THR A 109 -9.661 9.536 -6.290 1.00 40.44 H new ATOM 0 HG1 THR A 109 -11.017 10.496 -7.779 1.00 32.24 H new ATOM 0 HG21 THR A 109 -8.498 8.157 -7.974 1.00 13.32 H new ATOM 0 HG22 THR A 109 -8.946 7.204 -6.540 1.00 13.32 H new ATOM 0 HG23 THR A 109 -9.898 7.060 -8.037 1.00 13.32 H new ATOM 1654 N LEU A 110 -10.408 8.223 -3.930 1.00 73.32 N ATOM 1655 CA LEU A 110 -9.869 7.573 -2.740 1.00 24.45 C ATOM 1656 C LEU A 110 -10.898 6.632 -2.120 1.00 25.44 C ATOM 1657 O LEU A 110 -10.589 5.486 -1.793 1.00 3.32 O ATOM 1658 CB LEU A 110 -9.437 8.622 -1.714 1.00 13.12 C ATOM 1659 CG LEU A 110 -9.218 8.116 -0.288 1.00 22.54 C ATOM 1660 CD1 LEU A 110 -7.836 8.507 0.211 1.00 73.20 C ATOM 1661 CD2 LEU A 110 -10.296 8.658 0.642 1.00 51.25 C ATOM 0 H LEU A 110 -10.376 9.242 -3.905 1.00 73.32 H new ATOM 0 HA LEU A 110 -9.000 6.986 -3.038 1.00 24.45 H new ATOM 0 HB2 LEU A 110 -8.511 9.081 -2.061 1.00 13.12 H new ATOM 0 HB3 LEU A 110 -10.192 9.408 -1.687 1.00 13.12 H new ATOM 0 HG LEU A 110 -9.285 7.028 -0.295 1.00 22.54 H new ATOM 0 HD11 LEU A 110 -7.698 8.138 1.227 1.00 73.20 H new ATOM 0 HD12 LEU A 110 -7.078 8.071 -0.439 1.00 73.20 H new ATOM 0 HD13 LEU A 110 -7.740 9.593 0.203 1.00 73.20 H new ATOM 0 HD21 LEU A 110 -10.124 8.288 1.653 1.00 51.25 H new ATOM 0 HD22 LEU A 110 -10.261 9.747 0.644 1.00 51.25 H new ATOM 0 HD23 LEU A 110 -11.275 8.327 0.296 1.00 51.25 H new ATOM 1673 N SER A 111 -12.123 7.124 -1.962 1.00 44.13 N ATOM 1674 CA SER A 111 -13.197 6.329 -1.380 1.00 22.11 C ATOM 1675 C SER A 111 -13.601 5.193 -2.316 1.00 22.21 C ATOM 1676 O SER A 111 -13.867 4.076 -1.874 1.00 2.22 O ATOM 1677 CB SER A 111 -14.409 7.212 -1.079 1.00 51.00 C ATOM 1678 OG SER A 111 -14.039 8.341 -0.305 1.00 55.13 O ATOM 0 H SER A 111 -12.396 8.070 -2.229 1.00 44.13 H new ATOM 0 HA SER A 111 -12.831 5.897 -0.449 1.00 22.11 H new ATOM 0 HB2 SER A 111 -14.864 7.541 -2.013 1.00 51.00 H new ATOM 0 HB3 SER A 111 -15.162 6.632 -0.545 1.00 51.00 H new ATOM 0 HG SER A 111 -13.962 9.126 -0.887 1.00 55.13 H new ATOM 1684 N GLU A 112 -13.643 5.490 -3.611 1.00 52.11 N ATOM 1685 CA GLU A 112 -14.015 4.495 -4.610 1.00 72.43 C ATOM 1686 C GLU A 112 -13.017 3.340 -4.625 1.00 51.34 C ATOM 1687 O GLU A 112 -13.401 2.175 -4.725 1.00 64.13 O ATOM 1688 CB GLU A 112 -14.092 5.135 -5.997 1.00 74.40 C ATOM 1689 CG GLU A 112 -14.105 4.126 -7.133 1.00 21.11 C ATOM 1690 CD GLU A 112 -14.695 4.694 -8.410 1.00 14.20 C ATOM 1691 OE1 GLU A 112 -14.701 5.934 -8.560 1.00 34.02 O ATOM 1692 OE2 GLU A 112 -15.150 3.899 -9.259 1.00 72.51 O ATOM 0 H GLU A 112 -13.424 6.410 -3.993 1.00 52.11 H new ATOM 0 HA GLU A 112 -14.996 4.102 -4.345 1.00 72.43 H new ATOM 0 HB2 GLU A 112 -14.992 5.747 -6.056 1.00 74.40 H new ATOM 0 HB3 GLU A 112 -13.242 5.805 -6.127 1.00 74.40 H new ATOM 0 HG2 GLU A 112 -13.087 3.789 -7.326 1.00 21.11 H new ATOM 0 HG3 GLU A 112 -14.679 3.250 -6.830 1.00 21.11 H new ATOM 1699 N ASN A 113 -11.734 3.673 -4.527 1.00 24.20 N ATOM 1700 CA ASN A 113 -10.680 2.665 -4.530 1.00 44.33 C ATOM 1701 C ASN A 113 -10.552 2.007 -3.159 1.00 52.20 C ATOM 1702 O ASN A 113 -10.286 0.809 -3.057 1.00 60.34 O ATOM 1703 CB ASN A 113 -9.345 3.296 -4.933 1.00 75.34 C ATOM 1704 CG ASN A 113 -9.285 3.626 -6.411 1.00 51.33 C ATOM 1705 OD1 ASN A 113 -8.410 3.143 -7.132 1.00 75.23 O ATOM 1706 ND2 ASN A 113 -10.216 4.452 -6.872 1.00 63.32 N ATOM 0 H ASN A 113 -11.399 4.633 -4.445 1.00 24.20 H new ATOM 0 HA ASN A 113 -10.946 1.898 -5.257 1.00 44.33 H new ATOM 0 HB2 ASN A 113 -9.187 4.206 -4.354 1.00 75.34 H new ATOM 0 HB3 ASN A 113 -8.533 2.613 -4.683 1.00 75.34 H new ATOM 0 HD21 ASN A 113 -10.226 4.710 -7.859 1.00 63.32 H new ATOM 0 HD22 ASN A 113 -10.922 4.829 -6.239 1.00 63.32 H new ATOM 1713 N LEU A 114 -10.743 2.798 -2.110 1.00 61.33 N ATOM 1714 CA LEU A 114 -10.650 2.293 -0.745 1.00 62.45 C ATOM 1715 C LEU A 114 -11.787 1.322 -0.444 1.00 22.22 C ATOM 1716 O LEU A 114 -11.566 0.235 0.090 1.00 42.42 O ATOM 1717 CB LEU A 114 -10.676 3.453 0.252 1.00 20.42 C ATOM 1718 CG LEU A 114 -10.876 3.072 1.720 1.00 13.41 C ATOM 1719 CD1 LEU A 114 -10.147 4.049 2.629 1.00 30.40 C ATOM 1720 CD2 LEU A 114 -12.359 3.028 2.062 1.00 62.24 C ATOM 0 H LEU A 114 -10.963 3.792 -2.178 1.00 61.33 H new ATOM 0 HA LEU A 114 -9.705 1.758 -0.646 1.00 62.45 H new ATOM 0 HB2 LEU A 114 -9.739 4.002 0.164 1.00 20.42 H new ATOM 0 HB3 LEU A 114 -11.474 4.137 -0.037 1.00 20.42 H new ATOM 0 HG LEU A 114 -10.457 2.078 1.878 1.00 13.41 H new ATOM 0 HD11 LEU A 114 -10.301 3.762 3.669 1.00 30.40 H new ATOM 0 HD12 LEU A 114 -9.081 4.032 2.401 1.00 30.40 H new ATOM 0 HD13 LEU A 114 -10.536 5.055 2.469 1.00 30.40 H new ATOM 0 HD21 LEU A 114 -12.483 2.755 3.110 1.00 62.24 H new ATOM 0 HD22 LEU A 114 -12.802 4.009 1.887 1.00 62.24 H new ATOM 0 HD23 LEU A 114 -12.856 2.289 1.434 1.00 62.24 H new ATOM 1732 N VAL A 115 -13.007 1.722 -0.791 1.00 41.40 N ATOM 1733 CA VAL A 115 -14.179 0.887 -0.562 1.00 11.33 C ATOM 1734 C VAL A 115 -14.116 -0.389 -1.394 1.00 24.43 C ATOM 1735 O VAL A 115 -14.520 -1.460 -0.939 1.00 3.44 O ATOM 1736 CB VAL A 115 -15.480 1.642 -0.896 1.00 54.04 C ATOM 1737 CG1 VAL A 115 -15.598 1.861 -2.397 1.00 33.24 C ATOM 1738 CG2 VAL A 115 -16.686 0.884 -0.362 1.00 54.11 C ATOM 0 H VAL A 115 -13.208 2.620 -1.232 1.00 41.40 H new ATOM 0 HA VAL A 115 -14.180 0.627 0.496 1.00 11.33 H new ATOM 0 HB VAL A 115 -15.450 2.618 -0.412 1.00 54.04 H new ATOM 0 HG11 VAL A 115 -16.523 2.396 -2.615 1.00 33.24 H new ATOM 0 HG12 VAL A 115 -14.749 2.447 -2.747 1.00 33.24 H new ATOM 0 HG13 VAL A 115 -15.608 0.897 -2.906 1.00 33.24 H new ATOM 0 HG21 VAL A 115 -17.597 1.431 -0.606 1.00 54.11 H new ATOM 0 HG22 VAL A 115 -16.724 -0.106 -0.817 1.00 54.11 H new ATOM 0 HG23 VAL A 115 -16.603 0.783 0.720 1.00 54.11 H new ATOM 1748 N ARG A 116 -13.606 -0.268 -2.615 1.00 12.42 N ATOM 1749 CA ARG A 116 -13.491 -1.412 -3.512 1.00 3.23 C ATOM 1750 C ARG A 116 -12.562 -2.471 -2.925 1.00 61.35 C ATOM 1751 O ARG A 116 -12.908 -3.650 -2.867 1.00 34.15 O ATOM 1752 CB ARG A 116 -12.972 -0.964 -4.880 1.00 31.54 C ATOM 1753 CG ARG A 116 -12.528 -2.115 -5.768 1.00 63.13 C ATOM 1754 CD ARG A 116 -12.012 -1.615 -7.108 1.00 55.22 C ATOM 1755 NE ARG A 116 -11.677 -2.715 -8.010 1.00 10.21 N ATOM 1756 CZ ARG A 116 -11.406 -2.551 -9.300 1.00 2.40 C ATOM 1757 NH1 ARG A 116 -11.429 -1.338 -9.837 1.00 41.40 N ATOM 1758 NH2 ARG A 116 -11.110 -3.601 -10.056 1.00 4.24 N ATOM 0 H ARG A 116 -13.266 0.610 -3.006 1.00 12.42 H new ATOM 0 HA ARG A 116 -14.482 -1.849 -3.633 1.00 3.23 H new ATOM 0 HB2 ARG A 116 -13.755 -0.403 -5.391 1.00 31.54 H new ATOM 0 HB3 ARG A 116 -12.134 -0.283 -4.736 1.00 31.54 H new ATOM 0 HG2 ARG A 116 -11.746 -2.684 -5.265 1.00 63.13 H new ATOM 0 HG3 ARG A 116 -13.364 -2.796 -5.929 1.00 63.13 H new ATOM 0 HD2 ARG A 116 -12.767 -0.981 -7.574 1.00 55.22 H new ATOM 0 HD3 ARG A 116 -11.130 -0.995 -6.948 1.00 55.22 H new ATOM 0 HE ARG A 116 -11.650 -3.660 -7.628 1.00 10.21 H new ATOM 0 HH11 ARG A 116 -11.655 -0.529 -9.259 1.00 41.40 H new ATOM 0 HH12 ARG A 116 -11.220 -1.215 -10.828 1.00 41.40 H new ATOM 0 HH21 ARG A 116 -11.090 -4.535 -9.647 1.00 4.24 H new ATOM 0 HH22 ARG A 116 -10.902 -3.474 -11.046 1.00 4.24 H new ATOM 1772 N GLU A 117 -11.381 -2.040 -2.492 1.00 61.23 N ATOM 1773 CA GLU A 117 -10.402 -2.952 -1.911 1.00 14.10 C ATOM 1774 C GLU A 117 -10.849 -3.422 -0.530 1.00 30.52 C ATOM 1775 O GLU A 117 -10.749 -4.604 -0.202 1.00 13.22 O ATOM 1776 CB GLU A 117 -9.035 -2.274 -1.814 1.00 52.43 C ATOM 1777 CG GLU A 117 -7.955 -2.960 -2.634 1.00 73.42 C ATOM 1778 CD GLU A 117 -8.416 -3.299 -4.038 1.00 74.41 C ATOM 1779 OE1 GLU A 117 -8.759 -2.364 -4.791 1.00 55.41 O ATOM 1780 OE2 GLU A 117 -8.433 -4.499 -4.384 1.00 34.43 O ATOM 0 H GLU A 117 -11.079 -1.066 -2.532 1.00 61.23 H new ATOM 0 HA GLU A 117 -10.322 -3.822 -2.563 1.00 14.10 H new ATOM 0 HB2 GLU A 117 -9.128 -1.239 -2.144 1.00 52.43 H new ATOM 0 HB3 GLU A 117 -8.725 -2.248 -0.769 1.00 52.43 H new ATOM 0 HG2 GLU A 117 -7.080 -2.313 -2.689 1.00 73.42 H new ATOM 0 HG3 GLU A 117 -7.644 -3.874 -2.127 1.00 73.42 H new ATOM 1787 N MET A 118 -11.340 -2.487 0.276 1.00 30.33 N ATOM 1788 CA MET A 118 -11.803 -2.804 1.622 1.00 11.13 C ATOM 1789 C MET A 118 -12.832 -3.929 1.592 1.00 34.51 C ATOM 1790 O MET A 118 -12.770 -4.862 2.394 1.00 43.00 O ATOM 1791 CB MET A 118 -12.406 -1.564 2.283 1.00 25.34 C ATOM 1792 CG MET A 118 -11.378 -0.679 2.970 1.00 52.14 C ATOM 1793 SD MET A 118 -11.700 -0.477 4.732 1.00 50.52 S ATOM 1794 CE MET A 118 -13.067 0.680 4.695 1.00 34.00 C ATOM 0 H MET A 118 -11.428 -1.503 0.021 1.00 30.33 H new ATOM 0 HA MET A 118 -10.944 -3.136 2.205 1.00 11.13 H new ATOM 0 HB2 MET A 118 -12.930 -0.979 1.528 1.00 25.34 H new ATOM 0 HB3 MET A 118 -13.150 -1.878 3.015 1.00 25.34 H new ATOM 0 HG2 MET A 118 -10.386 -1.108 2.833 1.00 52.14 H new ATOM 0 HG3 MET A 118 -11.370 0.300 2.492 1.00 52.14 H new ATOM 0 HE1 MET A 118 -12.714 1.670 4.983 1.00 34.00 H new ATOM 0 HE2 MET A 118 -13.481 0.722 3.688 1.00 34.00 H new ATOM 0 HE3 MET A 118 -13.839 0.353 5.392 1.00 34.00 H new ATOM 1804 N ALA A 119 -13.778 -3.836 0.663 1.00 62.12 N ATOM 1805 CA ALA A 119 -14.819 -4.847 0.529 1.00 53.54 C ATOM 1806 C ALA A 119 -14.243 -6.162 0.015 1.00 74.05 C ATOM 1807 O ALA A 119 -14.700 -7.241 0.392 1.00 12.54 O ATOM 1808 CB ALA A 119 -15.918 -4.353 -0.399 1.00 1.14 C ATOM 0 H ALA A 119 -13.845 -3.071 -0.008 1.00 62.12 H new ATOM 0 HA ALA A 119 -15.245 -5.027 1.516 1.00 53.54 H new ATOM 0 HB1 ALA A 119 -16.689 -5.118 -0.490 1.00 1.14 H new ATOM 0 HB2 ALA A 119 -16.357 -3.443 0.009 1.00 1.14 H new ATOM 0 HB3 ALA A 119 -15.497 -4.144 -1.382 1.00 1.14 H new ATOM 1814 N ASN A 120 -13.238 -6.066 -0.849 1.00 41.54 N ATOM 1815 CA ASN A 120 -12.600 -7.249 -1.416 1.00 45.31 C ATOM 1816 C ASN A 120 -11.814 -8.007 -0.350 1.00 54.13 C ATOM 1817 O ASN A 120 -11.642 -9.223 -0.437 1.00 73.15 O ATOM 1818 CB ASN A 120 -11.670 -6.852 -2.565 1.00 12.03 C ATOM 1819 CG ASN A 120 -12.432 -6.364 -3.782 1.00 60.35 C ATOM 1820 OD1 ASN A 120 -13.576 -6.757 -4.012 1.00 32.53 O ATOM 1821 ND2 ASN A 120 -11.799 -5.502 -4.570 1.00 62.22 N ATOM 0 H ASN A 120 -12.847 -5.181 -1.172 1.00 41.54 H new ATOM 0 HA ASN A 120 -13.382 -7.904 -1.800 1.00 45.31 H new ATOM 0 HB2 ASN A 120 -10.992 -6.069 -2.226 1.00 12.03 H new ATOM 0 HB3 ASN A 120 -11.055 -7.708 -2.844 1.00 12.03 H new ATOM 0 HD21 ASN A 120 -12.261 -5.139 -5.404 1.00 62.22 H new ATOM 0 HD22 ASN A 120 -10.851 -5.203 -4.341 1.00 62.22 H new ATOM 1828 N THR A 121 -11.339 -7.280 0.656 1.00 4.15 N ATOM 1829 CA THR A 121 -10.571 -7.882 1.739 1.00 31.13 C ATOM 1830 C THR A 121 -11.480 -8.306 2.887 1.00 74.44 C ATOM 1831 O THR A 121 -11.325 -9.393 3.445 1.00 34.13 O ATOM 1832 CB THR A 121 -9.502 -6.913 2.276 1.00 23.21 C ATOM 1833 OG1 THR A 121 -9.117 -5.992 1.251 1.00 5.30 O ATOM 1834 CG2 THR A 121 -8.280 -7.673 2.768 1.00 31.12 C ATOM 0 H THR A 121 -11.473 -6.273 0.743 1.00 4.15 H new ATOM 0 HA THR A 121 -10.078 -8.762 1.326 1.00 31.13 H new ATOM 0 HB THR A 121 -9.930 -6.364 3.115 1.00 23.21 H new ATOM 0 HG1 THR A 121 -9.838 -5.345 1.105 1.00 5.30 H new ATOM 0 HG21 THR A 121 -7.539 -6.967 3.143 1.00 31.12 H new ATOM 0 HG22 THR A 121 -8.572 -8.352 3.569 1.00 31.12 H new ATOM 0 HG23 THR A 121 -7.852 -8.246 1.945 1.00 31.12 H new ATOM 1842 N ALA A 122 -12.429 -7.444 3.235 1.00 44.43 N ATOM 1843 CA ALA A 122 -13.364 -7.730 4.316 1.00 51.01 C ATOM 1844 C ALA A 122 -14.102 -9.042 4.068 1.00 60.24 C ATOM 1845 O ALA A 122 -14.280 -9.847 4.983 1.00 51.31 O ATOM 1846 CB ALA A 122 -14.355 -6.587 4.474 1.00 25.41 C ATOM 0 H ALA A 122 -12.571 -6.541 2.783 1.00 44.43 H new ATOM 0 HA ALA A 122 -12.794 -7.831 5.240 1.00 51.01 H new ATOM 0 HB1 ALA A 122 -15.047 -6.815 5.285 1.00 25.41 H new ATOM 0 HB2 ALA A 122 -13.816 -5.668 4.704 1.00 25.41 H new ATOM 0 HB3 ALA A 122 -14.913 -6.458 3.546 1.00 25.41 H new ATOM 1852 N ARG A 123 -14.530 -9.250 2.828 1.00 42.33 N ATOM 1853 CA ARG A 123 -15.251 -10.463 2.462 1.00 53.24 C ATOM 1854 C ARG A 123 -14.438 -11.706 2.814 1.00 53.00 C ATOM 1855 O ARG A 123 -14.998 -12.762 3.110 1.00 52.45 O ATOM 1856 CB ARG A 123 -15.573 -10.459 0.966 1.00 21.10 C ATOM 1857 CG ARG A 123 -14.381 -10.794 0.085 1.00 71.53 C ATOM 1858 CD ARG A 123 -14.777 -10.881 -1.380 1.00 54.20 C ATOM 1859 NE ARG A 123 -14.799 -12.260 -1.862 1.00 70.40 N ATOM 1860 CZ ARG A 123 -14.782 -12.589 -3.147 1.00 54.41 C ATOM 1861 NH1 ARG A 123 -14.744 -11.645 -4.078 1.00 23.02 N ATOM 1862 NH2 ARG A 123 -14.804 -13.867 -3.507 1.00 0.42 N ATOM 0 H ARG A 123 -14.390 -8.594 2.059 1.00 42.33 H new ATOM 0 HA ARG A 123 -16.182 -10.486 3.028 1.00 53.24 H new ATOM 0 HB2 ARG A 123 -16.370 -11.177 0.773 1.00 21.10 H new ATOM 0 HB3 ARG A 123 -15.955 -9.477 0.688 1.00 21.10 H new ATOM 0 HG2 ARG A 123 -13.610 -10.034 0.210 1.00 71.53 H new ATOM 0 HG3 ARG A 123 -13.948 -11.742 0.403 1.00 71.53 H new ATOM 0 HD2 ARG A 123 -15.762 -10.434 -1.516 1.00 54.20 H new ATOM 0 HD3 ARG A 123 -14.077 -10.299 -1.980 1.00 54.20 H new ATOM 0 HE ARG A 123 -14.829 -13.011 -1.173 1.00 70.40 H new ATOM 0 HH11 ARG A 123 -14.728 -10.662 -3.807 1.00 23.02 H new ATOM 0 HH12 ARG A 123 -14.731 -11.902 -5.065 1.00 23.02 H new ATOM 0 HH21 ARG A 123 -14.834 -14.597 -2.795 1.00 0.42 H new ATOM 0 HH22 ARG A 123 -14.791 -14.119 -4.495 1.00 0.42 H new ATOM 1876 N ARG A 124 -13.116 -11.571 2.781 1.00 33.14 N ATOM 1877 CA ARG A 124 -12.227 -12.683 3.095 1.00 14.35 C ATOM 1878 C ARG A 124 -12.132 -12.893 4.603 1.00 65.22 C ATOM 1879 O ARG A 124 -11.698 -13.948 5.067 1.00 15.11 O ATOM 1880 CB ARG A 124 -10.835 -12.430 2.515 1.00 43.20 C ATOM 1881 CG ARG A 124 -10.856 -11.819 1.124 1.00 1.52 C ATOM 1882 CD ARG A 124 -9.464 -11.399 0.677 1.00 35.43 C ATOM 1883 NE ARG A 124 -9.461 -10.874 -0.685 1.00 11.35 N ATOM 1884 CZ ARG A 124 -8.370 -10.429 -1.299 1.00 12.05 C ATOM 1885 NH1 ARG A 124 -7.200 -10.447 -0.675 1.00 15.41 N ATOM 1886 NH2 ARG A 124 -8.448 -9.966 -2.540 1.00 42.53 N ATOM 0 H ARG A 124 -12.637 -10.703 2.540 1.00 33.14 H new ATOM 0 HA ARG A 124 -12.641 -13.585 2.645 1.00 14.35 H new ATOM 0 HB2 ARG A 124 -10.286 -11.768 3.185 1.00 43.20 H new ATOM 0 HB3 ARG A 124 -10.288 -13.372 2.480 1.00 43.20 H new ATOM 0 HG2 ARG A 124 -11.265 -12.539 0.415 1.00 1.52 H new ATOM 0 HG3 ARG A 124 -11.518 -10.953 1.116 1.00 1.52 H new ATOM 0 HD2 ARG A 124 -9.078 -10.641 1.358 1.00 35.43 H new ATOM 0 HD3 ARG A 124 -8.791 -12.254 0.737 1.00 35.43 H new ATOM 0 HE ARG A 124 -10.345 -10.847 -1.193 1.00 11.35 H new ATOM 0 HH11 ARG A 124 -7.136 -10.803 0.279 1.00 15.41 H new ATOM 0 HH12 ARG A 124 -6.364 -10.105 -1.149 1.00 15.41 H new ATOM 0 HH21 ARG A 124 -9.346 -9.951 -3.023 1.00 42.53 H new ATOM 0 HH22 ARG A 124 -7.610 -9.625 -3.011 1.00 42.53 H new ATOM 1900 N TYR A 125 -12.538 -11.882 5.363 1.00 74.11 N ATOM 1901 CA TYR A 125 -12.495 -11.954 6.818 1.00 75.42 C ATOM 1902 C TYR A 125 -13.855 -12.352 7.385 1.00 53.15 C ATOM 1903 O TYR A 125 -14.170 -12.061 8.539 1.00 44.55 O ATOM 1904 CB TYR A 125 -12.060 -10.610 7.405 1.00 52.25 C ATOM 1905 CG TYR A 125 -10.600 -10.293 7.171 1.00 65.51 C ATOM 1906 CD1 TYR A 125 -9.606 -10.905 7.927 1.00 15.00 C ATOM 1907 CD2 TYR A 125 -10.214 -9.381 6.197 1.00 61.33 C ATOM 1908 CE1 TYR A 125 -8.272 -10.618 7.719 1.00 44.32 C ATOM 1909 CE2 TYR A 125 -8.881 -9.089 5.981 1.00 2.31 C ATOM 1910 CZ TYR A 125 -7.913 -9.710 6.744 1.00 21.43 C ATOM 1911 OH TYR A 125 -6.585 -9.420 6.533 1.00 62.21 O ATOM 0 H TYR A 125 -12.901 -11.003 4.995 1.00 74.11 H new ATOM 0 HA TYR A 125 -11.768 -12.717 7.096 1.00 75.42 H new ATOM 0 HB2 TYR A 125 -12.670 -9.818 6.970 1.00 52.25 H new ATOM 0 HB3 TYR A 125 -12.256 -10.610 8.477 1.00 52.25 H new ATOM 0 HD1 TYR A 125 -9.883 -11.617 8.690 1.00 15.00 H new ATOM 0 HD2 TYR A 125 -10.968 -8.892 5.599 1.00 61.33 H new ATOM 0 HE1 TYR A 125 -7.513 -11.102 8.316 1.00 44.32 H new ATOM 0 HE2 TYR A 125 -8.598 -8.378 5.219 1.00 2.31 H new ATOM 0 HH TYR A 125 -6.504 -8.763 5.811 1.00 62.21 H new ATOM 1921 N ARG A 126 -14.659 -13.020 6.563 1.00 52.35 N ATOM 1922 CA ARG A 126 -15.985 -13.458 6.979 1.00 24.45 C ATOM 1923 C ARG A 126 -16.921 -12.265 7.156 1.00 70.15 C ATOM 1924 O ARG A 126 -17.763 -12.251 8.054 1.00 53.53 O ATOM 1925 CB ARG A 126 -15.898 -14.248 8.286 1.00 63.54 C ATOM 1926 CG ARG A 126 -16.772 -15.492 8.305 1.00 70.33 C ATOM 1927 CD ARG A 126 -18.209 -15.156 8.670 1.00 34.13 C ATOM 1928 NE ARG A 126 -18.891 -16.283 9.300 1.00 35.22 N ATOM 1929 CZ ARG A 126 -20.212 -16.368 9.423 1.00 2.30 C ATOM 1930 NH1 ARG A 126 -20.987 -15.397 8.960 1.00 23.44 N ATOM 1931 NH2 ARG A 126 -20.758 -17.426 10.008 1.00 31.03 N ATOM 0 H ARG A 126 -14.414 -13.269 5.605 1.00 52.35 H new ATOM 0 HA ARG A 126 -16.388 -14.103 6.198 1.00 24.45 H new ATOM 0 HB2 ARG A 126 -14.862 -14.540 8.456 1.00 63.54 H new ATOM 0 HB3 ARG A 126 -16.186 -13.599 9.113 1.00 63.54 H new ATOM 0 HG2 ARG A 126 -16.746 -15.971 7.326 1.00 70.33 H new ATOM 0 HG3 ARG A 126 -16.371 -16.209 9.022 1.00 70.33 H new ATOM 0 HD2 ARG A 126 -18.221 -14.301 9.346 1.00 34.13 H new ATOM 0 HD3 ARG A 126 -18.751 -14.860 7.772 1.00 34.13 H new ATOM 0 HE ARG A 126 -18.323 -17.047 9.666 1.00 35.22 H new ATOM 0 HH11 ARG A 126 -20.570 -14.583 8.508 1.00 23.44 H new ATOM 0 HH12 ARG A 126 -22.000 -15.464 9.055 1.00 23.44 H new ATOM 0 HH21 ARG A 126 -20.164 -18.175 10.364 1.00 31.03 H new ATOM 0 HH22 ARG A 126 -21.772 -17.490 10.102 1.00 31.03 H new ATOM 2041 N VAL A 134 -20.621 -3.530 -3.234 1.00 73.52 N ATOM 2042 CA VAL A 134 -19.514 -2.584 -3.300 1.00 14.30 C ATOM 2043 C VAL A 134 -19.786 -1.492 -4.329 1.00 12.41 C ATOM 2044 O VAL A 134 -19.477 -0.323 -4.103 1.00 0.10 O ATOM 2045 CB VAL A 134 -18.192 -3.290 -3.655 1.00 74.01 C ATOM 2046 CG1 VAL A 134 -17.011 -2.363 -3.415 1.00 62.53 C ATOM 2047 CG2 VAL A 134 -18.045 -4.575 -2.856 1.00 61.14 C ATOM 0 HA VAL A 134 -19.423 -2.134 -2.311 1.00 14.30 H new ATOM 0 HB VAL A 134 -18.210 -3.548 -4.714 1.00 74.01 H new ATOM 0 HG11 VAL A 134 -16.086 -2.879 -3.671 1.00 62.53 H new ATOM 0 HG12 VAL A 134 -17.115 -1.473 -4.036 1.00 62.53 H new ATOM 0 HG13 VAL A 134 -16.985 -2.071 -2.365 1.00 62.53 H new ATOM 0 HG21 VAL A 134 -17.106 -5.061 -3.119 1.00 61.14 H new ATOM 0 HG22 VAL A 134 -18.048 -4.344 -1.791 1.00 61.14 H new ATOM 0 HG23 VAL A 134 -18.876 -5.243 -3.085 1.00 61.14 H new ATOM 2057 N GLN A 135 -20.368 -1.882 -5.459 1.00 40.10 N ATOM 2058 CA GLN A 135 -20.682 -0.936 -6.523 1.00 24.12 C ATOM 2059 C GLN A 135 -21.549 0.204 -5.999 1.00 64.44 C ATOM 2060 O GLN A 135 -21.378 1.358 -6.393 1.00 31.30 O ATOM 2061 CB GLN A 135 -21.396 -1.648 -7.673 1.00 60.20 C ATOM 2062 CG GLN A 135 -22.665 -2.368 -7.248 1.00 14.43 C ATOM 2063 CD GLN A 135 -23.922 -1.639 -7.679 1.00 20.13 C ATOM 2064 OE1 GLN A 135 -23.964 -1.025 -8.746 1.00 24.12 O ATOM 2065 NE2 GLN A 135 -24.956 -1.701 -6.849 1.00 31.54 N ATOM 0 H GLN A 135 -20.631 -2.846 -5.661 1.00 40.10 H new ATOM 0 HA GLN A 135 -19.745 -0.517 -6.890 1.00 24.12 H new ATOM 0 HB2 GLN A 135 -21.643 -0.918 -8.444 1.00 60.20 H new ATOM 0 HB3 GLN A 135 -20.713 -2.368 -8.123 1.00 60.20 H new ATOM 0 HG2 GLN A 135 -22.668 -3.372 -7.673 1.00 14.43 H new ATOM 0 HG3 GLN A 135 -22.669 -2.481 -6.164 1.00 14.43 H new ATOM 0 HE21 GLN A 135 -24.878 -2.221 -5.975 1.00 31.54 H new ATOM 0 HE22 GLN A 135 -25.829 -1.229 -7.085 1.00 31.54 H new ATOM 2074 N ALA A 136 -22.478 -0.126 -5.108 1.00 52.35 N ATOM 2075 CA ALA A 136 -23.370 0.870 -4.530 1.00 20.33 C ATOM 2076 C ALA A 136 -22.605 1.836 -3.631 1.00 64.13 C ATOM 2077 O ALA A 136 -22.933 3.021 -3.555 1.00 71.15 O ATOM 2078 CB ALA A 136 -24.485 0.191 -3.748 1.00 54.04 C ATOM 0 H ALA A 136 -22.632 -1.076 -4.771 1.00 52.35 H new ATOM 0 HA ALA A 136 -23.810 1.443 -5.346 1.00 20.33 H new ATOM 0 HB1 ALA A 136 -25.144 0.948 -3.322 1.00 54.04 H new ATOM 0 HB2 ALA A 136 -25.057 -0.454 -4.415 1.00 54.04 H new ATOM 0 HB3 ALA A 136 -24.054 -0.408 -2.946 1.00 54.04 H new ATOM 2084 N ASP A 137 -21.586 1.322 -2.951 1.00 44.44 N ATOM 2085 CA ASP A 137 -20.772 2.140 -2.058 1.00 14.22 C ATOM 2086 C ASP A 137 -19.915 3.123 -2.850 1.00 31.53 C ATOM 2087 O ASP A 137 -19.706 4.260 -2.427 1.00 63.20 O ATOM 2088 CB ASP A 137 -19.882 1.251 -1.188 1.00 43.14 C ATOM 2089 CG ASP A 137 -20.625 0.671 -0.001 1.00 54.53 C ATOM 2090 OD1 ASP A 137 -21.813 1.013 0.181 1.00 50.14 O ATOM 2091 OD2 ASP A 137 -20.020 -0.126 0.745 1.00 43.34 O ATOM 0 H ASP A 137 -21.304 0.343 -3.001 1.00 44.44 H new ATOM 0 HA ASP A 137 -21.442 2.710 -1.414 1.00 14.22 H new ATOM 0 HB2 ASP A 137 -19.482 0.438 -1.794 1.00 43.14 H new ATOM 0 HB3 ASP A 137 -19.031 1.832 -0.832 1.00 43.14 H new ATOM 2096 N VAL A 138 -19.421 2.675 -3.999 1.00 45.24 N ATOM 2097 CA VAL A 138 -18.585 3.515 -4.850 1.00 35.43 C ATOM 2098 C VAL A 138 -19.395 4.649 -5.468 1.00 13.12 C ATOM 2099 O VAL A 138 -18.933 5.786 -5.545 1.00 23.52 O ATOM 2100 CB VAL A 138 -17.928 2.695 -5.976 1.00 25.43 C ATOM 2101 CG1 VAL A 138 -17.257 3.615 -6.985 1.00 22.42 C ATOM 2102 CG2 VAL A 138 -16.929 1.704 -5.399 1.00 63.51 C ATOM 0 H VAL A 138 -19.584 1.736 -4.363 1.00 45.24 H new ATOM 0 HA VAL A 138 -17.805 3.934 -4.214 1.00 35.43 H new ATOM 0 HB VAL A 138 -18.705 2.133 -6.494 1.00 25.43 H new ATOM 0 HG11 VAL A 138 -16.798 3.018 -7.773 1.00 22.42 H new ATOM 0 HG12 VAL A 138 -18.001 4.281 -7.421 1.00 22.42 H new ATOM 0 HG13 VAL A 138 -16.490 4.206 -6.485 1.00 22.42 H new ATOM 0 HG21 VAL A 138 -16.474 1.133 -6.208 1.00 63.51 H new ATOM 0 HG22 VAL A 138 -16.154 2.244 -4.855 1.00 63.51 H new ATOM 0 HG23 VAL A 138 -17.442 1.024 -4.719 1.00 63.51 H new ATOM 2112 N SER A 139 -20.609 4.330 -5.908 1.00 41.41 N ATOM 2113 CA SER A 139 -21.484 5.321 -6.524 1.00 41.13 C ATOM 2114 C SER A 139 -21.996 6.314 -5.484 1.00 62.25 C ATOM 2115 O SER A 139 -22.260 7.476 -5.795 1.00 54.34 O ATOM 2116 CB SER A 139 -22.664 4.633 -7.213 1.00 42.25 C ATOM 2117 OG SER A 139 -22.907 5.197 -8.490 1.00 31.33 O ATOM 0 H SER A 139 -21.008 3.393 -5.849 1.00 41.41 H new ATOM 0 HA SER A 139 -20.906 5.867 -7.269 1.00 41.13 H new ATOM 0 HB2 SER A 139 -22.459 3.567 -7.315 1.00 42.25 H new ATOM 0 HB3 SER A 139 -23.556 4.728 -6.594 1.00 42.25 H new ATOM 0 HG SER A 139 -23.665 4.739 -8.911 1.00 31.33 H new ATOM 2123 N LEU A 140 -22.133 5.848 -4.248 1.00 43.35 N ATOM 2124 CA LEU A 140 -22.613 6.693 -3.160 1.00 53.52 C ATOM 2125 C LEU A 140 -21.561 7.726 -2.770 1.00 24.23 C ATOM 2126 O LEU A 140 -21.849 8.921 -2.689 1.00 50.52 O ATOM 2127 CB LEU A 140 -22.980 5.837 -1.947 1.00 44.13 C ATOM 2128 CG LEU A 140 -23.318 6.600 -0.665 1.00 45.02 C ATOM 2129 CD1 LEU A 140 -24.446 5.911 0.085 1.00 33.31 C ATOM 2130 CD2 LEU A 140 -22.086 6.727 0.220 1.00 4.31 C ATOM 0 H LEU A 140 -21.918 4.889 -3.974 1.00 43.35 H new ATOM 0 HA LEU A 140 -23.502 7.220 -3.506 1.00 53.52 H new ATOM 0 HB2 LEU A 140 -23.835 5.215 -2.212 1.00 44.13 H new ATOM 0 HB3 LEU A 140 -22.149 5.164 -1.737 1.00 44.13 H new ATOM 0 HG LEU A 140 -23.650 7.602 -0.938 1.00 45.02 H new ATOM 0 HD11 LEU A 140 -24.672 6.468 0.994 1.00 33.31 H new ATOM 0 HD12 LEU A 140 -25.333 5.872 -0.547 1.00 33.31 H new ATOM 0 HD13 LEU A 140 -24.143 4.897 0.347 1.00 33.31 H new ATOM 0 HD21 LEU A 140 -22.345 7.272 1.128 1.00 4.31 H new ATOM 0 HD22 LEU A 140 -21.724 5.733 0.484 1.00 4.31 H new ATOM 0 HD23 LEU A 140 -21.306 7.266 -0.317 1.00 4.31 H new ATOM 2142 N VAL A 141 -20.341 7.259 -2.528 1.00 42.42 N ATOM 2143 CA VAL A 141 -19.244 8.143 -2.148 1.00 1.14 C ATOM 2144 C VAL A 141 -18.909 9.116 -3.274 1.00 62.23 C ATOM 2145 O VAL A 141 -18.617 10.288 -3.031 1.00 32.51 O ATOM 2146 CB VAL A 141 -17.980 7.344 -1.780 1.00 55.11 C ATOM 2147 CG1 VAL A 141 -18.221 6.512 -0.530 1.00 61.34 C ATOM 2148 CG2 VAL A 141 -17.550 6.463 -2.943 1.00 11.11 C ATOM 0 H VAL A 141 -20.086 6.273 -2.588 1.00 42.42 H new ATOM 0 HA VAL A 141 -19.576 8.703 -1.274 1.00 1.14 H new ATOM 0 HB VAL A 141 -17.174 8.047 -1.570 1.00 55.11 H new ATOM 0 HG11 VAL A 141 -17.317 5.954 -0.285 1.00 61.34 H new ATOM 0 HG12 VAL A 141 -18.478 7.169 0.301 1.00 61.34 H new ATOM 0 HG13 VAL A 141 -19.040 5.816 -0.709 1.00 61.34 H new ATOM 0 HG21 VAL A 141 -16.655 5.905 -2.666 1.00 11.11 H new ATOM 0 HG22 VAL A 141 -18.351 5.765 -3.187 1.00 11.11 H new ATOM 0 HG23 VAL A 141 -17.335 7.086 -3.811 1.00 11.11 H new ATOM 2158 N THR A 142 -18.951 8.622 -4.508 1.00 64.42 N ATOM 2159 CA THR A 142 -18.649 9.446 -5.671 1.00 22.21 C ATOM 2160 C THR A 142 -19.736 10.490 -5.901 1.00 2.42 C ATOM 2161 O THR A 142 -19.444 11.657 -6.165 1.00 15.33 O ATOM 2162 CB THR A 142 -18.498 8.590 -6.942 1.00 3.14 C ATOM 2163 OG1 THR A 142 -19.632 7.728 -7.090 1.00 62.33 O ATOM 2164 CG2 THR A 142 -17.225 7.758 -6.886 1.00 2.44 C ATOM 0 H THR A 142 -19.191 7.655 -4.727 1.00 64.42 H new ATOM 0 HA THR A 142 -17.704 9.948 -5.466 1.00 22.21 H new ATOM 0 HB THR A 142 -18.438 9.260 -7.800 1.00 3.14 H new ATOM 0 HG1 THR A 142 -19.505 6.923 -6.545 1.00 62.33 H new ATOM 0 HG21 THR A 142 -17.140 7.162 -7.794 1.00 2.44 H new ATOM 0 HG22 THR A 142 -16.362 8.419 -6.803 1.00 2.44 H new ATOM 0 HG23 THR A 142 -17.260 7.097 -6.020 1.00 2.44 H new ATOM 2172 N SER A 143 -20.991 10.064 -5.799 1.00 11.33 N ATOM 2173 CA SER A 143 -22.122 10.961 -5.999 1.00 11.24 C ATOM 2174 C SER A 143 -22.084 12.115 -5.000 1.00 12.20 C ATOM 2175 O SER A 143 -22.431 13.248 -5.332 1.00 21.20 O ATOM 2176 CB SER A 143 -23.439 10.196 -5.861 1.00 32.14 C ATOM 2177 OG SER A 143 -23.762 9.516 -7.062 1.00 20.41 O ATOM 0 H SER A 143 -21.250 9.102 -5.579 1.00 11.33 H new ATOM 0 HA SER A 143 -22.053 11.372 -7.006 1.00 11.24 H new ATOM 0 HB2 SER A 143 -23.363 9.480 -5.043 1.00 32.14 H new ATOM 0 HB3 SER A 143 -24.241 10.889 -5.605 1.00 32.14 H new ATOM 0 HG SER A 143 -23.372 8.617 -7.044 1.00 20.41 H new ATOM 2183 N MET A 144 -21.661 11.816 -3.777 1.00 51.02 N ATOM 2184 CA MET A 144 -21.576 12.827 -2.730 1.00 12.12 C ATOM 2185 C MET A 144 -20.515 13.870 -3.066 1.00 0.12 C ATOM 2186 O MET A 144 -20.725 15.068 -2.874 1.00 51.43 O ATOM 2187 CB MET A 144 -21.257 12.172 -1.384 1.00 61.11 C ATOM 2188 CG MET A 144 -22.353 11.246 -0.884 1.00 42.00 C ATOM 2189 SD MET A 144 -23.458 12.049 0.293 1.00 61.14 S ATOM 2190 CE MET A 144 -22.617 11.704 1.837 1.00 2.22 C ATOM 0 H MET A 144 -21.372 10.882 -3.486 1.00 51.02 H new ATOM 0 HA MET A 144 -22.542 13.327 -2.663 1.00 12.12 H new ATOM 0 HB2 MET A 144 -20.329 11.607 -1.475 1.00 61.11 H new ATOM 0 HB3 MET A 144 -21.085 12.951 -0.642 1.00 61.11 H new ATOM 0 HG2 MET A 144 -22.933 10.885 -1.733 1.00 42.00 H new ATOM 0 HG3 MET A 144 -21.900 10.374 -0.414 1.00 42.00 H new ATOM 0 HE1 MET A 144 -23.180 12.138 2.663 1.00 2.22 H new ATOM 0 HE2 MET A 144 -22.541 10.626 1.977 1.00 2.22 H new ATOM 0 HE3 MET A 144 -21.618 12.138 1.812 1.00 2.22 H new ATOM 2200 N THR A 145 -19.374 13.406 -3.567 1.00 3.02 N ATOM 2201 CA THR A 145 -18.280 14.299 -3.928 1.00 21.11 C ATOM 2202 C THR A 145 -18.655 15.175 -5.119 1.00 64.43 C ATOM 2203 O THR A 145 -18.333 16.363 -5.153 1.00 21.12 O ATOM 2204 CB THR A 145 -17.000 13.511 -4.267 1.00 21.32 C ATOM 2205 OG1 THR A 145 -17.158 12.837 -5.521 1.00 63.11 O ATOM 2206 CG2 THR A 145 -16.684 12.499 -3.177 1.00 70.15 C ATOM 0 H THR A 145 -19.184 12.418 -3.732 1.00 3.02 H new ATOM 0 HA THR A 145 -18.089 14.932 -3.061 1.00 21.11 H new ATOM 0 HB THR A 145 -16.172 14.216 -4.336 1.00 21.32 H new ATOM 0 HG1 THR A 145 -17.908 12.209 -5.463 1.00 63.11 H new ATOM 0 HG21 THR A 145 -15.776 11.955 -3.438 1.00 70.15 H new ATOM 0 HG22 THR A 145 -16.536 13.018 -2.230 1.00 70.15 H new ATOM 0 HG23 THR A 145 -17.513 11.798 -3.080 1.00 70.15 H new ATOM 2214 N SER A 146 -19.336 14.581 -6.093 1.00 63.44 N ATOM 2215 CA SER A 146 -19.750 15.307 -7.287 1.00 14.45 C ATOM 2216 C SER A 146 -20.443 16.614 -6.915 1.00 20.23 C ATOM 2217 O SER A 146 -20.386 17.596 -7.658 1.00 74.41 O ATOM 2218 CB SER A 146 -20.688 14.444 -8.134 1.00 34.41 C ATOM 2219 OG SER A 146 -20.098 14.122 -9.382 1.00 25.41 O ATOM 0 H SER A 146 -19.613 13.599 -6.079 1.00 63.44 H new ATOM 0 HA SER A 146 -18.858 15.541 -7.868 1.00 14.45 H new ATOM 0 HB2 SER A 146 -20.930 13.528 -7.595 1.00 34.41 H new ATOM 0 HB3 SER A 146 -21.626 14.974 -8.298 1.00 34.41 H new ATOM 0 HG SER A 146 -20.717 13.569 -9.903 1.00 25.41 H new ATOM 2225 N THR A 147 -21.098 16.622 -5.758 1.00 70.32 N ATOM 2226 CA THR A 147 -21.803 17.807 -5.286 1.00 60.34 C ATOM 2227 C THR A 147 -21.138 18.381 -4.040 1.00 3.11 C ATOM 2228 O THR A 147 -21.811 18.731 -3.070 1.00 72.41 O ATOM 2229 CB THR A 147 -23.277 17.494 -4.969 1.00 1.25 C ATOM 2230 OG1 THR A 147 -23.380 16.224 -4.317 1.00 31.04 O ATOM 2231 CG2 THR A 147 -24.113 17.487 -6.240 1.00 1.24 C ATOM 0 H THR A 147 -21.155 15.820 -5.130 1.00 70.32 H new ATOM 0 HA THR A 147 -21.760 18.542 -6.090 1.00 60.34 H new ATOM 0 HB THR A 147 -23.656 18.272 -4.307 1.00 1.25 H new ATOM 0 HG1 THR A 147 -24.321 16.034 -4.118 1.00 31.04 H new ATOM 0 HG21 THR A 147 -25.151 17.264 -5.992 1.00 1.24 H new ATOM 0 HG22 THR A 147 -24.057 18.465 -6.718 1.00 1.24 H new ATOM 0 HG23 THR A 147 -23.732 16.727 -6.922 1.00 1.24 H new ATOM 2239 N PHE A 148 -19.813 18.479 -4.074 1.00 11.23 N ATOM 2240 CA PHE A 148 -19.057 19.012 -2.947 1.00 24.33 C ATOM 2241 C PHE A 148 -18.360 20.316 -3.327 1.00 22.41 C ATOM 2242 O PHE A 148 -17.540 20.350 -4.244 1.00 54.04 O ATOM 2243 CB PHE A 148 -18.024 17.989 -2.468 1.00 2.44 C ATOM 2244 CG PHE A 148 -17.090 18.525 -1.421 1.00 12.45 C ATOM 2245 CD1 PHE A 148 -17.579 19.229 -0.333 1.00 25.24 C ATOM 2246 CD2 PHE A 148 -15.723 18.324 -1.525 1.00 44.30 C ATOM 2247 CE1 PHE A 148 -16.722 19.725 0.631 1.00 71.24 C ATOM 2248 CE2 PHE A 148 -14.860 18.817 -0.564 1.00 33.41 C ATOM 2249 CZ PHE A 148 -15.360 19.517 0.516 1.00 35.42 C ATOM 0 H PHE A 148 -19.241 18.196 -4.870 1.00 11.23 H new ATOM 0 HA PHE A 148 -19.757 19.217 -2.137 1.00 24.33 H new ATOM 0 HB2 PHE A 148 -18.545 17.119 -2.068 1.00 2.44 H new ATOM 0 HB3 PHE A 148 -17.441 17.646 -3.323 1.00 2.44 H new ATOM 0 HD1 PHE A 148 -18.642 19.392 -0.237 1.00 25.24 H new ATOM 0 HD2 PHE A 148 -15.327 17.776 -2.367 1.00 44.30 H new ATOM 0 HE1 PHE A 148 -17.116 20.274 1.473 1.00 71.24 H new ATOM 0 HE2 PHE A 148 -13.796 18.655 -0.658 1.00 33.41 H new ATOM 0 HZ PHE A 148 -14.688 19.901 1.269 1.00 35.42 H new