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 108 SER OG : rot 180:sc=-0.00956 USER MOD Set 1.2: A 109 THR OG1 : rot 81:sc= 1.04 USER MOD Set 2.1: A 99 ASN :FLIP amide:sc= -0.326 F(o=-5.4,f=-1.5) USER MOD Set 2.2: A 102 ASN : amide:sc= -1.2 K(o=-1.5,f=-5.4!) USER MOD Set 3.1: A 95 SER OG : rot -1:sc= 0.616 USER MOD Set 3.2: A 97 SER OG : rot 180:sc=-0.00912 USER MOD Set 4.1: A 41 SER OG : rot 70:sc= 0.635 USER MOD Set 4.2: A 121 THR OG1 : rot 75:sc= 1.19 USER MOD Set 5.1: A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.2: A 144 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 GLN : amide:sc= -0.0122 X(o=-0.012,f=-0.25) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.035 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 77:sc= 0.819 USER MOD Single : A 14 SER OG : rot 99:sc= 1.24 USER MOD Single : A 17 THR OG1 : rot 92:sc= 1.2 USER MOD Single : A 19 THR OG1 : rot -22:sc= -0.455 USER MOD Single : A 20 ASN : amide:sc= -2.44 X(o=-2.4,f=-2.5) USER MOD Single : A 21 THR OG1 : rot 71:sc= -2.74! USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 70:sc= 0.193 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= -1.7 USER MOD Single : A 33 ASN : amide:sc= -0.138 X(o=-0.14,f=-0.14) USER MOD Single : A 40 THR OG1 : rot 33:sc= -0.857 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= -1.94! C(o=-1.9!,f=-4.9!) USER MOD Single : A 57 SER OG : rot 180:sc= -0.704 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 GLN :FLIP amide:sc= -0.558 F(o=-2.6!,f=-0.56) USER MOD Single : A 61 THR OG1 : rot 64:sc= 1.4 USER MOD Single : A 62 SER OG : rot 71:sc= 0.0136 USER MOD Single : A 65 SER OG : rot -90:sc= 0.835 USER MOD Single : A 66 GLN : amide:sc= -0.242 X(o=-0.24,f=-0.012) USER MOD Single : A 70 ASN : amide:sc= -0.116 K(o=-0.12,f=-1.4!) USER MOD Single : A 75 SER OG : rot 91:sc= 0.48 USER MOD Single : A 76 SER OG : rot 180:sc= -0.723 USER MOD Single : A 80 TYR OH : rot 121:sc= 0.115 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 110:sc= 1.04 USER MOD Single : A 90 GLN : amide:sc= -2.05! C(o=-2.1!,f=-1.6!) USER MOD Single : A 94 SER OG : rot 97:sc= 0.173 USER MOD Single : A 100 ASN : amide:sc= 0.0472 K(o=0.047,f=-2.1!) USER MOD Single : A 101 ASN : amide:sc= -0.102 X(o=-0.1,f=-0.59) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 SER OG : rot 78:sc= -0.128 USER MOD Single : A 113 ASN : amide:sc= -2.36! C(o=-2.4!,f=-2.4!) USER MOD Single : A 118 MET CE :methyl 153:sc= -6.48! (180deg=-7.29!) USER MOD Single : A 120 ASN : amide:sc= -0.572 K(o=-0.57,f=-1.4!) USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= -0.608 X(o=-0.61,f=-0.3) USER MOD Single : A 139 SER OG : rot 79:sc= 1.19 USER MOD Single : A 142 THR OG1 : rot -96:sc= 0.0596 USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 145 THR OG1 : rot -94:sc= -0.346 USER MOD Single : A 146 SER OG : rot 65:sc= 1.07 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.00167 USER MOD ----------------------------------------------------------------- ATOM 189 N GLN A 7 -13.771 19.237 6.472 1.00 2.25 N ATOM 190 CA GLN A 7 -14.809 19.071 5.462 1.00 3.41 C ATOM 191 C GLN A 7 -14.686 17.717 4.771 1.00 50.10 C ATOM 192 O GLN A 7 -15.674 17.002 4.602 1.00 22.44 O ATOM 193 CB GLN A 7 -14.727 20.194 4.427 1.00 3.14 C ATOM 194 CG GLN A 7 -14.858 21.586 5.026 1.00 34.23 C ATOM 195 CD GLN A 7 -15.441 22.589 4.050 1.00 73.52 C ATOM 196 OE1 GLN A 7 -16.486 22.348 3.445 1.00 5.44 O ATOM 197 NE2 GLN A 7 -14.767 23.721 3.892 1.00 42.01 N ATOM 0 HA GLN A 7 -15.777 19.116 5.962 1.00 3.41 H new ATOM 0 HB2 GLN A 7 -13.775 20.122 3.900 1.00 3.14 H new ATOM 0 HB3 GLN A 7 -15.513 20.051 3.686 1.00 3.14 H new ATOM 0 HG2 GLN A 7 -15.490 21.538 5.913 1.00 34.23 H new ATOM 0 HG3 GLN A 7 -13.877 21.931 5.353 1.00 34.23 H new ATOM 0 HE21 GLN A 7 -13.905 23.878 4.414 1.00 42.01 H new ATOM 0 HE22 GLN A 7 -15.111 24.434 3.248 1.00 42.01 H new ATOM 206 N LEU A 8 -13.467 17.372 4.372 1.00 21.21 N ATOM 207 CA LEU A 8 -13.213 16.103 3.699 1.00 53.03 C ATOM 208 C LEU A 8 -13.592 14.926 4.593 1.00 14.23 C ATOM 209 O LEU A 8 -14.206 13.959 4.139 1.00 24.34 O ATOM 210 CB LEU A 8 -11.740 16.000 3.298 1.00 32.31 C ATOM 211 CG LEU A 8 -11.425 16.264 1.826 1.00 2.02 C ATOM 212 CD1 LEU A 8 -11.708 15.027 0.989 1.00 62.12 C ATOM 213 CD2 LEU A 8 -12.227 17.452 1.313 1.00 63.40 C ATOM 0 H LEU A 8 -12.639 17.953 4.503 1.00 21.21 H new ATOM 0 HA LEU A 8 -13.830 16.067 2.801 1.00 53.03 H new ATOM 0 HB2 LEU A 8 -11.169 16.705 3.903 1.00 32.31 H new ATOM 0 HB3 LEU A 8 -11.384 15.001 3.551 1.00 32.31 H new ATOM 0 HG LEU A 8 -10.365 16.502 1.739 1.00 2.02 H new ATOM 0 HD11 LEU A 8 -11.478 15.234 -0.056 1.00 62.12 H new ATOM 0 HD12 LEU A 8 -11.089 14.201 1.340 1.00 62.12 H new ATOM 0 HD13 LEU A 8 -12.760 14.758 1.082 1.00 62.12 H new ATOM 0 HD21 LEU A 8 -11.990 17.625 0.263 1.00 63.40 H new ATOM 0 HD22 LEU A 8 -13.292 17.243 1.415 1.00 63.40 H new ATOM 0 HD23 LEU A 8 -11.974 18.339 1.893 1.00 63.40 H new ATOM 225 N THR A 9 -13.224 15.016 5.867 1.00 73.23 N ATOM 226 CA THR A 9 -13.526 13.960 6.825 1.00 60.42 C ATOM 227 C THR A 9 -15.023 13.876 7.097 1.00 31.11 C ATOM 228 O THR A 9 -15.583 12.786 7.214 1.00 51.13 O ATOM 229 CB THR A 9 -12.786 14.182 8.158 1.00 45.42 C ATOM 230 OG1 THR A 9 -12.754 15.579 8.474 1.00 71.04 O ATOM 231 CG2 THR A 9 -11.365 13.642 8.085 1.00 44.40 C ATOM 0 H THR A 9 -12.717 15.809 6.259 1.00 73.23 H new ATOM 0 HA THR A 9 -13.187 13.024 6.381 1.00 60.42 H new ATOM 0 HB THR A 9 -13.323 13.645 8.940 1.00 45.42 H new ATOM 0 HG1 THR A 9 -12.284 15.712 9.323 1.00 71.04 H new ATOM 0 HG21 THR A 9 -10.862 13.810 9.038 1.00 44.40 H new ATOM 0 HG22 THR A 9 -11.392 12.573 7.873 1.00 44.40 H new ATOM 0 HG23 THR A 9 -10.821 14.155 7.292 1.00 44.40 H new ATOM 239 N SER A 10 -15.668 15.034 7.197 1.00 23.41 N ATOM 240 CA SER A 10 -17.102 15.092 7.459 1.00 73.44 C ATOM 241 C SER A 10 -17.882 14.368 6.367 1.00 53.53 C ATOM 242 O SER A 10 -18.803 13.601 6.648 1.00 31.43 O ATOM 243 CB SER A 10 -17.566 16.546 7.555 1.00 42.22 C ATOM 244 OG SER A 10 -17.551 16.998 8.898 1.00 3.55 O ATOM 0 H SER A 10 -15.220 15.945 7.101 1.00 23.41 H new ATOM 0 HA SER A 10 -17.294 14.594 8.410 1.00 73.44 H new ATOM 0 HB2 SER A 10 -16.919 17.179 6.948 1.00 42.22 H new ATOM 0 HB3 SER A 10 -18.573 16.637 7.148 1.00 42.22 H new ATOM 0 HG SER A 10 -17.850 17.931 8.933 1.00 3.55 H new ATOM 250 N THR A 11 -17.507 14.616 5.115 1.00 3.02 N ATOM 251 CA THR A 11 -18.171 13.990 3.979 1.00 31.23 C ATOM 252 C THR A 11 -17.704 12.551 3.793 1.00 22.52 C ATOM 253 O THR A 11 -18.517 11.637 3.651 1.00 61.31 O ATOM 254 CB THR A 11 -17.914 14.773 2.677 1.00 30.41 C ATOM 255 OG1 THR A 11 -17.544 16.123 2.982 1.00 73.41 O ATOM 256 CG2 THR A 11 -19.151 14.769 1.791 1.00 32.03 C ATOM 0 H THR A 11 -16.746 15.247 4.863 1.00 3.02 H new ATOM 0 HA THR A 11 -19.239 13.997 4.195 1.00 31.23 H new ATOM 0 HB THR A 11 -17.100 14.286 2.140 1.00 30.41 H new ATOM 0 HG1 THR A 11 -16.611 16.147 3.280 1.00 73.41 H new ATOM 0 HG21 THR A 11 -18.946 15.328 0.878 1.00 32.03 H new ATOM 0 HG22 THR A 11 -19.413 13.742 1.537 1.00 32.03 H new ATOM 0 HG23 THR A 11 -19.981 15.235 2.323 1.00 32.03 H new ATOM 264 N LEU A 12 -16.390 12.356 3.797 1.00 51.30 N ATOM 265 CA LEU A 12 -15.814 11.026 3.630 1.00 53.34 C ATOM 266 C LEU A 12 -16.353 10.062 4.681 1.00 1.12 C ATOM 267 O LEU A 12 -16.747 8.940 4.366 1.00 70.42 O ATOM 268 CB LEU A 12 -14.288 11.094 3.719 1.00 51.51 C ATOM 269 CG LEU A 12 -13.568 11.647 2.487 1.00 4.03 C ATOM 270 CD1 LEU A 12 -12.071 11.737 2.740 1.00 74.43 C ATOM 271 CD2 LEU A 12 -13.854 10.782 1.269 1.00 1.42 C ATOM 0 H LEU A 12 -15.704 13.101 3.914 1.00 51.30 H new ATOM 0 HA LEU A 12 -16.099 10.656 2.645 1.00 53.34 H new ATOM 0 HB2 LEU A 12 -14.021 11.710 4.578 1.00 51.51 H new ATOM 0 HB3 LEU A 12 -13.910 10.091 3.916 1.00 51.51 H new ATOM 0 HG LEU A 12 -13.944 12.651 2.290 1.00 4.03 H new ATOM 0 HD11 LEU A 12 -11.575 12.132 1.853 1.00 74.43 H new ATOM 0 HD12 LEU A 12 -11.884 12.399 3.586 1.00 74.43 H new ATOM 0 HD13 LEU A 12 -11.679 10.744 2.963 1.00 74.43 H new ATOM 0 HD21 LEU A 12 -13.334 11.190 0.402 1.00 1.42 H new ATOM 0 HD22 LEU A 12 -13.507 9.766 1.455 1.00 1.42 H new ATOM 0 HD23 LEU A 12 -14.927 10.769 1.076 1.00 1.42 H new ATOM 283 N ALA A 13 -16.370 10.510 5.932 1.00 70.43 N ATOM 284 CA ALA A 13 -16.865 9.690 7.031 1.00 52.21 C ATOM 285 C ALA A 13 -18.376 9.504 6.939 1.00 70.21 C ATOM 286 O ALA A 13 -18.894 8.418 7.200 1.00 21.11 O ATOM 287 CB ALA A 13 -16.488 10.312 8.367 1.00 72.12 C ATOM 0 H ALA A 13 -16.047 11.437 6.210 1.00 70.43 H new ATOM 0 HA ALA A 13 -16.399 8.708 6.957 1.00 52.21 H new ATOM 0 HB1 ALA A 13 -16.864 9.688 9.178 1.00 72.12 H new ATOM 0 HB2 ALA A 13 -15.403 10.387 8.440 1.00 72.12 H new ATOM 0 HB3 ALA A 13 -16.926 11.307 8.441 1.00 72.12 H new ATOM 293 N SER A 14 -19.078 10.570 6.568 1.00 61.21 N ATOM 294 CA SER A 14 -20.529 10.526 6.447 1.00 14.13 C ATOM 295 C SER A 14 -20.956 9.495 5.407 1.00 15.21 C ATOM 296 O SER A 14 -21.872 8.706 5.637 1.00 73.45 O ATOM 297 CB SER A 14 -21.074 11.905 6.069 1.00 62.14 C ATOM 298 OG SER A 14 -21.212 12.730 7.213 1.00 71.41 O ATOM 0 H SER A 14 -18.664 11.475 6.346 1.00 61.21 H new ATOM 0 HA SER A 14 -20.940 10.234 7.413 1.00 14.13 H new ATOM 0 HB2 SER A 14 -20.404 12.380 5.353 1.00 62.14 H new ATOM 0 HB3 SER A 14 -22.041 11.795 5.577 1.00 62.14 H new ATOM 0 HG SER A 14 -20.442 13.332 7.277 1.00 71.41 H new ATOM 304 N ALA A 15 -20.286 9.509 4.259 1.00 30.24 N ATOM 305 CA ALA A 15 -20.593 8.576 3.183 1.00 33.30 C ATOM 306 C ALA A 15 -20.216 7.149 3.569 1.00 12.45 C ATOM 307 O ALA A 15 -20.969 6.207 3.315 1.00 24.51 O ATOM 308 CB ALA A 15 -19.875 8.986 1.906 1.00 44.10 C ATOM 0 H ALA A 15 -19.526 10.157 4.051 1.00 30.24 H new ATOM 0 HA ALA A 15 -21.668 8.605 3.007 1.00 33.30 H new ATOM 0 HB1 ALA A 15 -20.114 8.279 1.111 1.00 44.10 H new ATOM 0 HB2 ALA A 15 -20.197 9.985 1.612 1.00 44.10 H new ATOM 0 HB3 ALA A 15 -18.799 8.988 2.078 1.00 44.10 H new ATOM 314 N LEU A 16 -19.048 6.997 4.182 1.00 35.32 N ATOM 315 CA LEU A 16 -18.571 5.684 4.603 1.00 4.24 C ATOM 316 C LEU A 16 -19.439 5.123 5.725 1.00 24.01 C ATOM 317 O LEU A 16 -19.459 3.915 5.965 1.00 31.24 O ATOM 318 CB LEU A 16 -17.115 5.773 5.064 1.00 2.10 C ATOM 319 CG LEU A 16 -16.094 6.153 3.992 1.00 63.14 C ATOM 320 CD1 LEU A 16 -14.854 6.762 4.628 1.00 53.25 C ATOM 321 CD2 LEU A 16 -15.723 4.938 3.154 1.00 74.11 C ATOM 0 H LEU A 16 -18.414 7.766 4.399 1.00 35.32 H new ATOM 0 HA LEU A 16 -18.635 5.010 3.749 1.00 4.24 H new ATOM 0 HB2 LEU A 16 -17.054 6.504 5.871 1.00 2.10 H new ATOM 0 HB3 LEU A 16 -16.829 4.809 5.485 1.00 2.10 H new ATOM 0 HG LEU A 16 -16.545 6.898 3.336 1.00 63.14 H new ATOM 0 HD11 LEU A 16 -14.138 7.026 3.850 1.00 53.25 H new ATOM 0 HD12 LEU A 16 -15.133 7.657 5.184 1.00 53.25 H new ATOM 0 HD13 LEU A 16 -14.401 6.040 5.307 1.00 53.25 H new ATOM 0 HD21 LEU A 16 -14.995 5.227 2.396 1.00 74.11 H new ATOM 0 HD22 LEU A 16 -15.292 4.171 3.797 1.00 74.11 H new ATOM 0 HD23 LEU A 16 -16.616 4.545 2.668 1.00 74.11 H new ATOM 333 N THR A 17 -20.156 6.009 6.410 1.00 34.41 N ATOM 334 CA THR A 17 -21.026 5.602 7.507 1.00 12.21 C ATOM 335 C THR A 17 -22.274 4.898 6.986 1.00 1.05 C ATOM 336 O THR A 17 -22.935 4.160 7.717 1.00 23.34 O ATOM 337 CB THR A 17 -21.452 6.809 8.364 1.00 4.31 C ATOM 338 OG1 THR A 17 -20.313 7.359 9.035 1.00 23.12 O ATOM 339 CG2 THR A 17 -22.503 6.404 9.386 1.00 0.41 C ATOM 0 H THR A 17 -20.151 7.012 6.225 1.00 34.41 H new ATOM 0 HA THR A 17 -20.453 4.911 8.125 1.00 12.21 H new ATOM 0 HB THR A 17 -21.883 7.562 7.704 1.00 4.31 H new ATOM 0 HG1 THR A 17 -19.923 8.072 8.487 1.00 23.12 H new ATOM 0 HG21 THR A 17 -22.788 7.273 9.979 1.00 0.41 H new ATOM 0 HG22 THR A 17 -23.380 6.013 8.870 1.00 0.41 H new ATOM 0 HG23 THR A 17 -22.095 5.635 10.042 1.00 0.41 H new ATOM 347 N LYS A 18 -22.593 5.130 5.717 1.00 51.02 N ATOM 348 CA LYS A 18 -23.761 4.517 5.096 1.00 74.44 C ATOM 349 C LYS A 18 -23.345 3.527 4.013 1.00 62.41 C ATOM 350 O LYS A 18 -24.154 3.131 3.174 1.00 32.32 O ATOM 351 CB LYS A 18 -24.669 5.592 4.497 1.00 0.14 C ATOM 352 CG LYS A 18 -23.922 6.640 3.691 1.00 50.04 C ATOM 353 CD LYS A 18 -24.875 7.520 2.899 1.00 73.32 C ATOM 354 CE LYS A 18 -25.336 8.717 3.716 1.00 1.41 C ATOM 355 NZ LYS A 18 -26.395 9.494 3.012 1.00 51.14 N ATOM 0 H LYS A 18 -22.058 5.739 5.098 1.00 51.02 H new ATOM 0 HA LYS A 18 -24.309 3.976 5.867 1.00 74.44 H new ATOM 0 HB2 LYS A 18 -25.410 5.114 3.857 1.00 0.14 H new ATOM 0 HB3 LYS A 18 -25.214 6.085 5.302 1.00 0.14 H new ATOM 0 HG2 LYS A 18 -23.326 7.259 4.362 1.00 50.04 H new ATOM 0 HG3 LYS A 18 -23.228 6.149 3.009 1.00 50.04 H new ATOM 0 HD2 LYS A 18 -24.382 7.866 1.990 1.00 73.32 H new ATOM 0 HD3 LYS A 18 -25.740 6.934 2.589 1.00 73.32 H new ATOM 0 HE2 LYS A 18 -25.716 8.375 4.679 1.00 1.41 H new ATOM 0 HE3 LYS A 18 -24.485 9.366 3.921 1.00 1.41 H new ATOM 0 HZ1 LYS A 18 -26.683 10.301 3.601 1.00 51.14 H new ATOM 0 HZ2 LYS A 18 -26.025 9.842 2.104 1.00 51.14 H new ATOM 0 HZ3 LYS A 18 -27.218 8.882 2.839 1.00 51.14 H new ATOM 369 N THR A 19 -22.076 3.129 4.037 1.00 10.33 N ATOM 370 CA THR A 19 -21.553 2.185 3.057 1.00 2.34 C ATOM 371 C THR A 19 -21.435 0.786 3.650 1.00 33.12 C ATOM 372 O THR A 19 -20.885 0.606 4.736 1.00 51.23 O ATOM 373 CB THR A 19 -20.173 2.626 2.534 1.00 44.51 C ATOM 374 OG1 THR A 19 -19.276 2.836 3.631 1.00 35.34 O ATOM 375 CG2 THR A 19 -20.288 3.903 1.714 1.00 21.50 C ATOM 0 H THR A 19 -21.392 3.446 4.724 1.00 10.33 H new ATOM 0 HA THR A 19 -22.260 2.167 2.227 1.00 2.34 H new ATOM 0 HB THR A 19 -19.783 1.835 1.893 1.00 44.51 H new ATOM 0 HG1 THR A 19 -19.791 2.994 4.449 1.00 35.34 H new ATOM 0 HG21 THR A 19 -19.301 4.195 1.355 1.00 21.50 H new ATOM 0 HG22 THR A 19 -20.947 3.731 0.863 1.00 21.50 H new ATOM 0 HG23 THR A 19 -20.698 4.699 2.336 1.00 21.50 H new ATOM 383 N ASN A 20 -21.956 -0.203 2.930 1.00 23.24 N ATOM 384 CA ASN A 20 -21.909 -1.587 3.386 1.00 64.12 C ATOM 385 C ASN A 20 -20.480 -1.999 3.726 1.00 73.11 C ATOM 386 O ASN A 20 -20.252 -2.807 4.628 1.00 14.34 O ATOM 387 CB ASN A 20 -22.478 -2.519 2.314 1.00 12.41 C ATOM 388 CG ASN A 20 -21.713 -2.433 1.008 1.00 52.02 C ATOM 389 OD1 ASN A 20 -20.610 -2.968 0.885 1.00 24.34 O ATOM 390 ND2 ASN A 20 -22.296 -1.760 0.023 1.00 43.22 N ATOM 0 H ASN A 20 -22.415 -0.071 2.029 1.00 23.24 H new ATOM 0 HA ASN A 20 -22.516 -1.667 4.288 1.00 64.12 H new ATOM 0 HB2 ASN A 20 -22.454 -3.546 2.679 1.00 12.41 H new ATOM 0 HB3 ASN A 20 -23.524 -2.268 2.136 1.00 12.41 H new ATOM 0 HD21 ASN A 20 -21.829 -1.670 -0.879 1.00 43.22 H new ATOM 0 HD22 ASN A 20 -23.211 -1.333 0.169 1.00 43.22 H new ATOM 397 N THR A 21 -19.518 -1.439 2.999 1.00 21.33 N ATOM 398 CA THR A 21 -18.112 -1.748 3.223 1.00 41.52 C ATOM 399 C THR A 21 -17.689 -1.385 4.642 1.00 63.25 C ATOM 400 O THR A 21 -16.682 -1.884 5.147 1.00 3.51 O ATOM 401 CB THR A 21 -17.207 -1.003 2.223 1.00 30.55 C ATOM 402 OG1 THR A 21 -17.896 -0.820 0.982 1.00 3.45 O ATOM 403 CG2 THR A 21 -15.917 -1.773 1.984 1.00 24.44 C ATOM 0 H THR A 21 -19.688 -0.768 2.249 1.00 21.33 H new ATOM 0 HA THR A 21 -17.997 -2.822 3.076 1.00 41.52 H new ATOM 0 HB THR A 21 -16.958 -0.030 2.647 1.00 30.55 H new ATOM 0 HG1 THR A 21 -18.612 -0.161 1.099 1.00 3.45 H new ATOM 0 HG21 THR A 21 -15.294 -1.228 1.275 1.00 24.44 H new ATOM 0 HG22 THR A 21 -15.381 -1.886 2.926 1.00 24.44 H new ATOM 0 HG23 THR A 21 -16.151 -2.758 1.580 1.00 24.44 H new ATOM 411 N LEU A 22 -18.463 -0.516 5.282 1.00 40.43 N ATOM 412 CA LEU A 22 -18.168 -0.087 6.644 1.00 13.23 C ATOM 413 C LEU A 22 -19.183 -0.662 7.627 1.00 45.00 C ATOM 414 O LEU A 22 -18.833 -1.048 8.742 1.00 32.31 O ATOM 415 CB LEU A 22 -18.166 1.440 6.730 1.00 44.24 C ATOM 416 CG LEU A 22 -16.792 2.106 6.810 1.00 70.22 C ATOM 417 CD1 LEU A 22 -16.248 2.038 8.229 1.00 23.21 C ATOM 418 CD2 LEU A 22 -15.824 1.451 5.834 1.00 31.24 C ATOM 0 H LEU A 22 -19.300 -0.094 4.879 1.00 40.43 H new ATOM 0 HA LEU A 22 -17.179 -0.461 6.910 1.00 13.23 H new ATOM 0 HB2 LEU A 22 -18.688 1.834 5.858 1.00 44.24 H new ATOM 0 HB3 LEU A 22 -18.742 1.735 7.607 1.00 44.24 H new ATOM 0 HG LEU A 22 -16.901 3.155 6.534 1.00 70.22 H new ATOM 0 HD11 LEU A 22 -15.270 2.517 8.267 1.00 23.21 H new ATOM 0 HD12 LEU A 22 -16.930 2.553 8.905 1.00 23.21 H new ATOM 0 HD13 LEU A 22 -16.154 0.995 8.533 1.00 23.21 H new ATOM 0 HD21 LEU A 22 -14.851 1.938 5.905 1.00 31.24 H new ATOM 0 HD22 LEU A 22 -15.720 0.394 6.079 1.00 31.24 H new ATOM 0 HD23 LEU A 22 -16.207 1.552 4.819 1.00 31.24 H new ATOM 430 N LYS A 23 -20.442 -0.716 7.205 1.00 31.55 N ATOM 431 CA LYS A 23 -21.509 -1.246 8.046 1.00 74.51 C ATOM 432 C LYS A 23 -21.361 -2.754 8.227 1.00 53.20 C ATOM 433 O LYS A 23 -21.686 -3.297 9.282 1.00 62.14 O ATOM 434 CB LYS A 23 -22.874 -0.926 7.435 1.00 30.14 C ATOM 435 CG LYS A 23 -23.348 0.491 7.711 1.00 14.00 C ATOM 436 CD LYS A 23 -24.667 0.783 7.016 1.00 1.14 C ATOM 437 CE LYS A 23 -24.469 1.044 5.531 1.00 73.44 C ATOM 438 NZ LYS A 23 -25.113 -0.007 4.694 1.00 12.43 N ATOM 0 H LYS A 23 -20.748 -0.399 6.285 1.00 31.55 H new ATOM 0 HA LYS A 23 -21.436 -0.772 9.025 1.00 74.51 H new ATOM 0 HB2 LYS A 23 -22.825 -1.080 6.357 1.00 30.14 H new ATOM 0 HB3 LYS A 23 -23.611 -1.629 7.824 1.00 30.14 H new ATOM 0 HG2 LYS A 23 -23.462 0.635 8.785 1.00 14.00 H new ATOM 0 HG3 LYS A 23 -22.593 1.201 7.373 1.00 14.00 H new ATOM 0 HD2 LYS A 23 -25.345 -0.060 7.151 1.00 1.14 H new ATOM 0 HD3 LYS A 23 -25.139 1.649 7.479 1.00 1.14 H new ATOM 0 HE2 LYS A 23 -24.885 2.018 5.275 1.00 73.44 H new ATOM 0 HE3 LYS A 23 -23.403 1.084 5.308 1.00 73.44 H new ATOM 0 HZ1 LYS A 23 -24.956 0.206 3.688 1.00 12.43 H new ATOM 0 HZ2 LYS A 23 -24.699 -0.934 4.921 1.00 12.43 H new ATOM 0 HZ3 LYS A 23 -26.134 -0.028 4.888 1.00 12.43 H new ATOM 452 N ALA A 24 -20.868 -3.423 7.190 1.00 72.22 N ATOM 453 CA ALA A 24 -20.674 -4.867 7.235 1.00 11.12 C ATOM 454 C ALA A 24 -19.510 -5.236 8.148 1.00 51.10 C ATOM 455 O ALA A 24 -19.623 -6.132 8.985 1.00 13.24 O ATOM 456 CB ALA A 24 -20.443 -5.414 5.834 1.00 1.31 C ATOM 0 H ALA A 24 -20.596 -2.988 6.308 1.00 72.22 H new ATOM 0 HA ALA A 24 -21.579 -5.317 7.643 1.00 11.12 H new ATOM 0 HB1 ALA A 24 -20.300 -6.493 5.884 1.00 1.31 H new ATOM 0 HB2 ALA A 24 -21.308 -5.191 5.209 1.00 1.31 H new ATOM 0 HB3 ALA A 24 -19.556 -4.950 5.404 1.00 1.31 H new ATOM 462 N VAL A 25 -18.390 -4.541 7.981 1.00 43.23 N ATOM 463 CA VAL A 25 -17.203 -4.796 8.790 1.00 13.45 C ATOM 464 C VAL A 25 -17.418 -4.353 10.232 1.00 25.55 C ATOM 465 O VAL A 25 -16.997 -5.030 11.170 1.00 70.44 O ATOM 466 CB VAL A 25 -15.969 -4.071 8.220 1.00 72.34 C ATOM 467 CG1 VAL A 25 -15.786 -4.406 6.748 1.00 11.52 C ATOM 468 CG2 VAL A 25 -16.092 -2.569 8.424 1.00 74.13 C ATOM 0 H VAL A 25 -18.279 -3.797 7.293 1.00 43.23 H new ATOM 0 HA VAL A 25 -17.026 -5.871 8.765 1.00 13.45 H new ATOM 0 HB VAL A 25 -15.086 -4.415 8.758 1.00 72.34 H new ATOM 0 HG11 VAL A 25 -14.910 -3.885 6.362 1.00 11.52 H new ATOM 0 HG12 VAL A 25 -15.648 -5.481 6.634 1.00 11.52 H new ATOM 0 HG13 VAL A 25 -16.669 -4.092 6.191 1.00 11.52 H new ATOM 0 HG21 VAL A 25 -15.212 -2.073 8.015 1.00 74.13 H new ATOM 0 HG22 VAL A 25 -16.984 -2.204 7.914 1.00 74.13 H new ATOM 0 HG23 VAL A 25 -16.169 -2.352 9.489 1.00 74.13 H new ATOM 478 N SER A 26 -18.076 -3.211 10.404 1.00 0.01 N ATOM 479 CA SER A 26 -18.344 -2.676 11.733 1.00 24.34 C ATOM 480 C SER A 26 -19.260 -3.608 12.521 1.00 10.11 C ATOM 481 O SER A 26 -18.984 -3.940 13.673 1.00 41.04 O ATOM 482 CB SER A 26 -18.979 -1.287 11.629 1.00 42.51 C ATOM 483 OG SER A 26 -19.549 -0.892 12.865 1.00 63.32 O ATOM 0 H SER A 26 -18.433 -2.639 9.639 1.00 0.01 H new ATOM 0 HA SER A 26 -17.395 -2.596 12.262 1.00 24.34 H new ATOM 0 HB2 SER A 26 -18.225 -0.561 11.324 1.00 42.51 H new ATOM 0 HB3 SER A 26 -19.747 -1.292 10.856 1.00 42.51 H new ATOM 0 HG SER A 26 -18.835 -0.708 13.511 1.00 63.32 H new ATOM 489 N ALA A 27 -20.352 -4.025 11.889 1.00 21.42 N ATOM 490 CA ALA A 27 -21.309 -4.921 12.528 1.00 21.45 C ATOM 491 C ALA A 27 -20.696 -6.296 12.771 1.00 1.23 C ATOM 492 O ALA A 27 -21.055 -6.986 13.724 1.00 30.44 O ATOM 493 CB ALA A 27 -22.565 -5.043 11.680 1.00 0.14 C ATOM 0 H ALA A 27 -20.596 -3.757 10.936 1.00 21.42 H new ATOM 0 HA ALA A 27 -21.577 -4.496 13.495 1.00 21.45 H new ATOM 0 HB1 ALA A 27 -23.270 -5.715 12.169 1.00 0.14 H new ATOM 0 HB2 ALA A 27 -23.022 -4.060 11.563 1.00 0.14 H new ATOM 0 HB3 ALA A 27 -22.305 -5.442 10.699 1.00 0.14 H new ATOM 499 N SER A 28 -19.771 -6.689 11.901 1.00 24.12 N ATOM 500 CA SER A 28 -19.112 -7.983 12.018 1.00 72.12 C ATOM 501 C SER A 28 -18.253 -8.045 13.277 1.00 22.35 C ATOM 502 O SER A 28 -18.003 -9.120 13.822 1.00 73.22 O ATOM 503 CB SER A 28 -18.247 -8.254 10.785 1.00 10.14 C ATOM 504 OG SER A 28 -18.925 -9.088 9.861 1.00 62.13 O ATOM 0 H SER A 28 -19.461 -6.129 11.107 1.00 24.12 H new ATOM 0 HA SER A 28 -19.884 -8.749 12.087 1.00 72.12 H new ATOM 0 HB2 SER A 28 -17.986 -7.311 10.305 1.00 10.14 H new ATOM 0 HB3 SER A 28 -17.313 -8.726 11.089 1.00 10.14 H new ATOM 0 HG SER A 28 -18.353 -9.245 9.081 1.00 62.13 H new ATOM 510 N LYS A 29 -17.805 -6.881 13.737 1.00 15.23 N ATOM 511 CA LYS A 29 -16.975 -6.799 14.934 1.00 11.23 C ATOM 512 C LYS A 29 -15.779 -7.739 14.832 1.00 33.14 C ATOM 513 O LYS A 29 -15.604 -8.649 15.643 1.00 74.32 O ATOM 514 CB LYS A 29 -17.801 -7.138 16.176 1.00 15.10 C ATOM 515 CG LYS A 29 -17.110 -6.784 17.481 1.00 22.32 C ATOM 516 CD LYS A 29 -16.813 -8.022 18.309 1.00 42.01 C ATOM 517 CE LYS A 29 -15.535 -7.858 19.118 1.00 42.42 C ATOM 518 NZ LYS A 29 -15.347 -8.969 20.091 1.00 3.23 N ATOM 0 H LYS A 29 -18.003 -5.981 13.299 1.00 15.23 H new ATOM 0 HA LYS A 29 -16.604 -5.778 15.020 1.00 11.23 H new ATOM 0 HB2 LYS A 29 -18.753 -6.610 16.124 1.00 15.10 H new ATOM 0 HB3 LYS A 29 -18.027 -8.204 16.172 1.00 15.10 H new ATOM 0 HG2 LYS A 29 -16.181 -6.255 17.270 1.00 22.32 H new ATOM 0 HG3 LYS A 29 -17.740 -6.104 18.055 1.00 22.32 H new ATOM 0 HD2 LYS A 29 -17.648 -8.220 18.981 1.00 42.01 H new ATOM 0 HD3 LYS A 29 -16.721 -8.887 17.652 1.00 42.01 H new ATOM 0 HE2 LYS A 29 -14.680 -7.819 18.443 1.00 42.42 H new ATOM 0 HE3 LYS A 29 -15.563 -6.908 19.652 1.00 42.42 H new ATOM 0 HZ1 LYS A 29 -14.465 -8.820 20.622 1.00 3.23 H new ATOM 0 HZ2 LYS A 29 -16.150 -8.991 20.752 1.00 3.23 H new ATOM 0 HZ3 LYS A 29 -15.294 -9.873 19.580 1.00 3.23 H new ATOM 532 N PRO A 30 -14.934 -7.517 13.814 1.00 14.25 N ATOM 533 CA PRO A 30 -13.740 -8.333 13.584 1.00 52.33 C ATOM 534 C PRO A 30 -12.671 -8.110 14.648 1.00 2.43 C ATOM 535 O PRO A 30 -12.659 -8.779 15.682 1.00 15.51 O ATOM 536 CB PRO A 30 -13.241 -7.856 12.218 1.00 15.22 C ATOM 537 CG PRO A 30 -13.762 -6.467 12.088 1.00 23.13 C ATOM 538 CD PRO A 30 -15.082 -6.450 12.809 1.00 13.23 C ATOM 0 HA PRO A 30 -13.962 -9.399 13.623 1.00 52.33 H new ATOM 0 HB2 PRO A 30 -12.153 -7.877 12.165 1.00 15.22 H new ATOM 0 HB3 PRO A 30 -13.612 -8.494 11.416 1.00 15.22 H new ATOM 0 HG2 PRO A 30 -13.069 -5.748 12.525 1.00 23.13 H new ATOM 0 HG3 PRO A 30 -13.886 -6.193 11.040 1.00 23.13 H new ATOM 0 HD2 PRO A 30 -15.274 -5.483 13.274 1.00 13.23 H new ATOM 0 HD3 PRO A 30 -15.913 -6.648 12.132 1.00 13.23 H new ATOM 546 N SER A 31 -11.774 -7.162 14.390 1.00 55.21 N ATOM 547 CA SER A 31 -10.699 -6.853 15.324 1.00 23.41 C ATOM 548 C SER A 31 -9.731 -5.838 14.723 1.00 52.33 C ATOM 549 O SER A 31 -9.673 -5.666 13.505 1.00 71.41 O ATOM 550 CB SER A 31 -9.945 -8.128 15.709 1.00 4.22 C ATOM 551 OG SER A 31 -10.140 -9.146 14.744 1.00 10.41 O ATOM 0 H SER A 31 -11.772 -6.596 13.542 1.00 55.21 H new ATOM 0 HA SER A 31 -11.144 -6.419 16.219 1.00 23.41 H new ATOM 0 HB2 SER A 31 -8.881 -7.911 15.803 1.00 4.22 H new ATOM 0 HB3 SER A 31 -10.287 -8.476 16.684 1.00 4.22 H new ATOM 0 HG SER A 31 -9.647 -9.949 15.012 1.00 10.41 H new ATOM 557 N ALA A 32 -8.973 -5.168 15.584 1.00 35.53 N ATOM 558 CA ALA A 32 -8.007 -4.172 15.139 1.00 21.51 C ATOM 559 C ALA A 32 -6.926 -4.807 14.271 1.00 14.31 C ATOM 560 O ALA A 32 -6.282 -4.129 13.471 1.00 41.51 O ATOM 561 CB ALA A 32 -7.381 -3.472 16.336 1.00 11.04 C ATOM 0 H ALA A 32 -9.009 -5.297 16.595 1.00 35.53 H new ATOM 0 HA ALA A 32 -8.535 -3.434 14.536 1.00 21.51 H new ATOM 0 HB1 ALA A 32 -6.661 -2.731 15.989 1.00 11.04 H new ATOM 0 HB2 ALA A 32 -8.160 -2.978 16.917 1.00 11.04 H new ATOM 0 HB3 ALA A 32 -6.873 -4.206 16.962 1.00 11.04 H new ATOM 567 N ASN A 33 -6.732 -6.111 14.434 1.00 13.52 N ATOM 568 CA ASN A 33 -5.728 -6.837 13.664 1.00 63.45 C ATOM 569 C ASN A 33 -6.145 -6.960 12.203 1.00 11.24 C ATOM 570 O ASN A 33 -5.365 -6.670 11.295 1.00 71.50 O ATOM 571 CB ASN A 33 -5.505 -8.228 14.261 1.00 64.10 C ATOM 572 CG ASN A 33 -5.582 -8.227 15.776 1.00 23.03 C ATOM 573 OD1 ASN A 33 -6.364 -8.969 16.369 1.00 21.50 O ATOM 574 ND2 ASN A 33 -4.769 -7.389 16.409 1.00 44.44 N ATOM 0 H ASN A 33 -7.257 -6.687 15.092 1.00 13.52 H new ATOM 0 HA ASN A 33 -4.795 -6.275 13.710 1.00 63.45 H new ATOM 0 HB2 ASN A 33 -6.251 -8.915 13.863 1.00 64.10 H new ATOM 0 HB3 ASN A 33 -4.529 -8.602 13.950 1.00 64.10 H new ATOM 0 HD21 ASN A 33 -4.777 -7.343 17.428 1.00 44.44 H new ATOM 0 HD22 ASN A 33 -4.137 -6.792 15.876 1.00 44.44 H new ATOM 581 N VAL A 34 -7.384 -7.390 11.981 1.00 41.15 N ATOM 582 CA VAL A 34 -7.908 -7.550 10.630 1.00 43.33 C ATOM 583 C VAL A 34 -8.360 -6.213 10.054 1.00 65.44 C ATOM 584 O VAL A 34 -8.199 -5.952 8.862 1.00 50.11 O ATOM 585 CB VAL A 34 -9.090 -8.536 10.598 1.00 71.41 C ATOM 586 CG1 VAL A 34 -9.744 -8.629 11.968 1.00 4.04 C ATOM 587 CG2 VAL A 34 -10.102 -8.121 9.542 1.00 10.43 C ATOM 0 H VAL A 34 -8.043 -7.634 12.720 1.00 41.15 H new ATOM 0 HA VAL A 34 -7.096 -7.949 10.022 1.00 43.33 H new ATOM 0 HB VAL A 34 -8.710 -9.523 10.335 1.00 71.41 H new ATOM 0 HG11 VAL A 34 -10.577 -9.330 11.926 1.00 4.04 H new ATOM 0 HG12 VAL A 34 -9.013 -8.977 12.697 1.00 4.04 H new ATOM 0 HG13 VAL A 34 -10.111 -7.646 12.263 1.00 4.04 H new ATOM 0 HG21 VAL A 34 -10.930 -8.829 9.534 1.00 10.43 H new ATOM 0 HG22 VAL A 34 -10.479 -7.124 9.771 1.00 10.43 H new ATOM 0 HG23 VAL A 34 -9.623 -8.111 8.563 1.00 10.43 H new ATOM 597 N ALA A 35 -8.926 -5.367 10.910 1.00 50.05 N ATOM 598 CA ALA A 35 -9.400 -4.056 10.487 1.00 42.05 C ATOM 599 C ALA A 35 -8.284 -3.257 9.822 1.00 13.30 C ATOM 600 O ALA A 35 -8.501 -2.591 8.810 1.00 12.50 O ATOM 601 CB ALA A 35 -9.964 -3.290 11.674 1.00 65.12 C ATOM 0 H ALA A 35 -9.067 -5.567 11.900 1.00 50.05 H new ATOM 0 HA ALA A 35 -10.193 -4.203 9.754 1.00 42.05 H new ATOM 0 HB1 ALA A 35 -10.314 -2.312 11.343 1.00 65.12 H new ATOM 0 HB2 ALA A 35 -10.796 -3.847 12.104 1.00 65.12 H new ATOM 0 HB3 ALA A 35 -9.186 -3.161 12.427 1.00 65.12 H new ATOM 607 N VAL A 36 -7.088 -3.328 10.397 1.00 63.32 N ATOM 608 CA VAL A 36 -5.937 -2.611 9.860 1.00 74.15 C ATOM 609 C VAL A 36 -5.537 -3.159 8.495 1.00 54.01 C ATOM 610 O VAL A 36 -5.155 -2.406 7.599 1.00 72.11 O ATOM 611 CB VAL A 36 -4.728 -2.698 10.810 1.00 51.25 C ATOM 612 CG1 VAL A 36 -3.480 -2.146 10.137 1.00 24.45 C ATOM 613 CG2 VAL A 36 -5.017 -1.959 12.107 1.00 23.31 C ATOM 0 H VAL A 36 -6.890 -3.875 11.235 1.00 63.32 H new ATOM 0 HA VAL A 36 -6.234 -1.567 9.757 1.00 74.15 H new ATOM 0 HB VAL A 36 -4.549 -3.746 11.049 1.00 51.25 H new ATOM 0 HG11 VAL A 36 -2.636 -2.215 10.823 1.00 24.45 H new ATOM 0 HG12 VAL A 36 -3.266 -2.724 9.238 1.00 24.45 H new ATOM 0 HG13 VAL A 36 -3.643 -1.103 9.867 1.00 24.45 H new ATOM 0 HG21 VAL A 36 -4.152 -2.030 12.767 1.00 23.31 H new ATOM 0 HG22 VAL A 36 -5.223 -0.911 11.890 1.00 23.31 H new ATOM 0 HG23 VAL A 36 -5.884 -2.405 12.595 1.00 23.31 H new ATOM 623 N ALA A 37 -5.629 -4.477 8.342 1.00 74.01 N ATOM 624 CA ALA A 37 -5.279 -5.126 7.085 1.00 52.32 C ATOM 625 C ALA A 37 -6.288 -4.787 5.992 1.00 63.41 C ATOM 626 O ALA A 37 -5.925 -4.632 4.827 1.00 54.42 O ATOM 627 CB ALA A 37 -5.192 -6.633 7.276 1.00 55.01 C ATOM 0 H ALA A 37 -5.943 -5.115 9.073 1.00 74.01 H new ATOM 0 HA ALA A 37 -4.304 -4.753 6.771 1.00 52.32 H new ATOM 0 HB1 ALA A 37 -4.930 -7.105 6.329 1.00 55.01 H new ATOM 0 HB2 ALA A 37 -4.428 -6.862 8.019 1.00 55.01 H new ATOM 0 HB3 ALA A 37 -6.155 -7.013 7.616 1.00 55.01 H new ATOM 633 N ILE A 38 -7.555 -4.675 6.378 1.00 62.15 N ATOM 634 CA ILE A 38 -8.614 -4.354 5.431 1.00 1.44 C ATOM 635 C ILE A 38 -8.511 -2.908 4.958 1.00 5.13 C ATOM 636 O ILE A 38 -8.658 -2.618 3.771 1.00 73.11 O ATOM 637 CB ILE A 38 -10.007 -4.582 6.046 1.00 15.01 C ATOM 638 CG1 ILE A 38 -10.200 -6.060 6.393 1.00 42.24 C ATOM 639 CG2 ILE A 38 -11.093 -4.112 5.089 1.00 71.04 C ATOM 640 CD1 ILE A 38 -11.415 -6.326 7.252 1.00 31.31 C ATOM 0 H ILE A 38 -7.872 -4.802 7.339 1.00 62.15 H new ATOM 0 HA ILE A 38 -8.487 -5.022 4.579 1.00 1.44 H new ATOM 0 HB ILE A 38 -10.081 -3.999 6.964 1.00 15.01 H new ATOM 0 HG12 ILE A 38 -10.285 -6.633 5.470 1.00 42.24 H new ATOM 0 HG13 ILE A 38 -9.312 -6.422 6.912 1.00 42.24 H new ATOM 0 HG21 ILE A 38 -12.072 -4.280 5.538 1.00 71.04 H new ATOM 0 HG22 ILE A 38 -10.964 -3.049 4.887 1.00 71.04 H new ATOM 0 HG23 ILE A 38 -11.022 -4.670 4.155 1.00 71.04 H new ATOM 0 HD11 ILE A 38 -11.488 -7.394 7.458 1.00 31.31 H new ATOM 0 HD12 ILE A 38 -11.323 -5.781 8.191 1.00 31.31 H new ATOM 0 HD13 ILE A 38 -12.311 -5.995 6.727 1.00 31.31 H new ATOM 652 N VAL A 39 -8.255 -2.001 5.897 1.00 65.35 N ATOM 653 CA VAL A 39 -8.127 -0.585 5.578 1.00 42.10 C ATOM 654 C VAL A 39 -6.859 -0.313 4.776 1.00 32.44 C ATOM 655 O VAL A 39 -6.850 0.520 3.870 1.00 40.50 O ATOM 656 CB VAL A 39 -8.110 0.279 6.852 1.00 23.24 C ATOM 657 CG1 VAL A 39 -6.935 -0.102 7.741 1.00 15.40 C ATOM 658 CG2 VAL A 39 -8.061 1.757 6.494 1.00 30.32 C ATOM 0 H VAL A 39 -8.132 -2.223 6.885 1.00 65.35 H new ATOM 0 HA VAL A 39 -8.997 -0.317 4.978 1.00 42.10 H new ATOM 0 HB VAL A 39 -9.030 0.094 7.407 1.00 23.24 H new ATOM 0 HG11 VAL A 39 -6.940 0.519 8.636 1.00 15.40 H new ATOM 0 HG12 VAL A 39 -7.020 -1.151 8.027 1.00 15.40 H new ATOM 0 HG13 VAL A 39 -6.003 0.052 7.198 1.00 15.40 H new ATOM 0 HG21 VAL A 39 -8.050 2.352 7.407 1.00 30.32 H new ATOM 0 HG22 VAL A 39 -7.160 1.962 5.916 1.00 30.32 H new ATOM 0 HG23 VAL A 39 -8.939 2.017 5.902 1.00 30.32 H new ATOM 668 N THR A 40 -5.788 -1.024 5.116 1.00 54.52 N ATOM 669 CA THR A 40 -4.513 -0.860 4.428 1.00 53.11 C ATOM 670 C THR A 40 -4.644 -1.176 2.943 1.00 1.15 C ATOM 671 O THR A 40 -4.066 -0.490 2.099 1.00 35.14 O ATOM 672 CB THR A 40 -3.425 -1.763 5.039 1.00 70.41 C ATOM 673 OG1 THR A 40 -3.987 -3.031 5.399 1.00 64.31 O ATOM 674 CG2 THR A 40 -2.806 -1.110 6.265 1.00 64.05 C ATOM 0 H THR A 40 -5.778 -1.718 5.863 1.00 54.52 H new ATOM 0 HA THR A 40 -4.221 0.183 4.550 1.00 53.11 H new ATOM 0 HB THR A 40 -2.644 -1.911 4.293 1.00 70.41 H new ATOM 0 HG1 THR A 40 -4.701 -3.263 4.769 1.00 64.31 H new ATOM 0 HG21 THR A 40 -2.041 -1.766 6.679 1.00 64.05 H new ATOM 0 HG22 THR A 40 -2.355 -0.159 5.982 1.00 64.05 H new ATOM 0 HG23 THR A 40 -3.579 -0.936 7.014 1.00 64.05 H new ATOM 682 N SER A 41 -5.408 -2.217 2.629 1.00 35.41 N ATOM 683 CA SER A 41 -5.613 -2.625 1.245 1.00 11.30 C ATOM 684 C SER A 41 -6.205 -1.484 0.423 1.00 64.12 C ATOM 685 O SER A 41 -5.764 -1.214 -0.693 1.00 53.31 O ATOM 686 CB SER A 41 -6.536 -3.845 1.181 1.00 43.24 C ATOM 687 OG SER A 41 -5.994 -4.931 1.911 1.00 74.33 O ATOM 0 H SER A 41 -5.895 -2.793 3.315 1.00 35.41 H new ATOM 0 HA SER A 41 -4.643 -2.889 0.824 1.00 11.30 H new ATOM 0 HB2 SER A 41 -7.516 -3.586 1.582 1.00 43.24 H new ATOM 0 HB3 SER A 41 -6.685 -4.139 0.142 1.00 43.24 H new ATOM 0 HG SER A 41 -6.032 -4.732 2.870 1.00 74.33 H new ATOM 693 N GLY A 42 -7.206 -0.815 0.986 1.00 11.24 N ATOM 694 CA GLY A 42 -7.843 0.290 0.293 1.00 61.03 C ATOM 695 C GLY A 42 -6.963 1.523 0.238 1.00 11.23 C ATOM 696 O GLY A 42 -6.970 2.256 -0.752 1.00 22.14 O ATOM 0 H GLY A 42 -7.588 -1.018 1.910 1.00 11.24 H new ATOM 0 HA2 GLY A 42 -8.095 -0.018 -0.722 1.00 61.03 H new ATOM 0 HA3 GLY A 42 -8.779 0.537 0.793 1.00 61.03 H new ATOM 700 N LEU A 43 -6.206 1.755 1.304 1.00 0.12 N ATOM 701 CA LEU A 43 -5.317 2.910 1.375 1.00 12.55 C ATOM 702 C LEU A 43 -4.258 2.851 0.279 1.00 14.02 C ATOM 703 O LEU A 43 -3.964 3.854 -0.372 1.00 74.12 O ATOM 704 CB LEU A 43 -4.645 2.978 2.747 1.00 4.23 C ATOM 705 CG LEU A 43 -5.521 3.470 3.900 1.00 71.04 C ATOM 706 CD1 LEU A 43 -4.812 3.271 5.231 1.00 44.25 C ATOM 707 CD2 LEU A 43 -5.891 4.932 3.703 1.00 25.51 C ATOM 0 H LEU A 43 -6.190 1.159 2.132 1.00 0.12 H new ATOM 0 HA LEU A 43 -5.917 3.808 1.227 1.00 12.55 H new ATOM 0 HB2 LEU A 43 -4.274 1.984 2.997 1.00 4.23 H new ATOM 0 HB3 LEU A 43 -3.777 3.633 2.672 1.00 4.23 H new ATOM 0 HG LEU A 43 -6.439 2.883 3.910 1.00 71.04 H new ATOM 0 HD11 LEU A 43 -5.450 3.627 6.040 1.00 44.25 H new ATOM 0 HD12 LEU A 43 -4.600 2.212 5.375 1.00 44.25 H new ATOM 0 HD13 LEU A 43 -3.877 3.832 5.233 1.00 44.25 H new ATOM 0 HD21 LEU A 43 -6.514 5.265 4.533 1.00 25.51 H new ATOM 0 HD22 LEU A 43 -4.984 5.535 3.666 1.00 25.51 H new ATOM 0 HD23 LEU A 43 -6.440 5.046 2.768 1.00 25.51 H new ATOM 719 N LYS A 44 -3.689 1.667 0.078 1.00 53.51 N ATOM 720 CA LYS A 44 -2.664 1.474 -0.942 1.00 34.23 C ATOM 721 C LYS A 44 -3.244 1.670 -2.339 1.00 52.14 C ATOM 722 O LYS A 44 -2.612 2.277 -3.204 1.00 14.33 O ATOM 723 CB LYS A 44 -2.055 0.075 -0.822 1.00 63.12 C ATOM 724 CG LYS A 44 -1.489 -0.226 0.555 1.00 30.11 C ATOM 725 CD LYS A 44 -1.540 -1.713 0.865 1.00 64.10 C ATOM 726 CE LYS A 44 -0.154 -2.268 1.158 1.00 20.43 C ATOM 727 NZ LYS A 44 0.022 -3.640 0.607 1.00 13.41 N ATOM 0 H LYS A 44 -3.920 0.827 0.608 1.00 53.51 H new ATOM 0 HA LYS A 44 -1.884 2.218 -0.784 1.00 34.23 H new ATOM 0 HB2 LYS A 44 -2.818 -0.666 -1.062 1.00 63.12 H new ATOM 0 HB3 LYS A 44 -1.262 -0.032 -1.563 1.00 63.12 H new ATOM 0 HG2 LYS A 44 -0.458 0.123 0.610 1.00 30.11 H new ATOM 0 HG3 LYS A 44 -2.052 0.324 1.309 1.00 30.11 H new ATOM 0 HD2 LYS A 44 -2.191 -1.885 1.722 1.00 64.10 H new ATOM 0 HD3 LYS A 44 -1.976 -2.247 0.021 1.00 64.10 H new ATOM 0 HE2 LYS A 44 0.600 -1.606 0.732 1.00 20.43 H new ATOM 0 HE3 LYS A 44 0.010 -2.286 2.235 1.00 20.43 H new ATOM 0 HZ1 LYS A 44 0.979 -3.983 0.828 1.00 13.41 H new ATOM 0 HZ2 LYS A 44 -0.681 -4.278 1.032 1.00 13.41 H new ATOM 0 HZ3 LYS A 44 -0.109 -3.619 -0.425 1.00 13.41 H new ATOM 741 N LYS A 45 -4.448 1.152 -2.553 1.00 31.25 N ATOM 742 CA LYS A 45 -5.115 1.271 -3.844 1.00 42.54 C ATOM 743 C LYS A 45 -5.512 2.719 -4.120 1.00 74.14 C ATOM 744 O LYS A 45 -5.304 3.230 -5.219 1.00 14.13 O ATOM 745 CB LYS A 45 -6.354 0.375 -3.887 1.00 72.14 C ATOM 746 CG LYS A 45 -7.108 0.440 -5.204 1.00 3.24 C ATOM 747 CD LYS A 45 -6.672 -0.663 -6.152 1.00 42.43 C ATOM 748 CE LYS A 45 -7.709 -0.908 -7.237 1.00 44.32 C ATOM 749 NZ LYS A 45 -7.141 -1.666 -8.386 1.00 34.12 N ATOM 0 H LYS A 45 -4.983 0.645 -1.848 1.00 31.25 H new ATOM 0 HA LYS A 45 -4.416 0.950 -4.616 1.00 42.54 H new ATOM 0 HB2 LYS A 45 -6.053 -0.656 -3.701 1.00 72.14 H new ATOM 0 HB3 LYS A 45 -7.027 0.661 -3.079 1.00 72.14 H new ATOM 0 HG2 LYS A 45 -8.178 0.357 -5.016 1.00 3.24 H new ATOM 0 HG3 LYS A 45 -6.941 1.410 -5.672 1.00 3.24 H new ATOM 0 HD2 LYS A 45 -5.720 -0.395 -6.611 1.00 42.43 H new ATOM 0 HD3 LYS A 45 -6.507 -1.583 -5.591 1.00 42.43 H new ATOM 0 HE2 LYS A 45 -8.550 -1.460 -6.818 1.00 44.32 H new ATOM 0 HE3 LYS A 45 -8.099 0.047 -7.589 1.00 44.32 H new ATOM 0 HZ1 LYS A 45 -7.879 -1.813 -9.104 1.00 34.12 H new ATOM 0 HZ2 LYS A 45 -6.355 -1.127 -8.803 1.00 34.12 H new ATOM 0 HZ3 LYS A 45 -6.792 -2.588 -8.055 1.00 34.12 H new ATOM 763 N ALA A 46 -6.081 3.372 -3.113 1.00 11.40 N ATOM 764 CA ALA A 46 -6.503 4.761 -3.246 1.00 31.34 C ATOM 765 C ALA A 46 -5.322 5.664 -3.586 1.00 32.42 C ATOM 766 O ALA A 46 -5.393 6.472 -4.513 1.00 44.15 O ATOM 767 CB ALA A 46 -7.179 5.232 -1.967 1.00 1.24 C ATOM 0 H ALA A 46 -6.260 2.962 -2.196 1.00 11.40 H new ATOM 0 HA ALA A 46 -7.219 4.820 -4.066 1.00 31.34 H new ATOM 0 HB1 ALA A 46 -7.489 6.271 -2.081 1.00 1.24 H new ATOM 0 HB2 ALA A 46 -8.053 4.612 -1.768 1.00 1.24 H new ATOM 0 HB3 ALA A 46 -6.480 5.151 -1.135 1.00 1.24 H new ATOM 773 N LEU A 47 -4.239 5.523 -2.831 1.00 34.44 N ATOM 774 CA LEU A 47 -3.042 6.326 -3.051 1.00 42.34 C ATOM 775 C LEU A 47 -2.372 5.954 -4.371 1.00 63.22 C ATOM 776 O LEU A 47 -1.824 6.810 -5.063 1.00 22.44 O ATOM 777 CB LEU A 47 -2.058 6.138 -1.896 1.00 43.12 C ATOM 778 CG LEU A 47 -2.607 6.411 -0.495 1.00 2.04 C ATOM 779 CD1 LEU A 47 -1.847 5.602 0.543 1.00 72.52 C ATOM 780 CD2 LEU A 47 -2.534 7.897 -0.174 1.00 32.51 C ATOM 0 H LEU A 47 -4.165 4.859 -2.060 1.00 34.44 H new ATOM 0 HA LEU A 47 -3.341 7.373 -3.098 1.00 42.34 H new ATOM 0 HB2 LEU A 47 -1.686 5.114 -1.925 1.00 43.12 H new ATOM 0 HB3 LEU A 47 -1.203 6.793 -2.063 1.00 43.12 H new ATOM 0 HG LEU A 47 -3.653 6.105 -0.469 1.00 2.04 H new ATOM 0 HD11 LEU A 47 -2.252 5.809 1.534 1.00 72.52 H new ATOM 0 HD12 LEU A 47 -1.951 4.539 0.324 1.00 72.52 H new ATOM 0 HD13 LEU A 47 -0.792 5.876 0.517 1.00 72.52 H new ATOM 0 HD21 LEU A 47 -2.929 8.073 0.827 1.00 32.51 H new ATOM 0 HD22 LEU A 47 -1.496 8.228 -0.218 1.00 32.51 H new ATOM 0 HD23 LEU A 47 -3.124 8.456 -0.900 1.00 32.51 H new ATOM 792 N GLY A 48 -2.422 4.670 -4.713 1.00 34.11 N ATOM 793 CA GLY A 48 -1.819 4.208 -5.948 1.00 41.13 C ATOM 794 C GLY A 48 -2.577 4.676 -7.174 1.00 55.22 C ATOM 795 O GLY A 48 -1.984 4.922 -8.224 1.00 63.45 O ATOM 0 H GLY A 48 -2.870 3.942 -4.156 1.00 34.11 H new ATOM 0 HA2 GLY A 48 -0.791 4.565 -6.002 1.00 41.13 H new ATOM 0 HA3 GLY A 48 -1.778 3.119 -5.944 1.00 41.13 H new ATOM 799 N ALA A 49 -3.894 4.797 -7.043 1.00 71.01 N ATOM 800 CA ALA A 49 -4.735 5.238 -8.149 1.00 3.43 C ATOM 801 C ALA A 49 -4.697 6.756 -8.295 1.00 54.44 C ATOM 802 O ALA A 49 -5.021 7.296 -9.355 1.00 34.52 O ATOM 803 CB ALA A 49 -6.165 4.761 -7.949 1.00 35.45 C ATOM 0 H ALA A 49 -4.402 4.596 -6.182 1.00 71.01 H new ATOM 0 HA ALA A 49 -4.344 4.800 -9.067 1.00 3.43 H new ATOM 0 HB1 ALA A 49 -6.781 5.098 -8.783 1.00 35.45 H new ATOM 0 HB2 ALA A 49 -6.182 3.672 -7.902 1.00 35.45 H new ATOM 0 HB3 ALA A 49 -6.558 5.170 -7.019 1.00 35.45 H new ATOM 809 N LEU A 50 -4.300 7.439 -7.228 1.00 44.45 N ATOM 810 CA LEU A 50 -4.220 8.896 -7.238 1.00 72.21 C ATOM 811 C LEU A 50 -2.789 9.361 -7.494 1.00 34.52 C ATOM 812 O LEU A 50 -2.460 10.528 -7.285 1.00 2.32 O ATOM 813 CB LEU A 50 -4.723 9.462 -5.909 1.00 74.14 C ATOM 814 CG LEU A 50 -6.205 9.829 -5.854 1.00 34.14 C ATOM 815 CD1 LEU A 50 -6.744 9.667 -4.441 1.00 23.00 C ATOM 816 CD2 LEU A 50 -6.422 11.252 -6.350 1.00 23.21 C ATOM 0 H LEU A 50 -4.028 7.008 -6.344 1.00 44.45 H new ATOM 0 HA LEU A 50 -4.852 9.265 -8.046 1.00 72.21 H new ATOM 0 HB2 LEU A 50 -4.521 8.731 -5.126 1.00 74.14 H new ATOM 0 HB3 LEU A 50 -4.140 10.352 -5.672 1.00 74.14 H new ATOM 0 HG LEU A 50 -6.751 9.150 -6.509 1.00 34.14 H new ATOM 0 HD11 LEU A 50 -7.801 9.933 -4.422 1.00 23.00 H new ATOM 0 HD12 LEU A 50 -6.625 8.631 -4.123 1.00 23.00 H new ATOM 0 HD13 LEU A 50 -6.193 10.320 -3.764 1.00 23.00 H new ATOM 0 HD21 LEU A 50 -7.483 11.496 -6.304 1.00 23.21 H new ATOM 0 HD22 LEU A 50 -5.863 11.945 -5.722 1.00 23.21 H new ATOM 0 HD23 LEU A 50 -6.075 11.335 -7.380 1.00 23.21 H new ATOM 828 N ARG A 51 -1.946 8.440 -7.948 1.00 1.41 N ATOM 829 CA ARG A 51 -0.551 8.757 -8.233 1.00 33.21 C ATOM 830 C ARG A 51 0.106 9.445 -7.040 1.00 35.22 C ATOM 831 O ARG A 51 1.008 10.266 -7.204 1.00 34.13 O ATOM 832 CB ARG A 51 -0.453 9.653 -9.469 1.00 52.34 C ATOM 833 CG ARG A 51 -0.546 8.892 -10.782 1.00 52.10 C ATOM 834 CD ARG A 51 -1.974 8.461 -11.075 1.00 32.24 C ATOM 835 NE ARG A 51 -2.267 8.473 -12.505 1.00 52.35 N ATOM 836 CZ ARG A 51 -3.466 8.209 -13.013 1.00 20.01 C ATOM 837 NH1 ARG A 51 -4.479 7.915 -12.209 1.00 53.21 N ATOM 838 NH2 ARG A 51 -3.654 8.241 -14.326 1.00 51.32 N ATOM 0 H ARG A 51 -2.204 7.469 -8.126 1.00 1.41 H new ATOM 0 HA ARG A 51 -0.024 7.822 -8.426 1.00 33.21 H new ATOM 0 HB2 ARG A 51 -1.249 10.396 -9.432 1.00 52.34 H new ATOM 0 HB3 ARG A 51 0.492 10.196 -9.440 1.00 52.34 H new ATOM 0 HG2 ARG A 51 -0.180 9.520 -11.595 1.00 52.10 H new ATOM 0 HG3 ARG A 51 0.099 8.014 -10.742 1.00 52.10 H new ATOM 0 HD2 ARG A 51 -2.138 7.459 -10.680 1.00 32.24 H new ATOM 0 HD3 ARG A 51 -2.666 9.125 -10.558 1.00 32.24 H new ATOM 0 HE ARG A 51 -1.509 8.696 -13.150 1.00 52.35 H new ATOM 0 HH11 ARG A 51 -4.338 7.891 -11.199 1.00 53.21 H new ATOM 0 HH12 ARG A 51 -5.399 7.713 -12.601 1.00 53.21 H new ATOM 0 HH21 ARG A 51 -2.877 8.468 -14.947 1.00 51.32 H new ATOM 0 HH22 ARG A 51 -4.575 8.038 -14.714 1.00 51.32 H new ATOM 852 N ILE A 52 -0.354 9.103 -5.841 1.00 74.14 N ATOM 853 CA ILE A 52 0.189 9.686 -4.621 1.00 23.53 C ATOM 854 C ILE A 52 1.599 9.174 -4.347 1.00 20.00 C ATOM 855 O ILE A 52 1.868 7.979 -4.458 1.00 65.11 O ATOM 856 CB ILE A 52 -0.703 9.377 -3.403 1.00 43.10 C ATOM 857 CG1 ILE A 52 -2.115 9.919 -3.628 1.00 30.12 C ATOM 858 CG2 ILE A 52 -0.097 9.970 -2.140 1.00 32.42 C ATOM 859 CD1 ILE A 52 -2.155 11.404 -3.915 1.00 63.12 C ATOM 0 H ILE A 52 -1.101 8.425 -5.689 1.00 74.14 H new ATOM 0 HA ILE A 52 0.220 10.765 -4.774 1.00 23.53 H new ATOM 0 HB ILE A 52 -0.765 8.296 -3.280 1.00 43.10 H new ATOM 0 HG12 ILE A 52 -2.572 9.384 -4.460 1.00 30.12 H new ATOM 0 HG13 ILE A 52 -2.720 9.712 -2.745 1.00 30.12 H new ATOM 0 HG21 ILE A 52 -0.738 9.744 -1.288 1.00 32.42 H new ATOM 0 HG22 ILE A 52 0.891 9.541 -1.975 1.00 32.42 H new ATOM 0 HG23 ILE A 52 -0.009 11.051 -2.251 1.00 32.42 H new ATOM 0 HD11 ILE A 52 -3.188 11.718 -4.064 1.00 63.12 H new ATOM 0 HD12 ILE A 52 -1.728 11.949 -3.073 1.00 63.12 H new ATOM 0 HD13 ILE A 52 -1.578 11.616 -4.815 1.00 63.12 H new ATOM 871 N ASN A 53 2.496 10.088 -3.987 1.00 14.23 N ATOM 872 CA ASN A 53 3.878 9.728 -3.696 1.00 24.42 C ATOM 873 C ASN A 53 3.943 8.582 -2.690 1.00 12.52 C ATOM 874 O ASN A 53 3.198 8.559 -1.711 1.00 62.22 O ATOM 875 CB ASN A 53 4.638 10.940 -3.152 1.00 70.02 C ATOM 876 CG ASN A 53 5.805 10.543 -2.268 1.00 13.24 C ATOM 877 OD1 ASN A 53 6.622 9.702 -2.641 1.00 74.30 O ATOM 878 ND2 ASN A 53 5.885 11.147 -1.089 1.00 63.20 N ATOM 0 H ASN A 53 2.290 11.082 -3.890 1.00 14.23 H new ATOM 0 HA ASN A 53 4.344 9.400 -4.625 1.00 24.42 H new ATOM 0 HB2 ASN A 53 5.005 11.539 -3.985 1.00 70.02 H new ATOM 0 HB3 ASN A 53 3.953 11.569 -2.584 1.00 70.02 H new ATOM 0 HD21 ASN A 53 6.647 10.920 -0.450 1.00 63.20 H new ATOM 0 HD22 ASN A 53 5.184 11.839 -0.822 1.00 63.20 H new ATOM 885 N ALA A 54 4.838 7.632 -2.942 1.00 21.31 N ATOM 886 CA ALA A 54 5.001 6.484 -2.058 1.00 44.23 C ATOM 887 C ALA A 54 5.388 6.926 -0.650 1.00 62.21 C ATOM 888 O ALA A 54 4.939 6.346 0.338 1.00 3.14 O ATOM 889 CB ALA A 54 6.046 5.531 -2.619 1.00 53.42 C ATOM 0 H ALA A 54 5.461 7.635 -3.750 1.00 21.31 H new ATOM 0 HA ALA A 54 4.045 5.964 -1.998 1.00 44.23 H new ATOM 0 HB1 ALA A 54 6.158 4.678 -1.949 1.00 53.42 H new ATOM 0 HB2 ALA A 54 5.729 5.181 -3.602 1.00 53.42 H new ATOM 0 HB3 ALA A 54 7.001 6.050 -2.709 1.00 53.42 H new ATOM 895 N GLY A 55 6.225 7.956 -0.567 1.00 74.44 N ATOM 896 CA GLY A 55 6.657 8.456 0.725 1.00 42.44 C ATOM 897 C GLY A 55 5.496 8.867 1.607 1.00 21.04 C ATOM 898 O GLY A 55 5.401 8.444 2.759 1.00 31.55 O ATOM 0 H GLY A 55 6.611 8.452 -1.370 1.00 74.44 H new ATOM 0 HA2 GLY A 55 7.240 7.687 1.232 1.00 42.44 H new ATOM 0 HA3 GLY A 55 7.317 9.311 0.578 1.00 42.44 H new ATOM 902 N VAL A 56 4.609 9.697 1.066 1.00 21.34 N ATOM 903 CA VAL A 56 3.448 10.166 1.812 1.00 10.53 C ATOM 904 C VAL A 56 2.419 9.055 1.985 1.00 53.42 C ATOM 905 O VAL A 56 1.736 8.979 3.005 1.00 31.13 O ATOM 906 CB VAL A 56 2.779 11.365 1.113 1.00 23.04 C ATOM 907 CG1 VAL A 56 2.397 11.007 -0.314 1.00 45.05 C ATOM 908 CG2 VAL A 56 1.562 11.829 1.900 1.00 50.21 C ATOM 0 H VAL A 56 4.673 10.058 0.114 1.00 21.34 H new ATOM 0 HA VAL A 56 3.808 10.479 2.792 1.00 10.53 H new ATOM 0 HB VAL A 56 3.494 12.187 1.076 1.00 23.04 H new ATOM 0 HG11 VAL A 56 1.926 11.866 -0.791 1.00 45.05 H new ATOM 0 HG12 VAL A 56 3.291 10.728 -0.871 1.00 45.05 H new ATOM 0 HG13 VAL A 56 1.699 10.170 -0.305 1.00 45.05 H new ATOM 0 HG21 VAL A 56 1.102 12.676 1.392 1.00 50.21 H new ATOM 0 HG22 VAL A 56 0.842 11.014 1.971 1.00 50.21 H new ATOM 0 HG23 VAL A 56 1.869 12.130 2.902 1.00 50.21 H new ATOM 918 N SER A 57 2.314 8.192 0.978 1.00 2.32 N ATOM 919 CA SER A 57 1.365 7.085 1.016 1.00 53.31 C ATOM 920 C SER A 57 1.770 6.059 2.070 1.00 71.10 C ATOM 921 O SER A 57 0.951 5.258 2.520 1.00 13.15 O ATOM 922 CB SER A 57 1.276 6.415 -0.357 1.00 2.13 C ATOM 923 OG SER A 57 1.088 5.016 -0.230 1.00 65.24 O ATOM 0 H SER A 57 2.874 8.238 0.127 1.00 2.32 H new ATOM 0 HA SER A 57 0.387 7.486 1.281 1.00 53.31 H new ATOM 0 HB2 SER A 57 0.450 6.846 -0.923 1.00 2.13 H new ATOM 0 HB3 SER A 57 2.187 6.613 -0.922 1.00 2.13 H new ATOM 0 HG SER A 57 1.033 4.611 -1.121 1.00 65.24 H new ATOM 929 N SER A 58 3.041 6.089 2.459 1.00 1.42 N ATOM 930 CA SER A 58 3.557 5.160 3.456 1.00 63.13 C ATOM 931 C SER A 58 3.172 5.604 4.865 1.00 15.41 C ATOM 932 O SER A 58 2.740 4.795 5.684 1.00 73.52 O ATOM 933 CB SER A 58 5.079 5.051 3.344 1.00 50.51 C ATOM 934 OG SER A 58 5.614 4.271 4.399 1.00 1.30 O ATOM 0 H SER A 58 3.732 6.747 2.098 1.00 1.42 H new ATOM 0 HA SER A 58 3.114 4.182 3.267 1.00 63.13 H new ATOM 0 HB2 SER A 58 5.345 4.604 2.386 1.00 50.51 H new ATOM 0 HB3 SER A 58 5.520 6.047 3.364 1.00 50.51 H new ATOM 0 HG SER A 58 6.588 4.216 4.304 1.00 1.30 H new ATOM 940 N GLN A 59 3.330 6.896 5.134 1.00 62.33 N ATOM 941 CA GLN A 59 2.999 7.448 6.442 1.00 31.52 C ATOM 942 C GLN A 59 1.492 7.436 6.673 1.00 11.41 C ATOM 943 O GLN A 59 1.025 7.222 7.792 1.00 62.30 O ATOM 944 CB GLN A 59 3.535 8.875 6.567 1.00 20.45 C ATOM 945 CG GLN A 59 3.064 9.802 5.458 1.00 33.01 C ATOM 946 CD GLN A 59 3.577 11.218 5.622 1.00 21.32 C ATOM 947 OE1 GLN A 59 2.762 12.193 5.235 1.00 53.01 O flip ATOM 948 NE2 GLN A 59 4.694 11.435 6.093 1.00 72.35 N flip ATOM 0 H GLN A 59 3.685 7.579 4.465 1.00 62.33 H new ATOM 0 HA GLN A 59 3.469 6.823 7.201 1.00 31.52 H new ATOM 0 HB2 GLN A 59 3.227 9.287 7.528 1.00 20.45 H new ATOM 0 HB3 GLN A 59 4.625 8.846 6.567 1.00 20.45 H new ATOM 0 HG2 GLN A 59 3.395 9.409 4.497 1.00 33.01 H new ATOM 0 HG3 GLN A 59 1.974 9.815 5.439 1.00 33.01 H new ATOM 0 HE21 GLN A 59 5.288 10.656 6.378 1.00 72.35 H new ATOM 0 HE22 GLN A 59 5.025 12.394 6.199 1.00 72.35 H new ATOM 957 N LEU A 60 0.734 7.668 5.606 1.00 30.13 N ATOM 958 CA LEU A 60 -0.723 7.685 5.692 1.00 2.22 C ATOM 959 C LEU A 60 -1.255 6.345 6.191 1.00 63.54 C ATOM 960 O LEU A 60 -2.229 6.292 6.941 1.00 12.15 O ATOM 961 CB LEU A 60 -1.329 8.010 4.326 1.00 34.43 C ATOM 962 CG LEU A 60 -2.816 8.368 4.320 1.00 35.22 C ATOM 963 CD1 LEU A 60 -3.048 9.677 3.581 1.00 73.40 C ATOM 964 CD2 LEU A 60 -3.632 7.247 3.691 1.00 52.05 C ATOM 0 H LEU A 60 1.104 7.847 4.672 1.00 30.13 H new ATOM 0 HA LEU A 60 -1.012 8.457 6.405 1.00 2.22 H new ATOM 0 HB2 LEU A 60 -0.774 8.842 3.893 1.00 34.43 H new ATOM 0 HB3 LEU A 60 -1.180 7.152 3.671 1.00 34.43 H new ATOM 0 HG LEU A 60 -3.143 8.494 5.352 1.00 35.22 H new ATOM 0 HD11 LEU A 60 -4.112 9.915 3.587 1.00 73.40 H new ATOM 0 HD12 LEU A 60 -2.494 10.476 4.074 1.00 73.40 H new ATOM 0 HD13 LEU A 60 -2.704 9.579 2.551 1.00 73.40 H new ATOM 0 HD21 LEU A 60 -4.688 7.519 3.695 1.00 52.05 H new ATOM 0 HD22 LEU A 60 -3.302 7.089 2.664 1.00 52.05 H new ATOM 0 HD23 LEU A 60 -3.491 6.330 4.263 1.00 52.05 H new ATOM 976 N THR A 61 -0.605 5.263 5.772 1.00 63.13 N ATOM 977 CA THR A 61 -1.011 3.924 6.178 1.00 54.14 C ATOM 978 C THR A 61 -0.710 3.680 7.652 1.00 50.34 C ATOM 979 O THR A 61 -1.527 3.110 8.376 1.00 41.42 O ATOM 980 CB THR A 61 -0.305 2.843 5.336 1.00 4.14 C ATOM 981 OG1 THR A 61 0.761 3.431 4.582 1.00 64.15 O ATOM 982 CG2 THR A 61 -1.286 2.165 4.392 1.00 2.31 C ATOM 0 H THR A 61 0.204 5.289 5.152 1.00 63.13 H new ATOM 0 HA THR A 61 -2.087 3.858 6.014 1.00 54.14 H new ATOM 0 HB THR A 61 0.100 2.091 6.014 1.00 4.14 H new ATOM 0 HG1 THR A 61 1.444 3.776 5.195 1.00 64.15 H new ATOM 0 HG21 THR A 61 -0.764 1.406 3.809 1.00 2.31 H new ATOM 0 HG22 THR A 61 -2.081 1.695 4.970 1.00 2.31 H new ATOM 0 HG23 THR A 61 -1.716 2.907 3.720 1.00 2.31 H new ATOM 990 N SER A 62 0.466 4.116 8.091 1.00 71.03 N ATOM 991 CA SER A 62 0.876 3.942 9.479 1.00 43.32 C ATOM 992 C SER A 62 -0.069 4.682 10.421 1.00 53.14 C ATOM 993 O SER A 62 -0.392 4.194 11.504 1.00 55.15 O ATOM 994 CB SER A 62 2.308 4.444 9.677 1.00 2.32 C ATOM 995 OG SER A 62 3.205 3.785 8.800 1.00 71.21 O ATOM 0 H SER A 62 1.152 4.592 7.505 1.00 71.03 H new ATOM 0 HA SER A 62 0.836 2.878 9.713 1.00 43.32 H new ATOM 0 HB2 SER A 62 2.347 5.519 9.502 1.00 2.32 H new ATOM 0 HB3 SER A 62 2.616 4.278 10.709 1.00 2.32 H new ATOM 0 HG SER A 62 3.052 4.094 7.883 1.00 71.21 H new ATOM 1001 N ALA A 63 -0.508 5.864 10.000 1.00 60.52 N ATOM 1002 CA ALA A 63 -1.418 6.671 10.804 1.00 42.14 C ATOM 1003 C ALA A 63 -2.826 6.086 10.794 1.00 62.14 C ATOM 1004 O ALA A 63 -3.391 5.783 11.845 1.00 55.21 O ATOM 1005 CB ALA A 63 -1.436 8.106 10.300 1.00 51.40 C ATOM 0 H ALA A 63 -0.248 6.284 9.107 1.00 60.52 H new ATOM 0 HA ALA A 63 -1.058 6.664 11.833 1.00 42.14 H new ATOM 0 HB1 ALA A 63 -2.120 8.697 10.909 1.00 51.40 H new ATOM 0 HB2 ALA A 63 -0.433 8.528 10.367 1.00 51.40 H new ATOM 0 HB3 ALA A 63 -1.768 8.123 9.262 1.00 51.40 H new ATOM 1011 N VAL A 64 -3.388 5.932 9.599 1.00 32.45 N ATOM 1012 CA VAL A 64 -4.731 5.383 9.453 1.00 55.22 C ATOM 1013 C VAL A 64 -4.878 4.075 10.224 1.00 3.35 C ATOM 1014 O VAL A 64 -5.915 3.817 10.835 1.00 12.44 O ATOM 1015 CB VAL A 64 -5.076 5.134 7.972 1.00 33.24 C ATOM 1016 CG1 VAL A 64 -6.407 4.406 7.849 1.00 0.12 C ATOM 1017 CG2 VAL A 64 -5.104 6.447 7.204 1.00 33.13 C ATOM 0 H VAL A 64 -2.935 6.179 8.719 1.00 32.45 H new ATOM 0 HA VAL A 64 -5.421 6.121 9.861 1.00 55.22 H new ATOM 0 HB VAL A 64 -4.302 4.502 7.537 1.00 33.24 H new ATOM 0 HG11 VAL A 64 -6.634 4.239 6.796 1.00 0.12 H new ATOM 0 HG12 VAL A 64 -6.346 3.447 8.364 1.00 0.12 H new ATOM 0 HG13 VAL A 64 -7.195 5.010 8.299 1.00 0.12 H new ATOM 0 HG21 VAL A 64 -5.349 6.253 6.160 1.00 33.13 H new ATOM 0 HG22 VAL A 64 -5.857 7.106 7.637 1.00 33.13 H new ATOM 0 HG23 VAL A 64 -4.126 6.925 7.264 1.00 33.13 H new ATOM 1027 N SER A 65 -3.834 3.255 10.192 1.00 61.22 N ATOM 1028 CA SER A 65 -3.847 1.973 10.885 1.00 21.43 C ATOM 1029 C SER A 65 -3.868 2.173 12.398 1.00 1.43 C ATOM 1030 O SER A 65 -4.514 1.419 13.125 1.00 41.45 O ATOM 1031 CB SER A 65 -2.627 1.141 10.487 1.00 32.42 C ATOM 1032 OG SER A 65 -1.423 1.839 10.754 1.00 21.35 O ATOM 0 H SER A 65 -2.967 3.456 9.693 1.00 61.22 H new ATOM 0 HA SER A 65 -4.752 1.440 10.593 1.00 21.43 H new ATOM 0 HB2 SER A 65 -2.633 0.198 11.033 1.00 32.42 H new ATOM 0 HB3 SER A 65 -2.681 0.896 9.426 1.00 32.42 H new ATOM 0 HG SER A 65 -1.172 2.371 9.970 1.00 21.35 H new ATOM 1038 N GLN A 66 -3.159 3.196 12.863 1.00 62.15 N ATOM 1039 CA GLN A 66 -3.095 3.496 14.289 1.00 42.44 C ATOM 1040 C GLN A 66 -4.465 3.904 14.821 1.00 70.05 C ATOM 1041 O GLN A 66 -4.923 3.389 15.840 1.00 51.21 O ATOM 1042 CB GLN A 66 -2.080 4.610 14.551 1.00 30.43 C ATOM 1043 CG GLN A 66 -1.701 4.753 16.017 1.00 62.32 C ATOM 1044 CD GLN A 66 -0.226 4.499 16.265 1.00 30.15 C ATOM 1045 OE1 GLN A 66 0.429 5.244 16.993 1.00 70.44 O ATOM 1046 NE2 GLN A 66 0.302 3.443 15.660 1.00 54.44 N ATOM 0 H GLN A 66 -2.621 3.831 12.274 1.00 62.15 H new ATOM 0 HA GLN A 66 -2.777 2.594 14.811 1.00 42.44 H new ATOM 0 HB2 GLN A 66 -1.180 4.415 13.969 1.00 30.43 H new ATOM 0 HB3 GLN A 66 -2.490 5.555 14.196 1.00 30.43 H new ATOM 0 HG2 GLN A 66 -1.956 5.756 16.358 1.00 62.32 H new ATOM 0 HG3 GLN A 66 -2.291 4.055 16.611 1.00 62.32 H new ATOM 0 HE21 GLN A 66 -0.279 2.853 15.065 1.00 54.44 H new ATOM 0 HE22 GLN A 66 1.289 3.221 15.790 1.00 54.44 H new ATOM 1055 N ALA A 67 -5.114 4.829 14.123 1.00 3.53 N ATOM 1056 CA ALA A 67 -6.432 5.305 14.524 1.00 33.31 C ATOM 1057 C ALA A 67 -7.460 4.179 14.474 1.00 64.31 C ATOM 1058 O ALA A 67 -8.286 4.039 15.376 1.00 73.44 O ATOM 1059 CB ALA A 67 -6.869 6.462 13.637 1.00 61.51 C ATOM 0 H ALA A 67 -4.748 5.264 13.276 1.00 3.53 H new ATOM 0 HA ALA A 67 -6.366 5.657 15.554 1.00 33.31 H new ATOM 0 HB1 ALA A 67 -7.855 6.807 13.948 1.00 61.51 H new ATOM 0 HB2 ALA A 67 -6.154 7.279 13.727 1.00 61.51 H new ATOM 0 HB3 ALA A 67 -6.912 6.129 12.600 1.00 61.51 H new ATOM 1065 N VAL A 68 -7.404 3.380 13.413 1.00 24.50 N ATOM 1066 CA VAL A 68 -8.330 2.266 13.245 1.00 25.44 C ATOM 1067 C VAL A 68 -8.039 1.154 14.246 1.00 64.12 C ATOM 1068 O VAL A 68 -8.932 0.397 14.625 1.00 43.05 O ATOM 1069 CB VAL A 68 -8.262 1.690 11.819 1.00 52.14 C ATOM 1070 CG1 VAL A 68 -9.189 0.492 11.683 1.00 52.41 C ATOM 1071 CG2 VAL A 68 -8.605 2.761 10.795 1.00 12.42 C ATOM 0 H VAL A 68 -6.727 3.483 12.657 1.00 24.50 H new ATOM 0 HA VAL A 68 -9.332 2.657 13.423 1.00 25.44 H new ATOM 0 HB VAL A 68 -7.243 1.353 11.629 1.00 52.14 H new ATOM 0 HG11 VAL A 68 -9.128 0.098 10.669 1.00 52.41 H new ATOM 0 HG12 VAL A 68 -8.891 -0.281 12.391 1.00 52.41 H new ATOM 0 HG13 VAL A 68 -10.214 0.799 11.892 1.00 52.41 H new ATOM 0 HG21 VAL A 68 -8.552 2.336 9.793 1.00 12.42 H new ATOM 0 HG22 VAL A 68 -9.614 3.131 10.979 1.00 12.42 H new ATOM 0 HG23 VAL A 68 -7.896 3.584 10.878 1.00 12.42 H new ATOM 1081 N ALA A 69 -6.783 1.063 14.672 1.00 72.20 N ATOM 1082 CA ALA A 69 -6.374 0.045 15.631 1.00 75.43 C ATOM 1083 C ALA A 69 -6.603 0.516 17.064 1.00 54.15 C ATOM 1084 O ALA A 69 -6.306 -0.201 18.018 1.00 52.45 O ATOM 1085 CB ALA A 69 -4.912 -0.322 15.421 1.00 23.43 C ATOM 0 H ALA A 69 -6.032 1.682 14.368 1.00 72.20 H new ATOM 0 HA ALA A 69 -6.987 -0.841 15.465 1.00 75.43 H new ATOM 0 HB1 ALA A 69 -4.620 -1.083 16.144 1.00 23.43 H new ATOM 0 HB2 ALA A 69 -4.776 -0.710 14.411 1.00 23.43 H new ATOM 0 HB3 ALA A 69 -4.291 0.564 15.557 1.00 23.43 H new ATOM 1091 N ASN A 70 -7.134 1.725 17.205 1.00 23.35 N ATOM 1092 CA ASN A 70 -7.401 2.293 18.522 1.00 15.44 C ATOM 1093 C ASN A 70 -8.896 2.268 18.831 1.00 64.43 C ATOM 1094 O ASN A 70 -9.299 2.208 19.992 1.00 24.25 O ATOM 1095 CB ASN A 70 -6.878 3.728 18.598 1.00 0.04 C ATOM 1096 CG ASN A 70 -5.393 3.787 18.900 1.00 74.44 C ATOM 1097 OD1 ASN A 70 -4.857 2.930 19.602 1.00 41.23 O ATOM 1098 ND2 ASN A 70 -4.721 4.801 18.369 1.00 42.22 N ATOM 0 H ASN A 70 -7.388 2.331 16.425 1.00 23.35 H new ATOM 0 HA ASN A 70 -6.883 1.685 19.264 1.00 15.44 H new ATOM 0 HB2 ASN A 70 -7.074 4.234 17.653 1.00 0.04 H new ATOM 0 HB3 ASN A 70 -7.425 4.271 19.369 1.00 0.04 H new ATOM 0 HD21 ASN A 70 -3.719 4.893 18.537 1.00 42.22 H new ATOM 0 HD22 ASN A 70 -5.206 5.489 17.793 1.00 42.22 H new ATOM 1105 N VAL A 71 -9.712 2.313 17.783 1.00 30.51 N ATOM 1106 CA VAL A 71 -11.162 2.293 17.942 1.00 44.14 C ATOM 1107 C VAL A 71 -11.634 0.961 18.513 1.00 42.11 C ATOM 1108 O VAL A 71 -12.705 0.877 19.113 1.00 74.30 O ATOM 1109 CB VAL A 71 -11.877 2.547 16.602 1.00 51.53 C ATOM 1110 CG1 VAL A 71 -11.413 1.548 15.552 1.00 2.33 C ATOM 1111 CG2 VAL A 71 -13.385 2.483 16.783 1.00 53.22 C ATOM 0 H VAL A 71 -9.394 2.364 16.815 1.00 30.51 H new ATOM 0 HA VAL A 71 -11.415 3.093 18.638 1.00 44.14 H new ATOM 0 HB VAL A 71 -11.619 3.548 16.255 1.00 51.53 H new ATOM 0 HG11 VAL A 71 -11.929 1.743 14.612 1.00 2.33 H new ATOM 0 HG12 VAL A 71 -10.338 1.649 15.404 1.00 2.33 H new ATOM 0 HG13 VAL A 71 -11.640 0.536 15.887 1.00 2.33 H new ATOM 0 HG21 VAL A 71 -13.874 2.665 15.826 1.00 53.22 H new ATOM 0 HG22 VAL A 71 -13.666 1.497 17.152 1.00 53.22 H new ATOM 0 HG23 VAL A 71 -13.698 3.242 17.500 1.00 53.22 H new ATOM 1121 N ARG A 72 -10.827 -0.077 18.323 1.00 61.02 N ATOM 1122 CA ARG A 72 -11.163 -1.406 18.819 1.00 53.25 C ATOM 1123 C ARG A 72 -12.429 -1.933 18.150 1.00 44.32 C ATOM 1124 O ARG A 72 -13.247 -1.174 17.629 1.00 24.21 O ATOM 1125 CB ARG A 72 -11.351 -1.376 20.336 1.00 24.54 C ATOM 1126 CG ARG A 72 -12.780 -1.641 20.779 1.00 21.34 C ATOM 1127 CD ARG A 72 -12.930 -1.513 22.287 1.00 23.22 C ATOM 1128 NE ARG A 72 -11.963 -2.338 23.005 1.00 71.41 N ATOM 1129 CZ ARG A 72 -11.830 -2.334 24.327 1.00 2.45 C ATOM 1130 NH1 ARG A 72 -12.599 -1.550 25.070 1.00 35.41 N ATOM 1131 NH2 ARG A 72 -10.927 -3.113 24.907 1.00 44.01 N ATOM 0 H ARG A 72 -9.936 -0.024 17.829 1.00 61.02 H new ATOM 0 HA ARG A 72 -10.338 -2.075 18.575 1.00 53.25 H new ATOM 0 HB2 ARG A 72 -10.695 -2.120 20.789 1.00 24.54 H new ATOM 0 HB3 ARG A 72 -11.038 -0.403 20.713 1.00 24.54 H new ATOM 0 HG2 ARG A 72 -13.451 -0.939 20.285 1.00 21.34 H new ATOM 0 HG3 ARG A 72 -13.079 -2.641 20.466 1.00 21.34 H new ATOM 0 HD2 ARG A 72 -12.802 -0.470 22.577 1.00 23.22 H new ATOM 0 HD3 ARG A 72 -13.940 -1.803 22.577 1.00 23.22 H new ATOM 0 HE ARG A 72 -11.356 -2.952 22.462 1.00 71.41 H new ATOM 0 HH11 ARG A 72 -13.294 -0.949 24.627 1.00 35.41 H new ATOM 0 HH12 ARG A 72 -12.496 -1.548 26.085 1.00 35.41 H new ATOM 0 HH21 ARG A 72 -10.333 -3.716 24.338 1.00 44.01 H new ATOM 0 HH22 ARG A 72 -10.826 -3.109 25.922 1.00 44.01 H new ATOM 1145 N PRO A 73 -12.596 -3.264 18.162 1.00 42.43 N ATOM 1146 CA PRO A 73 -13.759 -3.921 17.559 1.00 32.52 C ATOM 1147 C PRO A 73 -15.042 -3.655 18.340 1.00 14.33 C ATOM 1148 O PRO A 73 -15.004 -3.335 19.526 1.00 33.21 O ATOM 1149 CB PRO A 73 -13.397 -5.407 17.618 1.00 30.00 C ATOM 1150 CG PRO A 73 -12.435 -5.518 18.751 1.00 14.43 C ATOM 1151 CD PRO A 73 -11.661 -4.229 18.764 1.00 20.33 C ATOM 0 HA PRO A 73 -13.957 -3.556 16.551 1.00 32.52 H new ATOM 0 HB2 PRO A 73 -14.280 -6.023 17.787 1.00 30.00 H new ATOM 0 HB3 PRO A 73 -12.948 -5.743 16.683 1.00 30.00 H new ATOM 0 HG2 PRO A 73 -12.959 -5.668 19.695 1.00 14.43 H new ATOM 0 HG3 PRO A 73 -11.770 -6.371 18.616 1.00 14.43 H new ATOM 0 HD2 PRO A 73 -11.381 -3.939 19.777 1.00 20.33 H new ATOM 0 HD3 PRO A 73 -10.739 -4.308 18.188 1.00 20.33 H new ATOM 1159 N GLY A 74 -16.179 -3.790 17.663 1.00 31.14 N ATOM 1160 CA GLY A 74 -17.459 -3.560 18.308 1.00 73.21 C ATOM 1161 C GLY A 74 -17.878 -2.105 18.264 1.00 3.15 C ATOM 1162 O GLY A 74 -18.719 -1.669 19.051 1.00 10.40 O ATOM 0 H GLY A 74 -16.236 -4.055 16.680 1.00 31.14 H new ATOM 0 HA2 GLY A 74 -18.221 -4.169 17.822 1.00 73.21 H new ATOM 0 HA3 GLY A 74 -17.403 -3.887 19.346 1.00 73.21 H new ATOM 1166 N SER A 75 -17.290 -1.348 17.342 1.00 65.34 N ATOM 1167 CA SER A 75 -17.603 0.069 17.202 1.00 62.44 C ATOM 1168 C SER A 75 -18.319 0.339 15.883 1.00 61.21 C ATOM 1169 O SER A 75 -18.004 -0.265 14.858 1.00 0.42 O ATOM 1170 CB SER A 75 -16.323 0.906 17.281 1.00 31.55 C ATOM 1171 OG SER A 75 -15.342 0.263 18.077 1.00 15.13 O ATOM 0 H SER A 75 -16.594 -1.693 16.681 1.00 65.34 H new ATOM 0 HA SER A 75 -18.265 0.352 18.020 1.00 62.44 H new ATOM 0 HB2 SER A 75 -15.930 1.072 16.278 1.00 31.55 H new ATOM 0 HB3 SER A 75 -16.551 1.886 17.700 1.00 31.55 H new ATOM 0 HG SER A 75 -14.784 -0.310 17.510 1.00 15.13 H new ATOM 1177 N SER A 76 -19.286 1.251 15.918 1.00 53.43 N ATOM 1178 CA SER A 76 -20.051 1.599 14.726 1.00 5.44 C ATOM 1179 C SER A 76 -19.123 1.980 13.576 1.00 22.44 C ATOM 1180 O SER A 76 -17.951 2.304 13.772 1.00 54.21 O ATOM 1181 CB SER A 76 -21.008 2.755 15.029 1.00 54.44 C ATOM 1182 OG SER A 76 -22.356 2.364 14.837 1.00 75.13 O ATOM 0 H SER A 76 -19.558 1.762 16.758 1.00 53.43 H new ATOM 0 HA SER A 76 -20.630 0.725 14.428 1.00 5.44 H new ATOM 0 HB2 SER A 76 -20.866 3.089 16.057 1.00 54.44 H new ATOM 0 HB3 SER A 76 -20.776 3.602 14.383 1.00 54.44 H new ATOM 0 HG SER A 76 -22.947 3.119 15.039 1.00 75.13 H new ATOM 1188 N PRO A 77 -19.659 1.941 12.348 1.00 55.55 N ATOM 1189 CA PRO A 77 -18.898 2.279 11.141 1.00 40.30 C ATOM 1190 C PRO A 77 -18.573 3.767 11.058 1.00 63.43 C ATOM 1191 O PRO A 77 -17.812 4.198 10.193 1.00 74.02 O ATOM 1192 CB PRO A 77 -19.838 1.873 10.003 1.00 1.20 C ATOM 1193 CG PRO A 77 -21.202 1.948 10.595 1.00 34.15 C ATOM 1194 CD PRO A 77 -21.049 1.564 12.041 1.00 3.31 C ATOM 0 HA PRO A 77 -17.932 1.775 11.114 1.00 40.30 H new ATOM 0 HB2 PRO A 77 -19.739 2.544 9.149 1.00 1.20 H new ATOM 0 HB3 PRO A 77 -19.616 0.867 9.646 1.00 1.20 H new ATOM 0 HG2 PRO A 77 -21.614 2.953 10.500 1.00 34.15 H new ATOM 0 HG3 PRO A 77 -21.887 1.273 10.083 1.00 34.15 H new ATOM 0 HD2 PRO A 77 -21.759 2.095 12.675 1.00 3.31 H new ATOM 0 HD3 PRO A 77 -21.220 0.498 12.194 1.00 3.31 H new ATOM 1202 N ALA A 78 -19.154 4.546 11.965 1.00 61.13 N ATOM 1203 CA ALA A 78 -18.923 5.985 11.996 1.00 70.45 C ATOM 1204 C ALA A 78 -17.526 6.306 12.515 1.00 21.55 C ATOM 1205 O ALA A 78 -16.841 7.180 11.984 1.00 61.30 O ATOM 1206 CB ALA A 78 -19.978 6.669 12.852 1.00 5.11 C ATOM 0 H ALA A 78 -19.788 4.205 12.688 1.00 61.13 H new ATOM 0 HA ALA A 78 -18.997 6.363 10.976 1.00 70.45 H new ATOM 0 HB1 ALA A 78 -19.794 7.743 12.867 1.00 5.11 H new ATOM 0 HB2 ALA A 78 -20.966 6.476 12.435 1.00 5.11 H new ATOM 0 HB3 ALA A 78 -19.931 6.279 13.869 1.00 5.11 H new ATOM 1212 N VAL A 79 -17.110 5.594 13.559 1.00 42.24 N ATOM 1213 CA VAL A 79 -15.794 5.803 14.150 1.00 5.20 C ATOM 1214 C VAL A 79 -14.692 5.256 13.249 1.00 15.11 C ATOM 1215 O VAL A 79 -13.626 5.857 13.120 1.00 60.34 O ATOM 1216 CB VAL A 79 -15.688 5.136 15.535 1.00 51.34 C ATOM 1217 CG1 VAL A 79 -16.426 5.957 16.581 1.00 11.10 C ATOM 1218 CG2 VAL A 79 -16.227 3.715 15.483 1.00 54.15 C ATOM 0 H VAL A 79 -17.666 4.868 14.012 1.00 42.24 H new ATOM 0 HA VAL A 79 -15.666 6.880 14.262 1.00 5.20 H new ATOM 0 HB VAL A 79 -14.637 5.092 15.819 1.00 51.34 H new ATOM 0 HG11 VAL A 79 -16.340 5.470 17.553 1.00 11.10 H new ATOM 0 HG12 VAL A 79 -15.990 6.954 16.635 1.00 11.10 H new ATOM 0 HG13 VAL A 79 -17.478 6.035 16.306 1.00 11.10 H new ATOM 0 HG21 VAL A 79 -16.145 3.258 16.469 1.00 54.15 H new ATOM 0 HG22 VAL A 79 -17.273 3.734 15.178 1.00 54.15 H new ATOM 0 HG23 VAL A 79 -15.650 3.133 14.764 1.00 54.15 H new ATOM 1228 N TYR A 80 -14.958 4.113 12.627 1.00 20.12 N ATOM 1229 CA TYR A 80 -13.989 3.483 11.740 1.00 53.44 C ATOM 1230 C TYR A 80 -13.715 4.360 10.521 1.00 32.23 C ATOM 1231 O TYR A 80 -12.563 4.582 10.149 1.00 75.21 O ATOM 1232 CB TYR A 80 -14.494 2.111 11.289 1.00 74.51 C ATOM 1233 CG TYR A 80 -14.195 1.003 12.275 1.00 53.54 C ATOM 1234 CD1 TYR A 80 -12.950 0.387 12.302 1.00 22.01 C ATOM 1235 CD2 TYR A 80 -15.159 0.572 13.179 1.00 40.34 C ATOM 1236 CE1 TYR A 80 -12.672 -0.625 13.199 1.00 13.33 C ATOM 1237 CE2 TYR A 80 -14.890 -0.440 14.081 1.00 43.14 C ATOM 1238 CZ TYR A 80 -13.645 -1.035 14.086 1.00 22.35 C ATOM 1239 OH TYR A 80 -13.373 -2.043 14.983 1.00 73.11 O ATOM 0 H TYR A 80 -15.837 3.604 12.721 1.00 20.12 H new ATOM 0 HA TYR A 80 -13.058 3.357 12.293 1.00 53.44 H new ATOM 0 HB2 TYR A 80 -15.571 2.164 11.130 1.00 74.51 H new ATOM 0 HB3 TYR A 80 -14.041 1.864 10.329 1.00 74.51 H new ATOM 0 HD1 TYR A 80 -12.186 0.706 11.609 1.00 22.01 H new ATOM 0 HD2 TYR A 80 -16.134 1.036 13.176 1.00 40.34 H new ATOM 0 HE1 TYR A 80 -11.699 -1.093 13.206 1.00 13.33 H new ATOM 0 HE2 TYR A 80 -15.649 -0.763 14.778 1.00 43.14 H new ATOM 0 HH TYR A 80 -13.498 -1.711 15.896 1.00 73.11 H new ATOM 1249 N ALA A 81 -14.783 4.857 9.906 1.00 35.33 N ATOM 1250 CA ALA A 81 -14.660 5.712 8.732 1.00 21.30 C ATOM 1251 C ALA A 81 -13.924 7.004 9.070 1.00 12.11 C ATOM 1252 O ALA A 81 -13.180 7.541 8.248 1.00 32.54 O ATOM 1253 CB ALA A 81 -16.034 6.019 8.156 1.00 74.11 C ATOM 0 H ALA A 81 -15.743 4.682 10.202 1.00 35.33 H new ATOM 0 HA ALA A 81 -14.076 5.177 7.983 1.00 21.30 H new ATOM 0 HB1 ALA A 81 -15.927 6.658 7.280 1.00 74.11 H new ATOM 0 HB2 ALA A 81 -16.524 5.089 7.869 1.00 74.11 H new ATOM 0 HB3 ALA A 81 -16.637 6.530 8.906 1.00 74.11 H new ATOM 1259 N LYS A 82 -14.137 7.500 10.284 1.00 4.44 N ATOM 1260 CA LYS A 82 -13.495 8.731 10.731 1.00 64.23 C ATOM 1261 C LYS A 82 -12.025 8.488 11.061 1.00 21.15 C ATOM 1262 O LYS A 82 -11.173 9.339 10.808 1.00 13.54 O ATOM 1263 CB LYS A 82 -14.218 9.291 11.958 1.00 24.13 C ATOM 1264 CG LYS A 82 -13.687 10.639 12.414 1.00 2.34 C ATOM 1265 CD LYS A 82 -12.650 10.487 13.514 1.00 1.42 C ATOM 1266 CE LYS A 82 -13.276 9.981 14.804 1.00 64.30 C ATOM 1267 NZ LYS A 82 -13.568 11.092 15.752 1.00 12.12 N ATOM 0 H LYS A 82 -14.749 7.069 10.976 1.00 4.44 H new ATOM 0 HA LYS A 82 -13.553 9.457 9.920 1.00 64.23 H new ATOM 0 HB2 LYS A 82 -15.280 9.386 11.732 1.00 24.13 H new ATOM 0 HB3 LYS A 82 -14.129 8.579 12.778 1.00 24.13 H new ATOM 0 HG2 LYS A 82 -13.245 11.163 11.566 1.00 2.34 H new ATOM 0 HG3 LYS A 82 -14.512 11.254 12.773 1.00 2.34 H new ATOM 0 HD2 LYS A 82 -11.873 9.795 13.190 1.00 1.42 H new ATOM 0 HD3 LYS A 82 -12.167 11.447 13.695 1.00 1.42 H new ATOM 0 HE2 LYS A 82 -14.198 9.447 14.575 1.00 64.30 H new ATOM 0 HE3 LYS A 82 -12.603 9.266 15.278 1.00 64.30 H new ATOM 0 HZ1 LYS A 82 -13.994 10.706 16.619 1.00 12.12 H new ATOM 0 HZ2 LYS A 82 -12.684 11.586 15.991 1.00 12.12 H new ATOM 0 HZ3 LYS A 82 -14.230 11.761 15.309 1.00 12.12 H new ATOM 1281 N ALA A 83 -11.736 7.321 11.627 1.00 32.20 N ATOM 1282 CA ALA A 83 -10.369 6.966 11.988 1.00 61.32 C ATOM 1283 C ALA A 83 -9.525 6.698 10.747 1.00 4.13 C ATOM 1284 O ALA A 83 -8.307 6.537 10.835 1.00 20.41 O ATOM 1285 CB ALA A 83 -10.364 5.750 12.903 1.00 33.40 C ATOM 0 H ALA A 83 -12.430 6.606 11.845 1.00 32.20 H new ATOM 0 HA ALA A 83 -9.929 7.810 12.519 1.00 61.32 H new ATOM 0 HB1 ALA A 83 -9.337 5.496 13.165 1.00 33.40 H new ATOM 0 HB2 ALA A 83 -10.925 5.975 13.810 1.00 33.40 H new ATOM 0 HB3 ALA A 83 -10.827 4.907 12.390 1.00 33.40 H new ATOM 1291 N ILE A 84 -10.179 6.653 9.591 1.00 20.35 N ATOM 1292 CA ILE A 84 -9.488 6.406 8.332 1.00 62.34 C ATOM 1293 C ILE A 84 -9.423 7.671 7.482 1.00 70.31 C ATOM 1294 O ILE A 84 -8.554 7.810 6.623 1.00 64.33 O ATOM 1295 CB ILE A 84 -10.175 5.291 7.522 1.00 0.42 C ATOM 1296 CG1 ILE A 84 -10.198 3.988 8.323 1.00 34.13 C ATOM 1297 CG2 ILE A 84 -9.465 5.088 6.192 1.00 41.43 C ATOM 1298 CD1 ILE A 84 -11.205 2.981 7.810 1.00 23.44 C ATOM 0 H ILE A 84 -11.186 6.784 9.501 1.00 20.35 H new ATOM 0 HA ILE A 84 -8.476 6.089 8.585 1.00 62.34 H new ATOM 0 HB ILE A 84 -11.204 5.590 7.321 1.00 0.42 H new ATOM 0 HG12 ILE A 84 -9.205 3.540 8.301 1.00 34.13 H new ATOM 0 HG13 ILE A 84 -10.422 4.215 9.365 1.00 34.13 H new ATOM 0 HG21 ILE A 84 -9.962 4.297 5.631 1.00 41.43 H new ATOM 0 HG22 ILE A 84 -9.496 6.014 5.618 1.00 41.43 H new ATOM 0 HG23 ILE A 84 -8.427 4.808 6.373 1.00 41.43 H new ATOM 0 HD11 ILE A 84 -11.166 2.082 8.425 1.00 23.44 H new ATOM 0 HD12 ILE A 84 -12.206 3.410 7.858 1.00 23.44 H new ATOM 0 HD13 ILE A 84 -10.969 2.724 6.777 1.00 23.44 H new ATOM 1310 N ALA A 85 -10.350 8.591 7.731 1.00 55.21 N ATOM 1311 CA ALA A 85 -10.396 9.846 6.991 1.00 24.24 C ATOM 1312 C ALA A 85 -9.601 10.933 7.705 1.00 25.55 C ATOM 1313 O ALA A 85 -8.935 11.749 7.068 1.00 34.31 O ATOM 1314 CB ALA A 85 -11.839 10.288 6.793 1.00 44.51 C ATOM 0 H ALA A 85 -11.078 8.491 8.438 1.00 55.21 H new ATOM 0 HA ALA A 85 -9.940 9.681 6.015 1.00 24.24 H new ATOM 0 HB1 ALA A 85 -11.859 11.227 6.239 1.00 44.51 H new ATOM 0 HB2 ALA A 85 -12.380 9.525 6.234 1.00 44.51 H new ATOM 0 HB3 ALA A 85 -12.313 10.430 7.764 1.00 44.51 H new ATOM 1320 N ALA A 86 -9.674 10.940 9.033 1.00 15.41 N ATOM 1321 CA ALA A 86 -8.960 11.926 9.833 1.00 14.21 C ATOM 1322 C ALA A 86 -7.472 11.929 9.500 1.00 20.34 C ATOM 1323 O ALA A 86 -6.908 12.941 9.082 1.00 23.30 O ATOM 1324 CB ALA A 86 -9.170 11.655 11.315 1.00 34.54 C ATOM 0 H ALA A 86 -10.221 10.273 9.577 1.00 15.41 H new ATOM 0 HA ALA A 86 -9.361 12.911 9.594 1.00 14.21 H new ATOM 0 HB1 ALA A 86 -8.631 12.399 11.901 1.00 34.54 H new ATOM 0 HB2 ALA A 86 -10.233 11.711 11.548 1.00 34.54 H new ATOM 0 HB3 ALA A 86 -8.796 10.661 11.560 1.00 34.54 H new ATOM 1330 N PRO A 87 -6.820 10.773 9.688 1.00 33.41 N ATOM 1331 CA PRO A 87 -5.388 10.618 9.414 1.00 70.21 C ATOM 1332 C PRO A 87 -5.076 10.664 7.922 1.00 62.01 C ATOM 1333 O PRO A 87 -3.918 10.792 7.525 1.00 41.54 O ATOM 1334 CB PRO A 87 -5.066 9.234 9.985 1.00 3.22 C ATOM 1335 CG PRO A 87 -6.360 8.497 9.947 1.00 42.11 C ATOM 1336 CD PRO A 87 -7.430 9.527 10.183 1.00 32.32 C ATOM 0 HA PRO A 87 -4.799 11.423 9.853 1.00 70.21 H new ATOM 0 HB2 PRO A 87 -4.305 8.728 9.391 1.00 3.22 H new ATOM 0 HB3 PRO A 87 -4.681 9.305 11.002 1.00 3.22 H new ATOM 0 HG2 PRO A 87 -6.499 8.003 8.986 1.00 42.11 H new ATOM 0 HG3 PRO A 87 -6.390 7.721 10.712 1.00 42.11 H new ATOM 0 HD2 PRO A 87 -8.346 9.286 9.643 1.00 32.32 H new ATOM 0 HD3 PRO A 87 -7.692 9.600 11.239 1.00 32.32 H new ATOM 1344 N SER A 88 -6.115 10.560 7.100 1.00 21.51 N ATOM 1345 CA SER A 88 -5.950 10.587 5.652 1.00 14.05 C ATOM 1346 C SER A 88 -5.936 12.021 5.133 1.00 24.15 C ATOM 1347 O SER A 88 -5.099 12.387 4.308 1.00 22.41 O ATOM 1348 CB SER A 88 -7.074 9.800 4.975 1.00 33.04 C ATOM 1349 OG SER A 88 -6.707 8.444 4.790 1.00 71.32 O ATOM 0 H SER A 88 -7.080 10.456 7.412 1.00 21.51 H new ATOM 0 HA SER A 88 -4.994 10.122 5.412 1.00 14.05 H new ATOM 0 HB2 SER A 88 -7.978 9.856 5.582 1.00 33.04 H new ATOM 0 HB3 SER A 88 -7.309 10.251 4.011 1.00 33.04 H new ATOM 0 HG SER A 88 -7.238 7.877 5.388 1.00 71.32 H new ATOM 1355 N VAL A 89 -6.869 12.832 5.624 1.00 74.43 N ATOM 1356 CA VAL A 89 -6.964 14.226 5.213 1.00 23.24 C ATOM 1357 C VAL A 89 -5.792 15.040 5.752 1.00 34.05 C ATOM 1358 O VAL A 89 -5.258 15.907 5.062 1.00 64.44 O ATOM 1359 CB VAL A 89 -8.282 14.865 5.692 1.00 42.14 C ATOM 1360 CG1 VAL A 89 -9.474 14.168 5.057 1.00 13.01 C ATOM 1361 CG2 VAL A 89 -8.373 14.820 7.210 1.00 62.41 C ATOM 0 H VAL A 89 -7.570 12.546 6.308 1.00 74.43 H new ATOM 0 HA VAL A 89 -6.939 14.236 4.123 1.00 23.24 H new ATOM 0 HB VAL A 89 -8.295 15.910 5.381 1.00 42.14 H new ATOM 0 HG11 VAL A 89 -10.396 14.633 5.407 1.00 13.01 H new ATOM 0 HG12 VAL A 89 -9.412 14.257 3.972 1.00 13.01 H new ATOM 0 HG13 VAL A 89 -9.470 13.114 5.336 1.00 13.01 H new ATOM 0 HG21 VAL A 89 -9.310 15.275 7.532 1.00 62.41 H new ATOM 0 HG22 VAL A 89 -8.339 13.784 7.546 1.00 62.41 H new ATOM 0 HG23 VAL A 89 -7.536 15.369 7.641 1.00 62.41 H new ATOM 1371 N GLN A 90 -5.399 14.752 6.989 1.00 42.25 N ATOM 1372 CA GLN A 90 -4.290 15.457 7.620 1.00 32.54 C ATOM 1373 C GLN A 90 -3.001 15.266 6.828 1.00 20.35 C ATOM 1374 O GLN A 90 -2.192 16.187 6.708 1.00 21.32 O ATOM 1375 CB GLN A 90 -4.098 14.966 9.056 1.00 45.11 C ATOM 1376 CG GLN A 90 -3.443 13.597 9.149 1.00 0.23 C ATOM 1377 CD GLN A 90 -3.220 13.152 10.580 1.00 20.55 C ATOM 1378 OE1 GLN A 90 -2.139 12.680 10.934 1.00 35.23 O ATOM 1379 NE2 GLN A 90 -4.244 13.302 11.414 1.00 55.34 N ATOM 0 H GLN A 90 -5.832 14.036 7.573 1.00 42.25 H new ATOM 0 HA GLN A 90 -4.530 16.520 7.635 1.00 32.54 H new ATOM 0 HB2 GLN A 90 -3.489 15.688 9.600 1.00 45.11 H new ATOM 0 HB3 GLN A 90 -5.068 14.930 9.551 1.00 45.11 H new ATOM 0 HG2 GLN A 90 -4.068 12.864 8.638 1.00 0.23 H new ATOM 0 HG3 GLN A 90 -2.487 13.620 8.627 1.00 0.23 H new ATOM 0 HE21 GLN A 90 -5.122 13.698 11.078 1.00 55.34 H new ATOM 0 HE22 GLN A 90 -4.152 13.021 12.390 1.00 55.34 H new ATOM 1388 N ILE A 91 -2.816 14.065 6.289 1.00 5.31 N ATOM 1389 CA ILE A 91 -1.626 13.754 5.507 1.00 3.04 C ATOM 1390 C ILE A 91 -1.785 14.206 4.059 1.00 25.31 C ATOM 1391 O ILE A 91 -0.841 14.708 3.446 1.00 22.45 O ATOM 1392 CB ILE A 91 -1.314 12.247 5.532 1.00 13.31 C ATOM 1393 CG1 ILE A 91 -0.484 11.895 6.769 1.00 55.44 C ATOM 1394 CG2 ILE A 91 -0.584 11.837 4.262 1.00 62.40 C ATOM 1395 CD1 ILE A 91 -1.054 10.746 7.571 1.00 61.32 C ATOM 0 H ILE A 91 -3.475 13.292 6.380 1.00 5.31 H new ATOM 0 HA ILE A 91 -0.798 14.295 5.964 1.00 3.04 H new ATOM 0 HB ILE A 91 -2.254 11.697 5.581 1.00 13.31 H new ATOM 0 HG12 ILE A 91 0.529 11.642 6.457 1.00 55.44 H new ATOM 0 HG13 ILE A 91 -0.411 12.774 7.410 1.00 55.44 H new ATOM 0 HG21 ILE A 91 -0.370 10.769 4.294 1.00 62.40 H new ATOM 0 HG22 ILE A 91 -1.209 12.056 3.396 1.00 62.40 H new ATOM 0 HG23 ILE A 91 0.351 12.392 4.184 1.00 62.40 H new ATOM 0 HD11 ILE A 91 -0.415 10.551 8.432 1.00 61.32 H new ATOM 0 HD12 ILE A 91 -2.056 11.003 7.913 1.00 61.32 H new ATOM 0 HD13 ILE A 91 -1.102 9.854 6.946 1.00 61.32 H new ATOM 1407 N LEU A 92 -2.985 14.027 3.519 1.00 12.34 N ATOM 1408 CA LEU A 92 -3.270 14.419 2.143 1.00 71.11 C ATOM 1409 C LEU A 92 -3.173 15.932 1.976 1.00 13.52 C ATOM 1410 O LEU A 92 -2.687 16.424 0.957 1.00 24.04 O ATOM 1411 CB LEU A 92 -4.663 13.937 1.732 1.00 61.32 C ATOM 1412 CG LEU A 92 -4.796 12.442 1.438 1.00 72.41 C ATOM 1413 CD1 LEU A 92 -6.226 11.978 1.668 1.00 63.55 C ATOM 1414 CD2 LEU A 92 -4.357 12.138 0.014 1.00 74.34 C ATOM 0 H LEU A 92 -3.776 13.613 4.012 1.00 12.34 H new ATOM 0 HA LEU A 92 -2.526 13.953 1.497 1.00 71.11 H new ATOM 0 HB2 LEU A 92 -5.364 14.195 2.526 1.00 61.32 H new ATOM 0 HB3 LEU A 92 -4.970 14.490 0.844 1.00 61.32 H new ATOM 0 HG LEU A 92 -4.145 11.897 2.122 1.00 72.41 H new ATOM 0 HD11 LEU A 92 -6.301 10.912 1.454 1.00 63.55 H new ATOM 0 HD12 LEU A 92 -6.505 12.160 2.706 1.00 63.55 H new ATOM 0 HD13 LEU A 92 -6.898 12.529 1.009 1.00 63.55 H new ATOM 0 HD21 LEU A 92 -4.458 11.070 -0.178 1.00 74.34 H new ATOM 0 HD22 LEU A 92 -4.982 12.693 -0.686 1.00 74.34 H new ATOM 0 HD23 LEU A 92 -3.316 12.433 -0.117 1.00 74.34 H new ATOM 1426 N VAL A 93 -3.638 16.665 2.982 1.00 75.44 N ATOM 1427 CA VAL A 93 -3.601 18.121 2.949 1.00 0.44 C ATOM 1428 C VAL A 93 -2.187 18.640 3.180 1.00 44.21 C ATOM 1429 O VAL A 93 -1.789 19.660 2.616 1.00 3.35 O ATOM 1430 CB VAL A 93 -4.539 18.731 4.008 1.00 14.41 C ATOM 1431 CG1 VAL A 93 -4.003 18.475 5.408 1.00 4.51 C ATOM 1432 CG2 VAL A 93 -4.722 20.221 3.761 1.00 72.41 C ATOM 0 H VAL A 93 -4.045 16.273 3.831 1.00 75.44 H new ATOM 0 HA VAL A 93 -3.939 18.423 1.958 1.00 0.44 H new ATOM 0 HB VAL A 93 -5.514 18.250 3.926 1.00 14.41 H new ATOM 0 HG11 VAL A 93 -4.679 18.913 6.142 1.00 4.51 H new ATOM 0 HG12 VAL A 93 -3.929 17.401 5.579 1.00 4.51 H new ATOM 0 HG13 VAL A 93 -3.016 18.927 5.508 1.00 4.51 H new ATOM 0 HG21 VAL A 93 -5.387 20.636 4.518 1.00 72.41 H new ATOM 0 HG22 VAL A 93 -3.755 20.720 3.815 1.00 72.41 H new ATOM 0 HG23 VAL A 93 -5.155 20.375 2.773 1.00 72.41 H new ATOM 1442 N SER A 94 -1.430 17.932 4.012 1.00 3.32 N ATOM 1443 CA SER A 94 -0.060 18.324 4.320 1.00 73.12 C ATOM 1444 C SER A 94 0.874 17.991 3.160 1.00 63.12 C ATOM 1445 O SER A 94 2.013 18.454 3.114 1.00 63.33 O ATOM 1446 CB SER A 94 0.419 17.622 5.593 1.00 15.31 C ATOM 1447 OG SER A 94 -0.041 18.297 6.751 1.00 51.14 O ATOM 0 H SER A 94 -1.742 17.084 4.485 1.00 3.32 H new ATOM 0 HA SER A 94 -0.043 19.402 4.479 1.00 73.12 H new ATOM 0 HB2 SER A 94 0.060 16.593 5.602 1.00 15.31 H new ATOM 0 HB3 SER A 94 1.508 17.580 5.601 1.00 15.31 H new ATOM 0 HG SER A 94 -0.855 17.863 7.081 1.00 51.14 H new ATOM 1453 N SER A 95 0.383 17.184 2.226 1.00 13.43 N ATOM 1454 CA SER A 95 1.173 16.785 1.067 1.00 44.40 C ATOM 1455 C SER A 95 0.647 17.447 -0.204 1.00 23.43 C ATOM 1456 O SER A 95 1.230 17.306 -1.277 1.00 43.35 O ATOM 1457 CB SER A 95 1.153 15.264 0.908 1.00 73.11 C ATOM 1458 OG SER A 95 1.730 14.872 -0.325 1.00 13.52 O ATOM 0 H SER A 95 -0.559 16.793 2.249 1.00 13.43 H new ATOM 0 HA SER A 95 2.200 17.113 1.229 1.00 44.40 H new ATOM 0 HB2 SER A 95 1.698 14.802 1.731 1.00 73.11 H new ATOM 0 HB3 SER A 95 0.126 14.903 0.963 1.00 73.11 H new ATOM 0 HG SER A 95 2.003 15.669 -0.826 1.00 13.52 H new ATOM 1464 N GLY A 96 -0.460 18.171 -0.072 1.00 34.40 N ATOM 1465 CA GLY A 96 -1.047 18.844 -1.216 1.00 33.51 C ATOM 1466 C GLY A 96 -1.940 17.929 -2.031 1.00 1.40 C ATOM 1467 O GLY A 96 -2.564 18.363 -3.000 1.00 35.03 O ATOM 0 H GLY A 96 -0.961 18.304 0.807 1.00 34.40 H new ATOM 0 HA2 GLY A 96 -1.627 19.700 -0.872 1.00 33.51 H new ATOM 0 HA3 GLY A 96 -0.252 19.232 -1.853 1.00 33.51 H new ATOM 1471 N SER A 97 -2.001 16.661 -1.639 1.00 53.51 N ATOM 1472 CA SER A 97 -2.819 15.681 -2.345 1.00 5.21 C ATOM 1473 C SER A 97 -4.275 16.133 -2.406 1.00 4.32 C ATOM 1474 O SER A 97 -5.033 15.708 -3.277 1.00 73.01 O ATOM 1475 CB SER A 97 -2.725 14.317 -1.658 1.00 14.23 C ATOM 1476 OG SER A 97 -1.375 13.916 -1.504 1.00 73.40 O ATOM 0 H SER A 97 -1.494 16.288 -0.837 1.00 53.51 H new ATOM 0 HA SER A 97 -2.440 15.594 -3.363 1.00 5.21 H new ATOM 0 HB2 SER A 97 -3.207 14.364 -0.682 1.00 14.23 H new ATOM 0 HB3 SER A 97 -3.264 13.573 -2.244 1.00 14.23 H new ATOM 0 HG SER A 97 -1.342 13.042 -1.061 1.00 73.40 H new ATOM 1482 N VAL A 98 -4.658 17.000 -1.474 1.00 32.12 N ATOM 1483 CA VAL A 98 -6.022 17.512 -1.421 1.00 13.15 C ATOM 1484 C VAL A 98 -6.035 19.026 -1.242 1.00 42.03 C ATOM 1485 O VAL A 98 -5.474 19.552 -0.281 1.00 53.10 O ATOM 1486 CB VAL A 98 -6.822 16.864 -0.275 1.00 61.13 C ATOM 1487 CG1 VAL A 98 -6.965 15.367 -0.503 1.00 31.15 C ATOM 1488 CG2 VAL A 98 -6.156 17.146 1.064 1.00 50.24 C ATOM 0 H VAL A 98 -4.043 17.362 -0.746 1.00 32.12 H new ATOM 0 HA VAL A 98 -6.492 17.257 -2.371 1.00 13.15 H new ATOM 0 HB VAL A 98 -7.820 17.302 -0.259 1.00 61.13 H new ATOM 0 HG11 VAL A 98 -7.533 14.927 0.317 1.00 31.15 H new ATOM 0 HG12 VAL A 98 -7.488 15.190 -1.443 1.00 31.15 H new ATOM 0 HG13 VAL A 98 -5.977 14.910 -0.546 1.00 31.15 H new ATOM 0 HG21 VAL A 98 -6.734 16.681 1.863 1.00 50.24 H new ATOM 0 HG22 VAL A 98 -5.146 16.737 1.061 1.00 50.24 H new ATOM 0 HG23 VAL A 98 -6.111 18.223 1.228 1.00 50.24 H new ATOM 1498 N ASN A 99 -6.679 19.721 -2.174 1.00 24.35 N ATOM 1499 CA ASN A 99 -6.765 21.177 -2.119 1.00 71.14 C ATOM 1500 C ASN A 99 -8.201 21.645 -2.335 1.00 43.04 C ATOM 1501 O ASN A 99 -9.123 20.836 -2.413 1.00 21.33 O ATOM 1502 CB ASN A 99 -5.848 21.802 -3.171 1.00 55.34 C ATOM 1503 CG ASN A 99 -5.152 20.760 -4.025 1.00 73.14 C ATOM 1504 OD1 ASN A 99 -5.831 20.301 -5.071 1.00 51.43 O flip ATOM 1505 ND2 ASN A 99 -4.017 20.371 -3.747 1.00 21.54 N flip ATOM 0 H ASN A 99 -7.149 19.301 -2.976 1.00 24.35 H new ATOM 0 HA ASN A 99 -6.442 21.499 -1.129 1.00 71.14 H new ATOM 0 HB2 ASN A 99 -6.432 22.462 -3.812 1.00 55.34 H new ATOM 0 HB3 ASN A 99 -5.100 22.420 -2.675 1.00 55.34 H new ATOM 0 HD21 ASN A 99 -3.533 20.751 -2.934 1.00 21.54 H new ATOM 0 HD22 ASN A 99 -3.561 19.669 -4.330 1.00 21.54 H new ATOM 1512 N ASN A 100 -8.380 22.958 -2.432 1.00 64.50 N ATOM 1513 CA ASN A 100 -9.703 23.536 -2.638 1.00 13.20 C ATOM 1514 C ASN A 100 -10.034 23.618 -4.126 1.00 53.04 C ATOM 1515 O ASN A 100 -10.186 24.706 -4.679 1.00 31.34 O ATOM 1516 CB ASN A 100 -9.779 24.929 -2.011 1.00 64.42 C ATOM 1517 CG ASN A 100 -9.054 25.004 -0.681 1.00 22.41 C ATOM 1518 OD1 ASN A 100 -7.825 24.955 -0.626 1.00 1.51 O ATOM 1519 ND2 ASN A 100 -9.815 25.122 0.401 1.00 13.12 N ATOM 0 H ASN A 100 -7.626 23.642 -2.371 1.00 64.50 H new ATOM 0 HA ASN A 100 -10.434 22.888 -2.155 1.00 13.20 H new ATOM 0 HB2 ASN A 100 -9.349 25.658 -2.698 1.00 64.42 H new ATOM 0 HB3 ASN A 100 -10.824 25.204 -1.868 1.00 64.42 H new ATOM 0 HD21 ASN A 100 -9.384 25.176 1.324 1.00 13.12 H new ATOM 0 HD22 ASN A 100 -10.830 25.159 0.309 1.00 13.12 H new ATOM 1526 N ASN A 101 -10.144 22.459 -4.767 1.00 71.51 N ATOM 1527 CA ASN A 101 -10.457 22.399 -6.190 1.00 72.52 C ATOM 1528 C ASN A 101 -10.533 20.952 -6.670 1.00 30.51 C ATOM 1529 O ASN A 101 -11.317 20.623 -7.559 1.00 21.55 O ATOM 1530 CB ASN A 101 -9.405 23.160 -6.997 1.00 0.42 C ATOM 1531 CG ASN A 101 -10.011 24.272 -7.833 1.00 54.25 C ATOM 1532 OD1 ASN A 101 -11.126 24.145 -8.338 1.00 30.24 O ATOM 1533 ND2 ASN A 101 -9.275 25.366 -7.985 1.00 61.04 N ATOM 0 H ASN A 101 -10.021 21.549 -4.324 1.00 71.51 H new ATOM 0 HA ASN A 101 -11.430 22.866 -6.342 1.00 72.52 H new ATOM 0 HB2 ASN A 101 -8.665 23.582 -6.317 1.00 0.42 H new ATOM 0 HB3 ASN A 101 -8.878 22.464 -7.650 1.00 0.42 H new ATOM 0 HD21 ASN A 101 -9.629 26.146 -8.539 1.00 61.04 H new ATOM 0 HD22 ASN A 101 -8.356 25.427 -7.548 1.00 61.04 H new ATOM 1540 N ASN A 102 -9.713 20.093 -6.073 1.00 54.33 N ATOM 1541 CA ASN A 102 -9.686 18.681 -6.439 1.00 13.15 C ATOM 1542 C ASN A 102 -10.170 17.810 -5.283 1.00 11.21 C ATOM 1543 O ASN A 102 -10.260 16.589 -5.408 1.00 43.22 O ATOM 1544 CB ASN A 102 -8.273 18.266 -6.850 1.00 71.51 C ATOM 1545 CG ASN A 102 -7.690 17.211 -5.927 1.00 2.44 C ATOM 1546 OD1 ASN A 102 -7.871 16.013 -6.144 1.00 75.22 O ATOM 1547 ND2 ASN A 102 -6.987 17.655 -4.892 1.00 72.43 N ATOM 0 H ASN A 102 -9.059 20.350 -5.334 1.00 54.33 H new ATOM 0 HA ASN A 102 -10.359 18.537 -7.284 1.00 13.15 H new ATOM 0 HB2 ASN A 102 -8.292 17.883 -7.870 1.00 71.51 H new ATOM 0 HB3 ASN A 102 -7.625 19.143 -6.851 1.00 71.51 H new ATOM 0 HD21 ASN A 102 -6.571 16.993 -4.237 1.00 72.43 H new ATOM 0 HD22 ASN A 102 -6.863 18.658 -4.752 1.00 72.43 H new ATOM 1554 N ALA A 103 -10.482 18.447 -4.159 1.00 43.41 N ATOM 1555 CA ALA A 103 -10.959 17.732 -2.982 1.00 40.53 C ATOM 1556 C ALA A 103 -12.109 16.797 -3.338 1.00 22.21 C ATOM 1557 O ALA A 103 -12.200 15.684 -2.819 1.00 15.41 O ATOM 1558 CB ALA A 103 -11.389 18.717 -1.905 1.00 51.12 C ATOM 0 H ALA A 103 -10.413 19.458 -4.039 1.00 43.41 H new ATOM 0 HA ALA A 103 -10.139 17.126 -2.597 1.00 40.53 H new ATOM 0 HB1 ALA A 103 -11.743 18.169 -1.032 1.00 51.12 H new ATOM 0 HB2 ALA A 103 -10.541 19.341 -1.623 1.00 51.12 H new ATOM 0 HB3 ALA A 103 -12.192 19.347 -2.288 1.00 51.12 H new ATOM 1564 N LYS A 104 -12.987 17.256 -4.224 1.00 72.52 N ATOM 1565 CA LYS A 104 -14.133 16.460 -4.650 1.00 64.34 C ATOM 1566 C LYS A 104 -13.687 15.285 -5.514 1.00 70.21 C ATOM 1567 O LYS A 104 -14.247 14.192 -5.427 1.00 64.42 O ATOM 1568 CB LYS A 104 -15.124 17.330 -5.424 1.00 1.32 C ATOM 1569 CG LYS A 104 -14.477 18.164 -6.517 1.00 61.33 C ATOM 1570 CD LYS A 104 -15.518 18.822 -7.407 1.00 13.54 C ATOM 1571 CE LYS A 104 -16.205 19.980 -6.700 1.00 74.43 C ATOM 1572 NZ LYS A 104 -16.544 21.082 -7.642 1.00 23.55 N ATOM 0 H LYS A 104 -12.927 18.176 -4.661 1.00 72.52 H new ATOM 0 HA LYS A 104 -14.623 16.067 -3.759 1.00 64.34 H new ATOM 0 HB2 LYS A 104 -15.885 16.690 -5.870 1.00 1.32 H new ATOM 0 HB3 LYS A 104 -15.634 17.994 -4.726 1.00 1.32 H new ATOM 0 HG2 LYS A 104 -13.846 18.930 -6.066 1.00 61.33 H new ATOM 0 HG3 LYS A 104 -13.827 17.532 -7.122 1.00 61.33 H new ATOM 0 HD2 LYS A 104 -15.043 19.182 -8.319 1.00 13.54 H new ATOM 0 HD3 LYS A 104 -16.262 18.084 -7.705 1.00 13.54 H new ATOM 0 HE2 LYS A 104 -17.114 19.623 -6.217 1.00 74.43 H new ATOM 0 HE3 LYS A 104 -15.555 20.362 -5.913 1.00 74.43 H new ATOM 0 HZ1 LYS A 104 -17.011 21.852 -7.122 1.00 23.55 H new ATOM 0 HZ2 LYS A 104 -15.674 21.441 -8.084 1.00 23.55 H new ATOM 0 HZ3 LYS A 104 -17.185 20.724 -8.379 1.00 23.55 H new ATOM 1586 N GLN A 105 -12.678 15.517 -6.347 1.00 64.33 N ATOM 1587 CA GLN A 105 -12.158 14.476 -7.226 1.00 34.22 C ATOM 1588 C GLN A 105 -11.393 13.424 -6.431 1.00 61.41 C ATOM 1589 O GLN A 105 -11.615 12.224 -6.594 1.00 45.23 O ATOM 1590 CB GLN A 105 -11.249 15.088 -8.293 1.00 30.32 C ATOM 1591 CG GLN A 105 -11.587 14.645 -9.707 1.00 34.50 C ATOM 1592 CD GLN A 105 -12.111 15.779 -10.565 1.00 71.22 C ATOM 1593 OE1 GLN A 105 -11.458 16.205 -11.518 1.00 61.13 O ATOM 1594 NE2 GLN A 105 -13.296 16.276 -10.230 1.00 24.01 N ATOM 0 H GLN A 105 -12.204 16.416 -6.432 1.00 64.33 H new ATOM 0 HA GLN A 105 -13.004 13.991 -7.714 1.00 34.22 H new ATOM 0 HB2 GLN A 105 -11.316 16.174 -8.236 1.00 30.32 H new ATOM 0 HB3 GLN A 105 -10.215 14.820 -8.075 1.00 30.32 H new ATOM 0 HG2 GLN A 105 -10.697 14.223 -10.174 1.00 34.50 H new ATOM 0 HG3 GLN A 105 -12.333 13.851 -9.666 1.00 34.50 H new ATOM 0 HE21 GLN A 105 -13.803 15.892 -9.432 1.00 24.01 H new ATOM 0 HE22 GLN A 105 -13.699 17.041 -10.770 1.00 24.01 H new ATOM 1603 N VAL A 106 -10.490 13.881 -5.568 1.00 13.23 N ATOM 1604 CA VAL A 106 -9.691 12.979 -4.747 1.00 31.04 C ATOM 1605 C VAL A 106 -10.567 12.216 -3.760 1.00 70.43 C ATOM 1606 O VAL A 106 -10.340 11.035 -3.498 1.00 63.51 O ATOM 1607 CB VAL A 106 -8.605 13.744 -3.968 1.00 61.54 C ATOM 1608 CG1 VAL A 106 -9.231 14.818 -3.092 1.00 10.31 C ATOM 1609 CG2 VAL A 106 -7.772 12.782 -3.133 1.00 20.24 C ATOM 0 H VAL A 106 -10.294 14.871 -5.420 1.00 13.23 H new ATOM 0 HA VAL A 106 -9.212 12.273 -5.425 1.00 31.04 H new ATOM 0 HB VAL A 106 -7.945 14.233 -4.685 1.00 61.54 H new ATOM 0 HG11 VAL A 106 -8.448 15.347 -2.550 1.00 10.31 H new ATOM 0 HG12 VAL A 106 -9.780 15.523 -3.717 1.00 10.31 H new ATOM 0 HG13 VAL A 106 -9.915 14.355 -2.381 1.00 10.31 H new ATOM 0 HG21 VAL A 106 -7.009 13.339 -2.589 1.00 20.24 H new ATOM 0 HG22 VAL A 106 -8.417 12.263 -2.424 1.00 20.24 H new ATOM 0 HG23 VAL A 106 -7.292 12.054 -3.787 1.00 20.24 H new ATOM 1619 N ALA A 107 -11.569 12.898 -3.215 1.00 14.34 N ATOM 1620 CA ALA A 107 -12.481 12.283 -2.259 1.00 33.02 C ATOM 1621 C ALA A 107 -13.300 11.175 -2.915 1.00 21.42 C ATOM 1622 O ALA A 107 -13.588 10.153 -2.293 1.00 31.14 O ATOM 1623 CB ALA A 107 -13.400 13.334 -1.655 1.00 20.12 C ATOM 0 H ALA A 107 -11.770 13.877 -3.419 1.00 14.34 H new ATOM 0 HA ALA A 107 -11.886 11.836 -1.463 1.00 33.02 H new ATOM 0 HB1 ALA A 107 -14.076 12.860 -0.943 1.00 20.12 H new ATOM 0 HB2 ALA A 107 -12.803 14.088 -1.142 1.00 20.12 H new ATOM 0 HB3 ALA A 107 -13.981 13.808 -2.446 1.00 20.12 H new ATOM 1629 N SER A 108 -13.671 11.387 -4.173 1.00 74.13 N ATOM 1630 CA SER A 108 -14.461 10.408 -4.911 1.00 74.12 C ATOM 1631 C SER A 108 -13.626 9.174 -5.242 1.00 32.24 C ATOM 1632 O SER A 108 -14.080 8.041 -5.081 1.00 15.31 O ATOM 1633 CB SER A 108 -15.007 11.028 -6.198 1.00 1.44 C ATOM 1634 OG SER A 108 -14.549 10.322 -7.339 1.00 43.30 O ATOM 0 H SER A 108 -13.438 12.227 -4.703 1.00 74.13 H new ATOM 0 HA SER A 108 -15.296 10.102 -4.281 1.00 74.12 H new ATOM 0 HB2 SER A 108 -16.097 11.020 -6.175 1.00 1.44 H new ATOM 0 HB3 SER A 108 -14.697 12.071 -6.263 1.00 1.44 H new ATOM 0 HG SER A 108 -14.913 10.737 -8.149 1.00 43.30 H new ATOM 1640 N THR A 109 -12.401 9.403 -5.704 1.00 10.34 N ATOM 1641 CA THR A 109 -11.502 8.312 -6.059 1.00 50.42 C ATOM 1642 C THR A 109 -10.990 7.596 -4.815 1.00 61.42 C ATOM 1643 O THR A 109 -10.813 6.376 -4.816 1.00 12.52 O ATOM 1644 CB THR A 109 -10.300 8.819 -6.878 1.00 72.54 C ATOM 1645 OG1 THR A 109 -10.684 9.953 -7.663 1.00 72.30 O ATOM 1646 CG2 THR A 109 -9.765 7.723 -7.788 1.00 3.35 C ATOM 0 H THR A 109 -12.009 10.334 -5.841 1.00 10.34 H new ATOM 0 HA THR A 109 -12.077 7.613 -6.667 1.00 50.42 H new ATOM 0 HB THR A 109 -9.512 9.110 -6.183 1.00 72.54 H new ATOM 0 HG1 THR A 109 -10.672 10.757 -7.103 1.00 72.30 H new ATOM 0 HG21 THR A 109 -8.917 8.104 -8.357 1.00 3.35 H new ATOM 0 HG22 THR A 109 -9.445 6.873 -7.185 1.00 3.35 H new ATOM 0 HG23 THR A 109 -10.549 7.406 -8.475 1.00 3.35 H new ATOM 1654 N LEU A 110 -10.753 8.359 -3.753 1.00 53.21 N ATOM 1655 CA LEU A 110 -10.261 7.796 -2.501 1.00 33.14 C ATOM 1656 C LEU A 110 -11.206 6.717 -1.981 1.00 20.43 C ATOM 1657 O LEU A 110 -10.822 5.555 -1.841 1.00 5.02 O ATOM 1658 CB LEU A 110 -10.100 8.898 -1.452 1.00 74.22 C ATOM 1659 CG LEU A 110 -9.583 8.452 -0.084 1.00 15.53 C ATOM 1660 CD1 LEU A 110 -8.137 8.881 0.106 1.00 32.21 C ATOM 1661 CD2 LEU A 110 -10.458 9.015 1.026 1.00 31.33 C ATOM 0 H LEU A 110 -10.894 9.369 -3.734 1.00 53.21 H new ATOM 0 HA LEU A 110 -9.289 7.341 -2.693 1.00 33.14 H new ATOM 0 HB2 LEU A 110 -9.419 9.652 -1.847 1.00 74.22 H new ATOM 0 HB3 LEU A 110 -11.066 9.383 -1.313 1.00 74.22 H new ATOM 0 HG LEU A 110 -9.627 7.364 -0.038 1.00 15.53 H new ATOM 0 HD11 LEU A 110 -7.786 8.555 1.085 1.00 32.21 H new ATOM 0 HD12 LEU A 110 -7.519 8.429 -0.670 1.00 32.21 H new ATOM 0 HD13 LEU A 110 -8.068 9.967 0.039 1.00 32.21 H new ATOM 0 HD21 LEU A 110 -10.075 8.687 1.993 1.00 31.33 H new ATOM 0 HD22 LEU A 110 -10.447 10.104 0.981 1.00 31.33 H new ATOM 0 HD23 LEU A 110 -11.480 8.657 0.900 1.00 31.33 H new ATOM 1673 N SER A 111 -12.445 7.108 -1.698 1.00 55.04 N ATOM 1674 CA SER A 111 -13.444 6.175 -1.192 1.00 35.33 C ATOM 1675 C SER A 111 -13.749 5.092 -2.223 1.00 4.15 C ATOM 1676 O SER A 111 -14.055 3.954 -1.872 1.00 25.11 O ATOM 1677 CB SER A 111 -14.728 6.920 -0.823 1.00 0.02 C ATOM 1678 OG SER A 111 -14.456 8.007 0.044 1.00 21.22 O ATOM 0 H SER A 111 -12.780 8.065 -1.811 1.00 55.04 H new ATOM 0 HA SER A 111 -13.040 5.698 -0.299 1.00 35.33 H new ATOM 0 HB2 SER A 111 -15.213 7.285 -1.728 1.00 0.02 H new ATOM 0 HB3 SER A 111 -15.425 6.233 -0.343 1.00 0.02 H new ATOM 0 HG SER A 111 -14.091 8.755 -0.474 1.00 21.22 H new ATOM 1684 N GLU A 112 -13.663 5.459 -3.498 1.00 52.24 N ATOM 1685 CA GLU A 112 -13.930 4.520 -4.582 1.00 34.51 C ATOM 1686 C GLU A 112 -12.935 3.362 -4.557 1.00 25.24 C ATOM 1687 O GLU A 112 -13.325 2.196 -4.537 1.00 60.04 O ATOM 1688 CB GLU A 112 -13.864 5.234 -5.933 1.00 52.53 C ATOM 1689 CG GLU A 112 -13.738 4.288 -7.116 1.00 12.04 C ATOM 1690 CD GLU A 112 -13.727 5.015 -8.446 1.00 3.43 C ATOM 1691 OE1 GLU A 112 -14.809 5.453 -8.892 1.00 31.02 O ATOM 1692 OE2 GLU A 112 -12.638 5.147 -9.041 1.00 42.43 O ATOM 0 H GLU A 112 -13.411 6.398 -3.805 1.00 52.24 H new ATOM 0 HA GLU A 112 -14.933 4.118 -4.440 1.00 34.51 H new ATOM 0 HB2 GLU A 112 -14.761 5.841 -6.058 1.00 52.53 H new ATOM 0 HB3 GLU A 112 -13.014 5.917 -5.932 1.00 52.53 H new ATOM 0 HG2 GLU A 112 -12.821 3.708 -7.016 1.00 12.04 H new ATOM 0 HG3 GLU A 112 -14.567 3.580 -7.100 1.00 12.04 H new ATOM 1699 N ASN A 113 -11.649 3.695 -4.558 1.00 4.52 N ATOM 1700 CA ASN A 113 -10.597 2.685 -4.537 1.00 33.43 C ATOM 1701 C ASN A 113 -10.477 2.054 -3.153 1.00 25.44 C ATOM 1702 O ASN A 113 -10.219 0.858 -3.024 1.00 74.15 O ATOM 1703 CB ASN A 113 -9.259 3.303 -4.945 1.00 12.34 C ATOM 1704 CG ASN A 113 -9.204 3.635 -6.425 1.00 25.11 C ATOM 1705 OD1 ASN A 113 -8.782 2.816 -7.241 1.00 42.22 O ATOM 1706 ND2 ASN A 113 -9.631 4.843 -6.774 1.00 52.54 N ATOM 0 H ASN A 113 -11.310 4.657 -4.573 1.00 4.52 H new ATOM 0 HA ASN A 113 -10.862 1.905 -5.251 1.00 33.43 H new ATOM 0 HB2 ASN A 113 -9.089 4.210 -4.365 1.00 12.34 H new ATOM 0 HB3 ASN A 113 -8.453 2.612 -4.700 1.00 12.34 H new ATOM 0 HD21 ASN A 113 -9.618 5.125 -7.754 1.00 52.54 H new ATOM 0 HD22 ASN A 113 -9.972 5.489 -6.062 1.00 52.54 H new ATOM 1713 N LEU A 114 -10.667 2.868 -2.119 1.00 12.33 N ATOM 1714 CA LEU A 114 -10.580 2.390 -0.743 1.00 12.43 C ATOM 1715 C LEU A 114 -11.675 1.369 -0.452 1.00 33.13 C ATOM 1716 O LEU A 114 -11.416 0.314 0.128 1.00 73.23 O ATOM 1717 CB LEU A 114 -10.690 3.564 0.232 1.00 74.12 C ATOM 1718 CG LEU A 114 -10.937 3.198 1.696 1.00 63.44 C ATOM 1719 CD1 LEU A 114 -10.270 4.208 2.618 1.00 54.05 C ATOM 1720 CD2 LEU A 114 -12.430 3.117 1.981 1.00 44.13 C ATOM 0 H LEU A 114 -10.882 3.861 -2.208 1.00 12.33 H new ATOM 0 HA LEU A 114 -9.612 1.905 -0.612 1.00 12.43 H new ATOM 0 HB2 LEU A 114 -9.770 4.146 0.174 1.00 74.12 H new ATOM 0 HB3 LEU A 114 -11.500 4.213 -0.101 1.00 74.12 H new ATOM 0 HG LEU A 114 -10.498 2.218 1.885 1.00 63.44 H new ATOM 0 HD11 LEU A 114 -10.456 3.932 3.656 1.00 54.05 H new ATOM 0 HD12 LEU A 114 -9.196 4.217 2.432 1.00 54.05 H new ATOM 0 HD13 LEU A 114 -10.679 5.200 2.428 1.00 54.05 H new ATOM 0 HD21 LEU A 114 -12.587 2.855 3.027 1.00 44.13 H new ATOM 0 HD22 LEU A 114 -12.893 4.082 1.775 1.00 44.13 H new ATOM 0 HD23 LEU A 114 -12.881 2.355 1.345 1.00 44.13 H new ATOM 1732 N VAL A 115 -12.899 1.688 -0.860 1.00 34.44 N ATOM 1733 CA VAL A 115 -14.033 0.797 -0.645 1.00 13.34 C ATOM 1734 C VAL A 115 -13.897 -0.474 -1.476 1.00 34.33 C ATOM 1735 O VAL A 115 -14.213 -1.569 -1.010 1.00 61.11 O ATOM 1736 CB VAL A 115 -15.365 1.487 -0.997 1.00 52.34 C ATOM 1737 CG1 VAL A 115 -16.475 0.459 -1.152 1.00 44.33 C ATOM 1738 CG2 VAL A 115 -15.725 2.518 0.060 1.00 23.34 C ATOM 0 H VAL A 115 -13.131 2.557 -1.341 1.00 34.44 H new ATOM 0 HA VAL A 115 -14.036 0.538 0.414 1.00 13.34 H new ATOM 0 HB VAL A 115 -15.246 2.003 -1.950 1.00 52.34 H new ATOM 0 HG11 VAL A 115 -17.408 0.965 -1.400 1.00 44.33 H new ATOM 0 HG12 VAL A 115 -16.217 -0.238 -1.949 1.00 44.33 H new ATOM 0 HG13 VAL A 115 -16.597 -0.088 -0.217 1.00 44.33 H new ATOM 0 HG21 VAL A 115 -16.668 2.996 -0.204 1.00 23.34 H new ATOM 0 HG22 VAL A 115 -15.826 2.027 1.028 1.00 23.34 H new ATOM 0 HG23 VAL A 115 -14.940 3.272 0.115 1.00 23.34 H new ATOM 1748 N ARG A 116 -13.426 -0.322 -2.709 1.00 41.23 N ATOM 1749 CA ARG A 116 -13.249 -1.458 -3.606 1.00 22.22 C ATOM 1750 C ARG A 116 -12.305 -2.489 -2.995 1.00 55.35 C ATOM 1751 O ARG A 116 -12.609 -3.681 -2.965 1.00 13.20 O ATOM 1752 CB ARG A 116 -12.705 -0.988 -4.956 1.00 53.12 C ATOM 1753 CG ARG A 116 -12.235 -2.124 -5.851 1.00 13.41 C ATOM 1754 CD ARG A 116 -11.667 -1.602 -7.162 1.00 21.22 C ATOM 1755 NE ARG A 116 -11.377 -2.681 -8.102 1.00 25.51 N ATOM 1756 CZ ARG A 116 -12.305 -3.286 -8.836 1.00 44.53 C ATOM 1757 NH1 ARG A 116 -13.574 -2.918 -8.740 1.00 3.32 N ATOM 1758 NH2 ARG A 116 -11.961 -4.260 -9.668 1.00 12.22 N ATOM 0 H ARG A 116 -13.160 0.577 -3.110 1.00 41.23 H new ATOM 0 HA ARG A 116 -14.222 -1.926 -3.758 1.00 22.22 H new ATOM 0 HB2 ARG A 116 -13.481 -0.425 -5.475 1.00 53.12 H new ATOM 0 HB3 ARG A 116 -11.874 -0.303 -4.785 1.00 53.12 H new ATOM 0 HG2 ARG A 116 -11.476 -2.708 -5.331 1.00 13.41 H new ATOM 0 HG3 ARG A 116 -13.069 -2.796 -6.056 1.00 13.41 H new ATOM 0 HD2 ARG A 116 -12.377 -0.909 -7.614 1.00 21.22 H new ATOM 0 HD3 ARG A 116 -10.755 -1.040 -6.963 1.00 21.22 H new ATOM 0 HE ARG A 116 -10.409 -2.987 -8.201 1.00 25.51 H new ATOM 0 HH11 ARG A 116 -13.841 -2.169 -8.102 1.00 3.32 H new ATOM 0 HH12 ARG A 116 -14.284 -3.384 -9.305 1.00 3.32 H new ATOM 0 HH21 ARG A 116 -10.984 -4.544 -9.744 1.00 12.22 H new ATOM 0 HH22 ARG A 116 -12.673 -4.725 -10.232 1.00 12.22 H new ATOM 1772 N GLU A 117 -11.158 -2.023 -2.512 1.00 5.50 N ATOM 1773 CA GLU A 117 -10.170 -2.905 -1.905 1.00 63.34 C ATOM 1774 C GLU A 117 -10.619 -3.352 -0.517 1.00 32.30 C ATOM 1775 O GLU A 117 -10.463 -4.516 -0.147 1.00 44.21 O ATOM 1776 CB GLU A 117 -8.813 -2.203 -1.812 1.00 1.25 C ATOM 1777 CG GLU A 117 -7.658 -3.036 -2.339 1.00 75.43 C ATOM 1778 CD GLU A 117 -7.916 -3.577 -3.732 1.00 14.23 C ATOM 1779 OE1 GLU A 117 -8.406 -2.807 -4.585 1.00 45.42 O ATOM 1780 OE2 GLU A 117 -7.631 -4.769 -3.970 1.00 64.43 O ATOM 0 H GLU A 117 -10.890 -1.039 -2.530 1.00 5.50 H new ATOM 0 HA GLU A 117 -10.072 -3.787 -2.538 1.00 63.34 H new ATOM 0 HB2 GLU A 117 -8.859 -1.267 -2.369 1.00 1.25 H new ATOM 0 HB3 GLU A 117 -8.618 -1.945 -0.771 1.00 1.25 H new ATOM 0 HG2 GLU A 117 -6.753 -2.429 -2.351 1.00 75.43 H new ATOM 0 HG3 GLU A 117 -7.475 -3.868 -1.659 1.00 75.43 H new ATOM 1787 N MET A 118 -11.178 -2.419 0.247 1.00 71.22 N ATOM 1788 CA MET A 118 -11.651 -2.716 1.593 1.00 63.42 C ATOM 1789 C MET A 118 -12.615 -3.898 1.583 1.00 42.12 C ATOM 1790 O MET A 118 -12.508 -4.806 2.407 1.00 61.34 O ATOM 1791 CB MET A 118 -12.336 -1.489 2.199 1.00 33.22 C ATOM 1792 CG MET A 118 -11.379 -0.546 2.908 1.00 40.12 C ATOM 1793 SD MET A 118 -11.748 -0.371 4.664 1.00 73.33 S ATOM 1794 CE MET A 118 -12.903 0.997 4.633 1.00 43.14 C ATOM 0 H MET A 118 -11.314 -1.451 -0.044 1.00 71.22 H new ATOM 0 HA MET A 118 -10.788 -2.980 2.204 1.00 63.42 H new ATOM 0 HB2 MET A 118 -12.851 -0.943 1.408 1.00 33.22 H new ATOM 0 HB3 MET A 118 -13.097 -1.820 2.906 1.00 33.22 H new ATOM 0 HG2 MET A 118 -10.360 -0.913 2.790 1.00 40.12 H new ATOM 0 HG3 MET A 118 -11.422 0.434 2.432 1.00 40.12 H new ATOM 0 HE1 MET A 118 -13.569 0.930 5.493 1.00 43.14 H new ATOM 0 HE2 MET A 118 -12.354 1.938 4.671 1.00 43.14 H new ATOM 0 HE3 MET A 118 -13.490 0.957 3.716 1.00 43.14 H new ATOM 1804 N ALA A 119 -13.556 -3.880 0.644 1.00 23.41 N ATOM 1805 CA ALA A 119 -14.537 -4.951 0.527 1.00 41.44 C ATOM 1806 C ALA A 119 -13.884 -6.243 0.045 1.00 11.10 C ATOM 1807 O ALA A 119 -14.228 -7.332 0.503 1.00 4.41 O ATOM 1808 CB ALA A 119 -15.657 -4.539 -0.418 1.00 61.10 C ATOM 0 H ALA A 119 -13.659 -3.136 -0.046 1.00 23.41 H new ATOM 0 HA ALA A 119 -14.959 -5.134 1.515 1.00 41.44 H new ATOM 0 HB1 ALA A 119 -16.383 -5.348 -0.496 1.00 61.10 H new ATOM 0 HB2 ALA A 119 -16.149 -3.646 -0.032 1.00 61.10 H new ATOM 0 HB3 ALA A 119 -15.242 -4.327 -1.403 1.00 61.10 H new ATOM 1814 N ASN A 120 -12.942 -6.113 -0.884 1.00 74.30 N ATOM 1815 CA ASN A 120 -12.242 -7.271 -1.428 1.00 54.31 C ATOM 1816 C ASN A 120 -11.472 -8.005 -0.336 1.00 72.42 C ATOM 1817 O ASN A 120 -11.264 -9.217 -0.412 1.00 50.02 O ATOM 1818 CB ASN A 120 -11.285 -6.838 -2.540 1.00 44.04 C ATOM 1819 CG ASN A 120 -12.010 -6.484 -3.823 1.00 12.52 C ATOM 1820 OD1 ASN A 120 -13.072 -7.032 -4.121 1.00 33.42 O ATOM 1821 ND2 ASN A 120 -11.440 -5.563 -4.591 1.00 55.45 N ATOM 0 H ASN A 120 -12.646 -5.219 -1.275 1.00 74.30 H new ATOM 0 HA ASN A 120 -12.986 -7.952 -1.842 1.00 54.31 H new ATOM 0 HB2 ASN A 120 -10.707 -5.977 -2.203 1.00 44.04 H new ATOM 0 HB3 ASN A 120 -10.575 -7.641 -2.737 1.00 44.04 H new ATOM 0 HD21 ASN A 120 -11.883 -5.284 -5.467 1.00 55.45 H new ATOM 0 HD22 ASN A 120 -10.559 -5.135 -4.305 1.00 55.45 H new ATOM 1828 N THR A 121 -11.049 -7.263 0.683 1.00 0.02 N ATOM 1829 CA THR A 121 -10.301 -7.842 1.792 1.00 71.14 C ATOM 1830 C THR A 121 -11.232 -8.259 2.925 1.00 55.45 C ATOM 1831 O THR A 121 -11.093 -9.346 3.486 1.00 52.30 O ATOM 1832 CB THR A 121 -9.254 -6.854 2.341 1.00 53.13 C ATOM 1833 OG1 THR A 121 -8.864 -5.934 1.315 1.00 32.42 O ATOM 1834 CG2 THR A 121 -8.030 -7.594 2.857 1.00 42.12 C ATOM 0 H THR A 121 -11.212 -6.259 0.763 1.00 0.02 H new ATOM 0 HA THR A 121 -9.790 -8.722 1.402 1.00 71.14 H new ATOM 0 HB THR A 121 -9.703 -6.306 3.169 1.00 53.13 H new ATOM 0 HG1 THR A 121 -9.580 -5.280 1.172 1.00 32.42 H new ATOM 0 HG21 THR A 121 -7.305 -6.876 3.239 1.00 42.12 H new ATOM 0 HG22 THR A 121 -8.326 -8.272 3.657 1.00 42.12 H new ATOM 0 HG23 THR A 121 -7.581 -8.165 2.045 1.00 42.12 H new ATOM 1842 N ALA A 122 -12.181 -7.390 3.256 1.00 43.23 N ATOM 1843 CA ALA A 122 -13.136 -7.671 4.320 1.00 23.15 C ATOM 1844 C ALA A 122 -13.890 -8.969 4.053 1.00 71.25 C ATOM 1845 O ALA A 122 -14.113 -9.766 4.965 1.00 14.21 O ATOM 1846 CB ALA A 122 -14.113 -6.513 4.471 1.00 65.10 C ATOM 0 H ALA A 122 -12.309 -6.485 2.802 1.00 43.23 H new ATOM 0 HA ALA A 122 -12.581 -7.789 5.251 1.00 23.15 H new ATOM 0 HB1 ALA A 122 -14.821 -6.736 5.269 1.00 65.10 H new ATOM 0 HB2 ALA A 122 -13.564 -5.604 4.716 1.00 65.10 H new ATOM 0 HB3 ALA A 122 -14.654 -6.369 3.536 1.00 65.10 H new ATOM 1852 N ARG A 123 -14.279 -9.175 2.799 1.00 64.41 N ATOM 1853 CA ARG A 123 -15.009 -10.377 2.415 1.00 52.14 C ATOM 1854 C ARG A 123 -14.235 -11.633 2.806 1.00 4.21 C ATOM 1855 O ARG A 123 -14.826 -12.669 3.108 1.00 32.04 O ATOM 1856 CB ARG A 123 -15.274 -10.378 0.908 1.00 44.31 C ATOM 1857 CG ARG A 123 -14.047 -10.711 0.074 1.00 32.44 C ATOM 1858 CD ARG A 123 -14.392 -10.825 -1.403 1.00 43.41 C ATOM 1859 NE ARG A 123 -14.458 -12.215 -1.845 1.00 60.15 N ATOM 1860 CZ ARG A 123 -13.385 -12.959 -2.091 1.00 63.14 C ATOM 1861 NH1 ARG A 123 -12.170 -12.450 -1.939 1.00 22.14 N ATOM 1862 NH2 ARG A 123 -13.526 -14.217 -2.490 1.00 4.13 N ATOM 0 H ARG A 123 -14.101 -8.526 2.033 1.00 64.41 H new ATOM 0 HA ARG A 123 -15.961 -10.378 2.946 1.00 52.14 H new ATOM 0 HB2 ARG A 123 -16.060 -11.100 0.686 1.00 44.31 H new ATOM 0 HB3 ARG A 123 -15.648 -9.398 0.613 1.00 44.31 H new ATOM 0 HG2 ARG A 123 -13.290 -9.939 0.214 1.00 32.44 H new ATOM 0 HG3 ARG A 123 -13.613 -11.649 0.421 1.00 32.44 H new ATOM 0 HD2 ARG A 123 -15.350 -10.340 -1.590 1.00 43.41 H new ATOM 0 HD3 ARG A 123 -13.645 -10.293 -1.992 1.00 43.41 H new ATOM 0 HE ARG A 123 -15.378 -12.638 -1.972 1.00 60.15 H new ATOM 0 HH11 ARG A 123 -12.057 -11.484 -1.632 1.00 22.14 H new ATOM 0 HH12 ARG A 123 -11.349 -13.025 -2.129 1.00 22.14 H new ATOM 0 HH21 ARG A 123 -14.458 -14.613 -2.608 1.00 4.13 H new ATOM 0 HH22 ARG A 123 -12.702 -14.788 -2.679 1.00 4.13 H new ATOM 1876 N ARG A 124 -12.910 -11.531 2.797 1.00 63.43 N ATOM 1877 CA ARG A 124 -12.055 -12.658 3.150 1.00 34.42 C ATOM 1878 C ARG A 124 -12.013 -12.856 4.663 1.00 71.14 C ATOM 1879 O ARG A 124 -11.602 -13.909 5.150 1.00 75.15 O ATOM 1880 CB ARG A 124 -10.639 -12.440 2.614 1.00 33.23 C ATOM 1881 CG ARG A 124 -10.603 -11.878 1.202 1.00 54.33 C ATOM 1882 CD ARG A 124 -9.197 -11.449 0.809 1.00 33.02 C ATOM 1883 NE ARG A 124 -9.141 -10.953 -0.563 1.00 53.33 N ATOM 1884 CZ ARG A 124 -8.089 -10.321 -1.073 1.00 54.41 C ATOM 1885 NH1 ARG A 124 -7.014 -10.109 -0.328 1.00 4.12 N ATOM 1886 NH2 ARG A 124 -8.113 -9.900 -2.331 1.00 61.13 N ATOM 0 H ARG A 124 -12.405 -10.680 2.549 1.00 63.43 H new ATOM 0 HA ARG A 124 -12.474 -13.555 2.695 1.00 34.42 H new ATOM 0 HB2 ARG A 124 -10.108 -11.760 3.280 1.00 33.23 H new ATOM 0 HB3 ARG A 124 -10.102 -13.389 2.632 1.00 33.23 H new ATOM 0 HG2 ARG A 124 -10.965 -12.630 0.501 1.00 54.33 H new ATOM 0 HG3 ARG A 124 -11.278 -11.025 1.131 1.00 54.33 H new ATOM 0 HD2 ARG A 124 -8.851 -10.671 1.490 1.00 33.02 H new ATOM 0 HD3 ARG A 124 -8.516 -12.293 0.917 1.00 33.02 H new ATOM 0 HE ARG A 124 -9.953 -11.099 -1.162 1.00 53.33 H new ATOM 0 HH11 ARG A 124 -6.992 -10.431 0.640 1.00 4.12 H new ATOM 0 HH12 ARG A 124 -6.208 -9.624 -0.722 1.00 4.12 H new ATOM 0 HH21 ARG A 124 -8.939 -10.061 -2.907 1.00 61.13 H new ATOM 0 HH22 ARG A 124 -7.305 -9.415 -2.722 1.00 61.13 H new ATOM 1900 N TYR A 125 -12.438 -11.837 5.400 1.00 11.42 N ATOM 1901 CA TYR A 125 -12.446 -11.897 6.856 1.00 32.34 C ATOM 1902 C TYR A 125 -13.828 -12.281 7.378 1.00 64.33 C ATOM 1903 O TYR A 125 -14.176 -11.984 8.520 1.00 30.13 O ATOM 1904 CB TYR A 125 -12.022 -10.550 7.446 1.00 34.21 C ATOM 1905 CG TYR A 125 -10.564 -10.223 7.219 1.00 62.11 C ATOM 1906 CD1 TYR A 125 -9.569 -10.832 7.974 1.00 33.23 C ATOM 1907 CD2 TYR A 125 -10.181 -9.303 6.251 1.00 52.04 C ATOM 1908 CE1 TYR A 125 -8.235 -10.535 7.771 1.00 33.11 C ATOM 1909 CE2 TYR A 125 -8.849 -9.001 6.040 1.00 51.40 C ATOM 1910 CZ TYR A 125 -7.880 -9.619 6.803 1.00 13.53 C ATOM 1911 OH TYR A 125 -6.553 -9.322 6.596 1.00 25.15 O ATOM 0 H TYR A 125 -12.782 -10.958 5.013 1.00 11.42 H new ATOM 0 HA TYR A 125 -11.734 -12.662 7.166 1.00 32.34 H new ATOM 0 HB2 TYR A 125 -12.635 -9.762 7.009 1.00 34.21 H new ATOM 0 HB3 TYR A 125 -12.223 -10.552 8.517 1.00 34.21 H new ATOM 0 HD1 TYR A 125 -9.843 -11.550 8.733 1.00 33.23 H new ATOM 0 HD2 TYR A 125 -10.937 -8.816 5.653 1.00 52.04 H new ATOM 0 HE1 TYR A 125 -7.474 -11.017 8.367 1.00 33.11 H new ATOM 0 HE2 TYR A 125 -8.568 -8.285 5.282 1.00 51.40 H new ATOM 0 HH TYR A 125 -6.474 -8.659 5.878 1.00 25.15 H new ATOM 1921 N ARG A 126 -14.609 -12.944 6.532 1.00 75.14 N ATOM 1922 CA ARG A 126 -15.952 -13.371 6.906 1.00 22.33 C ATOM 1923 C ARG A 126 -16.886 -12.171 7.036 1.00 52.11 C ATOM 1924 O ARG A 126 -17.770 -12.148 7.892 1.00 64.42 O ATOM 1925 CB ARG A 126 -15.916 -14.147 8.225 1.00 41.42 C ATOM 1926 CG ARG A 126 -16.765 -15.407 8.212 1.00 22.34 C ATOM 1927 CD ARG A 126 -18.249 -15.078 8.148 1.00 40.44 C ATOM 1928 NE ARG A 126 -18.743 -14.525 9.406 1.00 45.23 N ATOM 1929 CZ ARG A 126 -19.009 -15.262 10.478 1.00 32.12 C ATOM 1930 NH1 ARG A 126 -18.831 -16.575 10.445 1.00 72.44 N ATOM 1931 NH2 ARG A 126 -19.456 -14.686 11.587 1.00 62.02 N ATOM 0 H ARG A 126 -14.335 -13.197 5.583 1.00 75.14 H new ATOM 0 HA ARG A 126 -16.331 -14.023 6.119 1.00 22.33 H new ATOM 0 HB2 ARG A 126 -14.884 -14.416 8.451 1.00 41.42 H new ATOM 0 HB3 ARG A 126 -16.259 -13.496 9.029 1.00 41.42 H new ATOM 0 HG2 ARG A 126 -16.491 -16.023 7.356 1.00 22.34 H new ATOM 0 HG3 ARG A 126 -16.560 -15.995 9.107 1.00 22.34 H new ATOM 0 HD2 ARG A 126 -18.427 -14.364 7.344 1.00 40.44 H new ATOM 0 HD3 ARG A 126 -18.810 -15.980 7.904 1.00 40.44 H new ATOM 0 HE ARG A 126 -18.892 -13.518 9.464 1.00 45.23 H new ATOM 0 HH11 ARG A 126 -18.489 -17.022 9.594 1.00 72.44 H new ATOM 0 HH12 ARG A 126 -19.036 -17.138 11.270 1.00 72.44 H new ATOM 0 HH21 ARG A 126 -19.596 -13.676 11.617 1.00 62.02 H new ATOM 0 HH22 ARG A 126 -19.660 -15.253 12.410 1.00 62.02 H new ATOM 2041 N VAL A 134 -20.597 -3.344 -3.155 1.00 4.51 N ATOM 2042 CA VAL A 134 -19.507 -2.376 -3.212 1.00 14.10 C ATOM 2043 C VAL A 134 -19.769 -1.318 -4.278 1.00 50.42 C ATOM 2044 O VAL A 134 -19.488 -0.137 -4.075 1.00 22.33 O ATOM 2045 CB VAL A 134 -18.161 -3.064 -3.506 1.00 72.12 C ATOM 2046 CG1 VAL A 134 -17.017 -2.066 -3.401 1.00 14.02 C ATOM 2047 CG2 VAL A 134 -17.945 -4.237 -2.561 1.00 5.30 C ATOM 0 HA VAL A 134 -19.455 -1.898 -2.234 1.00 14.10 H new ATOM 0 HB VAL A 134 -18.184 -3.448 -4.526 1.00 72.12 H new ATOM 0 HG11 VAL A 134 -16.074 -2.570 -3.612 1.00 14.02 H new ATOM 0 HG12 VAL A 134 -17.168 -1.262 -4.122 1.00 14.02 H new ATOM 0 HG13 VAL A 134 -16.989 -1.650 -2.394 1.00 14.02 H new ATOM 0 HG21 VAL A 134 -16.989 -4.712 -2.783 1.00 5.30 H new ATOM 0 HG22 VAL A 134 -17.942 -3.879 -1.531 1.00 5.30 H new ATOM 0 HG23 VAL A 134 -18.749 -4.962 -2.691 1.00 5.30 H new ATOM 2057 N GLN A 135 -20.306 -1.750 -5.414 1.00 5.32 N ATOM 2058 CA GLN A 135 -20.605 -0.838 -6.513 1.00 60.22 C ATOM 2059 C GLN A 135 -21.509 0.298 -6.047 1.00 33.33 C ATOM 2060 O GLN A 135 -21.336 1.447 -6.450 1.00 11.12 O ATOM 2061 CB GLN A 135 -21.268 -1.595 -7.665 1.00 13.23 C ATOM 2062 CG GLN A 135 -22.505 -2.374 -7.248 1.00 53.42 C ATOM 2063 CD GLN A 135 -23.792 -1.711 -7.699 1.00 43.41 C ATOM 2064 OE1 GLN A 135 -23.928 -1.317 -8.859 1.00 34.31 O ATOM 2065 NE2 GLN A 135 -24.745 -1.583 -6.784 1.00 13.20 N ATOM 0 H GLN A 135 -20.543 -2.725 -5.598 1.00 5.32 H new ATOM 0 HA GLN A 135 -19.666 -0.409 -6.863 1.00 60.22 H new ATOM 0 HB2 GLN A 135 -21.542 -0.885 -8.446 1.00 13.23 H new ATOM 0 HB3 GLN A 135 -20.544 -2.284 -8.100 1.00 13.23 H new ATOM 0 HG2 GLN A 135 -22.454 -3.380 -7.665 1.00 53.42 H new ATOM 0 HG3 GLN A 135 -22.515 -2.478 -6.163 1.00 53.42 H new ATOM 0 HE21 GLN A 135 -24.590 -1.923 -5.835 1.00 13.20 H new ATOM 0 HE22 GLN A 135 -25.632 -1.144 -7.030 1.00 13.20 H new ATOM 2074 N ALA A 136 -22.474 -0.032 -5.195 1.00 32.12 N ATOM 2075 CA ALA A 136 -23.405 0.960 -4.673 1.00 2.43 C ATOM 2076 C ALA A 136 -22.695 1.951 -3.756 1.00 73.01 C ATOM 2077 O ALA A 136 -23.039 3.132 -3.717 1.00 72.24 O ATOM 2078 CB ALA A 136 -24.546 0.278 -3.933 1.00 61.03 C ATOM 0 H ALA A 136 -22.631 -0.979 -4.852 1.00 32.12 H new ATOM 0 HA ALA A 136 -23.815 1.515 -5.517 1.00 2.43 H new ATOM 0 HB1 ALA A 136 -25.233 1.032 -3.549 1.00 61.03 H new ATOM 0 HB2 ALA A 136 -25.079 -0.384 -4.616 1.00 61.03 H new ATOM 0 HB3 ALA A 136 -24.145 -0.304 -3.103 1.00 61.03 H new ATOM 2084 N ASP A 137 -21.703 1.461 -3.020 1.00 35.14 N ATOM 2085 CA ASP A 137 -20.944 2.303 -2.103 1.00 71.12 C ATOM 2086 C ASP A 137 -20.054 3.275 -2.870 1.00 25.25 C ATOM 2087 O ASP A 137 -19.875 4.424 -2.462 1.00 51.21 O ATOM 2088 CB ASP A 137 -20.093 1.440 -1.170 1.00 53.24 C ATOM 2089 CG ASP A 137 -20.907 0.822 -0.051 1.00 45.13 C ATOM 2090 OD1 ASP A 137 -22.103 1.160 0.070 1.00 31.52 O ATOM 2091 OD2 ASP A 137 -20.347 0.000 0.705 1.00 42.10 O ATOM 0 H ASP A 137 -21.406 0.485 -3.041 1.00 35.14 H new ATOM 0 HA ASP A 137 -21.652 2.879 -1.507 1.00 71.12 H new ATOM 0 HB2 ASP A 137 -19.615 0.649 -1.747 1.00 53.24 H new ATOM 0 HB3 ASP A 137 -19.296 2.049 -0.742 1.00 53.24 H new ATOM 2096 N VAL A 138 -19.497 2.809 -3.983 1.00 61.43 N ATOM 2097 CA VAL A 138 -18.625 3.637 -4.807 1.00 44.30 C ATOM 2098 C VAL A 138 -19.410 4.752 -5.490 1.00 64.23 C ATOM 2099 O VAL A 138 -18.941 5.886 -5.586 1.00 31.42 O ATOM 2100 CB VAL A 138 -17.904 2.800 -5.880 1.00 13.01 C ATOM 2101 CG1 VAL A 138 -17.148 3.702 -6.844 1.00 61.43 C ATOM 2102 CG2 VAL A 138 -16.966 1.795 -5.230 1.00 64.32 C ATOM 0 H VAL A 138 -19.634 1.862 -4.335 1.00 61.43 H new ATOM 0 HA VAL A 138 -17.883 4.075 -4.140 1.00 44.30 H new ATOM 0 HB VAL A 138 -18.653 2.249 -6.449 1.00 13.01 H new ATOM 0 HG11 VAL A 138 -16.645 3.092 -7.595 1.00 61.43 H new ATOM 0 HG12 VAL A 138 -17.848 4.378 -7.335 1.00 61.43 H new ATOM 0 HG13 VAL A 138 -16.408 4.283 -6.294 1.00 61.43 H new ATOM 0 HG21 VAL A 138 -16.465 1.212 -6.003 1.00 64.32 H new ATOM 0 HG22 VAL A 138 -16.222 2.324 -4.635 1.00 64.32 H new ATOM 0 HG23 VAL A 138 -17.538 1.127 -4.586 1.00 64.32 H new ATOM 2112 N SER A 139 -20.607 4.420 -5.963 1.00 22.34 N ATOM 2113 CA SER A 139 -21.457 5.393 -6.640 1.00 72.33 C ATOM 2114 C SER A 139 -22.003 6.420 -5.651 1.00 75.03 C ATOM 2115 O SER A 139 -22.228 7.578 -6.003 1.00 30.13 O ATOM 2116 CB SER A 139 -22.613 4.684 -7.347 1.00 0.52 C ATOM 2117 OG SER A 139 -22.162 3.526 -8.027 1.00 33.30 O ATOM 0 H SER A 139 -21.010 3.486 -5.890 1.00 22.34 H new ATOM 0 HA SER A 139 -20.852 5.915 -7.381 1.00 72.33 H new ATOM 0 HB2 SER A 139 -23.375 4.408 -6.618 1.00 0.52 H new ATOM 0 HB3 SER A 139 -23.083 5.366 -8.056 1.00 0.52 H new ATOM 0 HG SER A 139 -22.042 2.796 -7.385 1.00 33.30 H new ATOM 2123 N LEU A 140 -22.213 5.985 -4.413 1.00 4.45 N ATOM 2124 CA LEU A 140 -22.732 6.865 -3.372 1.00 70.11 C ATOM 2125 C LEU A 140 -21.687 7.896 -2.959 1.00 4.03 C ATOM 2126 O LEU A 140 -21.966 9.094 -2.909 1.00 14.14 O ATOM 2127 CB LEU A 140 -23.167 6.046 -2.156 1.00 23.23 C ATOM 2128 CG LEU A 140 -23.385 6.832 -0.861 1.00 42.14 C ATOM 2129 CD1 LEU A 140 -24.576 6.278 -0.095 1.00 4.35 C ATOM 2130 CD2 LEU A 140 -22.131 6.797 0.000 1.00 2.05 C ATOM 0 H LEU A 140 -22.032 5.029 -4.106 1.00 4.45 H new ATOM 0 HA LEU A 140 -23.596 7.394 -3.774 1.00 70.11 H new ATOM 0 HB2 LEU A 140 -24.094 5.529 -2.404 1.00 23.23 H new ATOM 0 HB3 LEU A 140 -22.414 5.280 -1.970 1.00 23.23 H new ATOM 0 HG LEU A 140 -23.596 7.870 -1.118 1.00 42.14 H new ATOM 0 HD11 LEU A 140 -24.716 6.849 0.823 1.00 4.35 H new ATOM 0 HD12 LEU A 140 -25.472 6.355 -0.711 1.00 4.35 H new ATOM 0 HD13 LEU A 140 -24.395 5.232 0.153 1.00 4.35 H new ATOM 0 HD21 LEU A 140 -22.303 7.361 0.917 1.00 2.05 H new ATOM 0 HD22 LEU A 140 -21.890 5.764 0.249 1.00 2.05 H new ATOM 0 HD23 LEU A 140 -21.301 7.241 -0.548 1.00 2.05 H new ATOM 2142 N VAL A 141 -20.480 7.422 -2.665 1.00 60.52 N ATOM 2143 CA VAL A 141 -19.391 8.302 -2.258 1.00 12.14 C ATOM 2144 C VAL A 141 -18.997 9.246 -3.388 1.00 13.45 C ATOM 2145 O VAL A 141 -18.704 10.420 -3.159 1.00 24.41 O ATOM 2146 CB VAL A 141 -18.153 7.498 -1.821 1.00 0.12 C ATOM 2147 CG1 VAL A 141 -18.462 6.673 -0.581 1.00 3.15 C ATOM 2148 CG2 VAL A 141 -17.667 6.609 -2.956 1.00 3.03 C ATOM 0 H VAL A 141 -20.232 6.433 -2.701 1.00 60.52 H new ATOM 0 HA VAL A 141 -19.754 8.884 -1.411 1.00 12.14 H new ATOM 0 HB VAL A 141 -17.356 8.199 -1.572 1.00 0.12 H new ATOM 0 HG11 VAL A 141 -17.575 6.112 -0.287 1.00 3.15 H new ATOM 0 HG12 VAL A 141 -18.758 7.336 0.232 1.00 3.15 H new ATOM 0 HG13 VAL A 141 -19.275 5.980 -0.798 1.00 3.15 H new ATOM 0 HG21 VAL A 141 -16.791 6.048 -2.629 1.00 3.03 H new ATOM 0 HG22 VAL A 141 -18.458 5.915 -3.239 1.00 3.03 H new ATOM 0 HG23 VAL A 141 -17.403 7.227 -3.814 1.00 3.03 H new ATOM 2158 N THR A 142 -18.994 8.727 -4.612 1.00 61.15 N ATOM 2159 CA THR A 142 -18.635 9.522 -5.780 1.00 21.20 C ATOM 2160 C THR A 142 -19.708 10.560 -6.089 1.00 33.21 C ATOM 2161 O THR A 142 -19.404 11.727 -6.334 1.00 12.54 O ATOM 2162 CB THR A 142 -18.422 8.635 -7.020 1.00 41.21 C ATOM 2163 OG1 THR A 142 -19.559 7.787 -7.217 1.00 64.30 O ATOM 2164 CG2 THR A 142 -17.169 7.785 -6.870 1.00 4.31 C ATOM 0 H THR A 142 -19.236 7.758 -4.820 1.00 61.15 H new ATOM 0 HA THR A 142 -17.700 10.029 -5.542 1.00 21.20 H new ATOM 0 HB THR A 142 -18.299 9.285 -7.887 1.00 41.21 H new ATOM 0 HG1 THR A 142 -19.385 6.908 -6.820 1.00 64.30 H new ATOM 0 HG21 THR A 142 -17.040 7.167 -7.759 1.00 4.31 H new ATOM 0 HG22 THR A 142 -16.301 8.434 -6.750 1.00 4.31 H new ATOM 0 HG23 THR A 142 -17.267 7.144 -5.994 1.00 4.31 H new ATOM 2172 N SER A 143 -20.965 10.126 -6.073 1.00 1.41 N ATOM 2173 CA SER A 143 -22.084 11.018 -6.355 1.00 2.12 C ATOM 2174 C SER A 143 -22.135 12.162 -5.346 1.00 54.44 C ATOM 2175 O SER A 143 -22.467 13.295 -5.694 1.00 11.22 O ATOM 2176 CB SER A 143 -23.402 10.241 -6.328 1.00 71.20 C ATOM 2177 OG SER A 143 -24.513 11.120 -6.370 1.00 71.24 O ATOM 0 H SER A 143 -21.233 9.164 -5.868 1.00 1.41 H new ATOM 0 HA SER A 143 -21.939 11.440 -7.350 1.00 2.12 H new ATOM 0 HB2 SER A 143 -23.443 9.558 -7.176 1.00 71.20 H new ATOM 0 HB3 SER A 143 -23.450 9.632 -5.425 1.00 71.20 H new ATOM 0 HG SER A 143 -25.343 10.599 -6.353 1.00 71.24 H new ATOM 2183 N MET A 144 -21.803 11.856 -4.097 1.00 53.21 N ATOM 2184 CA MET A 144 -21.809 12.858 -3.038 1.00 4.11 C ATOM 2185 C MET A 144 -20.657 13.843 -3.214 1.00 74.12 C ATOM 2186 O MET A 144 -20.822 15.047 -3.022 1.00 45.40 O ATOM 2187 CB MET A 144 -21.714 12.184 -1.668 1.00 23.32 C ATOM 2188 CG MET A 144 -22.922 11.326 -1.327 1.00 11.21 C ATOM 2189 SD MET A 144 -23.996 12.095 -0.100 1.00 73.54 S ATOM 2190 CE MET A 144 -23.355 11.374 1.410 1.00 53.23 C ATOM 0 H MET A 144 -21.526 10.922 -3.793 1.00 53.21 H new ATOM 0 HA MET A 144 -22.747 13.409 -3.100 1.00 4.11 H new ATOM 0 HB2 MET A 144 -20.818 11.564 -1.639 1.00 23.32 H new ATOM 0 HB3 MET A 144 -21.596 12.951 -0.902 1.00 23.32 H new ATOM 0 HG2 MET A 144 -23.494 11.133 -2.235 1.00 11.21 H new ATOM 0 HG3 MET A 144 -22.583 10.360 -0.953 1.00 11.21 H new ATOM 0 HE1 MET A 144 -23.919 11.753 2.262 1.00 53.23 H new ATOM 0 HE2 MET A 144 -23.452 10.289 1.365 1.00 53.23 H new ATOM 0 HE3 MET A 144 -22.304 11.640 1.523 1.00 53.23 H new ATOM 2200 N THR A 145 -19.491 13.321 -3.580 1.00 64.11 N ATOM 2201 CA THR A 145 -18.311 14.155 -3.780 1.00 14.30 C ATOM 2202 C THR A 145 -18.461 15.030 -5.019 1.00 63.15 C ATOM 2203 O THR A 145 -17.964 16.156 -5.058 1.00 51.43 O ATOM 2204 CB THR A 145 -17.037 13.300 -3.921 1.00 71.44 C ATOM 2205 OG1 THR A 145 -17.338 12.082 -4.612 1.00 32.42 O ATOM 2206 CG2 THR A 145 -16.446 12.982 -2.556 1.00 42.22 C ATOM 0 H THR A 145 -19.338 12.326 -3.744 1.00 64.11 H new ATOM 0 HA THR A 145 -18.219 14.790 -2.899 1.00 14.30 H new ATOM 0 HB THR A 145 -16.305 13.870 -4.493 1.00 71.44 H new ATOM 0 HG1 THR A 145 -17.524 11.374 -3.961 1.00 32.42 H new ATOM 0 HG21 THR A 145 -15.547 12.378 -2.680 1.00 42.22 H new ATOM 0 HG22 THR A 145 -16.191 13.910 -2.045 1.00 42.22 H new ATOM 0 HG23 THR A 145 -17.175 12.430 -1.963 1.00 42.22 H new ATOM 2214 N SER A 146 -19.148 14.507 -6.029 1.00 31.33 N ATOM 2215 CA SER A 146 -19.361 15.241 -7.271 1.00 51.03 C ATOM 2216 C SER A 146 -19.870 16.651 -6.988 1.00 52.44 C ATOM 2217 O SER A 146 -19.497 17.608 -7.669 1.00 71.24 O ATOM 2218 CB SER A 146 -20.355 14.497 -8.164 1.00 21.14 C ATOM 2219 OG SER A 146 -19.807 13.277 -8.632 1.00 64.13 O ATOM 0 H SER A 146 -19.567 13.577 -6.012 1.00 31.33 H new ATOM 0 HA SER A 146 -18.405 15.316 -7.789 1.00 51.03 H new ATOM 0 HB2 SER A 146 -21.271 14.298 -7.607 1.00 21.14 H new ATOM 0 HB3 SER A 146 -20.628 15.125 -9.012 1.00 21.14 H new ATOM 0 HG SER A 146 -19.653 12.676 -7.874 1.00 64.13 H new ATOM 2225 N THR A 147 -20.726 16.773 -5.978 1.00 45.21 N ATOM 2226 CA THR A 147 -21.288 18.066 -5.605 1.00 55.25 C ATOM 2227 C THR A 147 -20.740 18.535 -4.262 1.00 44.32 C ATOM 2228 O THR A 147 -21.500 18.870 -3.353 1.00 74.12 O ATOM 2229 CB THR A 147 -22.825 18.007 -5.528 1.00 1.21 C ATOM 2230 OG1 THR A 147 -23.240 16.768 -4.944 1.00 22.52 O ATOM 2231 CG2 THR A 147 -23.442 18.154 -6.911 1.00 25.43 C ATOM 0 H THR A 147 -21.045 15.993 -5.404 1.00 45.21 H new ATOM 0 HA THR A 147 -20.997 18.775 -6.380 1.00 55.25 H new ATOM 0 HB THR A 147 -23.167 18.833 -4.905 1.00 1.21 H new ATOM 0 HG1 THR A 147 -24.218 16.740 -4.897 1.00 22.52 H new ATOM 0 HG21 THR A 147 -24.528 18.109 -6.831 1.00 25.43 H new ATOM 0 HG22 THR A 147 -23.149 19.112 -7.340 1.00 25.43 H new ATOM 0 HG23 THR A 147 -23.092 17.346 -7.553 1.00 25.43 H new ATOM 2239 N PHE A 148 -19.417 18.561 -4.145 1.00 22.53 N ATOM 2240 CA PHE A 148 -18.767 18.990 -2.911 1.00 4.51 C ATOM 2241 C PHE A 148 -17.982 20.281 -3.132 1.00 72.43 C ATOM 2242 O PHE A 148 -17.067 20.330 -3.953 1.00 64.11 O ATOM 2243 CB PHE A 148 -17.835 17.894 -2.392 1.00 42.50 C ATOM 2244 CG PHE A 148 -16.947 18.346 -1.267 1.00 50.45 C ATOM 2245 CD1 PHE A 148 -17.454 18.507 0.011 1.00 75.41 C ATOM 2246 CD2 PHE A 148 -15.604 18.608 -1.489 1.00 11.54 C ATOM 2247 CE1 PHE A 148 -16.640 18.922 1.047 1.00 23.32 C ATOM 2248 CE2 PHE A 148 -14.785 19.024 -0.457 1.00 64.13 C ATOM 2249 CZ PHE A 148 -15.303 19.180 0.814 1.00 13.42 C ATOM 0 H PHE A 148 -18.774 18.290 -4.889 1.00 22.53 H new ATOM 0 HA PHE A 148 -19.541 19.179 -2.167 1.00 4.51 H new ATOM 0 HB2 PHE A 148 -18.434 17.048 -2.054 1.00 42.50 H new ATOM 0 HB3 PHE A 148 -17.214 17.537 -3.214 1.00 42.50 H new ATOM 0 HD1 PHE A 148 -18.498 18.306 0.200 1.00 75.41 H new ATOM 0 HD2 PHE A 148 -15.193 18.486 -2.480 1.00 11.54 H new ATOM 0 HE1 PHE A 148 -17.049 19.045 2.039 1.00 23.32 H new ATOM 0 HE2 PHE A 148 -13.741 19.227 -0.644 1.00 64.13 H new ATOM 0 HZ PHE A 148 -14.665 19.503 1.623 1.00 13.42 H new