USER MOD reduce.3.24.130724 H: found=0, std=0, add=709, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 710 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 339 ASN : amide:sc= -1.26 K(o=-0.82,f=0.4) USER MOD Set 1.2: A 384 HIS : no HE2:sc= -1.08 K(o=-0.82,f=-6.2!) USER MOD Set 1.3: B 147 ASN : amide:sc= 0.771 X(o=-0.82,f=-0.35) USER MOD Set 1.4: B 149 THR OG1 : rot 98:sc= 0.75 USER MOD Set 2.1: A 376 ASN : amide:sc= 0.75 K(o=2.6,f=-1.6) USER MOD Set 2.2: A 401 LYS NZ :NH3+ 174:sc= 1.9 (180deg=0.931) USER MOD Set 3.1: A 347 SER OG : rot 95:sc= 2.09 USER MOD Set 3.2: A 370 LYS NZ :NH3+ 165:sc= 2.07 (180deg=-0.179!) USER MOD Set 4.1: A 321 LYS NZ :NH3+ 174:sc= 1.19 (180deg=0) USER MOD Set 4.2: A 399 TYR OH : rot 180:sc= 1.07 USER MOD Single : A 318 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 324 LYS NZ :NH3+ -166:sc= 1.21 (180deg=1.07) USER MOD Single : A 327 LYS NZ :NH3+ -145:sc= 0.656 (180deg=-0.932!) USER MOD Single : A 332 SER OG : rot 180:sc= 0 USER MOD Single : A 340 GLN : amide:sc= 0.74 K(o=0.74,f=-8.4!) USER MOD Single : A 341 HIS : no HD1:sc= -0.14 K(o=-0.14,f=-1) USER MOD Single : A 346 ASN : amide:sc= -2.94! C(o=-2.9!,f=-6.6!) USER MOD Single : A 349 TYR OH : rot -130:sc= 0.283 USER MOD Single : A 351 THR OG1 : rot -70:sc= 0 USER MOD Single : A 352 LYS NZ :NH3+ 141:sc= -2.45! (180deg=-5.41!) USER MOD Single : A 360 HIS : no HE2:sc= -0.677 K(o=-0.68,f=-3.9!) USER MOD Single : A 361 LYS NZ :NH3+ 168:sc= 1.26 (180deg=0.965) USER MOD Single : A 364 LYS NZ :NH3+ -162:sc= 0.718 (180deg=-0.386!) USER MOD Single : A 366 GLN : amide:sc= -1.3! K(o=-1.3!,f=-0.017) USER MOD Single : A 375 ASN : amide:sc= 0.373 K(o=0.37,f=-8!) USER MOD Single : A 378 CYS SG : rot 180:sc= 0.0788 USER MOD Single : A 383 THR OG1 : rot 82:sc= 0.998 USER MOD Single : A 389 THR OG1 : rot 81:sc= 0.704 USER MOD Single : A 392 LYS NZ :NH3+ 175:sc= 1.5 (180deg=1.33) USER MOD Single : A 393 ASN : amide:sc= -0.248 K(o=-0.25,f=-0.75) USER MOD Single : A 394 THR OG1 : rot -76:sc= -0.345 USER MOD Single : A 395 SER OG : rot 180:sc= 0 USER MOD Single : A 404 LYS NZ :NH3+ 161:sc= 1.28 (180deg=1.05) USER MOD Single : B 150 GLN : amide:sc= -0.299 K(o=-0.3,f=-0.82) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 318 2.141 0.750 -0.968 1.00 52.51 N ATOM 2 CA MET A 318 3.300 1.503 -1.448 1.00 63.30 C ATOM 3 C MET A 318 4.506 0.593 -1.405 1.00 4.34 C ATOM 4 O MET A 318 5.226 0.541 -0.435 1.00 55.22 O ATOM 5 CB MET A 318 3.504 2.778 -0.596 1.00 2.14 C ATOM 6 CG MET A 318 4.740 3.614 -0.923 1.00 11.44 C ATOM 7 SD MET A 318 4.824 5.094 0.109 1.00 50.14 S ATOM 8 CE MET A 318 6.431 5.760 -0.362 1.00 22.54 C ATOM 0 HA MET A 318 3.144 1.834 -2.475 1.00 63.30 H new ATOM 0 HB2 MET A 318 2.623 3.410 -0.708 1.00 2.14 H new ATOM 0 HB3 MET A 318 3.555 2.485 0.453 1.00 2.14 H new ATOM 0 HG2 MET A 318 5.637 3.013 -0.775 1.00 11.44 H new ATOM 0 HG3 MET A 318 4.719 3.902 -1.974 1.00 11.44 H new ATOM 0 HE1 MET A 318 6.622 6.677 0.195 1.00 22.54 H new ATOM 0 HE2 MET A 318 7.208 5.030 -0.136 1.00 22.54 H new ATOM 0 HE3 MET A 318 6.436 5.976 -1.430 1.00 22.54 H new ATOM 20 N GLU A 319 4.633 -0.197 -2.415 1.00 43.14 N ATOM 21 CA GLU A 319 5.670 -1.166 -2.507 1.00 41.14 C ATOM 22 C GLU A 319 6.783 -0.788 -3.452 1.00 60.35 C ATOM 23 O GLU A 319 6.571 -0.215 -4.521 1.00 73.34 O ATOM 24 CB GLU A 319 5.143 -2.615 -2.672 1.00 73.11 C ATOM 25 CG GLU A 319 3.843 -2.767 -3.465 1.00 53.43 C ATOM 26 CD GLU A 319 2.617 -2.402 -2.617 1.00 70.53 C ATOM 27 OE1 GLU A 319 2.171 -3.249 -1.817 1.00 65.30 O ATOM 28 OE2 GLU A 319 2.135 -1.238 -2.687 1.00 4.32 O ATOM 0 H GLU A 319 4.004 -0.187 -3.218 1.00 43.14 H new ATOM 0 HA GLU A 319 6.154 -1.162 -1.530 1.00 41.14 H new ATOM 0 HB2 GLU A 319 5.916 -3.209 -3.161 1.00 73.11 H new ATOM 0 HB3 GLU A 319 4.993 -3.042 -1.680 1.00 73.11 H new ATOM 0 HG2 GLU A 319 3.878 -2.129 -4.348 1.00 53.43 H new ATOM 0 HG3 GLU A 319 3.749 -3.794 -3.818 1.00 53.43 H new ATOM 35 N ILE A 320 7.955 -1.090 -3.003 1.00 1.30 N ATOM 36 CA ILE A 320 9.201 -0.730 -3.602 1.00 62.13 C ATOM 37 C ILE A 320 10.039 -1.994 -3.740 1.00 53.14 C ATOM 38 O ILE A 320 10.274 -2.695 -2.759 1.00 32.21 O ATOM 39 CB ILE A 320 9.916 0.242 -2.628 1.00 45.32 C ATOM 40 CG1 ILE A 320 9.050 1.505 -2.428 1.00 51.20 C ATOM 41 CG2 ILE A 320 11.297 0.604 -3.149 1.00 22.35 C ATOM 42 CD1 ILE A 320 9.511 2.430 -1.324 1.00 14.55 C ATOM 0 H ILE A 320 8.078 -1.633 -2.148 1.00 1.30 H new ATOM 0 HA ILE A 320 9.059 -0.266 -4.578 1.00 62.13 H new ATOM 0 HB ILE A 320 10.046 -0.250 -1.664 1.00 45.32 H new ATOM 0 HG12 ILE A 320 9.028 2.064 -3.364 1.00 51.20 H new ATOM 0 HG13 ILE A 320 8.026 1.195 -2.218 1.00 51.20 H new ATOM 0 HG21 ILE A 320 11.782 1.287 -2.451 1.00 22.35 H new ATOM 0 HG22 ILE A 320 11.897 -0.300 -3.248 1.00 22.35 H new ATOM 0 HG23 ILE A 320 11.204 1.086 -4.122 1.00 22.35 H new ATOM 0 HD11 ILE A 320 8.839 3.286 -1.262 1.00 14.55 H new ATOM 0 HD12 ILE A 320 9.505 1.895 -0.374 1.00 14.55 H new ATOM 0 HD13 ILE A 320 10.522 2.777 -1.538 1.00 14.55 H new ATOM 54 N LYS A 321 10.445 -2.311 -4.932 1.00 21.04 N ATOM 55 CA LYS A 321 11.263 -3.482 -5.137 1.00 31.21 C ATOM 56 C LYS A 321 12.723 -3.115 -5.140 1.00 41.04 C ATOM 57 O LYS A 321 13.211 -2.485 -6.063 1.00 32.40 O ATOM 58 CB LYS A 321 10.860 -4.255 -6.397 1.00 4.22 C ATOM 59 CG LYS A 321 11.789 -5.427 -6.737 1.00 42.24 C ATOM 60 CD LYS A 321 11.151 -6.392 -7.724 1.00 23.10 C ATOM 61 CE LYS A 321 10.684 -5.721 -9.005 1.00 14.20 C ATOM 62 NZ LYS A 321 9.924 -6.674 -9.856 1.00 33.12 N ATOM 0 H LYS A 321 10.228 -1.783 -5.777 1.00 21.04 H new ATOM 0 HA LYS A 321 11.091 -4.158 -4.299 1.00 31.21 H new ATOM 0 HB2 LYS A 321 9.846 -4.634 -6.269 1.00 4.22 H new ATOM 0 HB3 LYS A 321 10.838 -3.566 -7.241 1.00 4.22 H new ATOM 0 HG2 LYS A 321 12.719 -5.043 -7.156 1.00 42.24 H new ATOM 0 HG3 LYS A 321 12.048 -5.962 -5.823 1.00 42.24 H new ATOM 0 HD2 LYS A 321 11.869 -7.174 -7.972 1.00 23.10 H new ATOM 0 HD3 LYS A 321 10.301 -6.880 -7.247 1.00 23.10 H new ATOM 0 HE2 LYS A 321 10.057 -4.863 -8.763 1.00 14.20 H new ATOM 0 HE3 LYS A 321 11.544 -5.341 -9.556 1.00 14.20 H new ATOM 0 HZ1 LYS A 321 9.529 -6.169 -10.675 1.00 33.12 H new ATOM 0 HZ2 LYS A 321 10.560 -7.427 -10.187 1.00 33.12 H new ATOM 0 HZ3 LYS A 321 9.150 -7.093 -9.302 1.00 33.12 H new ATOM 76 N LEU A 322 13.386 -3.525 -4.105 1.00 13.24 N ATOM 77 CA LEU A 322 14.769 -3.231 -3.887 1.00 10.23 C ATOM 78 C LEU A 322 15.592 -4.458 -4.130 1.00 51.14 C ATOM 79 O LEU A 322 15.111 -5.585 -3.966 1.00 24.32 O ATOM 80 CB LEU A 322 14.978 -2.817 -2.435 1.00 61.31 C ATOM 81 CG LEU A 322 14.235 -1.584 -1.966 1.00 13.44 C ATOM 82 CD1 LEU A 322 14.423 -1.401 -0.476 1.00 54.43 C ATOM 83 CD2 LEU A 322 14.727 -0.364 -2.709 1.00 4.34 C ATOM 0 H LEU A 322 12.968 -4.090 -3.366 1.00 13.24 H new ATOM 0 HA LEU A 322 15.066 -2.431 -4.565 1.00 10.23 H new ATOM 0 HB2 LEU A 322 14.687 -3.652 -1.798 1.00 61.31 H new ATOM 0 HB3 LEU A 322 16.044 -2.652 -2.278 1.00 61.31 H new ATOM 0 HG LEU A 322 13.173 -1.713 -2.173 1.00 13.44 H new ATOM 0 HD11 LEU A 322 13.885 -0.512 -0.148 1.00 54.43 H new ATOM 0 HD12 LEU A 322 14.036 -2.274 0.050 1.00 54.43 H new ATOM 0 HD13 LEU A 322 15.484 -1.285 -0.255 1.00 54.43 H new ATOM 0 HD21 LEU A 322 14.185 0.516 -2.363 1.00 4.34 H new ATOM 0 HD22 LEU A 322 15.793 -0.230 -2.523 1.00 4.34 H new ATOM 0 HD23 LEU A 322 14.559 -0.496 -3.778 1.00 4.34 H new ATOM 95 N ILE A 323 16.803 -4.256 -4.530 1.00 11.54 N ATOM 96 CA ILE A 323 17.737 -5.324 -4.652 1.00 2.40 C ATOM 97 C ILE A 323 18.701 -5.209 -3.481 1.00 45.01 C ATOM 98 O ILE A 323 19.441 -4.231 -3.370 1.00 33.33 O ATOM 99 CB ILE A 323 18.479 -5.261 -6.002 1.00 75.31 C ATOM 100 CG1 ILE A 323 17.478 -5.395 -7.171 1.00 32.12 C ATOM 101 CG2 ILE A 323 19.587 -6.306 -6.099 1.00 34.42 C ATOM 102 CD1 ILE A 323 16.483 -6.546 -7.066 1.00 3.35 C ATOM 0 H ILE A 323 17.174 -3.340 -4.783 1.00 11.54 H new ATOM 0 HA ILE A 323 17.227 -6.287 -4.630 1.00 2.40 H new ATOM 0 HB ILE A 323 18.963 -4.286 -6.068 1.00 75.31 H new ATOM 0 HG12 ILE A 323 16.919 -4.463 -7.254 1.00 32.12 H new ATOM 0 HG13 ILE A 323 18.043 -5.511 -8.096 1.00 32.12 H new ATOM 0 HG21 ILE A 323 20.081 -6.223 -7.067 1.00 34.42 H new ATOM 0 HG22 ILE A 323 20.315 -6.140 -5.305 1.00 34.42 H new ATOM 0 HG23 ILE A 323 19.158 -7.302 -5.995 1.00 34.42 H new ATOM 0 HD11 ILE A 323 15.831 -6.544 -7.939 1.00 3.35 H new ATOM 0 HD12 ILE A 323 17.024 -7.491 -7.019 1.00 3.35 H new ATOM 0 HD13 ILE A 323 15.882 -6.427 -6.164 1.00 3.35 H new ATOM 114 N LYS A 324 18.625 -6.149 -2.570 1.00 70.33 N ATOM 115 CA LYS A 324 19.432 -6.110 -1.362 1.00 61.40 C ATOM 116 C LYS A 324 20.868 -6.499 -1.640 1.00 54.31 C ATOM 117 O LYS A 324 21.122 -7.564 -2.167 1.00 23.22 O ATOM 118 CB LYS A 324 18.826 -7.004 -0.284 1.00 11.11 C ATOM 119 CG LYS A 324 19.576 -6.945 1.022 1.00 22.24 C ATOM 120 CD LYS A 324 18.807 -7.586 2.127 1.00 62.51 C ATOM 121 CE LYS A 324 19.562 -7.594 3.448 1.00 3.20 C ATOM 122 NZ LYS A 324 20.707 -8.534 3.428 1.00 52.11 N ATOM 0 H LYS A 324 18.009 -6.959 -2.638 1.00 70.33 H new ATOM 0 HA LYS A 324 19.436 -5.083 -0.998 1.00 61.40 H new ATOM 0 HB2 LYS A 324 17.790 -6.709 -0.115 1.00 11.11 H new ATOM 0 HB3 LYS A 324 18.810 -8.034 -0.641 1.00 11.11 H new ATOM 0 HG2 LYS A 324 20.539 -7.443 0.912 1.00 22.24 H new ATOM 0 HG3 LYS A 324 19.782 -5.906 1.277 1.00 22.24 H new ATOM 0 HD2 LYS A 324 17.862 -7.059 2.258 1.00 62.51 H new ATOM 0 HD3 LYS A 324 18.565 -8.611 1.847 1.00 62.51 H new ATOM 0 HE2 LYS A 324 19.922 -6.589 3.666 1.00 3.20 H new ATOM 0 HE3 LYS A 324 18.881 -7.870 4.253 1.00 3.20 H new ATOM 0 HZ1 LYS A 324 21.046 -8.689 4.399 1.00 52.11 H new ATOM 0 HZ2 LYS A 324 20.405 -9.441 3.018 1.00 52.11 H new ATOM 0 HZ3 LYS A 324 21.475 -8.133 2.853 1.00 52.11 H new ATOM 136 N GLY A 325 21.797 -5.703 -1.176 1.00 23.44 N ATOM 137 CA GLY A 325 23.173 -5.969 -1.488 1.00 1.44 C ATOM 138 C GLY A 325 24.072 -5.890 -0.275 1.00 53.21 C ATOM 139 O GLY A 325 23.597 -6.061 0.853 1.00 32.23 O ATOM 0 H GLY A 325 21.630 -4.883 -0.593 1.00 23.44 H new ATOM 0 HA2 GLY A 325 23.255 -6.961 -1.932 1.00 1.44 H new ATOM 0 HA3 GLY A 325 23.516 -5.255 -2.237 1.00 1.44 H new ATOM 143 N PRO A 326 25.376 -5.607 -0.468 1.00 40.11 N ATOM 144 CA PRO A 326 26.383 -5.621 0.618 1.00 63.44 C ATOM 145 C PRO A 326 26.223 -4.489 1.636 1.00 44.01 C ATOM 146 O PRO A 326 26.817 -4.522 2.700 1.00 0.21 O ATOM 147 CB PRO A 326 27.714 -5.478 -0.132 1.00 63.25 C ATOM 148 CG PRO A 326 27.364 -4.781 -1.401 1.00 71.24 C ATOM 149 CD PRO A 326 25.988 -5.257 -1.774 1.00 4.30 C ATOM 0 HA PRO A 326 26.294 -6.527 1.217 1.00 63.44 H new ATOM 0 HB2 PRO A 326 28.435 -4.903 0.449 1.00 63.25 H new ATOM 0 HB3 PRO A 326 28.165 -6.451 -0.327 1.00 63.25 H new ATOM 0 HG2 PRO A 326 27.379 -3.699 -1.268 1.00 71.24 H new ATOM 0 HG3 PRO A 326 28.083 -5.016 -2.186 1.00 71.24 H new ATOM 0 HD2 PRO A 326 25.421 -4.481 -2.288 1.00 4.30 H new ATOM 0 HD3 PRO A 326 26.028 -6.118 -2.442 1.00 4.30 H new ATOM 157 N LYS A 327 25.418 -3.501 1.308 1.00 12.43 N ATOM 158 CA LYS A 327 25.209 -2.384 2.211 1.00 53.10 C ATOM 159 C LYS A 327 23.812 -2.519 2.833 1.00 3.32 C ATOM 160 O LYS A 327 23.313 -1.629 3.528 1.00 41.30 O ATOM 161 CB LYS A 327 25.387 -1.060 1.436 1.00 34.40 C ATOM 162 CG LYS A 327 25.745 0.133 2.313 1.00 21.53 C ATOM 163 CD LYS A 327 26.162 1.349 1.469 1.00 62.23 C ATOM 164 CE LYS A 327 26.729 2.489 2.327 1.00 44.11 C ATOM 165 NZ LYS A 327 27.126 3.687 1.509 1.00 51.22 N ATOM 0 H LYS A 327 24.900 -3.446 0.431 1.00 12.43 H new ATOM 0 HA LYS A 327 25.941 -2.384 3.019 1.00 53.10 H new ATOM 0 HB2 LYS A 327 26.167 -1.193 0.686 1.00 34.40 H new ATOM 0 HB3 LYS A 327 24.464 -0.839 0.900 1.00 34.40 H new ATOM 0 HG2 LYS A 327 24.890 0.397 2.936 1.00 21.53 H new ATOM 0 HG3 LYS A 327 26.558 -0.140 2.986 1.00 21.53 H new ATOM 0 HD2 LYS A 327 26.910 1.041 0.738 1.00 62.23 H new ATOM 0 HD3 LYS A 327 25.300 1.713 0.910 1.00 62.23 H new ATOM 0 HE2 LYS A 327 25.985 2.788 3.065 1.00 44.11 H new ATOM 0 HE3 LYS A 327 27.597 2.127 2.878 1.00 44.11 H new ATOM 0 HZ1 LYS A 327 27.968 4.130 1.929 1.00 51.22 H new ATOM 0 HZ2 LYS A 327 27.341 3.388 0.537 1.00 51.22 H new ATOM 0 HZ3 LYS A 327 26.344 4.373 1.495 1.00 51.22 H new ATOM 179 N GLY A 328 23.215 -3.667 2.562 1.00 12.43 N ATOM 180 CA GLY A 328 21.897 -4.001 3.049 1.00 31.42 C ATOM 181 C GLY A 328 20.849 -3.431 2.153 1.00 2.21 C ATOM 182 O GLY A 328 20.955 -3.531 0.911 1.00 34.13 O ATOM 0 H GLY A 328 23.640 -4.398 1.991 1.00 12.43 H new ATOM 0 HA2 GLY A 328 21.787 -5.084 3.104 1.00 31.42 H new ATOM 0 HA3 GLY A 328 21.768 -3.616 4.060 1.00 31.42 H new ATOM 186 N LEU A 329 19.836 -2.864 2.751 1.00 4.35 N ATOM 187 CA LEU A 329 18.848 -2.117 2.013 1.00 61.10 C ATOM 188 C LEU A 329 19.236 -0.664 2.163 1.00 14.54 C ATOM 189 O LEU A 329 18.928 0.187 1.306 1.00 0.41 O ATOM 190 CB LEU A 329 17.400 -2.331 2.516 1.00 60.24 C ATOM 191 CG LEU A 329 16.823 -3.763 2.514 1.00 12.01 C ATOM 192 CD1 LEU A 329 17.417 -4.614 3.617 1.00 12.43 C ATOM 193 CD2 LEU A 329 15.315 -3.725 2.636 1.00 73.52 C ATOM 0 H LEU A 329 19.671 -2.905 3.757 1.00 4.35 H new ATOM 0 HA LEU A 329 18.841 -2.455 0.977 1.00 61.10 H new ATOM 0 HB2 LEU A 329 17.345 -1.953 3.537 1.00 60.24 H new ATOM 0 HB3 LEU A 329 16.743 -1.708 1.909 1.00 60.24 H new ATOM 0 HG LEU A 329 17.094 -4.222 1.563 1.00 12.01 H new ATOM 0 HD11 LEU A 329 16.983 -5.613 3.579 1.00 12.43 H new ATOM 0 HD12 LEU A 329 18.497 -4.682 3.483 1.00 12.43 H new ATOM 0 HD13 LEU A 329 17.199 -4.160 4.584 1.00 12.43 H new ATOM 0 HD21 LEU A 329 14.924 -4.742 2.633 1.00 73.52 H new ATOM 0 HD22 LEU A 329 15.038 -3.232 3.568 1.00 73.52 H new ATOM 0 HD23 LEU A 329 14.896 -3.173 1.795 1.00 73.52 H new ATOM 205 N GLY A 330 19.930 -0.405 3.278 1.00 1.31 N ATOM 206 CA GLY A 330 20.533 0.869 3.550 1.00 42.02 C ATOM 207 C GLY A 330 19.599 1.915 4.076 1.00 0.21 C ATOM 208 O GLY A 330 19.482 2.984 3.512 1.00 15.52 O ATOM 0 H GLY A 330 20.080 -1.095 4.014 1.00 1.31 H new ATOM 0 HA2 GLY A 330 21.337 0.726 4.272 1.00 42.02 H new ATOM 0 HA3 GLY A 330 20.990 1.240 2.633 1.00 42.02 H new ATOM 212 N PHE A 331 18.914 1.602 5.119 1.00 44.23 N ATOM 213 CA PHE A 331 18.107 2.562 5.831 1.00 54.24 C ATOM 214 C PHE A 331 17.953 2.089 7.241 1.00 14.11 C ATOM 215 O PHE A 331 18.145 0.900 7.518 1.00 44.35 O ATOM 216 CB PHE A 331 16.750 2.851 5.137 1.00 11.33 C ATOM 217 CG PHE A 331 15.816 1.702 4.989 1.00 53.52 C ATOM 218 CD1 PHE A 331 15.871 0.887 3.881 1.00 3.43 C ATOM 219 CD2 PHE A 331 14.864 1.456 5.947 1.00 22.24 C ATOM 220 CE1 PHE A 331 14.992 -0.157 3.739 1.00 32.34 C ATOM 221 CE2 PHE A 331 13.984 0.419 5.808 1.00 24.30 C ATOM 222 CZ PHE A 331 14.046 -0.390 4.707 1.00 71.20 C ATOM 0 H PHE A 331 18.890 0.663 5.517 1.00 44.23 H new ATOM 0 HA PHE A 331 18.614 3.527 5.829 1.00 54.24 H new ATOM 0 HB2 PHE A 331 16.240 3.633 5.699 1.00 11.33 H new ATOM 0 HB3 PHE A 331 16.954 3.253 4.145 1.00 11.33 H new ATOM 0 HD1 PHE A 331 16.612 1.071 3.117 1.00 3.43 H new ATOM 0 HD2 PHE A 331 14.810 2.089 6.820 1.00 22.24 H new ATOM 0 HE1 PHE A 331 15.044 -0.794 2.868 1.00 32.34 H new ATOM 0 HE2 PHE A 331 13.239 0.238 6.569 1.00 24.30 H new ATOM 0 HZ PHE A 331 13.352 -1.211 4.599 1.00 71.20 H new ATOM 232 N SER A 332 17.648 2.978 8.113 1.00 25.43 N ATOM 233 CA SER A 332 17.533 2.667 9.492 1.00 43.32 C ATOM 234 C SER A 332 16.098 2.817 9.920 1.00 62.25 C ATOM 235 O SER A 332 15.425 3.789 9.555 1.00 52.44 O ATOM 236 CB SER A 332 18.454 3.571 10.290 1.00 74.42 C ATOM 237 OG SER A 332 19.768 3.531 9.735 1.00 63.40 O ATOM 0 H SER A 332 17.468 3.956 7.887 1.00 25.43 H new ATOM 0 HA SER A 332 17.832 1.635 9.675 1.00 43.32 H new ATOM 0 HB2 SER A 332 18.075 4.593 10.279 1.00 74.42 H new ATOM 0 HB3 SER A 332 18.479 3.252 11.332 1.00 74.42 H new ATOM 0 HG SER A 332 20.359 4.117 10.252 1.00 63.40 H new ATOM 243 N ILE A 333 15.619 1.851 10.634 1.00 12.01 N ATOM 244 CA ILE A 333 14.256 1.831 11.083 1.00 35.41 C ATOM 245 C ILE A 333 14.182 1.891 12.587 1.00 4.40 C ATOM 246 O ILE A 333 15.132 1.521 13.270 1.00 32.25 O ATOM 247 CB ILE A 333 13.516 0.557 10.590 1.00 52.15 C ATOM 248 CG1 ILE A 333 14.312 -0.723 10.961 1.00 32.10 C ATOM 249 CG2 ILE A 333 13.270 0.639 9.102 1.00 23.25 C ATOM 250 CD1 ILE A 333 13.617 -2.020 10.605 1.00 15.22 C ATOM 0 H ILE A 333 16.166 1.042 10.928 1.00 12.01 H new ATOM 0 HA ILE A 333 13.769 2.710 10.661 1.00 35.41 H new ATOM 0 HB ILE A 333 12.550 0.499 11.091 1.00 52.15 H new ATOM 0 HG12 ILE A 333 15.278 -0.693 10.458 1.00 32.10 H new ATOM 0 HG13 ILE A 333 14.511 -0.714 12.033 1.00 32.10 H new ATOM 0 HG21 ILE A 333 12.751 -0.260 8.769 1.00 23.25 H new ATOM 0 HG22 ILE A 333 12.658 1.514 8.882 1.00 23.25 H new ATOM 0 HG23 ILE A 333 14.223 0.722 8.580 1.00 23.25 H new ATOM 0 HD11 ILE A 333 14.244 -2.862 10.899 1.00 15.22 H new ATOM 0 HD12 ILE A 333 12.663 -2.077 11.129 1.00 15.22 H new ATOM 0 HD13 ILE A 333 13.443 -2.056 9.530 1.00 15.22 H new ATOM 262 N ALA A 334 13.078 2.387 13.074 1.00 61.04 N ATOM 263 CA ALA A 334 12.748 2.414 14.471 1.00 5.34 C ATOM 264 C ALA A 334 11.264 2.176 14.564 1.00 12.14 C ATOM 265 O ALA A 334 10.483 2.825 13.869 1.00 63.50 O ATOM 266 CB ALA A 334 13.123 3.744 15.115 1.00 45.13 C ATOM 0 H ALA A 334 12.355 2.800 12.484 1.00 61.04 H new ATOM 0 HA ALA A 334 13.308 1.649 15.009 1.00 5.34 H new ATOM 0 HB1 ALA A 334 12.857 3.724 16.172 1.00 45.13 H new ATOM 0 HB2 ALA A 334 14.196 3.908 15.014 1.00 45.13 H new ATOM 0 HB3 ALA A 334 12.584 4.552 14.621 1.00 45.13 H new ATOM 272 N GLY A 335 10.889 1.232 15.347 1.00 52.52 N ATOM 273 CA GLY A 335 9.510 0.862 15.466 1.00 60.40 C ATOM 274 C GLY A 335 9.414 -0.597 15.755 1.00 71.44 C ATOM 275 O GLY A 335 10.320 -1.350 15.397 1.00 21.25 O ATOM 0 H GLY A 335 11.525 0.687 15.929 1.00 52.52 H new ATOM 0 HA2 GLY A 335 9.036 1.434 16.263 1.00 60.40 H new ATOM 0 HA3 GLY A 335 8.978 1.098 14.544 1.00 60.40 H new ATOM 279 N GLY A 336 8.398 -0.991 16.439 1.00 2.31 N ATOM 280 CA GLY A 336 8.225 -2.368 16.803 1.00 22.24 C ATOM 281 C GLY A 336 7.857 -2.421 18.241 1.00 63.24 C ATOM 282 O GLY A 336 7.936 -1.386 18.886 1.00 75.13 O ATOM 0 H GLY A 336 7.657 -0.372 16.767 1.00 2.31 H new ATOM 0 HA2 GLY A 336 7.447 -2.828 16.194 1.00 22.24 H new ATOM 0 HA3 GLY A 336 9.143 -2.928 16.624 1.00 22.24 H new ATOM 286 N VAL A 337 7.487 -3.593 18.750 1.00 35.43 N ATOM 287 CA VAL A 337 7.086 -3.776 20.163 1.00 21.15 C ATOM 288 C VAL A 337 8.053 -3.073 21.118 1.00 3.54 C ATOM 289 O VAL A 337 9.239 -3.427 21.199 1.00 60.44 O ATOM 290 CB VAL A 337 6.994 -5.280 20.569 1.00 33.21 C ATOM 291 CG1 VAL A 337 6.548 -5.435 22.021 1.00 44.02 C ATOM 292 CG2 VAL A 337 6.057 -6.039 19.656 1.00 12.23 C ATOM 0 H VAL A 337 7.453 -4.452 18.201 1.00 35.43 H new ATOM 0 HA VAL A 337 6.095 -3.329 20.246 1.00 21.15 H new ATOM 0 HB VAL A 337 7.994 -5.703 20.467 1.00 33.21 H new ATOM 0 HG11 VAL A 337 6.493 -6.494 22.274 1.00 44.02 H new ATOM 0 HG12 VAL A 337 7.266 -4.942 22.677 1.00 44.02 H new ATOM 0 HG13 VAL A 337 5.566 -4.980 22.151 1.00 44.02 H new ATOM 0 HG21 VAL A 337 6.015 -7.083 19.965 1.00 12.23 H new ATOM 0 HG22 VAL A 337 5.060 -5.603 19.714 1.00 12.23 H new ATOM 0 HG23 VAL A 337 6.420 -5.979 18.630 1.00 12.23 H new ATOM 302 N GLY A 338 7.554 -2.025 21.750 1.00 54.53 N ATOM 303 CA GLY A 338 8.315 -1.281 22.730 1.00 51.54 C ATOM 304 C GLY A 338 9.018 -0.093 22.128 1.00 11.31 C ATOM 305 O GLY A 338 9.169 0.944 22.777 1.00 71.33 O ATOM 0 H GLY A 338 6.611 -1.669 21.596 1.00 54.53 H new ATOM 0 HA2 GLY A 338 7.648 -0.942 23.523 1.00 51.54 H new ATOM 0 HA3 GLY A 338 9.051 -1.940 23.192 1.00 51.54 H new ATOM 309 N ASN A 339 9.384 -0.212 20.873 1.00 31.21 N ATOM 310 CA ASN A 339 10.123 0.824 20.166 1.00 72.30 C ATOM 311 C ASN A 339 9.198 1.549 19.200 1.00 15.33 C ATOM 312 O ASN A 339 9.638 2.089 18.200 1.00 12.41 O ATOM 313 CB ASN A 339 11.330 0.216 19.414 1.00 64.12 C ATOM 314 CG ASN A 339 12.300 1.274 18.845 1.00 11.51 C ATOM 315 OD1 ASN A 339 12.402 2.381 19.362 1.00 12.11 O ATOM 316 ND2 ASN A 339 13.065 0.910 17.840 1.00 71.24 N ATOM 0 H ASN A 339 9.179 -1.034 20.304 1.00 31.21 H new ATOM 0 HA ASN A 339 10.506 1.541 20.892 1.00 72.30 H new ATOM 0 HB2 ASN A 339 11.877 -0.439 20.092 1.00 64.12 H new ATOM 0 HB3 ASN A 339 10.963 -0.405 18.597 1.00 64.12 H new ATOM 0 HD21 ASN A 339 13.764 1.555 17.472 1.00 71.24 H new ATOM 0 HD22 ASN A 339 12.959 -0.017 17.428 1.00 71.24 H new ATOM 323 N GLN A 340 7.904 1.556 19.523 1.00 74.23 N ATOM 324 CA GLN A 340 6.905 2.253 18.739 1.00 13.03 C ATOM 325 C GLN A 340 7.365 3.694 18.473 1.00 12.12 C ATOM 326 O GLN A 340 7.738 4.441 19.417 1.00 42.10 O ATOM 327 CB GLN A 340 5.527 2.171 19.441 1.00 75.45 C ATOM 328 CG GLN A 340 5.454 2.787 20.836 1.00 22.33 C ATOM 329 CD GLN A 340 4.704 4.108 20.867 1.00 63.11 C ATOM 330 OE1 GLN A 340 3.504 4.147 21.089 1.00 45.43 O ATOM 331 NE2 GLN A 340 5.387 5.182 20.596 1.00 61.23 N ATOM 0 H GLN A 340 7.527 1.075 20.339 1.00 74.23 H new ATOM 0 HA GLN A 340 6.787 1.775 17.767 1.00 13.03 H new ATOM 0 HB2 GLN A 340 4.788 2.663 18.808 1.00 75.45 H new ATOM 0 HB3 GLN A 340 5.238 1.122 19.512 1.00 75.45 H new ATOM 0 HG2 GLN A 340 4.967 2.084 21.512 1.00 22.33 H new ATOM 0 HG3 GLN A 340 6.466 2.942 21.212 1.00 22.33 H new ATOM 0 HE21 GLN A 340 6.389 5.117 20.415 1.00 61.23 H new ATOM 0 HE22 GLN A 340 4.921 6.089 20.565 1.00 61.23 H new ATOM 340 N HIS A 341 7.419 4.037 17.209 1.00 32.22 N ATOM 341 CA HIS A 341 7.966 5.305 16.766 1.00 71.34 C ATOM 342 C HIS A 341 6.969 6.412 17.047 1.00 13.23 C ATOM 343 O HIS A 341 7.278 7.394 17.710 1.00 65.50 O ATOM 344 CB HIS A 341 8.281 5.210 15.261 1.00 43.05 C ATOM 345 CG HIS A 341 9.100 6.338 14.689 1.00 64.23 C ATOM 346 ND1 HIS A 341 10.372 6.172 14.184 1.00 21.31 N ATOM 347 CD2 HIS A 341 8.794 7.644 14.494 1.00 42.04 C ATOM 348 CE1 HIS A 341 10.787 7.349 13.713 1.00 52.52 C ATOM 349 NE2 HIS A 341 9.867 8.276 13.876 1.00 71.14 N ATOM 0 H HIS A 341 7.084 3.443 16.451 1.00 32.22 H new ATOM 0 HA HIS A 341 8.886 5.533 17.305 1.00 71.34 H new ATOM 0 HB2 HIS A 341 8.809 4.274 15.078 1.00 43.05 H new ATOM 0 HB3 HIS A 341 7.339 5.157 14.715 1.00 43.05 H new ATOM 0 HD2 HIS A 341 7.865 8.118 14.774 1.00 42.04 H new ATOM 0 HE1 HIS A 341 11.751 7.519 13.258 1.00 52.52 H new ATOM 0 HE2 HIS A 341 9.929 9.257 13.604 1.00 71.14 H new ATOM 357 N ILE A 342 5.773 6.214 16.588 1.00 4.02 N ATOM 358 CA ILE A 342 4.722 7.176 16.785 1.00 71.14 C ATOM 359 C ILE A 342 3.807 6.650 17.897 1.00 43.31 C ATOM 360 O ILE A 342 3.512 5.461 17.925 1.00 54.22 O ATOM 361 CB ILE A 342 3.929 7.395 15.452 1.00 13.14 C ATOM 362 CG1 ILE A 342 4.888 7.903 14.357 1.00 44.21 C ATOM 363 CG2 ILE A 342 2.764 8.368 15.641 1.00 53.31 C ATOM 364 CD1 ILE A 342 4.251 8.079 12.996 1.00 4.41 C ATOM 0 H ILE A 342 5.493 5.384 16.066 1.00 4.02 H new ATOM 0 HA ILE A 342 5.134 8.142 17.076 1.00 71.14 H new ATOM 0 HB ILE A 342 3.504 6.439 15.146 1.00 13.14 H new ATOM 0 HG12 ILE A 342 5.307 8.858 14.674 1.00 44.21 H new ATOM 0 HG13 ILE A 342 5.719 7.204 14.267 1.00 44.21 H new ATOM 0 HG21 ILE A 342 2.238 8.494 14.695 1.00 53.31 H new ATOM 0 HG22 ILE A 342 2.076 7.972 16.388 1.00 53.31 H new ATOM 0 HG23 ILE A 342 3.146 9.333 15.975 1.00 53.31 H new ATOM 0 HD11 ILE A 342 4.998 8.439 12.288 1.00 4.41 H new ATOM 0 HD12 ILE A 342 3.857 7.123 12.652 1.00 4.41 H new ATOM 0 HD13 ILE A 342 3.439 8.802 13.065 1.00 4.41 H new ATOM 376 N PRO A 343 3.440 7.509 18.887 1.00 71.14 N ATOM 377 CA PRO A 343 2.586 7.120 20.025 1.00 32.22 C ATOM 378 C PRO A 343 1.284 6.428 19.611 1.00 11.53 C ATOM 379 O PRO A 343 0.403 7.037 19.013 1.00 24.32 O ATOM 380 CB PRO A 343 2.291 8.449 20.748 1.00 20.42 C ATOM 381 CG PRO A 343 2.745 9.524 19.816 1.00 14.21 C ATOM 382 CD PRO A 343 3.836 8.925 18.982 1.00 64.11 C ATOM 0 HA PRO A 343 3.091 6.384 20.650 1.00 32.22 H new ATOM 0 HB2 PRO A 343 1.228 8.546 20.971 1.00 20.42 H new ATOM 0 HB3 PRO A 343 2.822 8.504 21.698 1.00 20.42 H new ATOM 0 HG2 PRO A 343 1.922 9.869 19.190 1.00 14.21 H new ATOM 0 HG3 PRO A 343 3.109 10.390 20.369 1.00 14.21 H new ATOM 0 HD2 PRO A 343 3.897 9.394 18.000 1.00 64.11 H new ATOM 0 HD3 PRO A 343 4.813 9.040 19.452 1.00 64.11 H new ATOM 390 N GLY A 344 1.206 5.146 19.912 1.00 51.12 N ATOM 391 CA GLY A 344 0.030 4.371 19.609 1.00 5.22 C ATOM 392 C GLY A 344 0.179 3.595 18.325 1.00 61.43 C ATOM 393 O GLY A 344 -0.682 2.797 17.971 1.00 43.13 O ATOM 0 H GLY A 344 1.951 4.621 20.369 1.00 51.12 H new ATOM 0 HA2 GLY A 344 -0.170 3.681 20.428 1.00 5.22 H new ATOM 0 HA3 GLY A 344 -0.832 5.034 19.534 1.00 5.22 H new ATOM 397 N ASP A 345 1.280 3.805 17.645 1.00 72.01 N ATOM 398 CA ASP A 345 1.519 3.168 16.369 1.00 34.21 C ATOM 399 C ASP A 345 2.790 2.320 16.470 1.00 72.31 C ATOM 400 O ASP A 345 3.918 2.810 16.308 1.00 64.35 O ATOM 401 CB ASP A 345 1.662 4.243 15.288 1.00 13.31 C ATOM 402 CG ASP A 345 1.600 3.714 13.885 1.00 50.25 C ATOM 403 OD1 ASP A 345 2.174 2.667 13.608 1.00 70.31 O ATOM 404 OD2 ASP A 345 0.967 4.371 13.020 1.00 23.34 O ATOM 0 H ASP A 345 2.033 4.418 17.957 1.00 72.01 H new ATOM 0 HA ASP A 345 0.684 2.520 16.102 1.00 34.21 H new ATOM 0 HB2 ASP A 345 0.873 4.983 15.421 1.00 13.31 H new ATOM 0 HB3 ASP A 345 2.611 4.760 15.428 1.00 13.31 H new ATOM 409 N ASN A 346 2.610 1.045 16.713 1.00 74.30 N ATOM 410 CA ASN A 346 3.704 0.133 17.008 1.00 5.40 C ATOM 411 C ASN A 346 4.333 -0.401 15.708 1.00 41.21 C ATOM 412 O ASN A 346 4.927 -1.480 15.676 1.00 41.45 O ATOM 413 CB ASN A 346 3.126 -1.018 17.823 1.00 24.03 C ATOM 414 CG ASN A 346 4.158 -1.749 18.633 1.00 20.24 C ATOM 415 OD1 ASN A 346 5.141 -1.166 19.101 1.00 43.00 O ATOM 416 ND2 ASN A 346 3.931 -2.987 18.837 1.00 73.31 N ATOM 0 H ASN A 346 1.692 0.600 16.713 1.00 74.30 H new ATOM 0 HA ASN A 346 4.488 0.648 17.564 1.00 5.40 H new ATOM 0 HB2 ASN A 346 2.357 -0.631 18.491 1.00 24.03 H new ATOM 0 HB3 ASN A 346 2.638 -1.722 17.149 1.00 24.03 H new ATOM 0 HD21 ASN A 346 4.574 -3.536 19.407 1.00 73.31 H new ATOM 0 HD22 ASN A 346 3.106 -3.428 18.431 1.00 73.31 H new ATOM 423 N SER A 347 4.265 0.390 14.665 1.00 42.45 N ATOM 424 CA SER A 347 4.743 -0.047 13.367 1.00 63.24 C ATOM 425 C SER A 347 6.205 0.307 13.176 1.00 14.14 C ATOM 426 O SER A 347 6.774 1.116 13.930 1.00 63.52 O ATOM 427 CB SER A 347 3.916 0.581 12.258 1.00 1.44 C ATOM 428 OG SER A 347 2.533 0.376 12.488 1.00 53.20 O ATOM 0 H SER A 347 3.886 1.337 14.684 1.00 42.45 H new ATOM 0 HA SER A 347 4.640 -1.131 13.323 1.00 63.24 H new ATOM 0 HB2 SER A 347 4.126 1.649 12.201 1.00 1.44 H new ATOM 0 HB3 SER A 347 4.198 0.149 11.298 1.00 1.44 H new ATOM 0 HG SER A 347 2.159 1.156 12.948 1.00 53.20 H new ATOM 434 N ILE A 348 6.815 -0.307 12.187 1.00 13.44 N ATOM 435 CA ILE A 348 8.177 -0.038 11.850 1.00 32.40 C ATOM 436 C ILE A 348 8.227 1.259 11.030 1.00 14.14 C ATOM 437 O ILE A 348 7.551 1.369 10.010 1.00 53.22 O ATOM 438 CB ILE A 348 8.739 -1.185 10.987 1.00 21.14 C ATOM 439 CG1 ILE A 348 8.404 -2.570 11.584 1.00 75.11 C ATOM 440 CG2 ILE A 348 10.230 -1.030 10.797 1.00 23.21 C ATOM 441 CD1 ILE A 348 8.884 -2.791 12.998 1.00 11.25 C ATOM 0 H ILE A 348 6.370 -1.009 11.596 1.00 13.44 H new ATOM 0 HA ILE A 348 8.768 0.055 12.761 1.00 32.40 H new ATOM 0 HB ILE A 348 8.257 -1.126 10.011 1.00 21.14 H new ATOM 0 HG12 ILE A 348 7.323 -2.708 11.558 1.00 75.11 H new ATOM 0 HG13 ILE A 348 8.839 -3.339 10.945 1.00 75.11 H new ATOM 0 HG21 ILE A 348 10.606 -1.850 10.185 1.00 23.21 H new ATOM 0 HG22 ILE A 348 10.437 -0.082 10.300 1.00 23.21 H new ATOM 0 HG23 ILE A 348 10.724 -1.046 11.768 1.00 23.21 H new ATOM 0 HD11 ILE A 348 8.601 -3.791 13.326 1.00 11.25 H new ATOM 0 HD12 ILE A 348 9.969 -2.691 13.034 1.00 11.25 H new ATOM 0 HD13 ILE A 348 8.430 -2.051 13.656 1.00 11.25 H new ATOM 453 N TYR A 349 9.009 2.220 11.461 1.00 11.03 N ATOM 454 CA TYR A 349 9.105 3.491 10.763 1.00 54.30 C ATOM 455 C TYR A 349 10.534 3.813 10.374 1.00 44.10 C ATOM 456 O TYR A 349 11.460 3.699 11.189 1.00 71.40 O ATOM 457 CB TYR A 349 8.486 4.624 11.607 1.00 22.21 C ATOM 458 CG TYR A 349 6.987 4.666 11.542 1.00 2.53 C ATOM 459 CD1 TYR A 349 6.364 5.382 10.545 1.00 52.01 C ATOM 460 CD2 TYR A 349 6.198 3.982 12.450 1.00 63.10 C ATOM 461 CE1 TYR A 349 5.003 5.421 10.443 1.00 73.45 C ATOM 462 CE2 TYR A 349 4.824 4.007 12.350 1.00 5.40 C ATOM 463 CZ TYR A 349 4.232 4.729 11.341 1.00 45.23 C ATOM 464 OH TYR A 349 2.863 4.748 11.211 1.00 64.10 O ATOM 0 H TYR A 349 9.592 2.150 12.295 1.00 11.03 H new ATOM 0 HA TYR A 349 8.535 3.404 9.838 1.00 54.30 H new ATOM 0 HB2 TYR A 349 8.794 4.503 12.646 1.00 22.21 H new ATOM 0 HB3 TYR A 349 8.884 5.580 11.266 1.00 22.21 H new ATOM 0 HD1 TYR A 349 6.964 5.924 9.829 1.00 52.01 H new ATOM 0 HD2 TYR A 349 6.665 3.422 13.247 1.00 63.10 H new ATOM 0 HE1 TYR A 349 4.535 5.995 9.657 1.00 73.45 H new ATOM 0 HE2 TYR A 349 4.217 3.464 13.059 1.00 5.40 H new ATOM 0 HH TYR A 349 2.455 4.968 12.075 1.00 64.10 H new ATOM 474 N VAL A 350 10.713 4.166 9.114 1.00 25.05 N ATOM 475 CA VAL A 350 12.013 4.526 8.569 1.00 13.23 C ATOM 476 C VAL A 350 12.493 5.819 9.224 1.00 73.14 C ATOM 477 O VAL A 350 11.869 6.850 9.089 1.00 2.55 O ATOM 478 CB VAL A 350 11.947 4.711 7.026 1.00 12.04 C ATOM 479 CG1 VAL A 350 13.315 5.056 6.455 1.00 64.01 C ATOM 480 CG2 VAL A 350 11.394 3.460 6.355 1.00 45.22 C ATOM 0 H VAL A 350 9.955 4.212 8.433 1.00 25.05 H new ATOM 0 HA VAL A 350 12.713 3.718 8.781 1.00 13.23 H new ATOM 0 HB VAL A 350 11.273 5.543 6.820 1.00 12.04 H new ATOM 0 HG11 VAL A 350 13.238 5.179 5.375 1.00 64.01 H new ATOM 0 HG12 VAL A 350 13.672 5.984 6.902 1.00 64.01 H new ATOM 0 HG13 VAL A 350 14.016 4.252 6.679 1.00 64.01 H new ATOM 0 HG21 VAL A 350 11.357 3.612 5.276 1.00 45.22 H new ATOM 0 HG22 VAL A 350 12.040 2.611 6.580 1.00 45.22 H new ATOM 0 HG23 VAL A 350 10.389 3.261 6.728 1.00 45.22 H new ATOM 490 N THR A 351 13.582 5.742 9.927 1.00 75.44 N ATOM 491 CA THR A 351 14.107 6.862 10.679 1.00 51.44 C ATOM 492 C THR A 351 15.240 7.532 9.915 1.00 74.34 C ATOM 493 O THR A 351 15.622 8.680 10.196 1.00 5.43 O ATOM 494 CB THR A 351 14.675 6.317 11.975 1.00 13.00 C ATOM 495 OG1 THR A 351 13.747 5.339 12.459 1.00 34.44 O ATOM 496 CG2 THR A 351 14.825 7.417 13.023 1.00 51.31 C ATOM 0 H THR A 351 14.144 4.894 10.001 1.00 75.44 H new ATOM 0 HA THR A 351 13.314 7.589 10.854 1.00 51.44 H new ATOM 0 HB THR A 351 15.662 5.893 11.794 1.00 13.00 H new ATOM 0 HG1 THR A 351 12.930 5.786 12.765 1.00 34.44 H new ATOM 0 HG21 THR A 351 15.235 6.993 13.940 1.00 51.31 H new ATOM 0 HG22 THR A 351 15.498 8.188 12.648 1.00 51.31 H new ATOM 0 HG23 THR A 351 13.850 7.857 13.231 1.00 51.31 H new ATOM 504 N LYS A 352 15.789 6.826 8.960 1.00 51.35 N ATOM 505 CA LYS A 352 16.919 7.322 8.252 1.00 62.32 C ATOM 506 C LYS A 352 17.111 6.478 7.040 1.00 62.54 C ATOM 507 O LYS A 352 16.707 5.330 7.038 1.00 14.01 O ATOM 508 CB LYS A 352 18.127 7.179 9.158 1.00 31.52 C ATOM 509 CG LYS A 352 19.320 8.013 8.784 1.00 61.41 C ATOM 510 CD LYS A 352 20.377 8.050 9.900 1.00 71.24 C ATOM 511 CE LYS A 352 19.986 8.958 11.104 1.00 72.33 C ATOM 512 NZ LYS A 352 18.735 8.555 11.795 1.00 34.52 N ATOM 0 H LYS A 352 15.465 5.906 8.662 1.00 51.35 H new ATOM 0 HA LYS A 352 16.784 8.364 7.962 1.00 62.32 H new ATOM 0 HB2 LYS A 352 17.829 7.437 10.174 1.00 31.52 H new ATOM 0 HB3 LYS A 352 18.428 6.131 9.170 1.00 31.52 H new ATOM 0 HG2 LYS A 352 19.769 7.614 7.874 1.00 61.41 H new ATOM 0 HG3 LYS A 352 18.995 9.029 8.560 1.00 61.41 H new ATOM 0 HD2 LYS A 352 20.546 7.036 10.261 1.00 71.24 H new ATOM 0 HD3 LYS A 352 21.321 8.401 9.483 1.00 71.24 H new ATOM 0 HE2 LYS A 352 20.803 8.955 11.826 1.00 72.33 H new ATOM 0 HE3 LYS A 352 19.877 9.983 10.750 1.00 72.33 H new ATOM 0 HZ1 LYS A 352 18.849 8.680 12.821 1.00 34.52 H new ATOM 0 HZ2 LYS A 352 17.947 9.146 11.460 1.00 34.52 H new ATOM 0 HZ3 LYS A 352 18.531 7.556 11.589 1.00 34.52 H new ATOM 526 N ILE A 353 17.692 7.031 6.022 1.00 62.45 N ATOM 527 CA ILE A 353 17.996 6.296 4.834 1.00 32.32 C ATOM 528 C ILE A 353 19.481 6.504 4.547 1.00 2.23 C ATOM 529 O ILE A 353 19.941 7.636 4.433 1.00 21.33 O ATOM 530 CB ILE A 353 17.115 6.745 3.627 1.00 11.42 C ATOM 531 CG1 ILE A 353 15.620 6.620 3.970 1.00 51.03 C ATOM 532 CG2 ILE A 353 17.424 5.887 2.418 1.00 2.51 C ATOM 533 CD1 ILE A 353 14.697 7.121 2.886 1.00 52.43 C ATOM 0 H ILE A 353 17.971 8.012 5.991 1.00 62.45 H new ATOM 0 HA ILE A 353 17.776 5.239 4.981 1.00 32.32 H new ATOM 0 HB ILE A 353 17.341 7.788 3.406 1.00 11.42 H new ATOM 0 HG12 ILE A 353 15.391 5.574 4.173 1.00 51.03 H new ATOM 0 HG13 ILE A 353 15.421 7.174 4.887 1.00 51.03 H new ATOM 0 HG21 ILE A 353 16.806 6.205 1.578 1.00 2.51 H new ATOM 0 HG22 ILE A 353 18.476 5.994 2.155 1.00 2.51 H new ATOM 0 HG23 ILE A 353 17.213 4.843 2.649 1.00 2.51 H new ATOM 0 HD11 ILE A 353 13.662 6.998 3.204 1.00 52.43 H new ATOM 0 HD12 ILE A 353 14.896 8.176 2.697 1.00 52.43 H new ATOM 0 HD13 ILE A 353 14.866 6.551 1.972 1.00 52.43 H new ATOM 545 N ILE A 354 20.219 5.425 4.528 1.00 74.54 N ATOM 546 CA ILE A 354 21.662 5.450 4.359 1.00 55.33 C ATOM 547 C ILE A 354 22.006 5.464 2.873 1.00 43.33 C ATOM 548 O ILE A 354 21.555 4.571 2.109 1.00 33.52 O ATOM 549 CB ILE A 354 22.313 4.200 5.029 1.00 40.32 C ATOM 550 CG1 ILE A 354 21.881 4.070 6.509 1.00 32.25 C ATOM 551 CG2 ILE A 354 23.839 4.236 4.913 1.00 44.11 C ATOM 552 CD1 ILE A 354 22.271 5.242 7.398 1.00 44.43 C ATOM 0 H ILE A 354 19.835 4.485 4.631 1.00 74.54 H new ATOM 0 HA ILE A 354 22.052 6.350 4.836 1.00 55.33 H new ATOM 0 HB ILE A 354 21.956 3.321 4.493 1.00 40.32 H new ATOM 0 HG12 ILE A 354 20.798 3.949 6.547 1.00 32.25 H new ATOM 0 HG13 ILE A 354 22.318 3.160 6.921 1.00 32.25 H new ATOM 0 HG21 ILE A 354 24.261 3.351 5.390 1.00 44.11 H new ATOM 0 HG22 ILE A 354 24.124 4.252 3.861 1.00 44.11 H new ATOM 0 HG23 ILE A 354 24.220 5.130 5.406 1.00 44.11 H new ATOM 0 HD11 ILE A 354 21.925 5.058 8.415 1.00 44.43 H new ATOM 0 HD12 ILE A 354 23.355 5.354 7.398 1.00 44.43 H new ATOM 0 HD13 ILE A 354 21.812 6.155 7.018 1.00 44.43 H new ATOM 564 N GLU A 355 22.809 6.443 2.436 1.00 54.25 N ATOM 565 CA GLU A 355 23.153 6.514 1.048 1.00 2.25 C ATOM 566 C GLU A 355 23.911 5.260 0.683 1.00 31.32 C ATOM 567 O GLU A 355 24.609 4.669 1.516 1.00 45.51 O ATOM 568 CB GLU A 355 23.950 7.814 0.681 1.00 25.23 C ATOM 569 CG GLU A 355 25.490 7.804 0.847 1.00 21.31 C ATOM 570 CD GLU A 355 26.183 6.954 -0.231 1.00 63.35 C ATOM 571 OE1 GLU A 355 25.904 7.182 -1.456 1.00 43.23 O ATOM 572 OE2 GLU A 355 26.919 6.000 0.127 1.00 63.25 O ATOM 0 H GLU A 355 23.214 7.172 3.024 1.00 54.25 H new ATOM 0 HA GLU A 355 22.237 6.575 0.460 1.00 2.25 H new ATOM 0 HB2 GLU A 355 23.729 8.057 -0.359 1.00 25.23 H new ATOM 0 HB3 GLU A 355 23.556 8.628 1.289 1.00 25.23 H new ATOM 0 HG2 GLU A 355 25.866 8.826 0.799 1.00 21.31 H new ATOM 0 HG3 GLU A 355 25.745 7.416 1.833 1.00 21.31 H new ATOM 579 N GLY A 356 23.749 4.830 -0.513 1.00 41.22 N ATOM 580 CA GLY A 356 24.430 3.650 -0.951 1.00 41.21 C ATOM 581 C GLY A 356 23.543 2.478 -0.801 1.00 11.42 C ATOM 582 O GLY A 356 23.775 1.439 -1.398 1.00 22.22 O ATOM 0 H GLY A 356 23.153 5.271 -1.213 1.00 41.22 H new ATOM 0 HA2 GLY A 356 24.732 3.758 -1.993 1.00 41.21 H new ATOM 0 HA3 GLY A 356 25.340 3.506 -0.368 1.00 41.21 H new ATOM 586 N GLY A 357 22.528 2.641 0.024 1.00 53.23 N ATOM 587 CA GLY A 357 21.552 1.652 0.143 1.00 62.21 C ATOM 588 C GLY A 357 20.698 1.648 -1.074 1.00 60.24 C ATOM 589 O GLY A 357 20.492 2.724 -1.715 1.00 41.21 O ATOM 0 H GLY A 357 22.384 3.463 0.611 1.00 53.23 H new ATOM 0 HA2 GLY A 357 22.021 0.677 0.274 1.00 62.21 H new ATOM 0 HA3 GLY A 357 20.942 1.833 1.028 1.00 62.21 H new ATOM 593 N ALA A 358 20.186 0.489 -1.407 1.00 22.40 N ATOM 594 CA ALA A 358 19.311 0.334 -2.535 1.00 42.23 C ATOM 595 C ALA A 358 18.127 1.256 -2.373 1.00 60.21 C ATOM 596 O ALA A 358 17.691 1.891 -3.318 1.00 12.25 O ATOM 597 CB ALA A 358 18.847 -1.106 -2.649 1.00 10.31 C ATOM 0 H ALA A 358 20.368 -0.376 -0.898 1.00 22.40 H new ATOM 0 HA ALA A 358 19.848 0.591 -3.448 1.00 42.23 H new ATOM 0 HB1 ALA A 358 18.184 -1.208 -3.509 1.00 10.31 H new ATOM 0 HB2 ALA A 358 19.711 -1.758 -2.778 1.00 10.31 H new ATOM 0 HB3 ALA A 358 18.311 -1.389 -1.743 1.00 10.31 H new ATOM 603 N ALA A 359 17.677 1.404 -1.142 1.00 31.11 N ATOM 604 CA ALA A 359 16.529 2.222 -0.881 1.00 13.43 C ATOM 605 C ALA A 359 16.831 3.732 -0.942 1.00 51.32 C ATOM 606 O ALA A 359 15.915 4.543 -0.971 1.00 50.13 O ATOM 607 CB ALA A 359 15.848 1.847 0.414 1.00 14.33 C ATOM 0 H ALA A 359 18.092 0.968 -0.318 1.00 31.11 H new ATOM 0 HA ALA A 359 15.832 2.016 -1.693 1.00 13.43 H new ATOM 0 HB1 ALA A 359 14.984 2.493 0.571 1.00 14.33 H new ATOM 0 HB2 ALA A 359 15.521 0.808 0.366 1.00 14.33 H new ATOM 0 HB3 ALA A 359 16.547 1.969 1.241 1.00 14.33 H new ATOM 613 N HIS A 360 18.091 4.106 -0.954 1.00 72.32 N ATOM 614 CA HIS A 360 18.414 5.518 -1.066 1.00 30.12 C ATOM 615 C HIS A 360 18.643 5.841 -2.529 1.00 61.41 C ATOM 616 O HIS A 360 18.416 6.959 -2.978 1.00 13.42 O ATOM 617 CB HIS A 360 19.673 5.889 -0.262 1.00 15.33 C ATOM 618 CG HIS A 360 19.867 7.389 -0.045 1.00 10.20 C ATOM 619 ND1 HIS A 360 19.775 8.345 -1.039 1.00 3.34 N ATOM 620 CD2 HIS A 360 20.151 8.075 1.088 1.00 33.14 C ATOM 621 CE1 HIS A 360 20.010 9.539 -0.491 1.00 3.35 C ATOM 622 NE2 HIS A 360 20.243 9.431 0.794 1.00 72.14 N ATOM 0 H HIS A 360 18.891 3.476 -0.890 1.00 72.32 H new ATOM 0 HA HIS A 360 17.583 6.094 -0.659 1.00 30.12 H new ATOM 0 HB2 HIS A 360 19.626 5.397 0.710 1.00 15.33 H new ATOM 0 HB3 HIS A 360 20.548 5.493 -0.778 1.00 15.33 H new ATOM 0 HD1 HIS A 360 19.564 8.169 -2.021 1.00 3.34 H new ATOM 0 HD2 HIS A 360 20.285 7.637 2.066 1.00 33.14 H new ATOM 0 HE1 HIS A 360 20.008 10.472 -1.035 1.00 3.35 H new ATOM 630 N LYS A 361 19.141 4.875 -3.263 1.00 24.03 N ATOM 631 CA LYS A 361 19.401 5.102 -4.665 1.00 32.23 C ATOM 632 C LYS A 361 18.133 4.871 -5.495 1.00 24.23 C ATOM 633 O LYS A 361 17.661 5.760 -6.180 1.00 33.50 O ATOM 634 CB LYS A 361 20.526 4.187 -5.152 1.00 3.31 C ATOM 635 CG LYS A 361 21.886 4.332 -4.421 1.00 12.32 C ATOM 636 CD LYS A 361 22.509 5.746 -4.494 1.00 23.23 C ATOM 637 CE LYS A 361 23.851 5.775 -3.730 1.00 12.12 C ATOM 638 NZ LYS A 361 24.493 7.123 -3.657 1.00 64.12 N ATOM 0 H LYS A 361 19.371 3.941 -2.922 1.00 24.03 H new ATOM 0 HA LYS A 361 19.712 6.139 -4.792 1.00 32.23 H new ATOM 0 HB2 LYS A 361 20.193 3.153 -5.057 1.00 3.31 H new ATOM 0 HB3 LYS A 361 20.685 4.374 -6.214 1.00 3.31 H new ATOM 0 HG2 LYS A 361 21.751 4.062 -3.374 1.00 12.32 H new ATOM 0 HG3 LYS A 361 22.590 3.617 -4.846 1.00 12.32 H new ATOM 0 HD2 LYS A 361 22.668 6.028 -5.535 1.00 23.23 H new ATOM 0 HD3 LYS A 361 21.822 6.477 -4.067 1.00 23.23 H new ATOM 0 HE2 LYS A 361 23.686 5.410 -2.716 1.00 12.12 H new ATOM 0 HE3 LYS A 361 24.543 5.082 -4.209 1.00 12.12 H new ATOM 0 HZ1 LYS A 361 25.270 7.100 -2.967 1.00 64.12 H new ATOM 0 HZ2 LYS A 361 24.868 7.380 -4.592 1.00 64.12 H new ATOM 0 HZ3 LYS A 361 23.788 7.828 -3.361 1.00 64.12 H new ATOM 652 N ASP A 362 17.601 3.680 -5.392 1.00 34.22 N ATOM 653 CA ASP A 362 16.373 3.270 -6.103 1.00 72.14 C ATOM 654 C ASP A 362 15.174 3.628 -5.337 1.00 74.32 C ATOM 655 O ASP A 362 14.206 4.159 -5.863 1.00 61.15 O ATOM 656 CB ASP A 362 16.295 1.758 -6.186 1.00 45.43 C ATOM 657 CG ASP A 362 14.931 1.286 -6.725 1.00 25.33 C ATOM 658 OD1 ASP A 362 14.620 1.487 -7.911 1.00 52.32 O ATOM 659 OD2 ASP A 362 14.090 0.831 -5.906 1.00 30.11 O ATOM 0 H ASP A 362 17.999 2.943 -4.809 1.00 34.22 H new ATOM 0 HA ASP A 362 16.411 3.758 -7.077 1.00 72.14 H new ATOM 0 HB2 ASP A 362 17.090 1.388 -6.833 1.00 45.43 H new ATOM 0 HB3 ASP A 362 16.463 1.330 -5.198 1.00 45.43 H new ATOM 664 N GLY A 363 15.320 3.377 -4.070 1.00 55.35 N ATOM 665 CA GLY A 363 14.239 3.196 -3.110 1.00 20.11 C ATOM 666 C GLY A 363 13.060 4.093 -3.133 1.00 54.21 C ATOM 667 O GLY A 363 12.032 3.669 -2.667 1.00 74.43 O ATOM 0 H GLY A 363 16.241 3.285 -3.642 1.00 55.35 H new ATOM 0 HA2 GLY A 363 13.871 2.177 -3.227 1.00 20.11 H new ATOM 0 HA3 GLY A 363 14.677 3.265 -2.114 1.00 20.11 H new ATOM 671 N LYS A 364 13.177 5.294 -3.677 1.00 54.14 N ATOM 672 CA LYS A 364 12.071 6.299 -3.723 1.00 24.32 C ATOM 673 C LYS A 364 11.299 6.368 -2.369 1.00 14.21 C ATOM 674 O LYS A 364 10.119 6.698 -2.318 1.00 24.34 O ATOM 675 CB LYS A 364 11.095 6.099 -4.983 1.00 41.34 C ATOM 676 CG LYS A 364 10.114 4.860 -5.044 1.00 11.21 C ATOM 677 CD LYS A 364 10.761 3.482 -5.359 1.00 24.12 C ATOM 678 CE LYS A 364 11.434 3.421 -6.724 1.00 33.10 C ATOM 679 NZ LYS A 364 12.075 2.097 -6.994 1.00 23.21 N ATOM 0 H LYS A 364 14.041 5.623 -4.109 1.00 54.14 H new ATOM 0 HA LYS A 364 12.540 7.272 -3.871 1.00 24.32 H new ATOM 0 HB2 LYS A 364 10.484 6.998 -5.064 1.00 41.34 H new ATOM 0 HB3 LYS A 364 11.722 6.058 -5.874 1.00 41.34 H new ATOM 0 HG2 LYS A 364 9.599 4.785 -4.087 1.00 11.21 H new ATOM 0 HG3 LYS A 364 9.355 5.062 -5.800 1.00 11.21 H new ATOM 0 HD2 LYS A 364 11.498 3.252 -4.590 1.00 24.12 H new ATOM 0 HD3 LYS A 364 9.994 2.710 -5.307 1.00 24.12 H new ATOM 0 HE2 LYS A 364 10.695 3.627 -7.498 1.00 33.10 H new ATOM 0 HE3 LYS A 364 12.189 4.205 -6.788 1.00 33.10 H new ATOM 0 HZ1 LYS A 364 12.761 2.195 -7.769 1.00 23.21 H new ATOM 0 HZ2 LYS A 364 12.565 1.767 -6.138 1.00 23.21 H new ATOM 0 HZ3 LYS A 364 11.345 1.406 -7.263 1.00 23.21 H new ATOM 693 N LEU A 365 12.045 6.132 -1.297 1.00 1.04 N ATOM 694 CA LEU A 365 11.530 5.963 0.044 1.00 53.25 C ATOM 695 C LEU A 365 11.691 7.255 0.824 1.00 33.23 C ATOM 696 O LEU A 365 12.593 8.057 0.533 1.00 33.42 O ATOM 697 CB LEU A 365 12.342 4.827 0.713 1.00 73.25 C ATOM 698 CG LEU A 365 11.944 4.389 2.130 1.00 71.04 C ATOM 699 CD1 LEU A 365 10.567 3.753 2.135 1.00 3.33 C ATOM 700 CD2 LEU A 365 12.978 3.427 2.694 1.00 0.21 C ATOM 0 H LEU A 365 13.061 6.051 -1.346 1.00 1.04 H new ATOM 0 HA LEU A 365 10.470 5.711 0.024 1.00 53.25 H new ATOM 0 HB2 LEU A 365 12.286 3.952 0.066 1.00 73.25 H new ATOM 0 HB3 LEU A 365 13.387 5.136 0.741 1.00 73.25 H new ATOM 0 HG LEU A 365 11.908 5.275 2.764 1.00 71.04 H new ATOM 0 HD11 LEU A 365 10.309 3.452 3.150 1.00 3.33 H new ATOM 0 HD12 LEU A 365 9.833 4.472 1.772 1.00 3.33 H new ATOM 0 HD13 LEU A 365 10.568 2.877 1.486 1.00 3.33 H new ATOM 0 HD21 LEU A 365 12.684 3.124 3.699 1.00 0.21 H new ATOM 0 HD22 LEU A 365 13.043 2.547 2.054 1.00 0.21 H new ATOM 0 HD23 LEU A 365 13.950 3.919 2.733 1.00 0.21 H new ATOM 712 N GLN A 366 10.837 7.464 1.791 1.00 2.34 N ATOM 713 CA GLN A 366 10.881 8.636 2.611 1.00 61.44 C ATOM 714 C GLN A 366 11.153 8.268 4.057 1.00 53.24 C ATOM 715 O GLN A 366 10.737 7.207 4.544 1.00 23.01 O ATOM 716 CB GLN A 366 9.549 9.359 2.555 1.00 61.14 C ATOM 717 CG GLN A 366 9.117 9.811 1.171 1.00 64.10 C ATOM 718 CD GLN A 366 7.745 10.448 1.179 1.00 13.23 C ATOM 719 OE1 GLN A 366 7.459 11.339 0.387 1.00 50.31 O ATOM 720 NE2 GLN A 366 6.875 9.978 2.042 1.00 15.34 N ATOM 0 H GLN A 366 10.086 6.817 2.030 1.00 2.34 H new ATOM 0 HA GLN A 366 11.679 9.276 2.235 1.00 61.44 H new ATOM 0 HB2 GLN A 366 8.780 8.703 2.962 1.00 61.14 H new ATOM 0 HB3 GLN A 366 9.600 10.232 3.206 1.00 61.14 H new ATOM 0 HG2 GLN A 366 9.844 10.523 0.780 1.00 64.10 H new ATOM 0 HG3 GLN A 366 9.114 8.955 0.496 1.00 64.10 H new ATOM 0 HE21 GLN A 366 7.146 9.236 2.687 1.00 15.34 H new ATOM 0 HE22 GLN A 366 5.927 10.355 2.068 1.00 15.34 H new ATOM 729 N ILE A 367 11.891 9.112 4.729 1.00 62.14 N ATOM 730 CA ILE A 367 12.052 8.985 6.148 1.00 34.25 C ATOM 731 C ILE A 367 10.672 9.252 6.783 1.00 72.22 C ATOM 732 O ILE A 367 10.099 10.320 6.578 1.00 64.23 O ATOM 733 CB ILE A 367 13.107 9.996 6.689 1.00 2.21 C ATOM 734 CG1 ILE A 367 14.487 9.701 6.070 1.00 13.41 C ATOM 735 CG2 ILE A 367 13.173 9.954 8.216 1.00 3.04 C ATOM 736 CD1 ILE A 367 15.578 10.674 6.477 1.00 32.31 C ATOM 0 H ILE A 367 12.391 9.897 4.312 1.00 62.14 H new ATOM 0 HA ILE A 367 12.413 7.988 6.401 1.00 34.25 H new ATOM 0 HB ILE A 367 12.804 11.002 6.399 1.00 2.21 H new ATOM 0 HG12 ILE A 367 14.791 8.694 6.354 1.00 13.41 H new ATOM 0 HG13 ILE A 367 14.394 9.712 4.984 1.00 13.41 H new ATOM 0 HG21 ILE A 367 13.917 10.669 8.568 1.00 3.04 H new ATOM 0 HG22 ILE A 367 12.198 10.212 8.630 1.00 3.04 H new ATOM 0 HG23 ILE A 367 13.451 8.951 8.541 1.00 3.04 H new ATOM 0 HD11 ILE A 367 16.515 10.392 5.996 1.00 32.31 H new ATOM 0 HD12 ILE A 367 15.300 11.682 6.168 1.00 32.31 H new ATOM 0 HD13 ILE A 367 15.704 10.648 7.559 1.00 32.31 H new ATOM 748 N GLY A 368 10.151 8.296 7.509 1.00 41.11 N ATOM 749 CA GLY A 368 8.827 8.433 8.074 1.00 51.41 C ATOM 750 C GLY A 368 7.854 7.417 7.505 1.00 43.33 C ATOM 751 O GLY A 368 6.720 7.313 7.966 1.00 3.31 O ATOM 0 H GLY A 368 10.619 7.416 7.724 1.00 41.11 H new ATOM 0 HA2 GLY A 368 8.881 8.315 9.156 1.00 51.41 H new ATOM 0 HA3 GLY A 368 8.454 9.439 7.881 1.00 51.41 H new ATOM 755 N ASP A 369 8.292 6.678 6.495 1.00 24.13 N ATOM 756 CA ASP A 369 7.481 5.621 5.908 1.00 42.31 C ATOM 757 C ASP A 369 7.328 4.438 6.852 1.00 70.13 C ATOM 758 O ASP A 369 8.288 4.031 7.539 1.00 20.34 O ATOM 759 CB ASP A 369 8.038 5.172 4.556 1.00 52.23 C ATOM 760 CG ASP A 369 7.707 6.139 3.421 1.00 30.50 C ATOM 761 OD1 ASP A 369 6.587 6.717 3.416 1.00 63.33 O ATOM 762 OD2 ASP A 369 8.529 6.303 2.512 1.00 62.24 O ATOM 0 H ASP A 369 9.209 6.792 6.064 1.00 24.13 H new ATOM 0 HA ASP A 369 6.488 6.039 5.739 1.00 42.31 H new ATOM 0 HB2 ASP A 369 9.120 5.067 4.632 1.00 52.23 H new ATOM 0 HB3 ASP A 369 7.639 4.187 4.314 1.00 52.23 H new ATOM 767 N LYS A 370 6.117 3.920 6.914 1.00 71.10 N ATOM 768 CA LYS A 370 5.762 2.786 7.754 1.00 11.01 C ATOM 769 C LYS A 370 5.911 1.502 6.981 1.00 43.33 C ATOM 770 O LYS A 370 5.260 1.303 5.963 1.00 14.53 O ATOM 771 CB LYS A 370 4.307 2.959 8.273 1.00 50.52 C ATOM 772 CG LYS A 370 3.552 1.692 8.691 1.00 11.22 C ATOM 773 CD LYS A 370 2.139 2.061 9.149 1.00 24.02 C ATOM 774 CE LYS A 370 1.179 0.868 9.181 1.00 53.14 C ATOM 775 NZ LYS A 370 1.635 -0.227 10.040 1.00 51.03 N ATOM 0 H LYS A 370 5.333 4.282 6.371 1.00 71.10 H new ATOM 0 HA LYS A 370 6.434 2.743 8.611 1.00 11.01 H new ATOM 0 HB2 LYS A 370 4.333 3.634 9.129 1.00 50.52 H new ATOM 0 HB3 LYS A 370 3.728 3.454 7.494 1.00 50.52 H new ATOM 0 HG2 LYS A 370 3.503 0.994 7.855 1.00 11.22 H new ATOM 0 HG3 LYS A 370 4.086 1.188 9.497 1.00 11.22 H new ATOM 0 HD2 LYS A 370 2.191 2.503 10.144 1.00 24.02 H new ATOM 0 HD3 LYS A 370 1.737 2.824 8.483 1.00 24.02 H new ATOM 0 HE2 LYS A 370 0.202 1.207 9.526 1.00 53.14 H new ATOM 0 HE3 LYS A 370 1.046 0.492 8.167 1.00 53.14 H new ATOM 0 HZ1 LYS A 370 0.845 -0.879 10.220 1.00 51.03 H new ATOM 0 HZ2 LYS A 370 2.407 -0.740 9.568 1.00 51.03 H new ATOM 0 HZ3 LYS A 370 1.977 0.159 10.943 1.00 51.03 H new ATOM 789 N LEU A 371 6.763 0.644 7.445 1.00 40.21 N ATOM 790 CA LEU A 371 6.931 -0.624 6.806 1.00 71.30 C ATOM 791 C LEU A 371 5.821 -1.533 7.215 1.00 60.32 C ATOM 792 O LEU A 371 5.682 -1.875 8.386 1.00 62.54 O ATOM 793 CB LEU A 371 8.279 -1.262 7.106 1.00 12.42 C ATOM 794 CG LEU A 371 9.504 -0.537 6.585 1.00 50.32 C ATOM 795 CD1 LEU A 371 10.750 -1.268 7.011 1.00 74.24 C ATOM 796 CD2 LEU A 371 9.459 -0.430 5.078 1.00 75.33 C ATOM 0 H LEU A 371 7.353 0.797 8.263 1.00 40.21 H new ATOM 0 HA LEU A 371 6.902 -0.458 5.729 1.00 71.30 H new ATOM 0 HB2 LEU A 371 8.376 -1.361 8.187 1.00 12.42 H new ATOM 0 HB3 LEU A 371 8.278 -2.270 6.692 1.00 12.42 H new ATOM 0 HG LEU A 371 9.516 0.470 7.003 1.00 50.32 H new ATOM 0 HD11 LEU A 371 11.627 -0.742 6.634 1.00 74.24 H new ATOM 0 HD12 LEU A 371 10.793 -1.311 8.099 1.00 74.24 H new ATOM 0 HD13 LEU A 371 10.733 -2.281 6.609 1.00 74.24 H new ATOM 0 HD21 LEU A 371 10.347 0.094 4.724 1.00 75.33 H new ATOM 0 HD22 LEU A 371 9.429 -1.429 4.643 1.00 75.33 H new ATOM 0 HD23 LEU A 371 8.568 0.123 4.779 1.00 75.33 H new ATOM 808 N LEU A 372 5.031 -1.874 6.252 1.00 21.24 N ATOM 809 CA LEU A 372 3.908 -2.741 6.419 1.00 31.22 C ATOM 810 C LEU A 372 4.454 -4.155 6.370 1.00 3.43 C ATOM 811 O LEU A 372 4.049 -5.034 7.134 1.00 44.21 O ATOM 812 CB LEU A 372 2.929 -2.500 5.229 1.00 12.21 C ATOM 813 CG LEU A 372 1.452 -2.980 5.338 1.00 64.13 C ATOM 814 CD1 LEU A 372 0.690 -2.629 4.067 1.00 4.05 C ATOM 815 CD2 LEU A 372 1.326 -4.476 5.598 1.00 64.41 C ATOM 0 H LEU A 372 5.152 -1.547 5.294 1.00 21.24 H new ATOM 0 HA LEU A 372 3.376 -2.566 7.354 1.00 31.22 H new ATOM 0 HB2 LEU A 372 2.910 -1.428 5.035 1.00 12.21 H new ATOM 0 HB3 LEU A 372 3.362 -2.976 4.349 1.00 12.21 H new ATOM 0 HG LEU A 372 1.024 -2.462 6.196 1.00 64.13 H new ATOM 0 HD11 LEU A 372 -0.342 -2.970 4.155 1.00 4.05 H new ATOM 0 HD12 LEU A 372 0.704 -1.549 3.921 1.00 4.05 H new ATOM 0 HD13 LEU A 372 1.161 -3.117 3.214 1.00 4.05 H new ATOM 0 HD21 LEU A 372 0.272 -4.746 5.663 1.00 64.41 H new ATOM 0 HD22 LEU A 372 1.792 -5.028 4.782 1.00 64.41 H new ATOM 0 HD23 LEU A 372 1.823 -4.726 6.535 1.00 64.41 H new ATOM 827 N ALA A 373 5.407 -4.370 5.470 1.00 24.24 N ATOM 828 CA ALA A 373 5.937 -5.689 5.271 1.00 53.44 C ATOM 829 C ALA A 373 7.254 -5.674 4.509 1.00 23.30 C ATOM 830 O ALA A 373 7.633 -4.662 3.904 1.00 51.31 O ATOM 831 CB ALA A 373 4.917 -6.517 4.495 1.00 3.04 C ATOM 0 H ALA A 373 5.817 -3.648 4.878 1.00 24.24 H new ATOM 0 HA ALA A 373 6.131 -6.124 6.252 1.00 53.44 H new ATOM 0 HB1 ALA A 373 5.308 -7.522 4.337 1.00 3.04 H new ATOM 0 HB2 ALA A 373 3.988 -6.574 5.062 1.00 3.04 H new ATOM 0 HB3 ALA A 373 4.725 -6.047 3.530 1.00 3.04 H new ATOM 837 N VAL A 374 7.925 -6.804 4.526 1.00 23.20 N ATOM 838 CA VAL A 374 9.107 -7.029 3.704 1.00 40.23 C ATOM 839 C VAL A 374 8.945 -8.400 3.027 1.00 2.44 C ATOM 840 O VAL A 374 8.775 -9.411 3.687 1.00 43.21 O ATOM 841 CB VAL A 374 10.453 -6.934 4.524 1.00 33.00 C ATOM 842 CG1 VAL A 374 10.555 -7.984 5.622 1.00 15.24 C ATOM 843 CG2 VAL A 374 11.656 -7.013 3.604 1.00 13.14 C ATOM 0 H VAL A 374 7.670 -7.600 5.111 1.00 23.20 H new ATOM 0 HA VAL A 374 9.182 -6.241 2.955 1.00 40.23 H new ATOM 0 HB VAL A 374 10.444 -5.961 5.015 1.00 33.00 H new ATOM 0 HG11 VAL A 374 11.501 -7.868 6.150 1.00 15.24 H new ATOM 0 HG12 VAL A 374 9.730 -7.858 6.324 1.00 15.24 H new ATOM 0 HG13 VAL A 374 10.506 -8.979 5.180 1.00 15.24 H new ATOM 0 HG21 VAL A 374 12.570 -6.945 4.194 1.00 13.14 H new ATOM 0 HG22 VAL A 374 11.641 -7.961 3.066 1.00 13.14 H new ATOM 0 HG23 VAL A 374 11.623 -6.190 2.890 1.00 13.14 H new ATOM 853 N ASN A 375 8.870 -8.389 1.682 1.00 23.24 N ATOM 854 CA ASN A 375 8.556 -9.603 0.857 1.00 22.13 C ATOM 855 C ASN A 375 7.203 -10.080 1.174 1.00 10.11 C ATOM 856 O ASN A 375 6.828 -11.224 1.000 1.00 4.22 O ATOM 857 CB ASN A 375 9.612 -10.665 0.961 1.00 30.43 C ATOM 858 CG ASN A 375 10.769 -10.221 0.166 1.00 4.24 C ATOM 859 OD1 ASN A 375 10.612 -9.584 -0.866 1.00 62.24 O ATOM 860 ND2 ASN A 375 11.906 -10.461 0.613 1.00 54.44 N ATOM 0 H ASN A 375 9.023 -7.548 1.125 1.00 23.24 H new ATOM 0 HA ASN A 375 8.566 -9.321 -0.196 1.00 22.13 H new ATOM 0 HB2 ASN A 375 9.899 -10.819 2.001 1.00 30.43 H new ATOM 0 HB3 ASN A 375 9.235 -11.618 0.589 1.00 30.43 H new ATOM 0 HD21 ASN A 375 12.731 -10.124 0.116 1.00 54.44 H new ATOM 0 HD22 ASN A 375 12.013 -10.994 1.476 1.00 54.44 H new ATOM 867 N ASN A 376 6.472 -9.090 1.532 1.00 63.44 N ATOM 868 CA ASN A 376 5.067 -9.130 1.968 1.00 41.34 C ATOM 869 C ASN A 376 4.869 -9.864 3.297 1.00 60.40 C ATOM 870 O ASN A 376 3.742 -10.114 3.707 1.00 33.02 O ATOM 871 CB ASN A 376 4.096 -9.650 0.877 1.00 74.42 C ATOM 872 CG ASN A 376 4.020 -8.736 -0.347 1.00 34.44 C ATOM 873 OD1 ASN A 376 3.220 -7.777 -0.397 1.00 41.24 O ATOM 874 ND2 ASN A 376 4.818 -9.027 -1.349 1.00 34.44 N ATOM 0 H ASN A 376 6.842 -8.139 1.539 1.00 63.44 H new ATOM 0 HA ASN A 376 4.803 -8.087 2.143 1.00 41.34 H new ATOM 0 HB2 ASN A 376 4.413 -10.644 0.561 1.00 74.42 H new ATOM 0 HB3 ASN A 376 3.100 -9.755 1.307 1.00 74.42 H new ATOM 0 HD21 ASN A 376 4.796 -8.463 -2.199 1.00 34.44 H new ATOM 0 HD22 ASN A 376 5.460 -9.816 -1.277 1.00 34.44 H new ATOM 881 N VAL A 377 5.965 -10.147 3.995 1.00 74.11 N ATOM 882 CA VAL A 377 5.892 -10.699 5.335 1.00 61.34 C ATOM 883 C VAL A 377 5.578 -9.539 6.253 1.00 21.22 C ATOM 884 O VAL A 377 6.344 -8.573 6.297 1.00 63.00 O ATOM 885 CB VAL A 377 7.236 -11.335 5.779 1.00 52.45 C ATOM 886 CG1 VAL A 377 7.113 -11.961 7.168 1.00 23.44 C ATOM 887 CG2 VAL A 377 7.722 -12.363 4.765 1.00 34.23 C ATOM 0 H VAL A 377 6.914 -10.001 3.650 1.00 74.11 H new ATOM 0 HA VAL A 377 5.137 -11.485 5.367 1.00 61.34 H new ATOM 0 HB VAL A 377 7.978 -10.538 5.830 1.00 52.45 H new ATOM 0 HG11 VAL A 377 8.069 -12.400 7.455 1.00 23.44 H new ATOM 0 HG12 VAL A 377 6.835 -11.193 7.890 1.00 23.44 H new ATOM 0 HG13 VAL A 377 6.348 -12.737 7.151 1.00 23.44 H new ATOM 0 HG21 VAL A 377 8.665 -12.791 5.104 1.00 34.23 H new ATOM 0 HG22 VAL A 377 6.980 -13.155 4.665 1.00 34.23 H new ATOM 0 HG23 VAL A 377 7.869 -11.880 3.799 1.00 34.23 H new ATOM 897 N CYS A 378 4.460 -9.621 6.932 1.00 41.51 N ATOM 898 CA CYS A 378 3.939 -8.550 7.757 1.00 22.32 C ATOM 899 C CYS A 378 4.876 -8.112 8.890 1.00 51.30 C ATOM 900 O CYS A 378 5.315 -8.916 9.710 1.00 4.25 O ATOM 901 CB CYS A 378 2.575 -8.959 8.301 1.00 52.30 C ATOM 902 SG CYS A 378 2.576 -10.579 9.100 1.00 65.51 S ATOM 0 H CYS A 378 3.870 -10.453 6.928 1.00 41.51 H new ATOM 0 HA CYS A 378 3.847 -7.672 7.117 1.00 22.32 H new ATOM 0 HB2 CYS A 378 2.238 -8.209 9.017 1.00 52.30 H new ATOM 0 HB3 CYS A 378 1.854 -8.966 7.484 1.00 52.30 H new ATOM 0 HG CYS A 378 1.381 -10.849 9.536 1.00 65.51 H new ATOM 908 N LEU A 379 5.167 -6.829 8.891 1.00 34.01 N ATOM 909 CA LEU A 379 5.948 -6.147 9.926 1.00 42.25 C ATOM 910 C LEU A 379 4.998 -5.395 10.848 1.00 2.41 C ATOM 911 O LEU A 379 5.405 -4.575 11.679 1.00 2.23 O ATOM 912 CB LEU A 379 6.953 -5.174 9.279 1.00 54.21 C ATOM 913 CG LEU A 379 8.359 -5.720 8.947 1.00 23.15 C ATOM 914 CD1 LEU A 379 8.309 -7.041 8.229 1.00 4.52 C ATOM 915 CD2 LEU A 379 9.117 -4.714 8.110 1.00 54.43 C ATOM 0 H LEU A 379 4.860 -6.201 8.149 1.00 34.01 H new ATOM 0 HA LEU A 379 6.509 -6.880 10.505 1.00 42.25 H new ATOM 0 HB2 LEU A 379 6.511 -4.798 8.356 1.00 54.21 H new ATOM 0 HB3 LEU A 379 7.072 -4.320 9.946 1.00 54.21 H new ATOM 0 HG LEU A 379 8.873 -5.883 9.894 1.00 23.15 H new ATOM 0 HD11 LEU A 379 9.324 -7.380 8.019 1.00 4.52 H new ATOM 0 HD12 LEU A 379 7.803 -7.776 8.855 1.00 4.52 H new ATOM 0 HD13 LEU A 379 7.764 -6.925 7.292 1.00 4.52 H new ATOM 0 HD21 LEU A 379 10.108 -5.105 7.879 1.00 54.43 H new ATOM 0 HD22 LEU A 379 8.575 -4.530 7.183 1.00 54.43 H new ATOM 0 HD23 LEU A 379 9.216 -3.780 8.664 1.00 54.43 H new ATOM 927 N GLU A 380 3.736 -5.693 10.678 1.00 1.01 N ATOM 928 CA GLU A 380 2.676 -5.141 11.474 1.00 14.42 C ATOM 929 C GLU A 380 2.639 -5.867 12.804 1.00 32.32 C ATOM 930 O GLU A 380 2.324 -7.059 12.836 1.00 63.43 O ATOM 931 CB GLU A 380 1.339 -5.336 10.753 1.00 0.13 C ATOM 932 CG GLU A 380 1.255 -4.667 9.392 1.00 75.25 C ATOM 933 CD GLU A 380 1.368 -3.171 9.485 1.00 52.33 C ATOM 934 OE1 GLU A 380 0.365 -2.507 9.809 1.00 70.34 O ATOM 935 OE2 GLU A 380 2.457 -2.617 9.255 1.00 63.24 O ATOM 0 H GLU A 380 3.411 -6.344 9.963 1.00 1.01 H new ATOM 0 HA GLU A 380 2.847 -4.076 11.633 1.00 14.42 H new ATOM 0 HB2 GLU A 380 1.159 -6.404 10.631 1.00 0.13 H new ATOM 0 HB3 GLU A 380 0.540 -4.948 11.385 1.00 0.13 H new ATOM 0 HG2 GLU A 380 2.049 -5.050 8.751 1.00 75.25 H new ATOM 0 HG3 GLU A 380 0.309 -4.929 8.918 1.00 75.25 H new ATOM 942 N GLU A 381 2.982 -5.145 13.876 1.00 14.32 N ATOM 943 CA GLU A 381 3.016 -5.658 15.229 1.00 63.44 C ATOM 944 C GLU A 381 4.024 -6.818 15.375 1.00 43.24 C ATOM 945 O GLU A 381 3.688 -7.997 15.261 1.00 20.14 O ATOM 946 CB GLU A 381 1.635 -6.046 15.710 1.00 10.21 C ATOM 947 CG GLU A 381 1.594 -6.421 17.159 1.00 30.25 C ATOM 948 CD GLU A 381 2.141 -5.344 18.047 1.00 21.21 C ATOM 949 OE1 GLU A 381 1.659 -4.190 17.976 1.00 50.22 O ATOM 950 OE2 GLU A 381 3.062 -5.623 18.816 1.00 31.31 O ATOM 0 H GLU A 381 3.249 -4.163 13.813 1.00 14.32 H new ATOM 0 HA GLU A 381 3.366 -4.852 15.874 1.00 63.44 H new ATOM 0 HB2 GLU A 381 0.951 -5.215 15.538 1.00 10.21 H new ATOM 0 HB3 GLU A 381 1.273 -6.884 15.115 1.00 10.21 H new ATOM 0 HG2 GLU A 381 0.565 -6.636 17.446 1.00 30.25 H new ATOM 0 HG3 GLU A 381 2.165 -7.337 17.310 1.00 30.25 H new ATOM 957 N VAL A 382 5.248 -6.434 15.567 1.00 0.54 N ATOM 958 CA VAL A 382 6.416 -7.335 15.680 1.00 30.42 C ATOM 959 C VAL A 382 7.466 -6.637 16.525 1.00 45.14 C ATOM 960 O VAL A 382 7.405 -5.410 16.694 1.00 74.52 O ATOM 961 CB VAL A 382 7.077 -7.706 14.292 1.00 5.42 C ATOM 962 CG1 VAL A 382 6.172 -8.576 13.428 1.00 4.34 C ATOM 963 CG2 VAL A 382 7.489 -6.453 13.529 1.00 15.45 C ATOM 0 H VAL A 382 5.500 -5.450 15.657 1.00 0.54 H new ATOM 0 HA VAL A 382 6.059 -8.265 16.123 1.00 30.42 H new ATOM 0 HB VAL A 382 7.968 -8.290 14.520 1.00 5.42 H new ATOM 0 HG11 VAL A 382 6.674 -8.801 12.487 1.00 4.34 H new ATOM 0 HG12 VAL A 382 5.951 -9.505 13.953 1.00 4.34 H new ATOM 0 HG13 VAL A 382 5.242 -8.045 13.225 1.00 4.34 H new ATOM 0 HG21 VAL A 382 7.941 -6.738 12.579 1.00 15.45 H new ATOM 0 HG22 VAL A 382 6.611 -5.835 13.343 1.00 15.45 H new ATOM 0 HG23 VAL A 382 8.211 -5.889 14.119 1.00 15.45 H new ATOM 973 N THR A 383 8.421 -7.363 17.035 1.00 72.41 N ATOM 974 CA THR A 383 9.447 -6.773 17.863 1.00 11.42 C ATOM 975 C THR A 383 10.470 -6.080 16.959 1.00 53.11 C ATOM 976 O THR A 383 10.805 -6.603 15.907 1.00 65.12 O ATOM 977 CB THR A 383 10.168 -7.851 18.665 1.00 53.32 C ATOM 978 OG1 THR A 383 9.226 -8.846 19.075 1.00 72.11 O ATOM 979 CG2 THR A 383 10.810 -7.247 19.910 1.00 12.21 C ATOM 0 H THR A 383 8.514 -8.369 16.894 1.00 72.41 H new ATOM 0 HA THR A 383 8.985 -6.062 18.547 1.00 11.42 H new ATOM 0 HB THR A 383 10.941 -8.294 18.037 1.00 53.32 H new ATOM 0 HG1 THR A 383 9.073 -9.475 18.339 1.00 72.11 H new ATOM 0 HG21 THR A 383 11.321 -8.029 20.472 1.00 12.21 H new ATOM 0 HG22 THR A 383 11.530 -6.484 19.614 1.00 12.21 H new ATOM 0 HG23 THR A 383 10.039 -6.796 20.535 1.00 12.21 H new ATOM 987 N HIS A 384 11.004 -4.937 17.399 1.00 21.51 N ATOM 988 CA HIS A 384 11.936 -4.136 16.564 1.00 43.43 C ATOM 989 C HIS A 384 13.081 -4.984 16.027 1.00 32.53 C ATOM 990 O HIS A 384 13.338 -5.005 14.838 1.00 54.25 O ATOM 991 CB HIS A 384 12.508 -2.909 17.319 1.00 15.20 C ATOM 992 CG HIS A 384 13.434 -2.088 16.465 1.00 72.32 C ATOM 993 ND1 HIS A 384 13.016 -1.346 15.402 1.00 75.45 N ATOM 994 CD2 HIS A 384 14.774 -1.956 16.504 1.00 21.32 C ATOM 995 CE1 HIS A 384 14.086 -0.800 14.836 1.00 54.33 C ATOM 996 NE2 HIS A 384 15.182 -1.138 15.468 1.00 51.54 N ATOM 0 H HIS A 384 10.816 -4.539 18.319 1.00 21.51 H new ATOM 0 HA HIS A 384 11.342 -3.770 15.726 1.00 43.43 H new ATOM 0 HB2 HIS A 384 11.685 -2.282 17.663 1.00 15.20 H new ATOM 0 HB3 HIS A 384 13.043 -3.249 18.206 1.00 15.20 H new ATOM 0 HD1 HIS A 384 12.050 -1.230 15.095 1.00 75.45 H new ATOM 0 HD2 HIS A 384 15.427 -2.417 17.231 1.00 21.32 H new ATOM 0 HE1 HIS A 384 14.056 -0.160 13.967 1.00 54.33 H new ATOM 1004 N GLU A 385 13.698 -5.711 16.919 1.00 24.32 N ATOM 1005 CA GLU A 385 14.834 -6.556 16.614 1.00 32.21 C ATOM 1006 C GLU A 385 14.450 -7.632 15.593 1.00 4.24 C ATOM 1007 O GLU A 385 15.191 -7.910 14.642 1.00 2.31 O ATOM 1008 CB GLU A 385 15.289 -7.185 17.916 1.00 4.31 C ATOM 1009 CG GLU A 385 16.473 -8.099 17.807 1.00 41.42 C ATOM 1010 CD GLU A 385 16.957 -8.544 19.150 1.00 63.01 C ATOM 1011 OE1 GLU A 385 16.671 -7.855 20.141 1.00 43.43 O ATOM 1012 OE2 GLU A 385 17.651 -9.578 19.232 1.00 35.30 O ATOM 0 H GLU A 385 13.423 -5.737 17.901 1.00 24.32 H new ATOM 0 HA GLU A 385 15.640 -5.971 16.172 1.00 32.21 H new ATOM 0 HB2 GLU A 385 15.529 -6.389 18.621 1.00 4.31 H new ATOM 0 HB3 GLU A 385 14.456 -7.746 18.340 1.00 4.31 H new ATOM 0 HG2 GLU A 385 16.205 -8.971 17.210 1.00 41.42 H new ATOM 0 HG3 GLU A 385 17.279 -7.588 17.281 1.00 41.42 H new ATOM 1019 N GLU A 386 13.237 -8.106 15.736 1.00 23.14 N ATOM 1020 CA GLU A 386 12.696 -9.194 14.969 1.00 32.31 C ATOM 1021 C GLU A 386 12.398 -8.701 13.562 1.00 15.44 C ATOM 1022 O GLU A 386 12.601 -9.407 12.573 1.00 63.03 O ATOM 1023 CB GLU A 386 11.446 -9.632 15.714 1.00 51.33 C ATOM 1024 CG GLU A 386 10.571 -10.676 15.091 1.00 30.45 C ATOM 1025 CD GLU A 386 9.410 -10.960 16.012 1.00 5.15 C ATOM 1026 OE1 GLU A 386 8.847 -9.970 16.587 1.00 50.42 O ATOM 1027 OE2 GLU A 386 9.101 -12.130 16.234 1.00 10.35 O ATOM 0 H GLU A 386 12.577 -7.728 16.416 1.00 23.14 H new ATOM 0 HA GLU A 386 13.379 -10.037 14.864 1.00 32.31 H new ATOM 0 HB2 GLU A 386 11.755 -10.000 16.692 1.00 51.33 H new ATOM 0 HB3 GLU A 386 10.835 -8.746 15.885 1.00 51.33 H new ATOM 0 HG2 GLU A 386 10.208 -10.333 14.122 1.00 30.45 H new ATOM 0 HG3 GLU A 386 11.142 -11.588 14.913 1.00 30.45 H new ATOM 1034 N ALA A 387 12.001 -7.451 13.490 1.00 10.14 N ATOM 1035 CA ALA A 387 11.693 -6.810 12.250 1.00 64.22 C ATOM 1036 C ALA A 387 12.955 -6.550 11.474 1.00 14.52 C ATOM 1037 O ALA A 387 13.032 -6.891 10.309 1.00 0.51 O ATOM 1038 CB ALA A 387 10.955 -5.520 12.489 1.00 32.44 C ATOM 0 H ALA A 387 11.884 -6.851 14.306 1.00 10.14 H new ATOM 0 HA ALA A 387 11.051 -7.472 11.669 1.00 64.22 H new ATOM 0 HB1 ALA A 387 10.730 -5.047 11.533 1.00 32.44 H new ATOM 0 HB2 ALA A 387 10.026 -5.726 13.020 1.00 32.44 H new ATOM 0 HB3 ALA A 387 11.575 -4.852 13.087 1.00 32.44 H new ATOM 1044 N VAL A 388 13.968 -5.981 12.136 1.00 14.54 N ATOM 1045 CA VAL A 388 15.235 -5.674 11.466 1.00 71.53 C ATOM 1046 C VAL A 388 15.825 -6.949 10.895 1.00 1.13 C ATOM 1047 O VAL A 388 16.254 -6.981 9.740 1.00 55.40 O ATOM 1048 CB VAL A 388 16.296 -5.041 12.401 1.00 43.54 C ATOM 1049 CG1 VAL A 388 17.478 -4.556 11.593 1.00 14.52 C ATOM 1050 CG2 VAL A 388 15.730 -3.917 13.238 1.00 34.30 C ATOM 0 H VAL A 388 13.937 -5.726 13.123 1.00 14.54 H new ATOM 0 HA VAL A 388 14.997 -4.946 10.690 1.00 71.53 H new ATOM 0 HB VAL A 388 16.624 -5.817 13.092 1.00 43.54 H new ATOM 0 HG11 VAL A 388 18.218 -4.113 12.260 1.00 14.52 H new ATOM 0 HG12 VAL A 388 17.925 -5.396 11.062 1.00 14.52 H new ATOM 0 HG13 VAL A 388 17.145 -3.808 10.873 1.00 14.52 H new ATOM 0 HG21 VAL A 388 16.514 -3.508 13.875 1.00 34.30 H new ATOM 0 HG22 VAL A 388 15.348 -3.133 12.584 1.00 34.30 H new ATOM 0 HG23 VAL A 388 14.920 -4.298 13.859 1.00 34.30 H new ATOM 1060 N THR A 389 15.816 -8.001 11.693 1.00 64.31 N ATOM 1061 CA THR A 389 16.308 -9.275 11.255 1.00 1.22 C ATOM 1062 C THR A 389 15.491 -9.812 10.044 1.00 50.13 C ATOM 1063 O THR A 389 16.055 -10.434 9.145 1.00 30.54 O ATOM 1064 CB THR A 389 16.343 -10.270 12.431 1.00 14.42 C ATOM 1065 OG1 THR A 389 17.153 -9.696 13.481 1.00 35.32 O ATOM 1066 CG2 THR A 389 16.951 -11.605 12.014 1.00 51.55 C ATOM 0 H THR A 389 15.469 -7.988 12.652 1.00 64.31 H new ATOM 0 HA THR A 389 17.332 -9.151 10.903 1.00 1.22 H new ATOM 0 HB THR A 389 15.323 -10.453 12.769 1.00 14.42 H new ATOM 0 HG1 THR A 389 16.617 -9.058 13.996 1.00 35.32 H new ATOM 0 HG21 THR A 389 16.960 -12.283 12.867 1.00 51.55 H new ATOM 0 HG22 THR A 389 16.356 -12.041 11.211 1.00 51.55 H new ATOM 0 HG23 THR A 389 17.972 -11.447 11.665 1.00 51.55 H new ATOM 1074 N ALA A 390 14.190 -9.485 9.976 1.00 23.44 N ATOM 1075 CA ALA A 390 13.367 -9.903 8.849 1.00 12.32 C ATOM 1076 C ALA A 390 13.843 -9.223 7.562 1.00 12.13 C ATOM 1077 O ALA A 390 13.856 -9.837 6.496 1.00 3.42 O ATOM 1078 CB ALA A 390 11.893 -9.615 9.108 1.00 4.24 C ATOM 0 H ALA A 390 13.698 -8.939 10.683 1.00 23.44 H new ATOM 0 HA ALA A 390 13.474 -10.981 8.728 1.00 12.32 H new ATOM 0 HB1 ALA A 390 11.303 -9.937 8.250 1.00 4.24 H new ATOM 0 HB2 ALA A 390 11.567 -10.156 9.996 1.00 4.24 H new ATOM 0 HB3 ALA A 390 11.753 -8.545 9.263 1.00 4.24 H new ATOM 1084 N LEU A 391 14.273 -7.963 7.669 1.00 11.44 N ATOM 1085 CA LEU A 391 14.804 -7.268 6.503 1.00 62.54 C ATOM 1086 C LEU A 391 16.235 -7.690 6.226 1.00 2.34 C ATOM 1087 O LEU A 391 16.714 -7.573 5.115 1.00 23.13 O ATOM 1088 CB LEU A 391 14.740 -5.729 6.588 1.00 12.44 C ATOM 1089 CG LEU A 391 13.358 -5.071 6.674 1.00 75.11 C ATOM 1090 CD1 LEU A 391 12.896 -4.891 8.095 1.00 73.52 C ATOM 1091 CD2 LEU A 391 13.320 -3.769 5.907 1.00 72.23 C ATOM 0 H LEU A 391 14.264 -7.417 8.531 1.00 11.44 H new ATOM 0 HA LEU A 391 14.149 -7.564 5.683 1.00 62.54 H new ATOM 0 HB2 LEU A 391 15.313 -5.418 7.462 1.00 12.44 H new ATOM 0 HB3 LEU A 391 15.249 -5.325 5.713 1.00 12.44 H new ATOM 0 HG LEU A 391 12.652 -5.755 6.202 1.00 75.11 H new ATOM 0 HD11 LEU A 391 11.912 -4.421 8.101 1.00 73.52 H new ATOM 0 HD12 LEU A 391 12.837 -5.863 8.584 1.00 73.52 H new ATOM 0 HD13 LEU A 391 13.604 -4.258 8.630 1.00 73.52 H new ATOM 0 HD21 LEU A 391 12.327 -3.328 5.988 1.00 72.23 H new ATOM 0 HD22 LEU A 391 14.057 -3.081 6.321 1.00 72.23 H new ATOM 0 HD23 LEU A 391 13.549 -3.958 4.858 1.00 72.23 H new ATOM 1103 N LYS A 392 16.927 -8.165 7.234 1.00 3.05 N ATOM 1104 CA LYS A 392 18.284 -8.610 7.039 1.00 51.31 C ATOM 1105 C LYS A 392 18.360 -9.962 6.348 1.00 24.41 C ATOM 1106 O LYS A 392 19.273 -10.196 5.539 1.00 13.11 O ATOM 1107 CB LYS A 392 19.083 -8.605 8.326 1.00 11.25 C ATOM 1108 CG LYS A 392 19.277 -7.212 8.865 1.00 71.20 C ATOM 1109 CD LYS A 392 20.324 -7.167 9.932 1.00 4.14 C ATOM 1110 CE LYS A 392 20.634 -5.737 10.302 1.00 23.11 C ATOM 1111 NZ LYS A 392 21.254 -4.961 9.192 1.00 60.35 N ATOM 0 H LYS A 392 16.577 -8.252 8.188 1.00 3.05 H new ATOM 0 HA LYS A 392 18.743 -7.882 6.370 1.00 51.31 H new ATOM 0 HB2 LYS A 392 18.573 -9.214 9.072 1.00 11.25 H new ATOM 0 HB3 LYS A 392 20.056 -9.064 8.150 1.00 11.25 H new ATOM 0 HG2 LYS A 392 19.559 -6.544 8.051 1.00 71.20 H new ATOM 0 HG3 LYS A 392 18.333 -6.844 9.267 1.00 71.20 H new ATOM 0 HD2 LYS A 392 19.980 -7.711 10.812 1.00 4.14 H new ATOM 0 HD3 LYS A 392 21.229 -7.664 9.584 1.00 4.14 H new ATOM 0 HE2 LYS A 392 19.714 -5.242 10.612 1.00 23.11 H new ATOM 0 HE3 LYS A 392 21.305 -5.729 11.161 1.00 23.11 H new ATOM 0 HZ1 LYS A 392 21.364 -3.968 9.482 1.00 60.35 H new ATOM 0 HZ2 LYS A 392 22.187 -5.361 8.967 1.00 60.35 H new ATOM 0 HZ3 LYS A 392 20.644 -5.011 8.351 1.00 60.35 H new ATOM 1125 N ASN A 393 17.366 -10.809 6.605 1.00 44.34 N ATOM 1126 CA ASN A 393 17.279 -12.187 6.063 1.00 1.32 C ATOM 1127 C ASN A 393 16.883 -12.245 4.577 1.00 65.24 C ATOM 1128 O ASN A 393 16.265 -13.200 4.120 1.00 15.01 O ATOM 1129 CB ASN A 393 16.294 -13.029 6.889 1.00 61.13 C ATOM 1130 CG ASN A 393 16.799 -13.389 8.276 1.00 61.21 C ATOM 1131 OD1 ASN A 393 17.992 -13.517 8.507 1.00 12.42 O ATOM 1132 ND2 ASN A 393 15.889 -13.574 9.208 1.00 15.32 N ATOM 0 H ASN A 393 16.578 -10.564 7.205 1.00 44.34 H new ATOM 0 HA ASN A 393 18.285 -12.599 6.138 1.00 1.32 H new ATOM 0 HB2 ASN A 393 15.357 -12.481 6.986 1.00 61.13 H new ATOM 0 HB3 ASN A 393 16.072 -13.947 6.345 1.00 61.13 H new ATOM 0 HD21 ASN A 393 16.172 -13.832 10.153 1.00 15.32 H new ATOM 0 HD22 ASN A 393 14.900 -13.460 8.985 1.00 15.32 H new ATOM 1139 N THR A 394 17.286 -11.270 3.834 1.00 44.40 N ATOM 1140 CA THR A 394 17.035 -11.226 2.420 1.00 15.30 C ATOM 1141 C THR A 394 18.336 -11.065 1.670 1.00 2.05 C ATOM 1142 O THR A 394 19.360 -10.643 2.250 1.00 12.42 O ATOM 1143 CB THR A 394 16.057 -10.085 2.052 1.00 33.13 C ATOM 1144 OG1 THR A 394 16.322 -8.965 2.869 1.00 71.20 O ATOM 1145 CG2 THR A 394 14.623 -10.516 2.218 1.00 62.42 C ATOM 0 H THR A 394 17.806 -10.468 4.189 1.00 44.40 H new ATOM 0 HA THR A 394 16.568 -12.167 2.131 1.00 15.30 H new ATOM 0 HB THR A 394 16.206 -9.825 1.004 1.00 33.13 H new ATOM 0 HG1 THR A 394 15.966 -9.124 3.768 1.00 71.20 H new ATOM 0 HG21 THR A 394 13.962 -9.691 1.951 1.00 62.42 H new ATOM 0 HG22 THR A 394 14.421 -11.367 1.568 1.00 62.42 H new ATOM 0 HG23 THR A 394 14.447 -10.802 3.255 1.00 62.42 H new ATOM 1153 N SER A 395 18.340 -11.433 0.426 1.00 55.23 N ATOM 1154 CA SER A 395 19.498 -11.285 -0.411 1.00 53.41 C ATOM 1155 C SER A 395 19.064 -11.042 -1.833 1.00 41.34 C ATOM 1156 O SER A 395 18.209 -11.752 -2.334 1.00 2.04 O ATOM 1157 CB SER A 395 20.401 -12.528 -0.329 1.00 12.03 C ATOM 1158 OG SER A 395 20.870 -12.728 0.999 1.00 44.43 O ATOM 0 H SER A 395 17.535 -11.848 -0.044 1.00 55.23 H new ATOM 0 HA SER A 395 20.076 -10.430 -0.060 1.00 53.41 H new ATOM 0 HB2 SER A 395 19.848 -13.407 -0.660 1.00 12.03 H new ATOM 0 HB3 SER A 395 21.248 -12.412 -1.005 1.00 12.03 H new ATOM 0 HG SER A 395 21.441 -13.524 1.028 1.00 44.43 H new ATOM 1164 N ASP A 396 19.574 -9.956 -2.392 1.00 0.25 N ATOM 1165 CA ASP A 396 19.439 -9.545 -3.814 1.00 23.12 C ATOM 1166 C ASP A 396 17.978 -9.297 -4.290 1.00 71.14 C ATOM 1167 O ASP A 396 17.754 -8.857 -5.384 1.00 25.30 O ATOM 1168 CB ASP A 396 20.188 -10.562 -4.715 1.00 3.42 C ATOM 1169 CG ASP A 396 20.292 -10.169 -6.183 1.00 24.54 C ATOM 1170 OD1 ASP A 396 21.121 -9.284 -6.498 1.00 72.35 O ATOM 1171 OD2 ASP A 396 19.579 -10.770 -7.017 1.00 52.11 O ATOM 0 H ASP A 396 20.126 -9.290 -1.852 1.00 0.25 H new ATOM 0 HA ASP A 396 19.903 -8.563 -3.903 1.00 23.12 H new ATOM 0 HB2 ASP A 396 21.194 -10.702 -4.320 1.00 3.42 H new ATOM 0 HB3 ASP A 396 19.682 -11.525 -4.648 1.00 3.42 H new ATOM 1176 N PHE A 397 16.998 -9.460 -3.427 1.00 72.13 N ATOM 1177 CA PHE A 397 15.630 -9.252 -3.862 1.00 3.53 C ATOM 1178 C PHE A 397 14.731 -8.963 -2.664 1.00 55.43 C ATOM 1179 O PHE A 397 14.637 -9.777 -1.733 1.00 22.23 O ATOM 1180 CB PHE A 397 15.149 -10.504 -4.617 1.00 3.41 C ATOM 1181 CG PHE A 397 13.869 -10.342 -5.378 1.00 4.02 C ATOM 1182 CD1 PHE A 397 13.886 -9.814 -6.657 1.00 55.43 C ATOM 1183 CD2 PHE A 397 12.660 -10.733 -4.833 1.00 53.05 C ATOM 1184 CE1 PHE A 397 12.723 -9.674 -7.377 1.00 12.15 C ATOM 1185 CE2 PHE A 397 11.493 -10.598 -5.551 1.00 73.41 C ATOM 1186 CZ PHE A 397 11.525 -10.067 -6.826 1.00 62.12 C ATOM 0 H PHE A 397 17.113 -9.727 -2.449 1.00 72.13 H new ATOM 0 HA PHE A 397 15.584 -8.391 -4.529 1.00 3.53 H new ATOM 0 HB2 PHE A 397 15.930 -10.810 -5.313 1.00 3.41 H new ATOM 0 HB3 PHE A 397 15.025 -11.315 -3.900 1.00 3.41 H new ATOM 0 HD1 PHE A 397 14.825 -9.508 -7.095 1.00 55.43 H new ATOM 0 HD2 PHE A 397 12.631 -11.148 -3.836 1.00 53.05 H new ATOM 0 HE1 PHE A 397 12.750 -9.257 -8.373 1.00 12.15 H new ATOM 0 HE2 PHE A 397 10.553 -10.907 -5.118 1.00 73.41 H new ATOM 0 HZ PHE A 397 10.610 -9.960 -7.390 1.00 62.12 H new ATOM 1196 N VAL A 398 14.116 -7.791 -2.656 1.00 20.30 N ATOM 1197 CA VAL A 398 13.238 -7.375 -1.573 1.00 12.24 C ATOM 1198 C VAL A 398 12.022 -6.586 -2.097 1.00 62.53 C ATOM 1199 O VAL A 398 12.177 -5.540 -2.708 1.00 50.41 O ATOM 1200 CB VAL A 398 13.989 -6.448 -0.549 1.00 44.43 C ATOM 1201 CG1 VAL A 398 13.046 -5.931 0.521 1.00 35.13 C ATOM 1202 CG2 VAL A 398 15.162 -7.153 0.106 1.00 54.21 C ATOM 0 H VAL A 398 14.211 -7.101 -3.401 1.00 20.30 H new ATOM 0 HA VAL A 398 12.909 -8.293 -1.086 1.00 12.24 H new ATOM 0 HB VAL A 398 14.374 -5.605 -1.123 1.00 44.43 H new ATOM 0 HG11 VAL A 398 13.596 -5.293 1.213 1.00 35.13 H new ATOM 0 HG12 VAL A 398 12.247 -5.355 0.054 1.00 35.13 H new ATOM 0 HG13 VAL A 398 12.617 -6.772 1.065 1.00 35.13 H new ATOM 0 HG21 VAL A 398 15.650 -6.474 0.805 1.00 54.21 H new ATOM 0 HG22 VAL A 398 14.805 -8.032 0.643 1.00 54.21 H new ATOM 0 HG23 VAL A 398 15.875 -7.460 -0.659 1.00 54.21 H new ATOM 1212 N TYR A 399 10.834 -7.099 -1.883 1.00 64.24 N ATOM 1213 CA TYR A 399 9.640 -6.311 -2.096 1.00 53.53 C ATOM 1214 C TYR A 399 9.304 -5.610 -0.804 1.00 62.50 C ATOM 1215 O TYR A 399 8.708 -6.198 0.101 1.00 31.32 O ATOM 1216 CB TYR A 399 8.426 -7.137 -2.567 1.00 42.13 C ATOM 1217 CG TYR A 399 8.335 -7.349 -4.061 1.00 5.13 C ATOM 1218 CD1 TYR A 399 7.998 -6.292 -4.900 1.00 42.43 C ATOM 1219 CD2 TYR A 399 8.552 -8.592 -4.631 1.00 22.11 C ATOM 1220 CE1 TYR A 399 7.890 -6.467 -6.264 1.00 65.00 C ATOM 1221 CE2 TYR A 399 8.444 -8.776 -6.000 1.00 61.42 C ATOM 1222 CZ TYR A 399 8.115 -7.709 -6.811 1.00 52.22 C ATOM 1223 OH TYR A 399 8.022 -7.886 -8.191 1.00 50.31 O ATOM 0 H TYR A 399 10.667 -8.053 -1.563 1.00 64.24 H new ATOM 0 HA TYR A 399 9.852 -5.604 -2.898 1.00 53.53 H new ATOM 0 HB2 TYR A 399 8.458 -8.111 -2.079 1.00 42.13 H new ATOM 0 HB3 TYR A 399 7.516 -6.641 -2.230 1.00 42.13 H new ATOM 0 HD1 TYR A 399 7.817 -5.316 -4.475 1.00 42.43 H new ATOM 0 HD2 TYR A 399 8.809 -9.430 -4.000 1.00 22.11 H new ATOM 0 HE1 TYR A 399 7.630 -5.633 -6.899 1.00 65.00 H new ATOM 0 HE2 TYR A 399 8.617 -9.751 -6.431 1.00 61.42 H new ATOM 0 HH TYR A 399 8.211 -8.821 -8.414 1.00 50.31 H new ATOM 1233 N LEU A 400 9.721 -4.397 -0.695 1.00 73.22 N ATOM 1234 CA LEU A 400 9.486 -3.620 0.476 1.00 1.21 C ATOM 1235 C LEU A 400 8.117 -3.014 0.396 1.00 34.14 C ATOM 1236 O LEU A 400 7.748 -2.446 -0.618 1.00 40.34 O ATOM 1237 CB LEU A 400 10.610 -2.597 0.664 1.00 51.20 C ATOM 1238 CG LEU A 400 10.435 -1.552 1.759 1.00 53.44 C ATOM 1239 CD1 LEU A 400 11.789 -1.173 2.295 1.00 10.31 C ATOM 1240 CD2 LEU A 400 9.818 -0.304 1.171 1.00 2.22 C ATOM 0 H LEU A 400 10.241 -3.909 -1.424 1.00 73.22 H new ATOM 0 HA LEU A 400 9.503 -4.245 1.369 1.00 1.21 H new ATOM 0 HB2 LEU A 400 11.532 -3.143 0.865 1.00 51.20 H new ATOM 0 HB3 LEU A 400 10.749 -2.073 -0.282 1.00 51.20 H new ATOM 0 HG LEU A 400 9.801 -1.962 2.545 1.00 53.44 H new ATOM 0 HD11 LEU A 400 11.673 -0.425 3.080 1.00 10.31 H new ATOM 0 HD12 LEU A 400 12.278 -2.056 2.705 1.00 10.31 H new ATOM 0 HD13 LEU A 400 12.397 -0.762 1.489 1.00 10.31 H new ATOM 0 HD21 LEU A 400 9.693 0.444 1.954 1.00 2.22 H new ATOM 0 HD22 LEU A 400 10.470 0.092 0.392 1.00 2.22 H new ATOM 0 HD23 LEU A 400 8.846 -0.546 0.742 1.00 2.22 H new ATOM 1252 N LYS A 401 7.362 -3.154 1.438 1.00 74.30 N ATOM 1253 CA LYS A 401 6.001 -2.746 1.410 1.00 74.13 C ATOM 1254 C LYS A 401 5.750 -1.705 2.486 1.00 53.22 C ATOM 1255 O LYS A 401 5.840 -2.003 3.677 1.00 32.02 O ATOM 1256 CB LYS A 401 5.146 -3.971 1.648 1.00 41.35 C ATOM 1257 CG LYS A 401 3.705 -3.837 1.256 1.00 3.22 C ATOM 1258 CD LYS A 401 2.955 -5.087 1.647 1.00 35.53 C ATOM 1259 CE LYS A 401 1.585 -5.127 1.033 1.00 65.12 C ATOM 1260 NZ LYS A 401 1.642 -5.356 -0.433 1.00 11.51 N ATOM 0 H LYS A 401 7.672 -3.552 2.325 1.00 74.30 H new ATOM 0 HA LYS A 401 5.754 -2.299 0.447 1.00 74.13 H new ATOM 0 HB2 LYS A 401 5.578 -4.807 1.098 1.00 41.35 H new ATOM 0 HB3 LYS A 401 5.195 -4.227 2.706 1.00 41.35 H new ATOM 0 HG2 LYS A 401 3.264 -2.968 1.745 1.00 3.22 H new ATOM 0 HG3 LYS A 401 3.624 -3.673 0.181 1.00 3.22 H new ATOM 0 HD2 LYS A 401 3.521 -5.964 1.333 1.00 35.53 H new ATOM 0 HD3 LYS A 401 2.869 -5.135 2.733 1.00 35.53 H new ATOM 0 HE2 LYS A 401 1.000 -5.918 1.502 1.00 65.12 H new ATOM 0 HE3 LYS A 401 1.069 -4.188 1.234 1.00 65.12 H new ATOM 0 HZ1 LYS A 401 0.678 -5.478 -0.803 1.00 11.51 H new ATOM 0 HZ2 LYS A 401 2.089 -4.538 -0.895 1.00 11.51 H new ATOM 0 HZ3 LYS A 401 2.199 -6.212 -0.629 1.00 11.51 H new ATOM 1274 N VAL A 402 5.473 -0.502 2.059 1.00 21.12 N ATOM 1275 CA VAL A 402 5.191 0.619 2.935 1.00 71.11 C ATOM 1276 C VAL A 402 3.689 0.941 2.946 1.00 33.32 C ATOM 1277 O VAL A 402 2.970 0.788 1.919 1.00 63.21 O ATOM 1278 CB VAL A 402 6.005 1.908 2.500 1.00 12.15 C ATOM 1279 CG1 VAL A 402 5.567 3.157 3.236 1.00 73.32 C ATOM 1280 CG2 VAL A 402 7.471 1.697 2.720 1.00 55.32 C ATOM 0 H VAL A 402 5.435 -0.262 1.068 1.00 21.12 H new ATOM 0 HA VAL A 402 5.502 0.331 3.939 1.00 71.11 H new ATOM 0 HB VAL A 402 5.799 2.059 1.440 1.00 12.15 H new ATOM 0 HG11 VAL A 402 6.160 4.006 2.896 1.00 73.32 H new ATOM 0 HG12 VAL A 402 4.513 3.347 3.035 1.00 73.32 H new ATOM 0 HG13 VAL A 402 5.713 3.018 4.307 1.00 73.32 H new ATOM 0 HG21 VAL A 402 8.017 2.590 2.417 1.00 55.32 H new ATOM 0 HG22 VAL A 402 7.656 1.500 3.776 1.00 55.32 H new ATOM 0 HG23 VAL A 402 7.809 0.847 2.128 1.00 55.32 H new ATOM 1290 N ALA A 403 3.243 1.341 4.100 1.00 21.25 N ATOM 1291 CA ALA A 403 1.942 1.852 4.360 1.00 25.55 C ATOM 1292 C ALA A 403 2.172 3.235 4.925 1.00 22.01 C ATOM 1293 O ALA A 403 3.265 3.524 5.397 1.00 65.40 O ATOM 1294 CB ALA A 403 1.222 0.989 5.380 1.00 33.21 C ATOM 0 H ALA A 403 3.824 1.314 4.938 1.00 21.25 H new ATOM 0 HA ALA A 403 1.325 1.866 3.462 1.00 25.55 H new ATOM 0 HB1 ALA A 403 0.228 1.397 5.565 1.00 33.21 H new ATOM 0 HB2 ALA A 403 1.131 -0.028 4.997 1.00 33.21 H new ATOM 0 HB3 ALA A 403 1.789 0.977 6.311 1.00 33.21 H new ATOM 1300 N LYS A 404 1.217 4.092 4.852 1.00 4.03 N ATOM 1301 CA LYS A 404 1.421 5.421 5.381 1.00 63.15 C ATOM 1302 C LYS A 404 1.158 5.405 6.876 1.00 13.01 C ATOM 1303 O LYS A 404 0.419 4.538 7.349 1.00 51.50 O ATOM 1304 CB LYS A 404 0.509 6.410 4.651 1.00 10.24 C ATOM 1305 CG LYS A 404 0.738 6.549 3.128 1.00 4.32 C ATOM 1306 CD LYS A 404 1.917 7.478 2.736 1.00 61.13 C ATOM 1307 CE LYS A 404 3.310 6.947 3.096 1.00 74.12 C ATOM 1308 NZ LYS A 404 4.375 7.883 2.694 1.00 64.10 N ATOM 0 H LYS A 404 0.299 3.917 4.443 1.00 4.03 H new ATOM 0 HA LYS A 404 2.450 5.742 5.221 1.00 63.15 H new ATOM 0 HB2 LYS A 404 -0.526 6.109 4.816 1.00 10.24 H new ATOM 0 HB3 LYS A 404 0.632 7.392 5.108 1.00 10.24 H new ATOM 0 HG2 LYS A 404 0.917 5.559 2.709 1.00 4.32 H new ATOM 0 HG3 LYS A 404 -0.175 6.929 2.669 1.00 4.32 H new ATOM 0 HD2 LYS A 404 1.879 7.654 1.661 1.00 61.13 H new ATOM 0 HD3 LYS A 404 1.776 8.443 3.222 1.00 61.13 H new ATOM 0 HE2 LYS A 404 3.366 6.773 4.171 1.00 74.12 H new ATOM 0 HE3 LYS A 404 3.469 5.985 2.609 1.00 74.12 H new ATOM 0 HZ1 LYS A 404 5.245 7.665 3.220 1.00 64.10 H new ATOM 0 HZ2 LYS A 404 4.554 7.788 1.674 1.00 64.10 H new ATOM 0 HZ3 LYS A 404 4.078 8.857 2.904 1.00 64.10 H new ATOM 1538 N ASN B 147 16.195 1.915 19.634 1.00 4.45 N ATOM 1539 CA ASN B 147 17.175 2.567 18.845 1.00 64.22 C ATOM 1540 C ASN B 147 16.793 2.346 17.423 1.00 5.50 C ATOM 1541 O ASN B 147 15.845 1.586 17.148 1.00 54.02 O ATOM 1542 CB ASN B 147 18.596 2.020 19.116 1.00 10.31 C ATOM 1543 CG ASN B 147 18.765 0.533 18.826 1.00 4.22 C ATOM 1544 OD1 ASN B 147 18.597 -0.293 19.700 1.00 40.51 O ATOM 1545 ND2 ASN B 147 19.108 0.190 17.609 1.00 54.43 N ATOM 0 HA ASN B 147 17.207 3.628 19.091 1.00 64.22 H new ATOM 0 HB2 ASN B 147 19.309 2.579 18.510 1.00 10.31 H new ATOM 0 HB3 ASN B 147 18.850 2.205 20.160 1.00 10.31 H new ATOM 0 HD21 ASN B 147 19.241 -0.794 17.375 1.00 54.43 H new ATOM 0 HD22 ASN B 147 19.242 0.907 16.896 1.00 54.43 H new ATOM 1552 N GLU B 148 17.445 3.020 16.534 1.00 71.33 N ATOM 1553 CA GLU B 148 17.225 2.792 15.152 1.00 51.54 C ATOM 1554 C GLU B 148 18.272 1.811 14.684 1.00 73.53 C ATOM 1555 O GLU B 148 19.396 1.794 15.216 1.00 54.12 O ATOM 1556 CB GLU B 148 17.261 4.097 14.347 1.00 33.14 C ATOM 1557 CG GLU B 148 18.568 4.869 14.423 1.00 64.34 C ATOM 1558 CD GLU B 148 18.545 6.101 13.558 1.00 51.04 C ATOM 1559 OE1 GLU B 148 18.737 5.990 12.331 1.00 10.40 O ATOM 1560 OE2 GLU B 148 18.340 7.214 14.070 1.00 50.55 O ATOM 0 H GLU B 148 18.138 3.737 16.746 1.00 71.33 H new ATOM 0 HA GLU B 148 16.229 2.379 14.992 1.00 51.54 H new ATOM 0 HB2 GLU B 148 17.054 3.866 13.302 1.00 33.14 H new ATOM 0 HB3 GLU B 148 16.455 4.743 14.696 1.00 33.14 H new ATOM 0 HG2 GLU B 148 18.761 5.155 15.457 1.00 64.34 H new ATOM 0 HG3 GLU B 148 19.389 4.223 14.113 1.00 64.34 H new ATOM 1567 N THR B 149 17.926 0.981 13.762 1.00 3.03 N ATOM 1568 CA THR B 149 18.844 -0.005 13.297 1.00 3.34 C ATOM 1569 C THR B 149 18.826 -0.046 11.770 1.00 33.13 C ATOM 1570 O THR B 149 17.750 -0.032 11.159 1.00 74.53 O ATOM 1571 CB THR B 149 18.464 -1.399 13.859 1.00 5.35 C ATOM 1572 OG1 THR B 149 18.225 -1.317 15.276 1.00 74.14 O ATOM 1573 CG2 THR B 149 19.591 -2.388 13.627 1.00 1.15 C ATOM 0 H THR B 149 17.011 0.964 13.312 1.00 3.03 H new ATOM 0 HA THR B 149 19.845 0.255 13.642 1.00 3.34 H new ATOM 0 HB THR B 149 17.563 -1.733 13.345 1.00 5.35 H new ATOM 0 HG1 THR B 149 17.261 -1.254 15.442 1.00 74.14 H new ATOM 0 HG21 THR B 149 19.309 -3.362 14.027 1.00 1.15 H new ATOM 0 HG22 THR B 149 19.783 -2.477 12.558 1.00 1.15 H new ATOM 0 HG23 THR B 149 20.492 -2.037 14.129 1.00 1.15 H new ATOM 1581 N GLN B 150 20.011 -0.039 11.165 1.00 62.12 N ATOM 1582 CA GLN B 150 20.140 -0.124 9.720 1.00 2.22 C ATOM 1583 C GLN B 150 19.883 -1.550 9.267 1.00 22.34 C ATOM 1584 O GLN B 150 20.365 -2.512 9.896 1.00 0.13 O ATOM 1585 CB GLN B 150 21.531 0.330 9.251 1.00 60.34 C ATOM 1586 CG GLN B 150 21.714 0.283 7.729 1.00 30.01 C ATOM 1587 CD GLN B 150 23.123 0.612 7.282 1.00 34.02 C ATOM 1588 OE1 GLN B 150 23.829 1.374 7.921 1.00 43.53 O ATOM 1589 NE2 GLN B 150 23.543 0.034 6.184 1.00 35.24 N ATOM 0 H GLN B 150 20.900 0.025 11.661 1.00 62.12 H new ATOM 0 HA GLN B 150 19.402 0.543 9.275 1.00 2.22 H new ATOM 0 HB2 GLN B 150 21.707 1.348 9.598 1.00 60.34 H new ATOM 0 HB3 GLN B 150 22.286 -0.301 9.719 1.00 60.34 H new ATOM 0 HG2 GLN B 150 21.450 -0.711 7.369 1.00 30.01 H new ATOM 0 HG3 GLN B 150 21.021 0.985 7.265 1.00 30.01 H new ATOM 0 HE21 GLN B 150 22.927 -0.598 5.673 1.00 35.24 H new ATOM 0 HE22 GLN B 150 24.486 0.216 5.840 1.00 35.24 H new ATOM 1598 N VAL B 151 19.134 -1.679 8.217 1.00 12.54 N ATOM 1599 CA VAL B 151 18.785 -2.958 7.650 1.00 12.30 C ATOM 1600 C VAL B 151 19.755 -3.381 6.538 1.00 41.12 C ATOM 1601 O VAL B 151 20.517 -4.350 6.781 1.00 15.44 O ATOM 1602 CB VAL B 151 17.308 -3.018 7.185 1.00 22.20 C ATOM 1603 CG1 VAL B 151 16.393 -2.972 8.390 1.00 65.51 C ATOM 1604 CG2 VAL B 151 16.979 -1.866 6.262 1.00 13.20 C ATOM 1605 OXT VAL B 151 19.807 -2.718 5.463 1.00 36.49 O ATOM 0 H VAL B 151 18.736 -0.886 7.714 1.00 12.54 H new ATOM 0 HA VAL B 151 18.886 -3.687 8.454 1.00 12.30 H new ATOM 0 HB VAL B 151 17.161 -3.950 6.640 1.00 22.20 H new ATOM 0 HG11 VAL B 151 15.355 -3.014 8.060 1.00 65.51 H new ATOM 0 HG12 VAL B 151 16.603 -3.822 9.039 1.00 65.51 H new ATOM 0 HG13 VAL B 151 16.562 -2.046 8.940 1.00 65.51 H new ATOM 0 HG21 VAL B 151 15.936 -1.934 5.952 1.00 13.20 H new ATOM 0 HG22 VAL B 151 17.141 -0.923 6.785 1.00 13.20 H new ATOM 0 HG23 VAL B 151 17.622 -1.909 5.383 1.00 13.20 H new