USER MOD reduce.3.24.130724 H: found=0, std=0, add=981, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 980 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 404 HIS : no HD1:sc= -4.65! C(o=-6.1!,f=-6.4!) USER MOD Set 1.2: A 408 ASN : amide:sc= -1.43! X(o=-6.1!,f=-5.9) USER MOD Single : A 318 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 320 SER OG : rot -120:sc= -0.149 USER MOD Single : A 326 GLN :FLIP amide:sc= -0.115 F(o=-2.2,f=-0.11) USER MOD Single : A 331 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 332 THR OG1 : rot 180:sc= 0 USER MOD Single : A 338 GLN : amide:sc= -3.38! C(o=-3.4!,f=-13!) USER MOD Single : A 341 SER OG : rot -2:sc= -3.89! USER MOD Single : A 346 THR OG1 : rot 180:sc= 0.135 USER MOD Single : A 351 SER OG : rot -120:sc= 0.0429 USER MOD Single : A 357 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 358 GLN : amide:sc= -7.91! C(o=-7.9!,f=-9.1!) USER MOD Single : A 361 ASN : amide:sc= -1.92! C(o=-1.9!,f=-4.8!) USER MOD Single : A 368 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 369 SER OG : rot 180:sc= 0 USER MOD Single : A 371 HIS : no HD1:sc= -0.332 X(o=-0.33,f=-0.17) USER MOD Single : A 373 THR OG1 : rot 180:sc= 0 USER MOD Single : A 378 THR OG1 : rot 180:sc= 0.0194 USER MOD Single : A 383 MET CE :methyl -159:sc= -16.9! (180deg=-19.1!) USER MOD Single : A 384 SER OG : rot 120:sc= -4.53! USER MOD Single : A 387 ASN : amide:sc= -1.35 K(o=-1.4,f=-6.2!) USER MOD Single : A 390 ASN : amide:sc= -0.0558 X(o=-0.056,f=-0.056) USER MOD Single : A 392 MET CE :methyl -156:sc= -0.26 (180deg=-1.68!) USER MOD Single : A 395 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 397 SER OG : rot 180:sc=0.000206 USER MOD Single : A 411 HIS : no HD1:sc= -1.13 K(o=-1.1,f=-2.3) USER MOD Single : A 414 THR OG1 : rot 180:sc= 0 USER MOD Single : A 418 GLN : amide:sc= -0.184 X(o=-0.18,f=-0.37) USER MOD Single : A 419 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 422 GLN : amide:sc= -0.0873 X(o=-0.087,f=-0.27) USER MOD Single : A 426 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 429 THR OG1 : rot 180:sc= 0 USER MOD Single : A 437 SER OG : rot 180:sc= 0.00827 USER MOD Single : A 446 LYS NZ :NH3+ 162:sc=-0.00131 (180deg=-0.164) USER MOD ----------------------------------------------------------------- ATOM 39 N GLN A 318 114.563 7.557 -4.471 1.00 0.00 N ATOM 40 CA GLN A 318 113.245 7.671 -5.159 1.00 0.00 C ATOM 41 C GLN A 318 112.726 6.284 -5.549 1.00 0.00 C ATOM 42 O GLN A 318 113.424 5.502 -6.162 1.00 0.00 O ATOM 43 CB GLN A 318 113.526 8.509 -6.408 1.00 0.00 C ATOM 44 CG GLN A 318 112.212 8.807 -7.133 1.00 0.00 C ATOM 45 CD GLN A 318 112.496 9.634 -8.387 1.00 0.00 C ATOM 46 OE1 GLN A 318 113.609 10.074 -8.601 1.00 0.00 O ATOM 47 NE2 GLN A 318 111.531 9.866 -9.235 1.00 0.00 N ATOM 0 HA GLN A 318 112.485 8.124 -4.523 1.00 0.00 H new ATOM 0 HB2 GLN A 318 114.019 9.441 -6.130 1.00 0.00 H new ATOM 0 HB3 GLN A 318 114.206 7.974 -7.071 1.00 0.00 H new ATOM 0 HG2 GLN A 318 111.715 7.876 -7.404 1.00 0.00 H new ATOM 0 HG3 GLN A 318 111.535 9.349 -6.473 1.00 0.00 H new ATOM 0 HE21 GLN A 318 110.597 9.498 -9.057 1.00 0.00 H new ATOM 0 HE22 GLN A 318 111.712 10.415 -10.075 1.00 0.00 H new ATOM 56 N ALA A 319 111.495 5.982 -5.233 1.00 0.00 N ATOM 57 CA ALA A 319 110.933 4.660 -5.629 1.00 0.00 C ATOM 58 C ALA A 319 111.087 4.462 -7.139 1.00 0.00 C ATOM 59 O ALA A 319 110.898 5.377 -7.915 1.00 0.00 O ATOM 60 CB ALA A 319 109.456 4.727 -5.241 1.00 0.00 C ATOM 0 H ALA A 319 110.857 6.591 -4.720 1.00 0.00 H new ATOM 0 HA ALA A 319 111.441 3.827 -5.144 1.00 0.00 H new ATOM 0 HB1 ALA A 319 108.969 3.787 -5.501 1.00 0.00 H new ATOM 0 HB2 ALA A 319 109.369 4.896 -4.168 1.00 0.00 H new ATOM 0 HB3 ALA A 319 108.976 5.545 -5.777 1.00 0.00 H new ATOM 66 N SER A 320 111.452 3.282 -7.563 1.00 0.00 N ATOM 67 CA SER A 320 111.642 3.046 -9.022 1.00 0.00 C ATOM 68 C SER A 320 110.704 1.942 -9.508 1.00 0.00 C ATOM 69 O SER A 320 110.062 2.068 -10.532 1.00 0.00 O ATOM 70 CB SER A 320 113.100 2.615 -9.165 1.00 0.00 C ATOM 71 OG SER A 320 113.911 3.765 -9.371 1.00 0.00 O ATOM 0 H SER A 320 111.626 2.475 -6.964 1.00 0.00 H new ATOM 0 HA SER A 320 111.419 3.932 -9.616 1.00 0.00 H new ATOM 0 HB2 SER A 320 113.424 2.083 -8.270 1.00 0.00 H new ATOM 0 HB3 SER A 320 113.207 1.925 -10.002 1.00 0.00 H new ATOM 0 HG SER A 320 114.375 3.688 -10.231 1.00 0.00 H new ATOM 77 N GLU A 321 110.611 0.864 -8.780 1.00 0.00 N ATOM 78 CA GLU A 321 109.704 -0.244 -9.207 1.00 0.00 C ATOM 79 C GLU A 321 109.262 -1.066 -8.003 1.00 0.00 C ATOM 80 O GLU A 321 109.955 -1.156 -7.014 1.00 0.00 O ATOM 81 CB GLU A 321 110.533 -1.107 -10.155 1.00 0.00 C ATOM 82 CG GLU A 321 110.505 -0.497 -11.553 1.00 0.00 C ATOM 83 CD GLU A 321 111.256 -1.410 -12.525 1.00 0.00 C ATOM 84 OE1 GLU A 321 111.869 -2.358 -12.063 1.00 0.00 O ATOM 85 OE2 GLU A 321 111.206 -1.143 -13.714 1.00 0.00 O ATOM 0 H GLU A 321 111.120 0.700 -7.911 1.00 0.00 H new ATOM 0 HA GLU A 321 108.802 0.137 -9.685 1.00 0.00 H new ATOM 0 HB2 GLU A 321 111.560 -1.176 -9.797 1.00 0.00 H new ATOM 0 HB3 GLU A 321 110.136 -2.122 -10.181 1.00 0.00 H new ATOM 0 HG2 GLU A 321 109.475 -0.366 -11.883 1.00 0.00 H new ATOM 0 HG3 GLU A 321 110.963 0.492 -11.539 1.00 0.00 H new ATOM 92 N PHE A 322 108.133 -1.710 -8.091 1.00 0.00 N ATOM 93 CA PHE A 322 107.699 -2.563 -6.956 1.00 0.00 C ATOM 94 C PHE A 322 107.167 -3.918 -7.440 1.00 0.00 C ATOM 95 O PHE A 322 106.666 -4.054 -8.539 1.00 0.00 O ATOM 96 CB PHE A 322 106.623 -1.750 -6.237 1.00 0.00 C ATOM 97 CG PHE A 322 105.585 -1.231 -7.203 1.00 0.00 C ATOM 98 CD1 PHE A 322 105.851 -0.084 -7.964 1.00 0.00 C ATOM 99 CD2 PHE A 322 104.341 -1.871 -7.309 1.00 0.00 C ATOM 100 CE1 PHE A 322 104.876 0.421 -8.832 1.00 0.00 C ATOM 101 CE2 PHE A 322 103.364 -1.360 -8.173 1.00 0.00 C ATOM 102 CZ PHE A 322 103.630 -0.215 -8.934 1.00 0.00 C ATOM 0 H PHE A 322 107.500 -1.683 -8.890 1.00 0.00 H new ATOM 0 HA PHE A 322 108.527 -2.807 -6.291 1.00 0.00 H new ATOM 0 HB2 PHE A 322 106.141 -2.370 -5.481 1.00 0.00 H new ATOM 0 HB3 PHE A 322 107.086 -0.913 -5.714 1.00 0.00 H new ATOM 0 HD1 PHE A 322 106.808 0.410 -7.881 1.00 0.00 H new ATOM 0 HD2 PHE A 322 104.137 -2.756 -6.725 1.00 0.00 H new ATOM 0 HE1 PHE A 322 105.083 1.301 -9.423 1.00 0.00 H new ATOM 0 HE2 PHE A 322 102.405 -1.850 -8.252 1.00 0.00 H new ATOM 0 HZ PHE A 322 102.876 0.178 -9.599 1.00 0.00 H new ATOM 112 N ILE A 323 107.297 -4.925 -6.614 1.00 0.00 N ATOM 113 CA ILE A 323 106.829 -6.295 -6.988 1.00 0.00 C ATOM 114 C ILE A 323 105.868 -6.814 -5.913 1.00 0.00 C ATOM 115 O ILE A 323 106.028 -6.512 -4.752 1.00 0.00 O ATOM 116 CB ILE A 323 108.108 -7.143 -7.036 1.00 0.00 C ATOM 117 CG1 ILE A 323 108.814 -6.918 -8.375 1.00 0.00 C ATOM 118 CG2 ILE A 323 107.766 -8.631 -6.888 1.00 0.00 C ATOM 119 CD1 ILE A 323 110.317 -6.766 -8.140 1.00 0.00 C ATOM 0 H ILE A 323 107.713 -4.856 -5.685 1.00 0.00 H new ATOM 0 HA ILE A 323 106.294 -6.321 -7.937 1.00 0.00 H new ATOM 0 HB ILE A 323 108.761 -6.846 -6.215 1.00 0.00 H new ATOM 0 HG12 ILE A 323 108.623 -7.757 -9.044 1.00 0.00 H new ATOM 0 HG13 ILE A 323 108.419 -6.026 -8.861 1.00 0.00 H new ATOM 0 HG21 ILE A 323 108.682 -9.220 -6.924 1.00 0.00 H new ATOM 0 HG22 ILE A 323 107.265 -8.796 -5.934 1.00 0.00 H new ATOM 0 HG23 ILE A 323 107.107 -8.935 -7.701 1.00 0.00 H new ATOM 0 HD11 ILE A 323 110.820 -6.606 -9.094 1.00 0.00 H new ATOM 0 HD12 ILE A 323 110.499 -5.913 -7.486 1.00 0.00 H new ATOM 0 HD13 ILE A 323 110.705 -7.671 -7.672 1.00 0.00 H new ATOM 131 N PRO A 324 104.836 -7.482 -6.350 1.00 0.00 N ATOM 132 CA PRO A 324 103.770 -7.915 -5.419 1.00 0.00 C ATOM 133 C PRO A 324 104.248 -9.031 -4.497 1.00 0.00 C ATOM 134 O PRO A 324 104.784 -10.029 -4.938 1.00 0.00 O ATOM 135 CB PRO A 324 102.651 -8.440 -6.318 1.00 0.00 C ATOM 136 CG PRO A 324 103.119 -8.288 -7.735 1.00 0.00 C ATOM 137 CD PRO A 324 104.571 -7.888 -7.730 1.00 0.00 C ATOM 0 HA PRO A 324 103.453 -7.093 -4.776 1.00 0.00 H new ATOM 0 HB2 PRO A 324 102.434 -9.484 -6.094 1.00 0.00 H new ATOM 0 HB3 PRO A 324 101.730 -7.881 -6.154 1.00 0.00 H new ATOM 0 HG2 PRO A 324 102.988 -9.224 -8.278 1.00 0.00 H new ATOM 0 HG3 PRO A 324 102.523 -7.535 -8.250 1.00 0.00 H new ATOM 0 HD2 PRO A 324 105.212 -8.717 -8.029 1.00 0.00 H new ATOM 0 HD3 PRO A 324 104.760 -7.071 -8.427 1.00 0.00 H new ATOM 145 N ALA A 325 103.796 -8.986 -3.281 1.00 0.00 N ATOM 146 CA ALA A 325 103.928 -10.167 -2.399 1.00 0.00 C ATOM 147 C ALA A 325 102.990 -11.263 -2.894 1.00 0.00 C ATOM 148 O ALA A 325 102.026 -10.996 -3.585 1.00 0.00 O ATOM 149 CB ALA A 325 103.536 -9.667 -1.012 1.00 0.00 C ATOM 0 H ALA A 325 103.339 -8.178 -2.859 1.00 0.00 H new ATOM 0 HA ALA A 325 104.932 -10.592 -2.387 1.00 0.00 H new ATOM 0 HB1 ALA A 325 103.608 -10.486 -0.296 1.00 0.00 H new ATOM 0 HB2 ALA A 325 104.208 -8.863 -0.712 1.00 0.00 H new ATOM 0 HB3 ALA A 325 102.512 -9.294 -1.036 1.00 0.00 H new ATOM 155 N GLN A 326 103.323 -12.498 -2.669 1.00 0.00 N ATOM 156 CA GLN A 326 102.508 -13.584 -3.270 1.00 0.00 C ATOM 157 C GLN A 326 101.056 -13.461 -2.817 1.00 0.00 C ATOM 158 O GLN A 326 100.761 -13.347 -1.644 1.00 0.00 O ATOM 159 CB GLN A 326 103.133 -14.886 -2.775 1.00 0.00 C ATOM 160 CG GLN A 326 102.479 -16.069 -3.491 1.00 0.00 C ATOM 161 CD GLN A 326 103.114 -16.260 -4.875 1.00 0.00 C ATOM 162 OE1 GLN A 326 103.884 -15.327 -5.377 1.00 0.00 O flip ATOM 163 NE2 GLN A 326 102.911 -17.277 -5.509 1.00 0.00 N flip ATOM 0 H GLN A 326 104.115 -12.801 -2.102 1.00 0.00 H new ATOM 0 HA GLN A 326 102.501 -13.541 -4.359 1.00 0.00 H new ATOM 0 HB2 GLN A 326 104.207 -14.881 -2.963 1.00 0.00 H new ATOM 0 HB3 GLN A 326 102.999 -14.980 -1.697 1.00 0.00 H new ATOM 0 HG2 GLN A 326 102.600 -16.976 -2.898 1.00 0.00 H new ATOM 0 HG3 GLN A 326 101.408 -15.896 -3.594 1.00 0.00 H new ATOM 0 HE21 GLN A 326 102.312 -18.007 -5.124 1.00 0.00 H new ATOM 0 HE22 GLN A 326 103.339 -17.400 -6.426 1.00 0.00 H new ATOM 172 N GLY A 327 100.153 -13.481 -3.753 1.00 0.00 N ATOM 173 CA GLY A 327 98.709 -13.365 -3.408 1.00 0.00 C ATOM 174 C GLY A 327 98.199 -11.947 -3.701 1.00 0.00 C ATOM 175 O GLY A 327 97.029 -11.663 -3.540 1.00 0.00 O ATOM 0 H GLY A 327 100.353 -13.573 -4.749 1.00 0.00 H new ATOM 0 HA2 GLY A 327 98.133 -14.091 -3.981 1.00 0.00 H new ATOM 0 HA3 GLY A 327 98.561 -13.601 -2.354 1.00 0.00 H new ATOM 179 N VAL A 328 99.040 -11.063 -4.181 1.00 0.00 N ATOM 180 CA VAL A 328 98.549 -9.698 -4.532 1.00 0.00 C ATOM 181 C VAL A 328 99.107 -9.252 -5.888 1.00 0.00 C ATOM 182 O VAL A 328 100.276 -9.412 -6.175 1.00 0.00 O ATOM 183 CB VAL A 328 99.058 -8.787 -3.416 1.00 0.00 C ATOM 184 CG1 VAL A 328 98.534 -7.368 -3.639 1.00 0.00 C ATOM 185 CG2 VAL A 328 98.559 -9.307 -2.066 1.00 0.00 C ATOM 0 H VAL A 328 100.034 -11.227 -4.343 1.00 0.00 H new ATOM 0 HA VAL A 328 97.463 -9.669 -4.618 1.00 0.00 H new ATOM 0 HB VAL A 328 100.148 -8.778 -3.422 1.00 0.00 H new ATOM 0 HG11 VAL A 328 98.896 -6.717 -2.843 1.00 0.00 H new ATOM 0 HG12 VAL A 328 98.887 -6.997 -4.601 1.00 0.00 H new ATOM 0 HG13 VAL A 328 97.444 -7.377 -3.632 1.00 0.00 H new ATOM 0 HG21 VAL A 328 98.922 -8.658 -1.269 1.00 0.00 H new ATOM 0 HG22 VAL A 328 97.469 -9.315 -2.060 1.00 0.00 H new ATOM 0 HG23 VAL A 328 98.930 -10.319 -1.906 1.00 0.00 H new ATOM 195 N ASP A 329 98.285 -8.641 -6.700 1.00 0.00 N ATOM 196 CA ASP A 329 98.769 -8.119 -8.012 1.00 0.00 C ATOM 197 C ASP A 329 99.633 -6.872 -7.801 1.00 0.00 C ATOM 198 O ASP A 329 99.442 -6.129 -6.859 1.00 0.00 O ATOM 199 CB ASP A 329 97.498 -7.759 -8.782 1.00 0.00 C ATOM 200 CG ASP A 329 96.746 -9.038 -9.155 1.00 0.00 C ATOM 201 OD1 ASP A 329 97.313 -10.105 -8.987 1.00 0.00 O ATOM 202 OD2 ASP A 329 95.616 -8.928 -9.602 1.00 0.00 O ATOM 0 H ASP A 329 97.296 -8.480 -6.510 1.00 0.00 H new ATOM 0 HA ASP A 329 99.383 -8.845 -8.545 1.00 0.00 H new ATOM 0 HB2 ASP A 329 96.862 -7.115 -8.174 1.00 0.00 H new ATOM 0 HB3 ASP A 329 97.752 -7.199 -9.682 1.00 0.00 H new ATOM 207 N GLU A 330 100.599 -6.646 -8.653 1.00 0.00 N ATOM 208 CA GLU A 330 101.481 -5.456 -8.466 1.00 0.00 C ATOM 209 C GLU A 330 100.645 -4.179 -8.523 1.00 0.00 C ATOM 210 O GLU A 330 100.878 -3.245 -7.789 1.00 0.00 O ATOM 211 CB GLU A 330 102.483 -5.483 -9.622 1.00 0.00 C ATOM 212 CG GLU A 330 103.550 -4.405 -9.391 1.00 0.00 C ATOM 213 CD GLU A 330 104.503 -4.365 -10.587 1.00 0.00 C ATOM 214 OE1 GLU A 330 104.285 -5.123 -11.518 1.00 0.00 O ATOM 215 OE2 GLU A 330 105.434 -3.577 -10.552 1.00 0.00 O ATOM 0 H GLU A 330 100.814 -7.228 -9.463 1.00 0.00 H new ATOM 0 HA GLU A 330 101.989 -5.478 -7.502 1.00 0.00 H new ATOM 0 HB2 GLU A 330 102.950 -6.465 -9.691 1.00 0.00 H new ATOM 0 HB3 GLU A 330 101.970 -5.307 -10.568 1.00 0.00 H new ATOM 0 HG2 GLU A 330 103.076 -3.432 -9.257 1.00 0.00 H new ATOM 0 HG3 GLU A 330 104.105 -4.618 -8.477 1.00 0.00 H new ATOM 222 N LYS A 331 99.618 -4.164 -9.327 1.00 0.00 N ATOM 223 CA LYS A 331 98.717 -2.977 -9.346 1.00 0.00 C ATOM 224 C LYS A 331 98.138 -2.766 -7.950 1.00 0.00 C ATOM 225 O LYS A 331 98.158 -1.679 -7.410 1.00 0.00 O ATOM 226 CB LYS A 331 97.608 -3.334 -10.335 1.00 0.00 C ATOM 227 CG LYS A 331 97.115 -2.064 -11.029 1.00 0.00 C ATOM 228 CD LYS A 331 97.577 -2.074 -12.486 1.00 0.00 C ATOM 229 CE LYS A 331 99.091 -2.298 -12.538 1.00 0.00 C ATOM 230 NZ LYS A 331 99.358 -2.804 -13.912 1.00 0.00 N ATOM 0 H LYS A 331 99.365 -4.916 -9.967 1.00 0.00 H new ATOM 0 HA LYS A 331 99.232 -2.060 -9.634 1.00 0.00 H new ATOM 0 HB2 LYS A 331 97.980 -4.044 -11.074 1.00 0.00 H new ATOM 0 HB3 LYS A 331 96.783 -3.820 -9.813 1.00 0.00 H new ATOM 0 HG2 LYS A 331 96.028 -2.008 -10.980 1.00 0.00 H new ATOM 0 HG3 LYS A 331 97.503 -1.183 -10.518 1.00 0.00 H new ATOM 0 HD2 LYS A 331 97.063 -2.862 -13.037 1.00 0.00 H new ATOM 0 HD3 LYS A 331 97.321 -1.130 -12.967 1.00 0.00 H new ATOM 0 HE2 LYS A 331 99.634 -1.373 -12.346 1.00 0.00 H new ATOM 0 HE3 LYS A 331 99.410 -3.017 -11.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 331 100.377 -2.981 -14.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 331 98.834 -3.689 -14.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 331 99.051 -2.096 -14.609 1.00 0.00 H new ATOM 244 N THR A 332 97.722 -3.827 -7.323 1.00 0.00 N ATOM 245 CA THR A 332 97.251 -3.729 -5.914 1.00 0.00 C ATOM 246 C THR A 332 98.382 -3.232 -5.008 1.00 0.00 C ATOM 247 O THR A 332 98.186 -2.382 -4.163 1.00 0.00 O ATOM 248 CB THR A 332 96.846 -5.156 -5.541 1.00 0.00 C ATOM 249 OG1 THR A 332 95.780 -5.577 -6.380 1.00 0.00 O ATOM 250 CG2 THR A 332 96.401 -5.199 -4.079 1.00 0.00 C ATOM 0 H THR A 332 97.687 -4.763 -7.726 1.00 0.00 H new ATOM 0 HA THR A 332 96.427 -3.025 -5.798 1.00 0.00 H new ATOM 0 HB THR A 332 97.698 -5.823 -5.674 1.00 0.00 H new ATOM 0 HG1 THR A 332 95.520 -6.492 -6.144 1.00 0.00 H new ATOM 0 HG21 THR A 332 96.113 -6.217 -3.816 1.00 0.00 H new ATOM 0 HG22 THR A 332 97.223 -4.878 -3.439 1.00 0.00 H new ATOM 0 HG23 THR A 332 95.550 -4.533 -3.938 1.00 0.00 H new ATOM 258 N LEU A 333 99.573 -3.729 -5.203 1.00 0.00 N ATOM 259 CA LEU A 333 100.726 -3.260 -4.381 1.00 0.00 C ATOM 260 C LEU A 333 100.948 -1.756 -4.576 1.00 0.00 C ATOM 261 O LEU A 333 101.294 -1.047 -3.658 1.00 0.00 O ATOM 262 CB LEU A 333 101.926 -4.060 -4.902 1.00 0.00 C ATOM 263 CG LEU A 333 103.237 -3.377 -4.490 1.00 0.00 C ATOM 264 CD1 LEU A 333 103.218 -3.071 -2.992 1.00 0.00 C ATOM 265 CD2 LEU A 333 104.412 -4.310 -4.797 1.00 0.00 C ATOM 0 H LEU A 333 99.798 -4.441 -5.898 1.00 0.00 H new ATOM 0 HA LEU A 333 100.564 -3.412 -3.314 1.00 0.00 H new ATOM 0 HB2 LEU A 333 101.896 -5.075 -4.505 1.00 0.00 H new ATOM 0 HB3 LEU A 333 101.875 -4.141 -5.988 1.00 0.00 H new ATOM 0 HG LEU A 333 103.345 -2.446 -5.047 1.00 0.00 H new ATOM 0 HD11 LEU A 333 104.152 -2.586 -2.708 1.00 0.00 H new ATOM 0 HD12 LEU A 333 102.382 -2.409 -2.767 1.00 0.00 H new ATOM 0 HD13 LEU A 333 103.106 -4.000 -2.432 1.00 0.00 H new ATOM 0 HD21 LEU A 333 105.345 -3.828 -4.506 1.00 0.00 H new ATOM 0 HD22 LEU A 333 104.294 -5.239 -4.240 1.00 0.00 H new ATOM 0 HD23 LEU A 333 104.434 -4.528 -5.865 1.00 0.00 H new ATOM 277 N ALA A 334 100.806 -1.275 -5.779 1.00 0.00 N ATOM 278 CA ALA A 334 101.078 0.167 -6.041 1.00 0.00 C ATOM 279 C ALA A 334 100.033 1.048 -5.353 1.00 0.00 C ATOM 280 O ALA A 334 100.353 2.054 -4.753 1.00 0.00 O ATOM 281 CB ALA A 334 100.985 0.318 -7.559 1.00 0.00 C ATOM 0 H ALA A 334 100.514 -1.817 -6.592 1.00 0.00 H new ATOM 0 HA ALA A 334 102.050 0.474 -5.655 1.00 0.00 H new ATOM 0 HB1 ALA A 334 101.174 1.356 -7.834 1.00 0.00 H new ATOM 0 HB2 ALA A 334 101.727 -0.324 -8.035 1.00 0.00 H new ATOM 0 HB3 ALA A 334 99.988 0.030 -7.893 1.00 0.00 H new ATOM 287 N ASP A 335 98.784 0.689 -5.439 1.00 0.00 N ATOM 288 CA ASP A 335 97.736 1.530 -4.799 1.00 0.00 C ATOM 289 C ASP A 335 97.937 1.556 -3.287 1.00 0.00 C ATOM 290 O ASP A 335 97.965 2.603 -2.677 1.00 0.00 O ATOM 291 CB ASP A 335 96.410 0.857 -5.158 1.00 0.00 C ATOM 292 CG ASP A 335 96.168 0.975 -6.663 1.00 0.00 C ATOM 293 OD1 ASP A 335 96.877 1.738 -7.299 1.00 0.00 O ATOM 294 OD2 ASP A 335 95.279 0.300 -7.154 1.00 0.00 O ATOM 0 H ASP A 335 98.445 -0.144 -5.921 1.00 0.00 H new ATOM 0 HA ASP A 335 97.768 2.565 -5.141 1.00 0.00 H new ATOM 0 HB2 ASP A 335 96.431 -0.192 -4.864 1.00 0.00 H new ATOM 0 HB3 ASP A 335 95.592 1.325 -4.610 1.00 0.00 H new ATOM 299 N ALA A 336 98.127 0.420 -2.679 1.00 0.00 N ATOM 300 CA ALA A 336 98.375 0.407 -1.212 1.00 0.00 C ATOM 301 C ALA A 336 99.741 1.012 -0.909 1.00 0.00 C ATOM 302 O ALA A 336 99.910 1.727 0.056 1.00 0.00 O ATOM 303 CB ALA A 336 98.331 -1.064 -0.822 1.00 0.00 C ATOM 0 H ALA A 336 98.122 -0.495 -3.131 1.00 0.00 H new ATOM 0 HA ALA A 336 97.643 0.993 -0.657 1.00 0.00 H new ATOM 0 HB1 ALA A 336 98.506 -1.162 0.249 1.00 0.00 H new ATOM 0 HB2 ALA A 336 97.353 -1.477 -1.069 1.00 0.00 H new ATOM 0 HB3 ALA A 336 99.103 -1.608 -1.366 1.00 0.00 H new ATOM 309 N ALA A 337 100.675 0.858 -1.804 1.00 0.00 N ATOM 310 CA ALA A 337 101.966 1.563 -1.647 1.00 0.00 C ATOM 311 C ALA A 337 101.698 3.060 -1.498 1.00 0.00 C ATOM 312 O ALA A 337 102.386 3.762 -0.783 1.00 0.00 O ATOM 313 CB ALA A 337 102.742 1.271 -2.937 1.00 0.00 C ATOM 0 H ALA A 337 100.596 0.273 -2.636 1.00 0.00 H new ATOM 0 HA ALA A 337 102.526 1.240 -0.769 1.00 0.00 H new ATOM 0 HB1 ALA A 337 103.714 1.762 -2.896 1.00 0.00 H new ATOM 0 HB2 ALA A 337 102.883 0.195 -3.041 1.00 0.00 H new ATOM 0 HB3 ALA A 337 102.181 1.648 -3.792 1.00 0.00 H new ATOM 319 N GLN A 338 100.706 3.552 -2.186 1.00 0.00 N ATOM 320 CA GLN A 338 100.388 5.001 -2.112 1.00 0.00 C ATOM 321 C GLN A 338 99.712 5.348 -0.782 1.00 0.00 C ATOM 322 O GLN A 338 100.091 6.292 -0.118 1.00 0.00 O ATOM 323 CB GLN A 338 99.417 5.242 -3.268 1.00 0.00 C ATOM 324 CG GLN A 338 100.199 5.610 -4.524 1.00 0.00 C ATOM 325 CD GLN A 338 99.306 6.434 -5.447 1.00 0.00 C ATOM 326 OE1 GLN A 338 98.161 6.096 -5.668 1.00 0.00 O ATOM 327 NE2 GLN A 338 99.789 7.509 -6.004 1.00 0.00 N ATOM 0 H GLN A 338 100.100 3.008 -2.799 1.00 0.00 H new ATOM 0 HA GLN A 338 101.285 5.616 -2.177 1.00 0.00 H new ATOM 0 HB2 GLN A 338 98.820 4.348 -3.448 1.00 0.00 H new ATOM 0 HB3 GLN A 338 98.723 6.042 -3.012 1.00 0.00 H new ATOM 0 HG2 GLN A 338 101.091 6.178 -4.258 1.00 0.00 H new ATOM 0 HG3 GLN A 338 100.536 4.708 -5.034 1.00 0.00 H new ATOM 0 HE21 GLN A 338 100.751 7.792 -5.817 1.00 0.00 H new ATOM 0 HE22 GLN A 338 99.205 8.067 -6.626 1.00 0.00 H new ATOM 336 N LEU A 339 98.625 4.693 -0.461 1.00 0.00 N ATOM 337 CA LEU A 339 97.852 5.129 0.741 1.00 0.00 C ATOM 338 C LEU A 339 98.688 4.925 2.010 1.00 0.00 C ATOM 339 O LEU A 339 98.683 5.743 2.907 1.00 0.00 O ATOM 340 CB LEU A 339 96.545 4.315 0.782 1.00 0.00 C ATOM 341 CG LEU A 339 96.734 2.893 0.270 1.00 0.00 C ATOM 342 CD1 LEU A 339 96.132 1.921 1.283 1.00 0.00 C ATOM 343 CD2 LEU A 339 95.987 2.755 -1.061 1.00 0.00 C ATOM 0 H LEU A 339 98.246 3.892 -0.966 1.00 0.00 H new ATOM 0 HA LEU A 339 97.613 6.191 0.686 1.00 0.00 H new ATOM 0 HB2 LEU A 339 96.171 4.284 1.805 1.00 0.00 H new ATOM 0 HB3 LEU A 339 95.787 4.818 0.181 1.00 0.00 H new ATOM 0 HG LEU A 339 97.793 2.675 0.132 1.00 0.00 H new ATOM 0 HD11 LEU A 339 96.261 0.899 0.927 1.00 0.00 H new ATOM 0 HD12 LEU A 339 96.635 2.038 2.243 1.00 0.00 H new ATOM 0 HD13 LEU A 339 95.069 2.132 1.403 1.00 0.00 H new ATOM 0 HD21 LEU A 339 96.111 1.742 -1.444 1.00 0.00 H new ATOM 0 HD22 LEU A 339 94.927 2.958 -0.906 1.00 0.00 H new ATOM 0 HD23 LEU A 339 96.391 3.467 -1.781 1.00 0.00 H new ATOM 355 N ALA A 340 99.500 3.910 2.037 1.00 0.00 N ATOM 356 CA ALA A 340 100.448 3.744 3.177 1.00 0.00 C ATOM 357 C ALA A 340 101.504 4.859 3.149 1.00 0.00 C ATOM 358 O ALA A 340 102.201 5.090 4.117 1.00 0.00 O ATOM 359 CB ALA A 340 101.096 2.384 2.936 1.00 0.00 C ATOM 0 H ALA A 340 99.551 3.186 1.320 1.00 0.00 H new ATOM 0 HA ALA A 340 99.956 3.800 4.148 1.00 0.00 H new ATOM 0 HB1 ALA A 340 101.813 2.176 3.731 1.00 0.00 H new ATOM 0 HB2 ALA A 340 100.328 1.611 2.929 1.00 0.00 H new ATOM 0 HB3 ALA A 340 101.611 2.392 1.976 1.00 0.00 H new ATOM 365 N SER A 341 101.703 5.476 2.007 1.00 0.00 N ATOM 366 CA SER A 341 102.801 6.485 1.875 1.00 0.00 C ATOM 367 C SER A 341 102.247 7.914 1.802 1.00 0.00 C ATOM 368 O SER A 341 102.951 8.843 1.468 1.00 0.00 O ATOM 369 CB SER A 341 103.506 6.131 0.568 1.00 0.00 C ATOM 370 OG SER A 341 102.618 6.354 -0.518 1.00 0.00 O ATOM 0 H SER A 341 101.152 5.324 1.162 1.00 0.00 H new ATOM 0 HA SER A 341 103.469 6.458 2.736 1.00 0.00 H new ATOM 0 HB2 SER A 341 104.404 6.738 0.449 1.00 0.00 H new ATOM 0 HB3 SER A 341 103.825 5.089 0.584 1.00 0.00 H new ATOM 0 HG SER A 341 101.752 6.659 -0.175 1.00 0.00 H new ATOM 376 N LEU A 342 100.990 8.099 2.066 1.00 0.00 N ATOM 377 CA LEU A 342 100.413 9.476 1.967 1.00 0.00 C ATOM 378 C LEU A 342 101.028 10.368 3.031 1.00 0.00 C ATOM 379 O LEU A 342 101.268 11.541 2.830 1.00 0.00 O ATOM 380 CB LEU A 342 98.932 9.307 2.266 1.00 0.00 C ATOM 381 CG LEU A 342 98.342 8.273 1.329 1.00 0.00 C ATOM 382 CD1 LEU A 342 96.831 8.226 1.534 1.00 0.00 C ATOM 383 CD2 LEU A 342 98.672 8.657 -0.110 1.00 0.00 C ATOM 0 H LEU A 342 100.335 7.368 2.344 1.00 0.00 H new ATOM 0 HA LEU A 342 100.599 9.926 0.992 1.00 0.00 H new ATOM 0 HB2 LEU A 342 98.792 8.997 3.302 1.00 0.00 H new ATOM 0 HB3 LEU A 342 98.415 10.259 2.146 1.00 0.00 H new ATOM 0 HG LEU A 342 98.761 7.288 1.537 1.00 0.00 H new ATOM 0 HD11 LEU A 342 96.396 7.484 0.864 1.00 0.00 H new ATOM 0 HD12 LEU A 342 96.612 7.955 2.567 1.00 0.00 H new ATOM 0 HD13 LEU A 342 96.404 9.205 1.318 1.00 0.00 H new ATOM 0 HD21 LEU A 342 98.250 7.917 -0.790 1.00 0.00 H new ATOM 0 HD22 LEU A 342 98.248 9.636 -0.332 1.00 0.00 H new ATOM 0 HD23 LEU A 342 99.754 8.693 -0.238 1.00 0.00 H new ATOM 395 N ALA A 343 101.106 9.843 4.213 1.00 0.00 N ATOM 396 CA ALA A 343 101.501 10.679 5.383 1.00 0.00 C ATOM 397 C ALA A 343 102.993 10.527 5.686 1.00 0.00 C ATOM 398 O ALA A 343 103.517 11.178 6.568 1.00 0.00 O ATOM 399 CB ALA A 343 100.659 10.156 6.547 1.00 0.00 C ATOM 0 H ALA A 343 100.913 8.865 4.427 1.00 0.00 H new ATOM 0 HA ALA A 343 101.332 11.740 5.198 1.00 0.00 H new ATOM 0 HB1 ALA A 343 100.893 10.723 7.448 1.00 0.00 H new ATOM 0 HB2 ALA A 343 99.601 10.270 6.311 1.00 0.00 H new ATOM 0 HB3 ALA A 343 100.882 9.102 6.713 1.00 0.00 H new ATOM 405 N ASP A 344 103.705 9.743 4.922 1.00 0.00 N ATOM 406 CA ASP A 344 105.174 9.662 5.150 1.00 0.00 C ATOM 407 C ASP A 344 105.815 11.020 4.899 1.00 0.00 C ATOM 408 O ASP A 344 105.605 11.653 3.884 1.00 0.00 O ATOM 409 CB ASP A 344 105.701 8.622 4.168 1.00 0.00 C ATOM 410 CG ASP A 344 105.137 8.890 2.776 1.00 0.00 C ATOM 411 OD1 ASP A 344 104.673 9.994 2.547 1.00 0.00 O ATOM 412 OD2 ASP A 344 105.172 7.983 1.960 1.00 0.00 O ATOM 0 H ASP A 344 103.341 9.166 4.164 1.00 0.00 H new ATOM 0 HA ASP A 344 105.409 9.380 6.176 1.00 0.00 H new ATOM 0 HB2 ASP A 344 106.790 8.654 4.141 1.00 0.00 H new ATOM 0 HB3 ASP A 344 105.419 7.622 4.498 1.00 0.00 H new ATOM 417 N GLU A 345 106.611 11.456 5.820 1.00 0.00 N ATOM 418 CA GLU A 345 107.303 12.760 5.662 1.00 0.00 C ATOM 419 C GLU A 345 108.706 12.540 5.096 1.00 0.00 C ATOM 420 O GLU A 345 109.491 13.458 4.967 1.00 0.00 O ATOM 421 CB GLU A 345 107.372 13.327 7.074 1.00 0.00 C ATOM 422 CG GLU A 345 105.954 13.593 7.586 1.00 0.00 C ATOM 423 CD GLU A 345 106.023 14.220 8.979 1.00 0.00 C ATOM 424 OE1 GLU A 345 107.107 14.258 9.537 1.00 0.00 O ATOM 425 OE2 GLU A 345 104.990 14.651 9.465 1.00 0.00 O ATOM 0 H GLU A 345 106.817 10.962 6.688 1.00 0.00 H new ATOM 0 HA GLU A 345 106.789 13.433 4.976 1.00 0.00 H new ATOM 0 HB2 GLU A 345 107.883 12.626 7.734 1.00 0.00 H new ATOM 0 HB3 GLU A 345 107.951 14.250 7.079 1.00 0.00 H new ATOM 0 HG2 GLU A 345 105.428 14.259 6.902 1.00 0.00 H new ATOM 0 HG3 GLU A 345 105.389 12.662 7.622 1.00 0.00 H new ATOM 432 N THR A 346 109.016 11.323 4.755 1.00 0.00 N ATOM 433 CA THR A 346 110.360 11.017 4.189 1.00 0.00 C ATOM 434 C THR A 346 110.418 11.484 2.735 1.00 0.00 C ATOM 435 O THR A 346 109.417 11.477 2.045 1.00 0.00 O ATOM 436 CB THR A 346 110.498 9.487 4.261 1.00 0.00 C ATOM 437 OG1 THR A 346 109.864 8.906 3.131 1.00 0.00 O ATOM 438 CG2 THR A 346 109.847 8.946 5.543 1.00 0.00 C ATOM 0 H THR A 346 108.393 10.520 4.844 1.00 0.00 H new ATOM 0 HA THR A 346 111.161 11.518 4.732 1.00 0.00 H new ATOM 0 HB THR A 346 111.557 9.229 4.270 1.00 0.00 H new ATOM 0 HG1 THR A 346 109.951 7.931 3.172 1.00 0.00 H new ATOM 0 HG21 THR A 346 109.955 7.862 5.576 1.00 0.00 H new ATOM 0 HG22 THR A 346 110.335 9.386 6.413 1.00 0.00 H new ATOM 0 HG23 THR A 346 108.788 9.206 5.551 1.00 0.00 H new ATOM 446 N PRO A 347 111.602 11.796 2.287 1.00 0.00 N ATOM 447 CA PRO A 347 111.789 12.167 0.867 1.00 0.00 C ATOM 448 C PRO A 347 111.252 11.043 -0.019 1.00 0.00 C ATOM 449 O PRO A 347 110.597 11.277 -1.015 1.00 0.00 O ATOM 450 CB PRO A 347 113.305 12.318 0.709 1.00 0.00 C ATOM 451 CG PRO A 347 113.911 11.778 1.972 1.00 0.00 C ATOM 452 CD PRO A 347 112.852 11.829 3.040 1.00 0.00 C ATOM 0 HA PRO A 347 111.263 13.078 0.583 1.00 0.00 H new ATOM 0 HB2 PRO A 347 113.663 11.768 -0.161 1.00 0.00 H new ATOM 0 HB3 PRO A 347 113.579 13.362 0.561 1.00 0.00 H new ATOM 0 HG2 PRO A 347 114.257 10.755 1.824 1.00 0.00 H new ATOM 0 HG3 PRO A 347 114.779 12.369 2.264 1.00 0.00 H new ATOM 0 HD2 PRO A 347 112.931 10.983 3.723 1.00 0.00 H new ATOM 0 HD3 PRO A 347 112.933 12.734 3.642 1.00 0.00 H new ATOM 460 N GLU A 348 111.466 9.820 0.385 1.00 0.00 N ATOM 461 CA GLU A 348 110.906 8.669 -0.376 1.00 0.00 C ATOM 462 C GLU A 348 109.375 8.699 -0.340 1.00 0.00 C ATOM 463 O GLU A 348 108.719 8.150 -1.195 1.00 0.00 O ATOM 464 CB GLU A 348 111.425 7.428 0.353 1.00 0.00 C ATOM 465 CG GLU A 348 112.942 7.333 0.188 1.00 0.00 C ATOM 466 CD GLU A 348 113.453 6.071 0.889 1.00 0.00 C ATOM 467 OE1 GLU A 348 112.667 5.444 1.580 1.00 0.00 O ATOM 468 OE2 GLU A 348 114.618 5.756 0.724 1.00 0.00 O ATOM 0 H GLU A 348 112.007 9.569 1.213 1.00 0.00 H new ATOM 0 HA GLU A 348 111.201 8.688 -1.425 1.00 0.00 H new ATOM 0 HB2 GLU A 348 111.167 7.481 1.411 1.00 0.00 H new ATOM 0 HB3 GLU A 348 110.949 6.533 -0.047 1.00 0.00 H new ATOM 0 HG2 GLU A 348 113.203 7.305 -0.870 1.00 0.00 H new ATOM 0 HG3 GLU A 348 113.421 8.216 0.611 1.00 0.00 H new ATOM 475 N GLY A 349 108.802 9.242 0.698 1.00 0.00 N ATOM 476 CA GLY A 349 107.319 9.191 0.841 1.00 0.00 C ATOM 477 C GLY A 349 106.662 9.803 -0.394 1.00 0.00 C ATOM 478 O GLY A 349 105.707 9.272 -0.935 1.00 0.00 O ATOM 0 H GLY A 349 109.295 9.718 1.453 1.00 0.00 H new ATOM 0 HA2 GLY A 349 106.991 8.159 0.966 1.00 0.00 H new ATOM 0 HA3 GLY A 349 107.011 9.733 1.735 1.00 0.00 H new ATOM 482 N ARG A 350 107.244 10.838 -0.923 1.00 0.00 N ATOM 483 CA ARG A 350 106.730 11.400 -2.206 1.00 0.00 C ATOM 484 C ARG A 350 107.167 10.532 -3.387 1.00 0.00 C ATOM 485 O ARG A 350 106.426 10.334 -4.327 1.00 0.00 O ATOM 486 CB ARG A 350 107.335 12.800 -2.305 1.00 0.00 C ATOM 487 CG ARG A 350 106.820 13.662 -1.150 1.00 0.00 C ATOM 488 CD ARG A 350 107.342 15.092 -1.310 1.00 0.00 C ATOM 489 NE ARG A 350 106.964 15.781 -0.044 1.00 0.00 N ATOM 490 CZ ARG A 350 107.420 16.978 0.215 1.00 0.00 C ATOM 491 NH1 ARG A 350 108.211 17.579 -0.633 1.00 0.00 N ATOM 492 NH2 ARG A 350 107.086 17.575 1.326 1.00 0.00 N ATOM 0 H ARG A 350 108.051 11.321 -0.527 1.00 0.00 H new ATOM 0 HA ARG A 350 105.641 11.430 -2.230 1.00 0.00 H new ATOM 0 HB2 ARG A 350 108.423 12.741 -2.271 1.00 0.00 H new ATOM 0 HB3 ARG A 350 107.070 13.256 -3.259 1.00 0.00 H new ATOM 0 HG2 ARG A 350 105.730 13.660 -1.138 1.00 0.00 H new ATOM 0 HG3 ARG A 350 107.150 13.247 -0.197 1.00 0.00 H new ATOM 0 HD2 ARG A 350 108.422 15.104 -1.459 1.00 0.00 H new ATOM 0 HD3 ARG A 350 106.895 15.582 -2.175 1.00 0.00 H new ATOM 0 HE ARG A 350 106.347 15.317 0.623 1.00 0.00 H new ATOM 0 HH11 ARG A 350 108.475 17.114 -1.502 1.00 0.00 H new ATOM 0 HH12 ARG A 350 108.564 18.513 -0.427 1.00 0.00 H new ATOM 0 HH21 ARG A 350 106.470 17.107 1.991 1.00 0.00 H new ATOM 0 HH22 ARG A 350 107.441 18.509 1.530 1.00 0.00 H new ATOM 506 N SER A 351 108.366 10.030 -3.364 1.00 0.00 N ATOM 507 CA SER A 351 108.838 9.205 -4.510 1.00 0.00 C ATOM 508 C SER A 351 107.969 7.951 -4.662 1.00 0.00 C ATOM 509 O SER A 351 107.689 7.511 -5.755 1.00 0.00 O ATOM 510 CB SER A 351 110.275 8.827 -4.163 1.00 0.00 C ATOM 511 OG SER A 351 110.958 9.975 -3.678 1.00 0.00 O ATOM 0 H SER A 351 109.038 10.153 -2.607 1.00 0.00 H new ATOM 0 HA SER A 351 108.777 9.744 -5.456 1.00 0.00 H new ATOM 0 HB2 SER A 351 110.284 8.039 -3.410 1.00 0.00 H new ATOM 0 HB3 SER A 351 110.782 8.433 -5.043 1.00 0.00 H new ATOM 0 HG SER A 351 111.727 10.166 -4.255 1.00 0.00 H new ATOM 517 N ILE A 352 107.550 7.367 -3.574 1.00 0.00 N ATOM 518 CA ILE A 352 106.712 6.135 -3.662 1.00 0.00 C ATOM 519 C ILE A 352 105.333 6.465 -4.238 1.00 0.00 C ATOM 520 O ILE A 352 104.861 5.824 -5.154 1.00 0.00 O ATOM 521 CB ILE A 352 106.590 5.637 -2.223 1.00 0.00 C ATOM 522 CG1 ILE A 352 107.983 5.322 -1.674 1.00 0.00 C ATOM 523 CG2 ILE A 352 105.740 4.368 -2.195 1.00 0.00 C ATOM 524 CD1 ILE A 352 107.893 5.051 -0.171 1.00 0.00 C ATOM 0 H ILE A 352 107.751 7.688 -2.627 1.00 0.00 H new ATOM 0 HA ILE A 352 107.152 5.384 -4.318 1.00 0.00 H new ATOM 0 HB ILE A 352 106.120 6.407 -1.611 1.00 0.00 H new ATOM 0 HG12 ILE A 352 108.399 4.454 -2.186 1.00 0.00 H new ATOM 0 HG13 ILE A 352 108.657 6.157 -1.863 1.00 0.00 H new ATOM 0 HG21 ILE A 352 105.652 4.012 -1.169 1.00 0.00 H new ATOM 0 HG22 ILE A 352 104.748 4.586 -2.590 1.00 0.00 H new ATOM 0 HG23 ILE A 352 106.213 3.600 -2.807 1.00 0.00 H new ATOM 0 HD11 ILE A 352 108.886 4.827 0.218 1.00 0.00 H new ATOM 0 HD12 ILE A 352 107.495 5.931 0.334 1.00 0.00 H new ATOM 0 HD13 ILE A 352 107.233 4.202 0.007 1.00 0.00 H new ATOM 536 N VAL A 353 104.687 7.470 -3.726 1.00 0.00 N ATOM 537 CA VAL A 353 103.350 7.842 -4.271 1.00 0.00 C ATOM 538 C VAL A 353 103.480 8.223 -5.751 1.00 0.00 C ATOM 539 O VAL A 353 102.666 7.849 -6.577 1.00 0.00 O ATOM 540 CB VAL A 353 102.908 9.036 -3.423 1.00 0.00 C ATOM 541 CG1 VAL A 353 101.461 9.400 -3.759 1.00 0.00 C ATOM 542 CG2 VAL A 353 103.015 8.673 -1.935 1.00 0.00 C ATOM 0 H VAL A 353 105.022 8.050 -2.957 1.00 0.00 H new ATOM 0 HA VAL A 353 102.627 7.028 -4.224 1.00 0.00 H new ATOM 0 HB VAL A 353 103.552 9.889 -3.637 1.00 0.00 H new ATOM 0 HG11 VAL A 353 101.150 10.251 -3.153 1.00 0.00 H new ATOM 0 HG12 VAL A 353 101.387 9.660 -4.815 1.00 0.00 H new ATOM 0 HG13 VAL A 353 100.813 8.549 -3.549 1.00 0.00 H new ATOM 0 HG21 VAL A 353 102.700 9.523 -1.330 1.00 0.00 H new ATOM 0 HG22 VAL A 353 102.373 7.818 -1.722 1.00 0.00 H new ATOM 0 HG23 VAL A 353 104.048 8.420 -1.696 1.00 0.00 H new ATOM 552 N ILE A 354 104.588 8.798 -6.119 1.00 0.00 N ATOM 553 CA ILE A 354 104.866 9.014 -7.568 1.00 0.00 C ATOM 554 C ILE A 354 105.210 7.685 -8.257 1.00 0.00 C ATOM 555 O ILE A 354 104.877 7.477 -9.402 1.00 0.00 O ATOM 556 CB ILE A 354 106.050 9.978 -7.601 1.00 0.00 C ATOM 557 CG1 ILE A 354 105.679 11.254 -6.838 1.00 0.00 C ATOM 558 CG2 ILE A 354 106.384 10.330 -9.051 1.00 0.00 C ATOM 559 CD1 ILE A 354 106.953 11.982 -6.404 1.00 0.00 C ATOM 0 H ILE A 354 105.313 9.128 -5.482 1.00 0.00 H new ATOM 0 HA ILE A 354 104.004 9.416 -8.100 1.00 0.00 H new ATOM 0 HB ILE A 354 106.917 9.509 -7.136 1.00 0.00 H new ATOM 0 HG12 ILE A 354 105.074 11.904 -7.470 1.00 0.00 H new ATOM 0 HG13 ILE A 354 105.075 11.005 -5.965 1.00 0.00 H new ATOM 0 HG21 ILE A 354 107.229 11.018 -9.073 1.00 0.00 H new ATOM 0 HG22 ILE A 354 106.641 9.422 -9.596 1.00 0.00 H new ATOM 0 HG23 ILE A 354 105.520 10.802 -9.519 1.00 0.00 H new ATOM 0 HD11 ILE A 354 106.687 12.889 -5.862 1.00 0.00 H new ATOM 0 HD12 ILE A 354 107.541 11.332 -5.757 1.00 0.00 H new ATOM 0 HD13 ILE A 354 107.540 12.245 -7.284 1.00 0.00 H new ATOM 571 N LEU A 355 105.846 6.775 -7.568 1.00 0.00 N ATOM 572 CA LEU A 355 106.172 5.458 -8.196 1.00 0.00 C ATOM 573 C LEU A 355 104.894 4.763 -8.662 1.00 0.00 C ATOM 574 O LEU A 355 104.841 4.196 -9.732 1.00 0.00 O ATOM 575 CB LEU A 355 106.848 4.637 -7.092 1.00 0.00 C ATOM 576 CG LEU A 355 106.992 3.180 -7.546 1.00 0.00 C ATOM 577 CD1 LEU A 355 108.472 2.845 -7.739 1.00 0.00 C ATOM 578 CD2 LEU A 355 106.393 2.252 -6.482 1.00 0.00 C ATOM 0 H LEU A 355 106.153 6.884 -6.602 1.00 0.00 H new ATOM 0 HA LEU A 355 106.814 5.573 -9.069 1.00 0.00 H new ATOM 0 HB2 LEU A 355 107.828 5.055 -6.863 1.00 0.00 H new ATOM 0 HB3 LEU A 355 106.259 4.686 -6.176 1.00 0.00 H new ATOM 0 HG LEU A 355 106.464 3.042 -8.490 1.00 0.00 H new ATOM 0 HD11 LEU A 355 108.571 1.809 -8.062 1.00 0.00 H new ATOM 0 HD12 LEU A 355 108.898 3.503 -8.496 1.00 0.00 H new ATOM 0 HD13 LEU A 355 109.002 2.984 -6.797 1.00 0.00 H new ATOM 0 HD21 LEU A 355 106.495 1.216 -6.804 1.00 0.00 H new ATOM 0 HD22 LEU A 355 106.920 2.392 -5.538 1.00 0.00 H new ATOM 0 HD23 LEU A 355 105.337 2.488 -6.346 1.00 0.00 H new ATOM 590 N ALA A 356 103.859 4.824 -7.876 1.00 0.00 N ATOM 591 CA ALA A 356 102.575 4.179 -8.278 1.00 0.00 C ATOM 592 C ALA A 356 102.005 4.848 -9.521 1.00 0.00 C ATOM 593 O ALA A 356 101.488 4.191 -10.403 1.00 0.00 O ATOM 594 CB ALA A 356 101.642 4.378 -7.081 1.00 0.00 C ATOM 0 H ALA A 356 103.844 5.293 -6.970 1.00 0.00 H new ATOM 0 HA ALA A 356 102.705 3.125 -8.525 1.00 0.00 H new ATOM 0 HB1 ALA A 356 100.672 3.930 -7.297 1.00 0.00 H new ATOM 0 HB2 ALA A 356 102.073 3.902 -6.200 1.00 0.00 H new ATOM 0 HB3 ALA A 356 101.515 5.444 -6.892 1.00 0.00 H new ATOM 600 N LYS A 357 101.990 6.146 -9.560 1.00 0.00 N ATOM 601 CA LYS A 357 101.325 6.817 -10.708 1.00 0.00 C ATOM 602 C LYS A 357 102.163 6.665 -11.976 1.00 0.00 C ATOM 603 O LYS A 357 101.650 6.389 -13.041 1.00 0.00 O ATOM 604 CB LYS A 357 101.210 8.289 -10.311 1.00 0.00 C ATOM 605 CG LYS A 357 100.584 8.407 -8.919 1.00 0.00 C ATOM 606 CD LYS A 357 100.211 9.865 -8.645 1.00 0.00 C ATOM 607 CE LYS A 357 101.485 10.689 -8.448 1.00 0.00 C ATOM 608 NZ LYS A 357 101.060 12.104 -8.634 1.00 0.00 N ATOM 0 H LYS A 357 102.401 6.764 -8.861 1.00 0.00 H new ATOM 0 HA LYS A 357 100.349 6.380 -10.922 1.00 0.00 H new ATOM 0 HB2 LYS A 357 102.196 8.754 -10.316 1.00 0.00 H new ATOM 0 HB3 LYS A 357 100.601 8.824 -11.039 1.00 0.00 H new ATOM 0 HG2 LYS A 357 99.698 7.776 -8.853 1.00 0.00 H new ATOM 0 HG3 LYS A 357 101.285 8.052 -8.163 1.00 0.00 H new ATOM 0 HD2 LYS A 357 99.631 10.266 -9.476 1.00 0.00 H new ATOM 0 HD3 LYS A 357 99.582 9.930 -7.757 1.00 0.00 H new ATOM 0 HE2 LYS A 357 101.908 10.531 -7.456 1.00 0.00 H new ATOM 0 HE3 LYS A 357 102.252 10.409 -9.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 357 101.881 12.732 -8.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 357 100.668 12.226 -9.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 357 100.334 12.344 -7.929 1.00 0.00 H new ATOM 622 N GLN A 358 103.426 6.958 -11.892 1.00 0.00 N ATOM 623 CA GLN A 358 104.271 6.959 -13.116 1.00 0.00 C ATOM 624 C GLN A 358 104.526 5.533 -13.604 1.00 0.00 C ATOM 625 O GLN A 358 104.594 5.279 -14.790 1.00 0.00 O ATOM 626 CB GLN A 358 105.580 7.614 -12.684 1.00 0.00 C ATOM 627 CG GLN A 358 106.347 6.686 -11.744 1.00 0.00 C ATOM 628 CD GLN A 358 107.509 7.453 -11.111 1.00 0.00 C ATOM 629 OE1 GLN A 358 107.365 8.601 -10.739 1.00 0.00 O ATOM 630 NE2 GLN A 358 108.666 6.865 -10.973 1.00 0.00 N ATOM 0 H GLN A 358 103.912 7.198 -11.028 1.00 0.00 H new ATOM 0 HA GLN A 358 103.793 7.488 -13.941 1.00 0.00 H new ATOM 0 HB2 GLN A 358 106.188 7.841 -13.560 1.00 0.00 H new ATOM 0 HB3 GLN A 358 105.374 8.561 -12.185 1.00 0.00 H new ATOM 0 HG2 GLN A 358 105.682 6.305 -10.968 1.00 0.00 H new ATOM 0 HG3 GLN A 358 106.723 5.823 -12.294 1.00 0.00 H new ATOM 0 HE21 GLN A 358 108.789 5.902 -11.285 1.00 0.00 H new ATOM 0 HE22 GLN A 358 109.447 7.369 -10.554 1.00 0.00 H new ATOM 639 N ARG A 359 104.810 4.635 -12.706 1.00 0.00 N ATOM 640 CA ARG A 359 105.227 3.271 -13.136 1.00 0.00 C ATOM 641 C ARG A 359 104.038 2.470 -13.665 1.00 0.00 C ATOM 642 O ARG A 359 104.188 1.655 -14.553 1.00 0.00 O ATOM 643 CB ARG A 359 105.792 2.601 -11.883 1.00 0.00 C ATOM 644 CG ARG A 359 107.050 3.338 -11.421 1.00 0.00 C ATOM 645 CD ARG A 359 108.105 3.287 -12.529 1.00 0.00 C ATOM 646 NE ARG A 359 109.320 3.912 -11.934 1.00 0.00 N ATOM 647 CZ ARG A 359 110.376 4.128 -12.671 1.00 0.00 C ATOM 648 NH1 ARG A 359 110.377 3.795 -13.935 1.00 0.00 N ATOM 649 NH2 ARG A 359 111.437 4.676 -12.143 1.00 0.00 N ATOM 0 H ARG A 359 104.772 4.783 -11.698 1.00 0.00 H new ATOM 0 HA ARG A 359 105.957 3.321 -13.944 1.00 0.00 H new ATOM 0 HB2 ARG A 359 105.045 2.606 -11.089 1.00 0.00 H new ATOM 0 HB3 ARG A 359 106.028 1.558 -12.093 1.00 0.00 H new ATOM 0 HG2 ARG A 359 106.810 4.373 -11.180 1.00 0.00 H new ATOM 0 HG3 ARG A 359 107.439 2.881 -10.512 1.00 0.00 H new ATOM 0 HD2 ARG A 359 108.301 2.261 -12.840 1.00 0.00 H new ATOM 0 HD3 ARG A 359 107.775 3.831 -13.414 1.00 0.00 H new ATOM 0 HE ARG A 359 109.327 4.172 -10.948 1.00 0.00 H new ATOM 0 HH11 ARG A 359 109.550 3.364 -14.350 1.00 0.00 H new ATOM 0 HH12 ARG A 359 111.204 3.966 -14.507 1.00 0.00 H new ATOM 0 HH21 ARG A 359 111.440 4.935 -11.156 1.00 0.00 H new ATOM 0 HH22 ARG A 359 112.263 4.845 -12.717 1.00 0.00 H new ATOM 663 N PHE A 360 102.918 2.524 -12.994 1.00 0.00 N ATOM 664 CA PHE A 360 101.836 1.562 -13.345 1.00 0.00 C ATOM 665 C PHE A 360 100.473 2.244 -13.421 1.00 0.00 C ATOM 666 O PHE A 360 99.594 1.792 -14.129 1.00 0.00 O ATOM 667 CB PHE A 360 101.851 0.530 -12.218 1.00 0.00 C ATOM 668 CG PHE A 360 103.086 -0.331 -12.340 1.00 0.00 C ATOM 669 CD1 PHE A 360 103.059 -1.489 -13.128 1.00 0.00 C ATOM 670 CD2 PHE A 360 104.260 0.030 -11.664 1.00 0.00 C ATOM 671 CE1 PHE A 360 104.206 -2.288 -13.240 1.00 0.00 C ATOM 672 CE2 PHE A 360 105.407 -0.769 -11.776 1.00 0.00 C ATOM 673 CZ PHE A 360 105.380 -1.927 -12.565 1.00 0.00 C ATOM 0 H PHE A 360 102.709 3.175 -12.237 1.00 0.00 H new ATOM 0 HA PHE A 360 102.003 1.118 -14.327 1.00 0.00 H new ATOM 0 HB2 PHE A 360 101.839 1.032 -11.251 1.00 0.00 H new ATOM 0 HB3 PHE A 360 100.956 -0.090 -12.267 1.00 0.00 H new ATOM 0 HD1 PHE A 360 102.155 -1.766 -13.649 1.00 0.00 H new ATOM 0 HD2 PHE A 360 104.281 0.923 -11.057 1.00 0.00 H new ATOM 0 HE1 PHE A 360 104.185 -3.181 -13.846 1.00 0.00 H new ATOM 0 HE2 PHE A 360 106.311 -0.492 -11.254 1.00 0.00 H new ATOM 0 HZ PHE A 360 106.264 -2.541 -12.653 1.00 0.00 H new ATOM 683 N ASN A 361 100.206 3.165 -12.540 1.00 0.00 N ATOM 684 CA ASN A 361 98.804 3.646 -12.416 1.00 0.00 C ATOM 685 C ASN A 361 98.735 4.980 -11.672 1.00 0.00 C ATOM 686 O ASN A 361 98.810 5.024 -10.460 1.00 0.00 O ATOM 687 CB ASN A 361 98.109 2.555 -11.606 1.00 0.00 C ATOM 688 CG ASN A 361 96.601 2.812 -11.580 1.00 0.00 C ATOM 689 OD1 ASN A 361 96.053 3.177 -10.561 1.00 0.00 O ATOM 690 ND2 ASN A 361 95.903 2.637 -12.669 1.00 0.00 N ATOM 0 H ASN A 361 100.883 3.598 -11.912 1.00 0.00 H new ATOM 0 HA ASN A 361 98.344 3.819 -13.389 1.00 0.00 H new ATOM 0 HB2 ASN A 361 98.313 1.578 -12.044 1.00 0.00 H new ATOM 0 HB3 ASN A 361 98.502 2.537 -10.589 1.00 0.00 H new ATOM 0 HD21 ASN A 361 94.897 2.807 -12.663 1.00 0.00 H new ATOM 0 HD22 ASN A 361 96.363 2.330 -13.526 1.00 0.00 H new ATOM 697 N LEU A 362 98.445 6.046 -12.367 1.00 0.00 N ATOM 698 CA LEU A 362 98.201 7.339 -11.671 1.00 0.00 C ATOM 699 C LEU A 362 97.066 7.158 -10.663 1.00 0.00 C ATOM 700 O LEU A 362 95.905 7.333 -10.979 1.00 0.00 O ATOM 701 CB LEU A 362 97.774 8.312 -12.776 1.00 0.00 C ATOM 702 CG LEU A 362 98.853 8.391 -13.860 1.00 0.00 C ATOM 703 CD1 LEU A 362 98.333 9.223 -15.035 1.00 0.00 C ATOM 704 CD2 LEU A 362 100.105 9.057 -13.289 1.00 0.00 C ATOM 0 H LEU A 362 98.367 6.077 -13.384 1.00 0.00 H new ATOM 0 HA LEU A 362 99.077 7.699 -11.131 1.00 0.00 H new ATOM 0 HB2 LEU A 362 96.832 7.984 -13.215 1.00 0.00 H new ATOM 0 HB3 LEU A 362 97.601 9.301 -12.352 1.00 0.00 H new ATOM 0 HG LEU A 362 99.097 7.385 -14.200 1.00 0.00 H new ATOM 0 HD11 LEU A 362 99.100 9.280 -15.808 1.00 0.00 H new ATOM 0 HD12 LEU A 362 97.439 8.754 -15.445 1.00 0.00 H new ATOM 0 HD13 LEU A 362 98.090 10.228 -14.690 1.00 0.00 H new ATOM 0 HD21 LEU A 362 100.872 9.113 -14.061 1.00 0.00 H new ATOM 0 HD22 LEU A 362 99.859 10.063 -12.949 1.00 0.00 H new ATOM 0 HD23 LEU A 362 100.478 8.471 -12.449 1.00 0.00 H new ATOM 716 N ARG A 363 97.394 6.781 -9.459 1.00 0.00 N ATOM 717 CA ARG A 363 96.345 6.553 -8.430 1.00 0.00 C ATOM 718 C ARG A 363 96.616 7.444 -7.225 1.00 0.00 C ATOM 719 O ARG A 363 97.687 7.991 -7.079 1.00 0.00 O ATOM 720 CB ARG A 363 96.477 5.077 -8.051 1.00 0.00 C ATOM 721 CG ARG A 363 95.401 4.707 -7.029 1.00 0.00 C ATOM 722 CD ARG A 363 94.029 4.714 -7.704 1.00 0.00 C ATOM 723 NE ARG A 363 93.062 4.404 -6.614 1.00 0.00 N ATOM 724 CZ ARG A 363 91.856 3.994 -6.901 1.00 0.00 C ATOM 725 NH1 ARG A 363 91.486 3.852 -8.146 1.00 0.00 N ATOM 726 NH2 ARG A 363 91.015 3.725 -5.940 1.00 0.00 N ATOM 0 H ARG A 363 98.350 6.620 -9.143 1.00 0.00 H new ATOM 0 HA ARG A 363 95.343 6.787 -8.789 1.00 0.00 H new ATOM 0 HB2 ARG A 363 96.378 4.454 -8.940 1.00 0.00 H new ATOM 0 HB3 ARG A 363 97.467 4.886 -7.636 1.00 0.00 H new ATOM 0 HG2 ARG A 363 95.606 3.722 -6.610 1.00 0.00 H new ATOM 0 HG3 ARG A 363 95.413 5.415 -6.200 1.00 0.00 H new ATOM 0 HD2 ARG A 363 93.817 5.683 -8.156 1.00 0.00 H new ATOM 0 HD3 ARG A 363 93.977 3.972 -8.501 1.00 0.00 H new ATOM 0 HE ARG A 363 93.343 4.512 -5.640 1.00 0.00 H new ATOM 0 HH11 ARG A 363 92.141 4.062 -8.900 1.00 0.00 H new ATOM 0 HH12 ARG A 363 90.543 3.531 -8.364 1.00 0.00 H new ATOM 0 HH21 ARG A 363 91.300 3.835 -4.967 1.00 0.00 H new ATOM 0 HH22 ARG A 363 90.072 3.405 -6.162 1.00 0.00 H new ATOM 740 N GLU A 364 95.659 7.609 -6.364 1.00 0.00 N ATOM 741 CA GLU A 364 95.883 8.475 -5.177 1.00 0.00 C ATOM 742 C GLU A 364 95.215 7.866 -3.948 1.00 0.00 C ATOM 743 O GLU A 364 94.918 6.689 -3.905 1.00 0.00 O ATOM 744 CB GLU A 364 95.250 9.815 -5.537 1.00 0.00 C ATOM 745 CG GLU A 364 95.846 10.326 -6.850 1.00 0.00 C ATOM 746 CD GLU A 364 95.278 11.711 -7.164 1.00 0.00 C ATOM 747 OE1 GLU A 364 94.357 12.122 -6.477 1.00 0.00 O ATOM 748 OE2 GLU A 364 95.774 12.337 -8.087 1.00 0.00 O ATOM 0 H GLU A 364 94.734 7.184 -6.428 1.00 0.00 H new ATOM 0 HA GLU A 364 96.940 8.584 -4.936 1.00 0.00 H new ATOM 0 HB2 GLU A 364 94.170 9.704 -5.635 1.00 0.00 H new ATOM 0 HB3 GLU A 364 95.426 10.538 -4.740 1.00 0.00 H new ATOM 0 HG2 GLU A 364 96.932 10.376 -6.774 1.00 0.00 H new ATOM 0 HG3 GLU A 364 95.615 9.634 -7.660 1.00 0.00 H new ATOM 755 N ARG A 365 95.007 8.654 -2.938 1.00 0.00 N ATOM 756 CA ARG A 365 94.390 8.120 -1.690 1.00 0.00 C ATOM 757 C ARG A 365 92.891 8.406 -1.666 1.00 0.00 C ATOM 758 O ARG A 365 92.404 9.285 -2.348 1.00 0.00 O ATOM 759 CB ARG A 365 95.073 8.870 -0.554 1.00 0.00 C ATOM 760 CG ARG A 365 94.625 10.331 -0.574 1.00 0.00 C ATOM 761 CD ARG A 365 95.389 11.110 0.494 1.00 0.00 C ATOM 762 NE ARG A 365 94.871 12.504 0.402 1.00 0.00 N ATOM 763 CZ ARG A 365 95.198 13.262 -0.611 1.00 0.00 C ATOM 764 NH1 ARG A 365 95.981 12.804 -1.551 1.00 0.00 N ATOM 765 NH2 ARG A 365 94.740 14.482 -0.683 1.00 0.00 N ATOM 0 H ARG A 365 95.236 9.648 -2.918 1.00 0.00 H new ATOM 0 HA ARG A 365 94.515 7.040 -1.612 1.00 0.00 H new ATOM 0 HB2 ARG A 365 94.820 8.413 0.403 1.00 0.00 H new ATOM 0 HB3 ARG A 365 96.156 8.808 -0.661 1.00 0.00 H new ATOM 0 HG2 ARG A 365 94.807 10.765 -1.557 1.00 0.00 H new ATOM 0 HG3 ARG A 365 93.553 10.397 -0.390 1.00 0.00 H new ATOM 0 HD2 ARG A 365 95.218 10.691 1.486 1.00 0.00 H new ATOM 0 HD3 ARG A 365 96.463 11.076 0.314 1.00 0.00 H new ATOM 0 HE ARG A 365 94.259 12.868 1.132 1.00 0.00 H new ATOM 0 HH11 ARG A 365 96.340 11.851 -1.496 1.00 0.00 H new ATOM 0 HH12 ARG A 365 96.233 13.400 -2.340 1.00 0.00 H new ATOM 0 HH21 ARG A 365 94.129 14.841 0.050 1.00 0.00 H new ATOM 0 HH22 ARG A 365 94.993 15.076 -1.472 1.00 0.00 H new ATOM 779 N ASP A 366 92.172 7.727 -0.816 1.00 0.00 N ATOM 780 CA ASP A 366 90.717 8.029 -0.674 1.00 0.00 C ATOM 781 C ASP A 366 90.356 8.223 0.799 1.00 0.00 C ATOM 782 O ASP A 366 89.344 7.747 1.272 1.00 0.00 O ATOM 783 CB ASP A 366 89.994 6.813 -1.255 1.00 0.00 C ATOM 784 CG ASP A 366 90.262 6.731 -2.759 1.00 0.00 C ATOM 785 OD1 ASP A 366 90.756 7.703 -3.307 1.00 0.00 O ATOM 786 OD2 ASP A 366 89.968 5.698 -3.338 1.00 0.00 O ATOM 0 H ASP A 366 92.524 6.981 -0.217 1.00 0.00 H new ATOM 0 HA ASP A 366 90.436 8.948 -1.189 1.00 0.00 H new ATOM 0 HB2 ASP A 366 90.338 5.903 -0.763 1.00 0.00 H new ATOM 0 HB3 ASP A 366 88.923 6.890 -1.069 1.00 0.00 H new ATOM 791 N VAL A 367 91.187 8.906 1.527 1.00 0.00 N ATOM 792 CA VAL A 367 90.908 9.120 2.977 1.00 0.00 C ATOM 793 C VAL A 367 89.769 10.130 3.153 1.00 0.00 C ATOM 794 O VAL A 367 88.898 9.963 3.982 1.00 0.00 O ATOM 795 CB VAL A 367 92.210 9.683 3.547 1.00 0.00 C ATOM 796 CG1 VAL A 367 92.086 9.841 5.063 1.00 0.00 C ATOM 797 CG2 VAL A 367 93.364 8.728 3.227 1.00 0.00 C ATOM 0 H VAL A 367 92.050 9.328 1.184 1.00 0.00 H new ATOM 0 HA VAL A 367 90.601 8.203 3.479 1.00 0.00 H new ATOM 0 HB VAL A 367 92.407 10.657 3.098 1.00 0.00 H new ATOM 0 HG11 VAL A 367 93.017 10.243 5.464 1.00 0.00 H new ATOM 0 HG12 VAL A 367 91.268 10.524 5.292 1.00 0.00 H new ATOM 0 HG13 VAL A 367 91.885 8.870 5.515 1.00 0.00 H new ATOM 0 HG21 VAL A 367 94.292 9.130 3.634 1.00 0.00 H new ATOM 0 HG22 VAL A 367 93.164 7.754 3.673 1.00 0.00 H new ATOM 0 HG23 VAL A 367 93.458 8.620 2.146 1.00 0.00 H new ATOM 807 N GLN A 368 89.827 11.222 2.437 1.00 0.00 N ATOM 808 CA GLN A 368 88.814 12.301 2.625 1.00 0.00 C ATOM 809 C GLN A 368 87.430 11.845 2.158 1.00 0.00 C ATOM 810 O GLN A 368 86.420 12.262 2.689 1.00 0.00 O ATOM 811 CB GLN A 368 89.312 13.466 1.769 1.00 0.00 C ATOM 812 CG GLN A 368 90.647 13.973 2.319 1.00 0.00 C ATOM 813 CD GLN A 368 91.170 15.103 1.432 1.00 0.00 C ATOM 814 OE1 GLN A 368 90.717 15.275 0.317 1.00 0.00 O ATOM 815 NE2 GLN A 368 92.110 15.888 1.883 1.00 0.00 N ATOM 0 H GLN A 368 90.535 11.413 1.728 1.00 0.00 H new ATOM 0 HA GLN A 368 88.708 12.576 3.674 1.00 0.00 H new ATOM 0 HB2 GLN A 368 89.432 13.145 0.734 1.00 0.00 H new ATOM 0 HB3 GLN A 368 88.577 14.271 1.770 1.00 0.00 H new ATOM 0 HG2 GLN A 368 90.519 14.329 3.341 1.00 0.00 H new ATOM 0 HG3 GLN A 368 91.371 13.159 2.353 1.00 0.00 H new ATOM 0 HE21 GLN A 368 92.490 15.743 2.819 1.00 0.00 H new ATOM 0 HE22 GLN A 368 92.465 16.646 1.300 1.00 0.00 H new ATOM 824 N SER A 369 87.374 10.940 1.225 1.00 0.00 N ATOM 825 CA SER A 369 86.052 10.403 0.796 1.00 0.00 C ATOM 826 C SER A 369 85.613 9.297 1.749 1.00 0.00 C ATOM 827 O SER A 369 84.437 9.046 1.932 1.00 0.00 O ATOM 828 CB SER A 369 86.286 9.833 -0.599 1.00 0.00 C ATOM 829 OG SER A 369 85.762 10.730 -1.570 1.00 0.00 O ATOM 0 H SER A 369 88.182 10.549 0.741 1.00 0.00 H new ATOM 0 HA SER A 369 85.274 11.167 0.798 1.00 0.00 H new ATOM 0 HB2 SER A 369 87.352 9.680 -0.767 1.00 0.00 H new ATOM 0 HB3 SER A 369 85.806 8.859 -0.691 1.00 0.00 H new ATOM 0 HG SER A 369 85.913 10.366 -2.467 1.00 0.00 H new ATOM 835 N LEU A 370 86.551 8.600 2.314 1.00 0.00 N ATOM 836 CA LEU A 370 86.198 7.465 3.211 1.00 0.00 C ATOM 837 C LEU A 370 86.362 7.865 4.679 1.00 0.00 C ATOM 838 O LEU A 370 86.110 7.085 5.575 1.00 0.00 O ATOM 839 CB LEU A 370 87.185 6.359 2.849 1.00 0.00 C ATOM 840 CG LEU A 370 87.080 6.037 1.357 1.00 0.00 C ATOM 841 CD1 LEU A 370 87.833 4.737 1.059 1.00 0.00 C ATOM 842 CD2 LEU A 370 85.609 5.877 0.969 1.00 0.00 C ATOM 0 H LEU A 370 87.551 8.765 2.195 1.00 0.00 H new ATOM 0 HA LEU A 370 85.161 7.152 3.086 1.00 0.00 H new ATOM 0 HB2 LEU A 370 88.201 6.672 3.092 1.00 0.00 H new ATOM 0 HB3 LEU A 370 86.977 5.466 3.438 1.00 0.00 H new ATOM 0 HG LEU A 370 87.520 6.851 0.780 1.00 0.00 H new ATOM 0 HD11 LEU A 370 87.758 4.508 -0.004 1.00 0.00 H new ATOM 0 HD12 LEU A 370 88.882 4.853 1.332 1.00 0.00 H new ATOM 0 HD13 LEU A 370 87.396 3.923 1.637 1.00 0.00 H new ATOM 0 HD21 LEU A 370 85.536 5.648 -0.094 1.00 0.00 H new ATOM 0 HD22 LEU A 370 85.167 5.065 1.547 1.00 0.00 H new ATOM 0 HD23 LEU A 370 85.075 6.804 1.178 1.00 0.00 H new ATOM 854 N HIS A 371 86.854 9.046 4.932 1.00 0.00 N ATOM 855 CA HIS A 371 87.116 9.454 6.341 1.00 0.00 C ATOM 856 C HIS A 371 88.129 8.501 6.978 1.00 0.00 C ATOM 857 O HIS A 371 87.888 7.923 8.019 1.00 0.00 O ATOM 858 CB HIS A 371 85.762 9.353 7.046 1.00 0.00 C ATOM 859 CG HIS A 371 84.715 10.051 6.222 1.00 0.00 C ATOM 860 ND1 HIS A 371 84.660 11.431 6.111 1.00 0.00 N ATOM 861 CD2 HIS A 371 83.675 9.572 5.465 1.00 0.00 C ATOM 862 CE1 HIS A 371 83.619 11.732 5.312 1.00 0.00 C ATOM 863 NE2 HIS A 371 82.985 10.635 4.890 1.00 0.00 N ATOM 0 H HIS A 371 87.086 9.745 4.226 1.00 0.00 H new ATOM 0 HA HIS A 371 87.532 10.459 6.412 1.00 0.00 H new ATOM 0 HB2 HIS A 371 85.491 8.307 7.188 1.00 0.00 H new ATOM 0 HB3 HIS A 371 85.821 9.804 8.037 1.00 0.00 H new ATOM 0 HD2 HIS A 371 83.429 8.528 5.335 1.00 0.00 H new ATOM 0 HE1 HIS A 371 83.332 12.738 5.045 1.00 0.00 H new ATOM 0 HE2 HIS A 371 82.170 10.587 4.278 1.00 0.00 H new ATOM 871 N ALA A 372 89.245 8.303 6.334 1.00 0.00 N ATOM 872 CA ALA A 372 90.262 7.350 6.868 1.00 0.00 C ATOM 873 C ALA A 372 91.299 8.092 7.715 1.00 0.00 C ATOM 874 O ALA A 372 91.275 9.302 7.827 1.00 0.00 O ATOM 875 CB ALA A 372 90.920 6.739 5.632 1.00 0.00 C ATOM 0 H ALA A 372 89.499 8.761 5.458 1.00 0.00 H new ATOM 0 HA ALA A 372 89.815 6.592 7.511 1.00 0.00 H new ATOM 0 HB1 ALA A 372 91.683 6.025 5.942 1.00 0.00 H new ATOM 0 HB2 ALA A 372 90.166 6.228 5.033 1.00 0.00 H new ATOM 0 HB3 ALA A 372 91.381 7.528 5.038 1.00 0.00 H new ATOM 881 N THR A 373 92.190 7.370 8.339 1.00 0.00 N ATOM 882 CA THR A 373 93.206 8.026 9.211 1.00 0.00 C ATOM 883 C THR A 373 94.616 7.787 8.667 1.00 0.00 C ATOM 884 O THR A 373 94.994 6.674 8.374 1.00 0.00 O ATOM 885 CB THR A 373 93.048 7.349 10.571 1.00 0.00 C ATOM 886 OG1 THR A 373 91.802 7.721 11.144 1.00 0.00 O ATOM 887 CG2 THR A 373 94.191 7.771 11.496 1.00 0.00 C ATOM 0 H THR A 373 92.258 6.354 8.283 1.00 0.00 H new ATOM 0 HA THR A 373 93.064 9.105 9.263 1.00 0.00 H new ATOM 0 HB THR A 373 93.077 6.267 10.441 1.00 0.00 H new ATOM 0 HG1 THR A 373 91.700 7.285 12.016 1.00 0.00 H new ATOM 0 HG21 THR A 373 94.073 7.285 12.465 1.00 0.00 H new ATOM 0 HG22 THR A 373 95.143 7.476 11.055 1.00 0.00 H new ATOM 0 HG23 THR A 373 94.172 8.853 11.628 1.00 0.00 H new ATOM 895 N PHE A 374 95.420 8.808 8.623 1.00 0.00 N ATOM 896 CA PHE A 374 96.840 8.621 8.205 1.00 0.00 C ATOM 897 C PHE A 374 97.702 8.325 9.435 1.00 0.00 C ATOM 898 O PHE A 374 97.505 8.893 10.491 1.00 0.00 O ATOM 899 CB PHE A 374 97.264 9.957 7.596 1.00 0.00 C ATOM 900 CG PHE A 374 96.366 10.322 6.437 1.00 0.00 C ATOM 901 CD1 PHE A 374 96.601 9.778 5.167 1.00 0.00 C ATOM 902 CD2 PHE A 374 95.308 11.224 6.629 1.00 0.00 C ATOM 903 CE1 PHE A 374 95.781 10.138 4.089 1.00 0.00 C ATOM 904 CE2 PHE A 374 94.486 11.579 5.551 1.00 0.00 C ATOM 905 CZ PHE A 374 94.725 11.037 4.281 1.00 0.00 C ATOM 0 H PHE A 374 95.159 9.766 8.858 1.00 0.00 H new ATOM 0 HA PHE A 374 96.954 7.795 7.503 1.00 0.00 H new ATOM 0 HB2 PHE A 374 97.223 10.738 8.355 1.00 0.00 H new ATOM 0 HB3 PHE A 374 98.298 9.896 7.257 1.00 0.00 H new ATOM 0 HD1 PHE A 374 97.413 9.082 5.019 1.00 0.00 H new ATOM 0 HD2 PHE A 374 95.127 11.644 7.607 1.00 0.00 H new ATOM 0 HE1 PHE A 374 95.964 9.722 3.109 1.00 0.00 H new ATOM 0 HE2 PHE A 374 93.669 12.270 5.699 1.00 0.00 H new ATOM 0 HZ PHE A 374 94.094 11.313 3.449 1.00 0.00 H new ATOM 915 N VAL A 375 98.709 7.514 9.285 1.00 0.00 N ATOM 916 CA VAL A 375 99.643 7.267 10.419 1.00 0.00 C ATOM 917 C VAL A 375 101.056 7.706 10.027 1.00 0.00 C ATOM 918 O VAL A 375 101.719 7.033 9.264 1.00 0.00 O ATOM 919 CB VAL A 375 99.594 5.758 10.653 1.00 0.00 C ATOM 920 CG1 VAL A 375 100.242 5.428 11.998 1.00 0.00 C ATOM 921 CG2 VAL A 375 98.137 5.290 10.662 1.00 0.00 C ATOM 0 H VAL A 375 98.927 7.010 8.425 1.00 0.00 H new ATOM 0 HA VAL A 375 99.369 7.822 11.316 1.00 0.00 H new ATOM 0 HB VAL A 375 100.135 5.250 9.855 1.00 0.00 H new ATOM 0 HG11 VAL A 375 100.207 4.351 12.164 1.00 0.00 H new ATOM 0 HG12 VAL A 375 101.280 5.761 11.993 1.00 0.00 H new ATOM 0 HG13 VAL A 375 99.702 5.936 12.797 1.00 0.00 H new ATOM 0 HG21 VAL A 375 98.102 4.213 10.829 1.00 0.00 H new ATOM 0 HG22 VAL A 375 97.596 5.799 11.460 1.00 0.00 H new ATOM 0 HG23 VAL A 375 97.674 5.524 9.703 1.00 0.00 H new ATOM 931 N PRO A 376 101.434 8.863 10.499 1.00 0.00 N ATOM 932 CA PRO A 376 102.743 9.451 10.120 1.00 0.00 C ATOM 933 C PRO A 376 103.878 8.467 10.413 1.00 0.00 C ATOM 934 O PRO A 376 103.762 7.604 11.261 1.00 0.00 O ATOM 935 CB PRO A 376 102.866 10.704 10.993 1.00 0.00 C ATOM 936 CG PRO A 376 101.748 10.629 11.989 1.00 0.00 C ATOM 937 CD PRO A 376 100.693 9.721 11.421 1.00 0.00 C ATOM 0 HA PRO A 376 102.806 9.682 9.057 1.00 0.00 H new ATOM 0 HB2 PRO A 376 103.833 10.736 11.495 1.00 0.00 H new ATOM 0 HB3 PRO A 376 102.790 11.608 10.389 1.00 0.00 H new ATOM 0 HG2 PRO A 376 102.110 10.245 12.943 1.00 0.00 H new ATOM 0 HG3 PRO A 376 101.338 11.621 12.179 1.00 0.00 H new ATOM 0 HD2 PRO A 376 100.202 9.140 12.202 1.00 0.00 H new ATOM 0 HD3 PRO A 376 99.915 10.284 10.906 1.00 0.00 H new ATOM 945 N PHE A 377 104.966 8.574 9.698 1.00 0.00 N ATOM 946 CA PHE A 377 106.096 7.628 9.915 1.00 0.00 C ATOM 947 C PHE A 377 106.758 7.888 11.269 1.00 0.00 C ATOM 948 O PHE A 377 107.109 9.004 11.596 1.00 0.00 O ATOM 949 CB PHE A 377 107.081 7.913 8.778 1.00 0.00 C ATOM 950 CG PHE A 377 108.281 7.005 8.913 1.00 0.00 C ATOM 951 CD1 PHE A 377 109.364 7.393 9.716 1.00 0.00 C ATOM 952 CD2 PHE A 377 108.315 5.776 8.240 1.00 0.00 C ATOM 953 CE1 PHE A 377 110.479 6.552 9.845 1.00 0.00 C ATOM 954 CE2 PHE A 377 109.429 4.935 8.368 1.00 0.00 C ATOM 955 CZ PHE A 377 110.512 5.323 9.170 1.00 0.00 C ATOM 0 H PHE A 377 105.120 9.276 8.974 1.00 0.00 H new ATOM 0 HA PHE A 377 105.763 6.590 9.918 1.00 0.00 H new ATOM 0 HB2 PHE A 377 106.597 7.753 7.814 1.00 0.00 H new ATOM 0 HB3 PHE A 377 107.396 8.956 8.808 1.00 0.00 H new ATOM 0 HD1 PHE A 377 109.339 8.340 10.235 1.00 0.00 H new ATOM 0 HD2 PHE A 377 107.482 5.477 7.622 1.00 0.00 H new ATOM 0 HE1 PHE A 377 111.312 6.851 10.464 1.00 0.00 H new ATOM 0 HE2 PHE A 377 109.453 3.988 7.849 1.00 0.00 H new ATOM 0 HZ PHE A 377 111.371 4.676 9.268 1.00 0.00 H new ATOM 965 N THR A 378 107.027 6.848 12.008 1.00 0.00 N ATOM 966 CA THR A 378 107.778 7.015 13.283 1.00 0.00 C ATOM 967 C THR A 378 109.127 6.303 13.185 1.00 0.00 C ATOM 968 O THR A 378 109.244 5.258 12.571 1.00 0.00 O ATOM 969 CB THR A 378 106.905 6.361 14.353 1.00 0.00 C ATOM 970 OG1 THR A 378 106.372 5.144 13.849 1.00 0.00 O ATOM 971 CG2 THR A 378 105.766 7.305 14.734 1.00 0.00 C ATOM 0 H THR A 378 106.759 5.890 11.784 1.00 0.00 H new ATOM 0 HA THR A 378 107.979 8.062 13.512 1.00 0.00 H new ATOM 0 HB THR A 378 107.508 6.153 15.237 1.00 0.00 H new ATOM 0 HG1 THR A 378 105.813 4.723 14.535 1.00 0.00 H new ATOM 0 HG21 THR A 378 105.145 6.836 15.497 1.00 0.00 H new ATOM 0 HG22 THR A 378 106.179 8.235 15.124 1.00 0.00 H new ATOM 0 HG23 THR A 378 105.160 7.518 13.853 1.00 0.00 H new ATOM 1017 N ARG A 382 110.288 2.632 12.478 1.00 0.00 N ATOM 1018 CA ARG A 382 110.886 2.843 11.129 1.00 0.00 C ATOM 1019 C ARG A 382 109.860 2.506 10.050 1.00 0.00 C ATOM 1020 O ARG A 382 110.144 1.801 9.103 1.00 0.00 O ATOM 1021 CB ARG A 382 112.081 1.890 11.062 1.00 0.00 C ATOM 1022 CG ARG A 382 113.105 2.276 12.132 1.00 0.00 C ATOM 1023 CD ARG A 382 114.345 1.390 11.994 1.00 0.00 C ATOM 1024 NE ARG A 382 115.172 1.698 13.194 1.00 0.00 N ATOM 1025 CZ ARG A 382 116.293 1.059 13.403 1.00 0.00 C ATOM 1026 NH1 ARG A 382 116.696 0.145 12.560 1.00 0.00 N ATOM 1027 NH2 ARG A 382 117.012 1.335 14.455 1.00 0.00 N ATOM 0 HA ARG A 382 111.192 3.876 10.967 1.00 0.00 H new ATOM 0 HB2 ARG A 382 111.749 0.863 11.215 1.00 0.00 H new ATOM 0 HB3 ARG A 382 112.539 1.933 10.074 1.00 0.00 H new ATOM 0 HG2 ARG A 382 113.381 3.325 12.025 1.00 0.00 H new ATOM 0 HG3 ARG A 382 112.671 2.160 13.125 1.00 0.00 H new ATOM 0 HD2 ARG A 382 114.075 0.335 11.961 1.00 0.00 H new ATOM 0 HD3 ARG A 382 114.887 1.609 11.074 1.00 0.00 H new ATOM 0 HE ARG A 382 114.862 2.410 13.855 1.00 0.00 H new ATOM 0 HH11 ARG A 382 116.135 -0.072 11.736 1.00 0.00 H new ATOM 0 HH12 ARG A 382 117.571 -0.352 12.726 1.00 0.00 H new ATOM 0 HH21 ARG A 382 116.699 2.049 15.113 1.00 0.00 H new ATOM 0 HH22 ARG A 382 117.887 0.837 14.620 1.00 0.00 H new ATOM 1041 N MET A 383 108.668 3.016 10.186 1.00 0.00 N ATOM 1042 CA MET A 383 107.617 2.734 9.159 1.00 0.00 C ATOM 1043 C MET A 383 106.430 3.691 9.302 1.00 0.00 C ATOM 1044 O MET A 383 106.334 4.455 10.241 1.00 0.00 O ATOM 1045 CB MET A 383 107.172 1.294 9.418 1.00 0.00 C ATOM 1046 CG MET A 383 106.948 1.090 10.915 1.00 0.00 C ATOM 1047 SD MET A 383 105.730 -0.225 11.172 1.00 0.00 S ATOM 1048 CE MET A 383 106.634 -1.541 10.322 1.00 0.00 C ATOM 0 H MET A 383 108.373 3.613 10.958 1.00 0.00 H new ATOM 0 HA MET A 383 108.004 2.870 8.149 1.00 0.00 H new ATOM 0 HB2 MET A 383 106.254 1.082 8.870 1.00 0.00 H new ATOM 0 HB3 MET A 383 107.928 0.598 9.055 1.00 0.00 H new ATOM 0 HG2 MET A 383 107.888 0.829 11.402 1.00 0.00 H new ATOM 0 HG3 MET A 383 106.599 2.017 11.371 1.00 0.00 H new ATOM 0 HE1 MET A 383 105.940 -2.329 10.029 1.00 0.00 H new ATOM 0 HE2 MET A 383 107.118 -1.135 9.434 1.00 0.00 H new ATOM 0 HE3 MET A 383 107.390 -1.954 10.990 1.00 0.00 H new ATOM 1058 N SER A 384 105.536 3.647 8.355 1.00 0.00 N ATOM 1059 CA SER A 384 104.340 4.541 8.371 1.00 0.00 C ATOM 1060 C SER A 384 103.223 3.889 7.555 1.00 0.00 C ATOM 1061 O SER A 384 103.463 2.967 6.812 1.00 0.00 O ATOM 1062 CB SER A 384 104.800 5.835 7.705 1.00 0.00 C ATOM 1063 OG SER A 384 104.839 5.648 6.296 1.00 0.00 O ATOM 0 H SER A 384 105.583 3.017 7.554 1.00 0.00 H new ATOM 0 HA SER A 384 103.959 4.723 9.376 1.00 0.00 H new ATOM 0 HB2 SER A 384 104.120 6.649 7.957 1.00 0.00 H new ATOM 0 HB3 SER A 384 105.786 6.117 8.074 1.00 0.00 H new ATOM 0 HG SER A 384 104.229 6.283 5.865 1.00 0.00 H new ATOM 1069 N GLY A 385 102.008 4.347 7.670 1.00 0.00 N ATOM 1070 CA GLY A 385 100.917 3.717 6.869 1.00 0.00 C ATOM 1071 C GLY A 385 99.582 4.406 7.140 1.00 0.00 C ATOM 1072 O GLY A 385 99.526 5.509 7.635 1.00 0.00 O ATOM 0 H GLY A 385 101.724 5.118 8.274 1.00 0.00 H new ATOM 0 HA2 GLY A 385 101.156 3.780 5.807 1.00 0.00 H new ATOM 0 HA3 GLY A 385 100.842 2.658 7.116 1.00 0.00 H new ATOM 1076 N ILE A 386 98.512 3.784 6.735 1.00 0.00 N ATOM 1077 CA ILE A 386 97.168 4.415 6.871 1.00 0.00 C ATOM 1078 C ILE A 386 96.131 3.367 7.298 1.00 0.00 C ATOM 1079 O ILE A 386 96.226 2.209 6.942 1.00 0.00 O ATOM 1080 CB ILE A 386 96.855 4.935 5.474 1.00 0.00 C ATOM 1081 CG1 ILE A 386 95.505 5.660 5.494 1.00 0.00 C ATOM 1082 CG2 ILE A 386 96.812 3.758 4.491 1.00 0.00 C ATOM 1083 CD1 ILE A 386 95.095 6.024 4.065 1.00 0.00 C ATOM 0 H ILE A 386 98.509 2.856 6.311 1.00 0.00 H new ATOM 0 HA ILE A 386 97.147 5.203 7.624 1.00 0.00 H new ATOM 0 HB ILE A 386 97.629 5.634 5.156 1.00 0.00 H new ATOM 0 HG12 ILE A 386 94.746 5.024 5.950 1.00 0.00 H new ATOM 0 HG13 ILE A 386 95.574 6.561 6.104 1.00 0.00 H new ATOM 0 HG21 ILE A 386 96.588 4.128 3.490 1.00 0.00 H new ATOM 0 HG22 ILE A 386 97.779 3.254 4.484 1.00 0.00 H new ATOM 0 HG23 ILE A 386 96.039 3.055 4.799 1.00 0.00 H new ATOM 0 HD11 ILE A 386 94.135 6.539 4.082 1.00 0.00 H new ATOM 0 HD12 ILE A 386 95.849 6.676 3.625 1.00 0.00 H new ATOM 0 HD13 ILE A 386 95.009 5.116 3.469 1.00 0.00 H new ATOM 1095 N ASN A 387 95.103 3.775 7.991 1.00 0.00 N ATOM 1096 CA ASN A 387 94.025 2.813 8.359 1.00 0.00 C ATOM 1097 C ASN A 387 92.668 3.372 7.932 1.00 0.00 C ATOM 1098 O ASN A 387 92.323 4.486 8.259 1.00 0.00 O ATOM 1099 CB ASN A 387 94.088 2.707 9.882 1.00 0.00 C ATOM 1100 CG ASN A 387 95.532 2.476 10.322 1.00 0.00 C ATOM 1101 OD1 ASN A 387 96.222 1.640 9.776 1.00 0.00 O ATOM 1102 ND2 ASN A 387 96.020 3.194 11.296 1.00 0.00 N ATOM 0 H ASN A 387 94.963 4.731 8.318 1.00 0.00 H new ATOM 0 HA ASN A 387 94.152 1.845 7.875 1.00 0.00 H new ATOM 0 HB2 ASN A 387 93.701 3.619 10.336 1.00 0.00 H new ATOM 0 HB3 ASN A 387 93.457 1.887 10.226 1.00 0.00 H new ATOM 0 HD21 ASN A 387 96.983 3.053 11.600 1.00 0.00 H new ATOM 0 HD22 ASN A 387 95.438 3.896 11.753 1.00 0.00 H new ATOM 1109 N ILE A 388 91.839 2.565 7.345 1.00 0.00 N ATOM 1110 CA ILE A 388 90.448 3.005 7.067 1.00 0.00 C ATOM 1111 C ILE A 388 89.497 1.844 7.318 1.00 0.00 C ATOM 1112 O ILE A 388 89.844 0.703 7.106 1.00 0.00 O ATOM 1113 CB ILE A 388 90.408 3.425 5.593 1.00 0.00 C ATOM 1114 CG1 ILE A 388 88.960 3.434 5.094 1.00 0.00 C ATOM 1115 CG2 ILE A 388 91.201 2.438 4.751 1.00 0.00 C ATOM 1116 CD1 ILE A 388 88.892 4.192 3.772 1.00 0.00 C ATOM 0 H ILE A 388 92.063 1.617 7.044 1.00 0.00 H new ATOM 0 HA ILE A 388 90.147 3.833 7.709 1.00 0.00 H new ATOM 0 HB ILE A 388 90.840 4.422 5.504 1.00 0.00 H new ATOM 0 HG12 ILE A 388 88.602 2.413 4.961 1.00 0.00 H new ATOM 0 HG13 ILE A 388 88.311 3.906 5.832 1.00 0.00 H new ATOM 0 HG21 ILE A 388 91.168 2.743 3.705 1.00 0.00 H new ATOM 0 HG22 ILE A 388 92.236 2.419 5.091 1.00 0.00 H new ATOM 0 HG23 ILE A 388 90.768 1.443 4.853 1.00 0.00 H new ATOM 0 HD11 ILE A 388 87.864 4.202 3.411 1.00 0.00 H new ATOM 0 HD12 ILE A 388 89.234 5.216 3.922 1.00 0.00 H new ATOM 0 HD13 ILE A 388 89.530 3.700 3.037 1.00 0.00 H new ATOM 1128 N ASP A 389 88.269 2.162 7.611 1.00 0.00 N ATOM 1129 CA ASP A 389 87.180 1.142 7.704 1.00 0.00 C ATOM 1130 C ASP A 389 87.495 -0.125 6.907 1.00 0.00 C ATOM 1131 O ASP A 389 87.398 -1.227 7.407 1.00 0.00 O ATOM 1132 CB ASP A 389 86.014 1.851 7.041 1.00 0.00 C ATOM 1133 CG ASP A 389 85.463 2.931 7.975 1.00 0.00 C ATOM 1134 OD1 ASP A 389 85.893 2.974 9.116 1.00 0.00 O ATOM 1135 OD2 ASP A 389 84.621 3.694 7.535 1.00 0.00 O ATOM 0 H ASP A 389 87.962 3.117 7.796 1.00 0.00 H new ATOM 0 HA ASP A 389 87.013 0.818 8.731 1.00 0.00 H new ATOM 0 HB2 ASP A 389 86.337 2.300 6.102 1.00 0.00 H new ATOM 0 HB3 ASP A 389 85.231 1.133 6.799 1.00 0.00 H new ATOM 1140 N ASN A 390 87.614 0.030 5.622 1.00 0.00 N ATOM 1141 CA ASN A 390 87.635 -1.163 4.727 1.00 0.00 C ATOM 1142 C ASN A 390 89.067 -1.590 4.380 1.00 0.00 C ATOM 1143 O ASN A 390 89.274 -2.588 3.719 1.00 0.00 O ATOM 1144 CB ASN A 390 86.906 -0.700 3.467 1.00 0.00 C ATOM 1145 CG ASN A 390 86.570 -1.911 2.595 1.00 0.00 C ATOM 1146 OD1 ASN A 390 85.826 -2.780 3.003 1.00 0.00 O ATOM 1147 ND2 ASN A 390 87.090 -2.004 1.401 1.00 0.00 N ATOM 0 H ASN A 390 87.698 0.930 5.149 1.00 0.00 H new ATOM 0 HA ASN A 390 87.171 -2.028 5.200 1.00 0.00 H new ATOM 0 HB2 ASN A 390 85.993 -0.169 3.737 1.00 0.00 H new ATOM 0 HB3 ASN A 390 87.529 0.000 2.910 1.00 0.00 H new ATOM 0 HD21 ASN A 390 86.871 -2.807 0.811 1.00 0.00 H new ATOM 0 HD22 ASN A 390 87.715 -1.274 1.059 1.00 0.00 H new ATOM 1154 N ARG A 391 90.057 -0.846 4.792 1.00 0.00 N ATOM 1155 CA ARG A 391 91.459 -1.231 4.441 1.00 0.00 C ATOM 1156 C ARG A 391 92.411 -0.877 5.587 1.00 0.00 C ATOM 1157 O ARG A 391 92.374 0.211 6.112 1.00 0.00 O ATOM 1158 CB ARG A 391 91.817 -0.413 3.192 1.00 0.00 C ATOM 1159 CG ARG A 391 90.978 -0.863 1.993 1.00 0.00 C ATOM 1160 CD ARG A 391 90.978 0.243 0.931 1.00 0.00 C ATOM 1161 NE ARG A 391 92.386 0.326 0.447 1.00 0.00 N ATOM 1162 CZ ARG A 391 92.649 0.808 -0.739 1.00 0.00 C ATOM 1163 NH1 ARG A 391 91.686 1.250 -1.502 1.00 0.00 N ATOM 1164 NH2 ARG A 391 93.884 0.859 -1.159 1.00 0.00 N ATOM 0 H ARG A 391 89.961 0.002 5.350 1.00 0.00 H new ATOM 0 HA ARG A 391 91.546 -2.303 4.263 1.00 0.00 H new ATOM 0 HB2 ARG A 391 91.647 0.646 3.384 1.00 0.00 H new ATOM 0 HB3 ARG A 391 92.877 -0.530 2.965 1.00 0.00 H new ATOM 0 HG2 ARG A 391 91.384 -1.784 1.575 1.00 0.00 H new ATOM 0 HG3 ARG A 391 89.958 -1.079 2.309 1.00 0.00 H new ATOM 0 HD2 ARG A 391 90.295 0.005 0.115 1.00 0.00 H new ATOM 0 HD3 ARG A 391 90.651 1.193 1.353 1.00 0.00 H new ATOM 0 HE ARG A 391 93.148 0.005 1.045 1.00 0.00 H new ATOM 0 HH11 ARG A 391 90.721 1.221 -1.174 1.00 0.00 H new ATOM 0 HH12 ARG A 391 91.899 1.625 -2.426 1.00 0.00 H new ATOM 0 HH21 ARG A 391 94.640 0.523 -0.562 1.00 0.00 H new ATOM 0 HH22 ARG A 391 94.093 1.235 -2.084 1.00 0.00 H new ATOM 1178 N MET A 392 93.389 -1.701 5.825 1.00 0.00 N ATOM 1179 CA MET A 392 94.484 -1.306 6.758 1.00 0.00 C ATOM 1180 C MET A 392 95.828 -1.651 6.118 1.00 0.00 C ATOM 1181 O MET A 392 96.151 -2.802 5.923 1.00 0.00 O ATOM 1182 CB MET A 392 94.261 -2.134 8.024 1.00 0.00 C ATOM 1183 CG MET A 392 93.043 -1.597 8.777 1.00 0.00 C ATOM 1184 SD MET A 392 92.856 -2.492 10.340 1.00 0.00 S ATOM 1185 CE MET A 392 92.653 -4.145 9.631 1.00 0.00 C ATOM 0 H MET A 392 93.480 -2.631 5.416 1.00 0.00 H new ATOM 0 HA MET A 392 94.484 -0.239 6.982 1.00 0.00 H new ATOM 0 HB2 MET A 392 94.108 -3.181 7.764 1.00 0.00 H new ATOM 0 HB3 MET A 392 95.144 -2.089 8.661 1.00 0.00 H new ATOM 0 HG2 MET A 392 93.162 -0.531 8.968 1.00 0.00 H new ATOM 0 HG3 MET A 392 92.146 -1.714 8.169 1.00 0.00 H new ATOM 0 HE1 MET A 392 92.114 -4.779 10.335 1.00 0.00 H new ATOM 0 HE2 MET A 392 92.089 -4.075 8.701 1.00 0.00 H new ATOM 0 HE3 MET A 392 93.633 -4.578 9.430 1.00 0.00 H new ATOM 1195 N ILE A 393 96.568 -0.665 5.699 1.00 0.00 N ATOM 1196 CA ILE A 393 97.833 -0.947 4.965 1.00 0.00 C ATOM 1197 C ILE A 393 98.985 -0.175 5.599 1.00 0.00 C ATOM 1198 O ILE A 393 98.828 0.952 6.018 1.00 0.00 O ATOM 1199 CB ILE A 393 97.572 -0.473 3.540 1.00 0.00 C ATOM 1200 CG1 ILE A 393 96.476 -1.352 2.927 1.00 0.00 C ATOM 1201 CG2 ILE A 393 98.859 -0.578 2.718 1.00 0.00 C ATOM 1202 CD1 ILE A 393 96.457 -1.183 1.410 1.00 0.00 C ATOM 0 H ILE A 393 96.353 0.323 5.832 1.00 0.00 H new ATOM 0 HA ILE A 393 98.110 -2.001 4.993 1.00 0.00 H new ATOM 0 HB ILE A 393 97.248 0.568 3.542 1.00 0.00 H new ATOM 0 HG12 ILE A 393 96.652 -2.397 3.182 1.00 0.00 H new ATOM 0 HG13 ILE A 393 95.506 -1.081 3.343 1.00 0.00 H new ATOM 0 HG21 ILE A 393 98.669 -0.238 1.700 1.00 0.00 H new ATOM 0 HG22 ILE A 393 99.631 0.044 3.170 1.00 0.00 H new ATOM 0 HG23 ILE A 393 99.194 -1.615 2.698 1.00 0.00 H new ATOM 0 HD11 ILE A 393 95.675 -1.811 0.984 1.00 0.00 H new ATOM 0 HD12 ILE A 393 96.259 -0.140 1.163 1.00 0.00 H new ATOM 0 HD13 ILE A 393 97.423 -1.477 0.999 1.00 0.00 H new ATOM 1214 N ARG A 394 100.160 -0.733 5.598 1.00 0.00 N ATOM 1215 CA ARG A 394 101.331 0.026 6.121 1.00 0.00 C ATOM 1216 C ARG A 394 102.520 -0.113 5.171 1.00 0.00 C ATOM 1217 O ARG A 394 102.639 -1.078 4.453 1.00 0.00 O ATOM 1218 CB ARG A 394 101.649 -0.606 7.477 1.00 0.00 C ATOM 1219 CG ARG A 394 100.404 -0.582 8.366 1.00 0.00 C ATOM 1220 CD ARG A 394 100.064 0.863 8.738 1.00 0.00 C ATOM 1221 NE ARG A 394 98.983 0.750 9.757 1.00 0.00 N ATOM 1222 CZ ARG A 394 99.263 0.367 10.974 1.00 0.00 C ATOM 1223 NH1 ARG A 394 100.493 0.081 11.308 1.00 0.00 N ATOM 1224 NH2 ARG A 394 98.310 0.271 11.861 1.00 0.00 N ATOM 0 H ARG A 394 100.362 -1.674 5.261 1.00 0.00 H new ATOM 0 HA ARG A 394 101.121 1.092 6.211 1.00 0.00 H new ATOM 0 HB2 ARG A 394 101.989 -1.633 7.339 1.00 0.00 H new ATOM 0 HB3 ARG A 394 102.462 -0.063 7.960 1.00 0.00 H new ATOM 0 HG2 ARG A 394 99.564 -1.041 7.844 1.00 0.00 H new ATOM 0 HG3 ARG A 394 100.578 -1.169 9.268 1.00 0.00 H new ATOM 0 HD2 ARG A 394 100.934 1.383 9.140 1.00 0.00 H new ATOM 0 HD3 ARG A 394 99.729 1.427 7.867 1.00 0.00 H new ATOM 0 HE ARG A 394 98.020 0.973 9.503 1.00 0.00 H new ATOM 0 HH11 ARG A 394 101.240 0.156 10.617 1.00 0.00 H new ATOM 0 HH12 ARG A 394 100.707 -0.218 12.260 1.00 0.00 H new ATOM 0 HH21 ARG A 394 97.349 0.495 11.603 1.00 0.00 H new ATOM 0 HH22 ARG A 394 98.527 -0.028 12.812 1.00 0.00 H new ATOM 1238 N LYS A 395 103.455 0.790 5.263 1.00 0.00 N ATOM 1239 CA LYS A 395 104.715 0.664 4.477 1.00 0.00 C ATOM 1240 C LYS A 395 105.907 0.930 5.396 1.00 0.00 C ATOM 1241 O LYS A 395 105.924 1.892 6.131 1.00 0.00 O ATOM 1242 CB LYS A 395 104.619 1.739 3.389 1.00 0.00 C ATOM 1243 CG LYS A 395 104.872 3.123 4.005 1.00 0.00 C ATOM 1244 CD LYS A 395 106.355 3.480 3.876 1.00 0.00 C ATOM 1245 CE LYS A 395 106.671 4.687 4.765 1.00 0.00 C ATOM 1246 NZ LYS A 395 108.119 4.958 4.543 1.00 0.00 N ATOM 0 H LYS A 395 103.400 1.619 5.855 1.00 0.00 H new ATOM 0 HA LYS A 395 104.847 -0.328 4.044 1.00 0.00 H new ATOM 0 HB2 LYS A 395 105.348 1.541 2.603 1.00 0.00 H new ATOM 0 HB3 LYS A 395 103.634 1.712 2.924 1.00 0.00 H new ATOM 0 HG2 LYS A 395 104.262 3.873 3.502 1.00 0.00 H new ATOM 0 HG3 LYS A 395 104.577 3.124 5.054 1.00 0.00 H new ATOM 0 HD2 LYS A 395 106.971 2.629 4.168 1.00 0.00 H new ATOM 0 HD3 LYS A 395 106.596 3.707 2.838 1.00 0.00 H new ATOM 0 HE2 LYS A 395 106.062 5.549 4.493 1.00 0.00 H new ATOM 0 HE3 LYS A 395 106.466 4.470 5.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 108.412 5.773 5.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 108.675 4.123 4.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 108.283 5.168 3.538 1.00 0.00 H new ATOM 1260 N GLY A 396 106.847 0.039 5.444 1.00 0.00 N ATOM 1261 CA GLY A 396 107.962 0.204 6.417 1.00 0.00 C ATOM 1262 C GLY A 396 109.199 -0.518 5.905 1.00 0.00 C ATOM 1263 O GLY A 396 109.122 -1.328 5.006 1.00 0.00 O ATOM 0 H GLY A 396 106.896 -0.794 4.857 1.00 0.00 H new ATOM 0 HA2 GLY A 396 108.180 1.262 6.560 1.00 0.00 H new ATOM 0 HA3 GLY A 396 107.672 -0.195 7.389 1.00 0.00 H new ATOM 1267 N SER A 397 110.298 -0.377 6.587 1.00 0.00 N ATOM 1268 CA SER A 397 111.466 -1.228 6.246 1.00 0.00 C ATOM 1269 C SER A 397 111.048 -2.693 6.353 1.00 0.00 C ATOM 1270 O SER A 397 110.134 -3.033 7.078 1.00 0.00 O ATOM 1271 CB SER A 397 112.538 -0.886 7.279 1.00 0.00 C ATOM 1272 OG SER A 397 112.806 0.510 7.233 1.00 0.00 O ATOM 0 H SER A 397 110.437 0.280 7.354 1.00 0.00 H new ATOM 0 HA SER A 397 111.837 -1.060 5.235 1.00 0.00 H new ATOM 0 HB2 SER A 397 112.203 -1.171 8.276 1.00 0.00 H new ATOM 0 HB3 SER A 397 113.448 -1.450 7.076 1.00 0.00 H new ATOM 0 HG SER A 397 113.492 0.733 7.896 1.00 0.00 H new ATOM 1278 N VAL A 398 111.660 -3.555 5.596 1.00 0.00 N ATOM 1279 CA VAL A 398 111.234 -4.978 5.617 1.00 0.00 C ATOM 1280 C VAL A 398 111.313 -5.521 7.039 1.00 0.00 C ATOM 1281 O VAL A 398 110.474 -6.284 7.466 1.00 0.00 O ATOM 1282 CB VAL A 398 112.216 -5.700 4.702 1.00 0.00 C ATOM 1283 CG1 VAL A 398 112.013 -7.209 4.830 1.00 0.00 C ATOM 1284 CG2 VAL A 398 111.964 -5.265 3.257 1.00 0.00 C ATOM 0 H VAL A 398 112.433 -3.338 4.967 1.00 0.00 H new ATOM 0 HA VAL A 398 110.205 -5.112 5.284 1.00 0.00 H new ATOM 0 HB VAL A 398 113.239 -5.451 4.985 1.00 0.00 H new ATOM 0 HG11 VAL A 398 112.715 -7.727 4.176 1.00 0.00 H new ATOM 0 HG12 VAL A 398 112.186 -7.513 5.862 1.00 0.00 H new ATOM 0 HG13 VAL A 398 110.993 -7.465 4.543 1.00 0.00 H new ATOM 0 HG21 VAL A 398 112.663 -5.777 2.596 1.00 0.00 H new ATOM 0 HG22 VAL A 398 110.943 -5.520 2.973 1.00 0.00 H new ATOM 0 HG23 VAL A 398 112.107 -4.188 3.171 1.00 0.00 H new ATOM 1294 N ASP A 399 112.273 -5.084 7.795 1.00 0.00 N ATOM 1295 CA ASP A 399 112.348 -5.525 9.217 1.00 0.00 C ATOM 1296 C ASP A 399 111.110 -5.052 9.987 1.00 0.00 C ATOM 1297 O ASP A 399 110.492 -5.807 10.710 1.00 0.00 O ATOM 1298 CB ASP A 399 113.612 -4.865 9.771 1.00 0.00 C ATOM 1299 CG ASP A 399 113.907 -5.419 11.165 1.00 0.00 C ATOM 1300 OD1 ASP A 399 113.209 -6.330 11.580 1.00 0.00 O ATOM 1301 OD2 ASP A 399 114.825 -4.922 11.797 1.00 0.00 O ATOM 0 H ASP A 399 113.008 -4.443 7.496 1.00 0.00 H new ATOM 0 HA ASP A 399 112.381 -6.610 9.311 1.00 0.00 H new ATOM 0 HB2 ASP A 399 114.455 -5.055 9.107 1.00 0.00 H new ATOM 0 HB3 ASP A 399 113.480 -3.784 9.818 1.00 0.00 H new ATOM 1306 N ALA A 400 110.739 -3.808 9.840 1.00 0.00 N ATOM 1307 CA ALA A 400 109.544 -3.295 10.575 1.00 0.00 C ATOM 1308 C ALA A 400 108.270 -3.945 10.047 1.00 0.00 C ATOM 1309 O ALA A 400 107.429 -4.388 10.800 1.00 0.00 O ATOM 1310 CB ALA A 400 109.521 -1.786 10.306 1.00 0.00 C ATOM 0 H ALA A 400 111.209 -3.126 9.245 1.00 0.00 H new ATOM 0 HA ALA A 400 109.597 -3.520 11.640 1.00 0.00 H new ATOM 0 HB1 ALA A 400 108.668 -1.339 10.816 1.00 0.00 H new ATOM 0 HB2 ALA A 400 110.442 -1.336 10.677 1.00 0.00 H new ATOM 0 HB3 ALA A 400 109.437 -1.609 9.234 1.00 0.00 H new ATOM 1316 N ILE A 401 108.091 -3.957 8.762 1.00 0.00 N ATOM 1317 CA ILE A 401 106.833 -4.520 8.204 1.00 0.00 C ATOM 1318 C ILE A 401 106.740 -6.019 8.480 1.00 0.00 C ATOM 1319 O ILE A 401 105.710 -6.526 8.866 1.00 0.00 O ATOM 1320 CB ILE A 401 106.921 -4.265 6.708 1.00 0.00 C ATOM 1321 CG1 ILE A 401 107.032 -2.760 6.453 1.00 0.00 C ATOM 1322 CG2 ILE A 401 105.664 -4.815 6.049 1.00 0.00 C ATOM 1323 CD1 ILE A 401 105.873 -2.038 7.144 1.00 0.00 C ATOM 0 H ILE A 401 108.756 -3.604 8.074 1.00 0.00 H new ATOM 0 HA ILE A 401 105.950 -4.064 8.652 1.00 0.00 H new ATOM 0 HB ILE A 401 107.800 -4.757 6.291 1.00 0.00 H new ATOM 0 HG12 ILE A 401 107.984 -2.386 6.830 1.00 0.00 H new ATOM 0 HG13 ILE A 401 107.012 -2.560 5.382 1.00 0.00 H new ATOM 0 HG21 ILE A 401 105.711 -4.640 4.974 1.00 0.00 H new ATOM 0 HG22 ILE A 401 105.592 -5.886 6.240 1.00 0.00 H new ATOM 0 HG23 ILE A 401 104.788 -4.313 6.461 1.00 0.00 H new ATOM 0 HD11 ILE A 401 105.952 -0.966 6.962 1.00 0.00 H new ATOM 0 HD12 ILE A 401 104.927 -2.405 6.746 1.00 0.00 H new ATOM 0 HD13 ILE A 401 105.913 -2.228 8.217 1.00 0.00 H new ATOM 1335 N ARG A 402 107.810 -6.729 8.290 1.00 0.00 N ATOM 1336 CA ARG A 402 107.790 -8.194 8.547 1.00 0.00 C ATOM 1337 C ARG A 402 107.419 -8.472 9.998 1.00 0.00 C ATOM 1338 O ARG A 402 106.548 -9.270 10.283 1.00 0.00 O ATOM 1339 CB ARG A 402 109.217 -8.654 8.253 1.00 0.00 C ATOM 1340 CG ARG A 402 109.414 -10.075 8.771 1.00 0.00 C ATOM 1341 CD ARG A 402 110.324 -10.839 7.809 1.00 0.00 C ATOM 1342 NE ARG A 402 111.701 -10.370 8.128 1.00 0.00 N ATOM 1343 CZ ARG A 402 112.676 -10.566 7.280 1.00 0.00 C ATOM 1344 NH1 ARG A 402 112.450 -11.175 6.145 1.00 0.00 N ATOM 1345 NH2 ARG A 402 113.879 -10.153 7.566 1.00 0.00 N ATOM 0 H ARG A 402 108.703 -6.358 7.966 1.00 0.00 H new ATOM 0 HA ARG A 402 107.056 -8.717 7.934 1.00 0.00 H new ATOM 0 HB2 ARG A 402 109.408 -8.618 7.180 1.00 0.00 H new ATOM 0 HB3 ARG A 402 109.932 -7.981 8.727 1.00 0.00 H new ATOM 0 HG2 ARG A 402 109.855 -10.054 9.768 1.00 0.00 H new ATOM 0 HG3 ARG A 402 108.452 -10.580 8.859 1.00 0.00 H new ATOM 0 HD2 ARG A 402 110.231 -11.916 7.949 1.00 0.00 H new ATOM 0 HD3 ARG A 402 110.066 -10.629 6.771 1.00 0.00 H new ATOM 0 HE ARG A 402 111.884 -9.894 9.011 1.00 0.00 H new ATOM 0 HH11 ARG A 402 111.510 -11.499 5.919 1.00 0.00 H new ATOM 0 HH12 ARG A 402 113.214 -11.326 5.486 1.00 0.00 H new ATOM 0 HH21 ARG A 402 114.058 -9.678 8.451 1.00 0.00 H new ATOM 0 HH22 ARG A 402 114.641 -10.305 6.905 1.00 0.00 H new ATOM 1359 N ARG A 403 107.974 -7.731 10.908 1.00 0.00 N ATOM 1360 CA ARG A 403 107.537 -7.866 12.320 1.00 0.00 C ATOM 1361 C ARG A 403 106.057 -7.498 12.433 1.00 0.00 C ATOM 1362 O ARG A 403 105.314 -8.089 13.188 1.00 0.00 O ATOM 1363 CB ARG A 403 108.394 -6.872 13.097 1.00 0.00 C ATOM 1364 CG ARG A 403 109.867 -7.257 12.970 1.00 0.00 C ATOM 1365 CD ARG A 403 110.731 -6.099 13.463 1.00 0.00 C ATOM 1366 NE ARG A 403 110.573 -6.102 14.944 1.00 0.00 N ATOM 1367 CZ ARG A 403 111.207 -5.224 15.676 1.00 0.00 C ATOM 1368 NH1 ARG A 403 111.984 -4.336 15.114 1.00 0.00 N ATOM 1369 NH2 ARG A 403 111.064 -5.233 16.973 1.00 0.00 N ATOM 0 H ARG A 403 108.707 -7.042 10.738 1.00 0.00 H new ATOM 0 HA ARG A 403 107.652 -8.881 12.700 1.00 0.00 H new ATOM 0 HB2 ARG A 403 108.237 -5.864 12.714 1.00 0.00 H new ATOM 0 HB3 ARG A 403 108.099 -6.864 14.146 1.00 0.00 H new ATOM 0 HG2 ARG A 403 110.073 -8.154 13.554 1.00 0.00 H new ATOM 0 HG3 ARG A 403 110.107 -7.490 11.932 1.00 0.00 H new ATOM 0 HD2 ARG A 403 111.774 -6.236 13.177 1.00 0.00 H new ATOM 0 HD3 ARG A 403 110.404 -5.152 13.033 1.00 0.00 H new ATOM 0 HE ARG A 403 109.968 -6.792 15.389 1.00 0.00 H new ATOM 0 HH11 ARG A 403 112.098 -4.326 14.100 1.00 0.00 H new ATOM 0 HH12 ARG A 403 112.477 -3.653 15.689 1.00 0.00 H new ATOM 0 HH21 ARG A 403 110.458 -5.925 17.414 1.00 0.00 H new ATOM 0 HH22 ARG A 403 111.558 -4.548 17.545 1.00 0.00 H new ATOM 1383 N HIS A 404 105.623 -6.530 11.676 1.00 0.00 N ATOM 1384 CA HIS A 404 104.192 -6.124 11.729 1.00 0.00 C ATOM 1385 C HIS A 404 103.282 -7.222 11.166 1.00 0.00 C ATOM 1386 O HIS A 404 102.206 -7.458 11.674 1.00 0.00 O ATOM 1387 CB HIS A 404 104.132 -4.854 10.881 1.00 0.00 C ATOM 1388 CG HIS A 404 102.717 -4.585 10.450 1.00 0.00 C ATOM 1389 ND1 HIS A 404 102.101 -5.341 9.469 1.00 0.00 N ATOM 1390 CD2 HIS A 404 101.792 -3.653 10.848 1.00 0.00 C ATOM 1391 CE1 HIS A 404 100.856 -4.857 9.307 1.00 0.00 C ATOM 1392 NE2 HIS A 404 100.615 -3.826 10.123 1.00 0.00 N ATOM 0 H HIS A 404 106.199 -6.001 11.021 1.00 0.00 H new ATOM 0 HA HIS A 404 103.842 -5.956 12.748 1.00 0.00 H new ATOM 0 HB2 HIS A 404 104.513 -4.008 11.453 1.00 0.00 H new ATOM 0 HB3 HIS A 404 104.772 -4.962 10.006 1.00 0.00 H new ATOM 0 HD2 HIS A 404 101.952 -2.901 11.607 1.00 0.00 H new ATOM 0 HE1 HIS A 404 100.139 -5.253 8.603 1.00 0.00 H new ATOM 0 HE2 HIS A 404 99.755 -3.283 10.199 1.00 0.00 H new ATOM 1400 N VAL A 405 103.703 -7.925 10.153 1.00 0.00 N ATOM 1401 CA VAL A 405 102.846 -9.020 9.619 1.00 0.00 C ATOM 1402 C VAL A 405 102.700 -10.126 10.659 1.00 0.00 C ATOM 1403 O VAL A 405 101.610 -10.564 10.970 1.00 0.00 O ATOM 1404 CB VAL A 405 103.575 -9.530 8.381 1.00 0.00 C ATOM 1405 CG1 VAL A 405 102.918 -10.826 7.901 1.00 0.00 C ATOM 1406 CG2 VAL A 405 103.486 -8.472 7.284 1.00 0.00 C ATOM 0 H VAL A 405 104.594 -7.792 9.675 1.00 0.00 H new ATOM 0 HA VAL A 405 101.839 -8.679 9.379 1.00 0.00 H new ATOM 0 HB VAL A 405 104.620 -9.726 8.619 1.00 0.00 H new ATOM 0 HG11 VAL A 405 103.438 -11.192 7.016 1.00 0.00 H new ATOM 0 HG12 VAL A 405 102.973 -11.576 8.690 1.00 0.00 H new ATOM 0 HG13 VAL A 405 101.874 -10.635 7.655 1.00 0.00 H new ATOM 0 HG21 VAL A 405 104.005 -8.827 6.393 1.00 0.00 H new ATOM 0 HG22 VAL A 405 102.440 -8.284 7.044 1.00 0.00 H new ATOM 0 HG23 VAL A 405 103.950 -7.549 7.630 1.00 0.00 H new ATOM 1416 N GLU A 406 103.782 -10.568 11.223 1.00 0.00 N ATOM 1417 CA GLU A 406 103.674 -11.630 12.256 1.00 0.00 C ATOM 1418 C GLU A 406 102.885 -11.119 13.463 1.00 0.00 C ATOM 1419 O GLU A 406 102.138 -11.854 14.078 1.00 0.00 O ATOM 1420 CB GLU A 406 105.116 -11.961 12.646 1.00 0.00 C ATOM 1421 CG GLU A 406 105.846 -12.559 11.442 1.00 0.00 C ATOM 1422 CD GLU A 406 107.266 -12.954 11.850 1.00 0.00 C ATOM 1423 OE1 GLU A 406 107.663 -12.606 12.950 1.00 0.00 O ATOM 1424 OE2 GLU A 406 107.932 -13.600 11.057 1.00 0.00 O ATOM 0 H GLU A 406 104.728 -10.246 11.018 1.00 0.00 H new ATOM 0 HA GLU A 406 103.146 -12.510 11.888 1.00 0.00 H new ATOM 0 HB2 GLU A 406 105.628 -11.060 12.985 1.00 0.00 H new ATOM 0 HB3 GLU A 406 105.126 -12.665 13.478 1.00 0.00 H new ATOM 0 HG2 GLU A 406 105.307 -13.431 11.073 1.00 0.00 H new ATOM 0 HG3 GLU A 406 105.878 -11.836 10.627 1.00 0.00 H new ATOM 1431 N ALA A 407 103.013 -9.861 13.792 1.00 0.00 N ATOM 1432 CA ALA A 407 102.231 -9.324 14.941 1.00 0.00 C ATOM 1433 C ALA A 407 100.746 -9.298 14.593 1.00 0.00 C ATOM 1434 O ALA A 407 99.900 -9.641 15.396 1.00 0.00 O ATOM 1435 CB ALA A 407 102.756 -7.907 15.152 1.00 0.00 C ATOM 0 H ALA A 407 103.618 -9.189 13.320 1.00 0.00 H new ATOM 0 HA ALA A 407 102.340 -9.934 15.838 1.00 0.00 H new ATOM 0 HB1 ALA A 407 102.227 -7.443 15.985 1.00 0.00 H new ATOM 0 HB2 ALA A 407 103.822 -7.943 15.375 1.00 0.00 H new ATOM 0 HB3 ALA A 407 102.594 -7.321 14.248 1.00 0.00 H new ATOM 1441 N ASN A 408 100.438 -9.016 13.363 1.00 0.00 N ATOM 1442 CA ASN A 408 99.028 -9.105 12.907 1.00 0.00 C ATOM 1443 C ASN A 408 98.546 -10.543 13.054 1.00 0.00 C ATOM 1444 O ASN A 408 97.363 -10.819 13.045 1.00 0.00 O ATOM 1445 CB ASN A 408 99.079 -8.692 11.437 1.00 0.00 C ATOM 1446 CG ASN A 408 98.948 -7.171 11.333 1.00 0.00 C ATOM 1447 OD1 ASN A 408 97.864 -6.653 11.158 1.00 0.00 O ATOM 1448 ND2 ASN A 408 100.017 -6.429 11.439 1.00 0.00 N ATOM 0 H ASN A 408 101.106 -8.726 12.649 1.00 0.00 H new ATOM 0 HA ASN A 408 98.345 -8.477 13.479 1.00 0.00 H new ATOM 0 HB2 ASN A 408 100.017 -9.019 10.988 1.00 0.00 H new ATOM 0 HB3 ASN A 408 98.275 -9.176 10.883 1.00 0.00 H new ATOM 0 HD21 ASN A 408 99.942 -5.414 11.375 1.00 0.00 H new ATOM 0 HD22 ASN A 408 100.928 -6.864 11.586 1.00 0.00 H new ATOM 1455 N GLY A 409 99.461 -11.466 12.984 1.00 0.00 N ATOM 1456 CA GLY A 409 99.069 -12.893 12.892 1.00 0.00 C ATOM 1457 C GLY A 409 99.074 -13.293 11.421 1.00 0.00 C ATOM 1458 O GLY A 409 98.439 -14.248 11.018 1.00 0.00 O ATOM 0 H GLY A 409 100.466 -11.291 12.987 1.00 0.00 H new ATOM 0 HA2 GLY A 409 99.762 -13.515 13.458 1.00 0.00 H new ATOM 0 HA3 GLY A 409 98.080 -13.044 13.324 1.00 0.00 H new ATOM 1462 N GLY A 410 99.758 -12.534 10.607 1.00 0.00 N ATOM 1463 CA GLY A 410 99.771 -12.837 9.141 1.00 0.00 C ATOM 1464 C GLY A 410 101.181 -13.237 8.706 1.00 0.00 C ATOM 1465 O GLY A 410 102.024 -13.554 9.522 1.00 0.00 O ATOM 0 H GLY A 410 100.306 -11.721 10.889 1.00 0.00 H new ATOM 0 HA2 GLY A 410 99.071 -13.643 8.921 1.00 0.00 H new ATOM 0 HA3 GLY A 410 99.441 -11.965 8.577 1.00 0.00 H new ATOM 1469 N HIS A 411 101.416 -13.321 7.424 1.00 0.00 N ATOM 1470 CA HIS A 411 102.741 -13.816 6.946 1.00 0.00 C ATOM 1471 C HIS A 411 103.195 -13.067 5.684 1.00 0.00 C ATOM 1472 O HIS A 411 102.395 -12.591 4.903 1.00 0.00 O ATOM 1473 CB HIS A 411 102.529 -15.300 6.644 1.00 0.00 C ATOM 1474 CG HIS A 411 102.193 -16.027 7.916 1.00 0.00 C ATOM 1475 ND1 HIS A 411 100.885 -16.213 8.339 1.00 0.00 N ATOM 1476 CD2 HIS A 411 102.981 -16.621 8.870 1.00 0.00 C ATOM 1477 CE1 HIS A 411 100.926 -16.892 9.499 1.00 0.00 C ATOM 1478 NE2 HIS A 411 102.180 -17.167 9.868 1.00 0.00 N ATOM 0 H HIS A 411 100.753 -13.070 6.691 1.00 0.00 H new ATOM 0 HA HIS A 411 103.520 -13.655 7.691 1.00 0.00 H new ATOM 0 HB2 HIS A 411 101.725 -15.423 5.919 1.00 0.00 H new ATOM 0 HB3 HIS A 411 103.429 -15.723 6.197 1.00 0.00 H new ATOM 0 HD2 HIS A 411 104.060 -16.659 8.849 1.00 0.00 H new ATOM 0 HE1 HIS A 411 100.051 -17.180 10.064 1.00 0.00 H new ATOM 0 HE2 HIS A 411 102.485 -17.669 10.702 1.00 0.00 H new ATOM 1486 N PHE A 412 104.484 -12.995 5.475 1.00 0.00 N ATOM 1487 CA PHE A 412 105.029 -12.317 4.252 1.00 0.00 C ATOM 1488 C PHE A 412 105.601 -13.358 3.280 1.00 0.00 C ATOM 1489 O PHE A 412 106.042 -14.412 3.692 1.00 0.00 O ATOM 1490 CB PHE A 412 106.144 -11.391 4.760 1.00 0.00 C ATOM 1491 CG PHE A 412 106.959 -12.096 5.822 1.00 0.00 C ATOM 1492 CD1 PHE A 412 107.995 -12.965 5.452 1.00 0.00 C ATOM 1493 CD2 PHE A 412 106.670 -11.887 7.178 1.00 0.00 C ATOM 1494 CE1 PHE A 412 108.744 -13.622 6.439 1.00 0.00 C ATOM 1495 CE2 PHE A 412 107.417 -12.546 8.164 1.00 0.00 C ATOM 1496 CZ PHE A 412 108.455 -13.413 7.794 1.00 0.00 C ATOM 0 H PHE A 412 105.191 -13.379 6.102 1.00 0.00 H new ATOM 0 HA PHE A 412 104.258 -11.765 3.715 1.00 0.00 H new ATOM 0 HB2 PHE A 412 106.788 -11.096 3.932 1.00 0.00 H new ATOM 0 HB3 PHE A 412 105.711 -10.478 5.169 1.00 0.00 H new ATOM 0 HD1 PHE A 412 108.216 -13.128 4.408 1.00 0.00 H new ATOM 0 HD2 PHE A 412 105.871 -11.218 7.463 1.00 0.00 H new ATOM 0 HE1 PHE A 412 109.544 -14.289 6.154 1.00 0.00 H new ATOM 0 HE2 PHE A 412 107.193 -12.386 9.208 1.00 0.00 H new ATOM 0 HZ PHE A 412 109.032 -13.920 8.554 1.00 0.00 H new ATOM 1506 N PRO A 413 105.534 -13.041 2.012 1.00 0.00 N ATOM 1507 CA PRO A 413 106.009 -13.978 0.966 1.00 0.00 C ATOM 1508 C PRO A 413 107.536 -14.008 0.928 1.00 0.00 C ATOM 1509 O PRO A 413 108.181 -12.987 0.792 1.00 0.00 O ATOM 1510 CB PRO A 413 105.489 -13.397 -0.345 1.00 0.00 C ATOM 1511 CG PRO A 413 104.741 -12.146 0.000 1.00 0.00 C ATOM 1512 CD PRO A 413 105.019 -11.801 1.441 1.00 0.00 C ATOM 0 HA PRO A 413 105.663 -14.995 1.149 1.00 0.00 H new ATOM 0 HB2 PRO A 413 106.313 -13.179 -1.025 1.00 0.00 H new ATOM 0 HB3 PRO A 413 104.838 -14.109 -0.852 1.00 0.00 H new ATOM 0 HG2 PRO A 413 105.050 -11.328 -0.651 1.00 0.00 H new ATOM 0 HG3 PRO A 413 103.672 -12.290 -0.155 1.00 0.00 H new ATOM 0 HD2 PRO A 413 105.745 -10.992 1.524 1.00 0.00 H new ATOM 0 HD3 PRO A 413 104.115 -11.472 1.953 1.00 0.00 H new ATOM 1520 N THR A 414 108.121 -15.158 1.071 1.00 0.00 N ATOM 1521 CA THR A 414 109.610 -15.229 1.068 1.00 0.00 C ATOM 1522 C THR A 414 110.172 -14.853 -0.299 1.00 0.00 C ATOM 1523 O THR A 414 111.222 -14.261 -0.398 1.00 0.00 O ATOM 1524 CB THR A 414 109.952 -16.676 1.385 1.00 0.00 C ATOM 1525 OG1 THR A 414 111.322 -16.911 1.089 1.00 0.00 O ATOM 1526 CG2 THR A 414 109.081 -17.626 0.559 1.00 0.00 C ATOM 0 H THR A 414 107.640 -16.050 1.189 1.00 0.00 H new ATOM 0 HA THR A 414 110.038 -14.535 1.792 1.00 0.00 H new ATOM 0 HB THR A 414 109.764 -16.859 2.443 1.00 0.00 H new ATOM 0 HG1 THR A 414 111.546 -17.843 1.294 1.00 0.00 H new ATOM 0 HG21 THR A 414 109.339 -18.657 0.799 1.00 0.00 H new ATOM 0 HG22 THR A 414 108.031 -17.452 0.792 1.00 0.00 H new ATOM 0 HG23 THR A 414 109.252 -17.446 -0.502 1.00 0.00 H new ATOM 1534 N ASP A 415 109.487 -15.182 -1.355 1.00 0.00 N ATOM 1535 CA ASP A 415 110.008 -14.824 -2.695 1.00 0.00 C ATOM 1536 C ASP A 415 110.130 -13.313 -2.786 1.00 0.00 C ATOM 1537 O ASP A 415 111.007 -12.784 -3.432 1.00 0.00 O ATOM 1538 CB ASP A 415 108.970 -15.348 -3.687 1.00 0.00 C ATOM 1539 CG ASP A 415 108.953 -16.878 -3.648 1.00 0.00 C ATOM 1540 OD1 ASP A 415 109.867 -17.446 -3.072 1.00 0.00 O ATOM 1541 OD2 ASP A 415 108.028 -17.455 -4.195 1.00 0.00 O ATOM 0 H ASP A 415 108.596 -15.679 -1.347 1.00 0.00 H new ATOM 0 HA ASP A 415 110.991 -15.249 -2.897 1.00 0.00 H new ATOM 0 HB2 ASP A 415 107.984 -14.956 -3.438 1.00 0.00 H new ATOM 0 HB3 ASP A 415 109.206 -15.002 -4.693 1.00 0.00 H new ATOM 1546 N VAL A 416 109.253 -12.612 -2.134 1.00 0.00 N ATOM 1547 CA VAL A 416 109.317 -11.129 -2.181 1.00 0.00 C ATOM 1548 C VAL A 416 110.309 -10.592 -1.163 1.00 0.00 C ATOM 1549 O VAL A 416 111.166 -9.806 -1.489 1.00 0.00 O ATOM 1550 CB VAL A 416 107.909 -10.676 -1.866 1.00 0.00 C ATOM 1551 CG1 VAL A 416 107.901 -9.166 -1.618 1.00 0.00 C ATOM 1552 CG2 VAL A 416 107.031 -11.017 -3.064 1.00 0.00 C ATOM 0 H VAL A 416 108.496 -12.999 -1.571 1.00 0.00 H new ATOM 0 HA VAL A 416 109.659 -10.761 -3.149 1.00 0.00 H new ATOM 0 HB VAL A 416 107.533 -11.174 -0.972 1.00 0.00 H new ATOM 0 HG11 VAL A 416 106.886 -8.840 -1.391 1.00 0.00 H new ATOM 0 HG12 VAL A 416 108.554 -8.932 -0.777 1.00 0.00 H new ATOM 0 HG13 VAL A 416 108.257 -8.649 -2.509 1.00 0.00 H new ATOM 0 HG21 VAL A 416 106.007 -10.701 -2.866 1.00 0.00 H new ATOM 0 HG22 VAL A 416 107.405 -10.501 -3.948 1.00 0.00 H new ATOM 0 HG23 VAL A 416 107.052 -12.093 -3.236 1.00 0.00 H new ATOM 1562 N ASP A 417 110.314 -11.127 0.020 1.00 0.00 N ATOM 1563 CA ASP A 417 111.401 -10.752 0.966 1.00 0.00 C ATOM 1564 C ASP A 417 112.760 -11.008 0.312 1.00 0.00 C ATOM 1565 O ASP A 417 113.645 -10.182 0.364 1.00 0.00 O ATOM 1566 CB ASP A 417 111.207 -11.629 2.202 1.00 0.00 C ATOM 1567 CG ASP A 417 110.000 -11.129 2.994 1.00 0.00 C ATOM 1568 OD1 ASP A 417 109.382 -10.172 2.555 1.00 0.00 O ATOM 1569 OD2 ASP A 417 109.718 -11.705 4.029 1.00 0.00 O ATOM 0 H ASP A 417 109.628 -11.795 0.372 1.00 0.00 H new ATOM 0 HA ASP A 417 111.368 -9.696 1.236 1.00 0.00 H new ATOM 0 HB2 ASP A 417 111.057 -12.667 1.905 1.00 0.00 H new ATOM 0 HB3 ASP A 417 112.101 -11.602 2.825 1.00 0.00 H new ATOM 1574 N GLN A 418 112.888 -12.056 -0.447 1.00 0.00 N ATOM 1575 CA GLN A 418 114.137 -12.211 -1.249 1.00 0.00 C ATOM 1576 C GLN A 418 114.256 -11.069 -2.265 1.00 0.00 C ATOM 1577 O GLN A 418 115.269 -10.409 -2.337 1.00 0.00 O ATOM 1578 CB GLN A 418 113.999 -13.560 -1.957 1.00 0.00 C ATOM 1579 CG GLN A 418 114.062 -14.688 -0.925 1.00 0.00 C ATOM 1580 CD GLN A 418 115.429 -14.677 -0.239 1.00 0.00 C ATOM 1581 OE1 GLN A 418 116.451 -14.642 -0.896 1.00 0.00 O ATOM 1582 NE2 GLN A 418 115.492 -14.706 1.064 1.00 0.00 N ATOM 0 H GLN A 418 112.199 -12.801 -0.549 1.00 0.00 H new ATOM 0 HA GLN A 418 115.033 -12.176 -0.629 1.00 0.00 H new ATOM 0 HB2 GLN A 418 113.055 -13.602 -2.500 1.00 0.00 H new ATOM 0 HB3 GLN A 418 114.795 -13.680 -2.692 1.00 0.00 H new ATOM 0 HG2 GLN A 418 113.271 -14.563 -0.185 1.00 0.00 H new ATOM 0 HG3 GLN A 418 113.895 -15.649 -1.411 1.00 0.00 H new ATOM 0 HE21 GLN A 418 114.634 -14.735 1.616 1.00 0.00 H new ATOM 0 HE22 GLN A 418 116.399 -14.699 1.531 1.00 0.00 H new ATOM 1591 N LYS A 419 113.218 -10.778 -3.005 1.00 0.00 N ATOM 1592 CA LYS A 419 113.286 -9.622 -3.952 1.00 0.00 C ATOM 1593 C LYS A 419 113.644 -8.336 -3.201 1.00 0.00 C ATOM 1594 O LYS A 419 114.456 -7.553 -3.647 1.00 0.00 O ATOM 1595 CB LYS A 419 111.890 -9.516 -4.567 1.00 0.00 C ATOM 1596 CG LYS A 419 111.671 -10.677 -5.539 1.00 0.00 C ATOM 1597 CD LYS A 419 110.295 -10.542 -6.196 1.00 0.00 C ATOM 1598 CE LYS A 419 110.030 -11.760 -7.083 1.00 0.00 C ATOM 1599 NZ LYS A 419 108.921 -12.491 -6.411 1.00 0.00 N ATOM 0 H LYS A 419 112.333 -11.285 -2.996 1.00 0.00 H new ATOM 0 HA LYS A 419 114.052 -9.766 -4.714 1.00 0.00 H new ATOM 0 HB2 LYS A 419 111.133 -9.537 -3.783 1.00 0.00 H new ATOM 0 HB3 LYS A 419 111.782 -8.565 -5.089 1.00 0.00 H new ATOM 0 HG2 LYS A 419 112.451 -10.679 -6.301 1.00 0.00 H new ATOM 0 HG3 LYS A 419 111.741 -11.627 -5.009 1.00 0.00 H new ATOM 0 HD2 LYS A 419 109.522 -10.461 -5.432 1.00 0.00 H new ATOM 0 HD3 LYS A 419 110.252 -9.630 -6.791 1.00 0.00 H new ATOM 0 HE2 LYS A 419 109.750 -11.460 -8.093 1.00 0.00 H new ATOM 0 HE3 LYS A 419 110.919 -12.385 -7.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 419 108.682 -13.341 -6.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 419 109.219 -12.770 -5.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 419 108.087 -11.874 -6.347 1.00 0.00 H new ATOM 1613 N VAL A 420 113.173 -8.196 -1.996 1.00 0.00 N ATOM 1614 CA VAL A 420 113.627 -7.062 -1.142 1.00 0.00 C ATOM 1615 C VAL A 420 115.142 -7.153 -0.948 1.00 0.00 C ATOM 1616 O VAL A 420 115.848 -6.165 -0.962 1.00 0.00 O ATOM 1617 CB VAL A 420 112.885 -7.266 0.191 1.00 0.00 C ATOM 1618 CG1 VAL A 420 113.683 -6.664 1.359 1.00 0.00 C ATOM 1619 CG2 VAL A 420 111.516 -6.592 0.115 1.00 0.00 C ATOM 0 H VAL A 420 112.491 -8.819 -1.563 1.00 0.00 H new ATOM 0 HA VAL A 420 113.418 -6.083 -1.573 1.00 0.00 H new ATOM 0 HB VAL A 420 112.769 -8.336 0.364 1.00 0.00 H new ATOM 0 HG11 VAL A 420 113.139 -6.820 2.290 1.00 0.00 H new ATOM 0 HG12 VAL A 420 114.657 -7.149 1.422 1.00 0.00 H new ATOM 0 HG13 VAL A 420 113.820 -5.595 1.194 1.00 0.00 H new ATOM 0 HG21 VAL A 420 110.987 -6.734 1.058 1.00 0.00 H new ATOM 0 HG22 VAL A 420 111.645 -5.526 -0.071 1.00 0.00 H new ATOM 0 HG23 VAL A 420 110.937 -7.034 -0.696 1.00 0.00 H new ATOM 1629 N ASP A 421 115.637 -8.336 -0.745 1.00 0.00 N ATOM 1630 CA ASP A 421 117.098 -8.501 -0.518 1.00 0.00 C ATOM 1631 C ASP A 421 117.857 -8.143 -1.792 1.00 0.00 C ATOM 1632 O ASP A 421 118.916 -7.553 -1.761 1.00 0.00 O ATOM 1633 CB ASP A 421 117.279 -9.981 -0.170 1.00 0.00 C ATOM 1634 CG ASP A 421 118.688 -10.209 0.380 1.00 0.00 C ATOM 1635 OD1 ASP A 421 119.399 -9.234 0.556 1.00 0.00 O ATOM 1636 OD2 ASP A 421 119.032 -11.355 0.618 1.00 0.00 O ATOM 0 H ASP A 421 115.094 -9.199 -0.726 1.00 0.00 H new ATOM 0 HA ASP A 421 117.479 -7.855 0.273 1.00 0.00 H new ATOM 0 HB2 ASP A 421 116.536 -10.285 0.567 1.00 0.00 H new ATOM 0 HB3 ASP A 421 117.119 -10.596 -1.056 1.00 0.00 H new ATOM 1641 N GLN A 422 117.294 -8.472 -2.911 1.00 0.00 N ATOM 1642 CA GLN A 422 117.937 -8.136 -4.209 1.00 0.00 C ATOM 1643 C GLN A 422 117.943 -6.620 -4.434 1.00 0.00 C ATOM 1644 O GLN A 422 118.915 -6.056 -4.893 1.00 0.00 O ATOM 1645 CB GLN A 422 117.066 -8.839 -5.246 1.00 0.00 C ATOM 1646 CG GLN A 422 117.001 -10.331 -4.916 1.00 0.00 C ATOM 1647 CD GLN A 422 118.400 -10.940 -5.022 1.00 0.00 C ATOM 1648 OE1 GLN A 422 119.091 -10.739 -6.002 1.00 0.00 O ATOM 1649 NE2 GLN A 422 118.852 -11.682 -4.047 1.00 0.00 N ATOM 0 H GLN A 422 116.405 -8.966 -2.987 1.00 0.00 H new ATOM 0 HA GLN A 422 118.979 -8.451 -4.257 1.00 0.00 H new ATOM 0 HB2 GLN A 422 116.064 -8.410 -5.248 1.00 0.00 H new ATOM 0 HB3 GLN A 422 117.478 -8.692 -6.245 1.00 0.00 H new ATOM 0 HG2 GLN A 422 116.606 -10.475 -3.910 1.00 0.00 H new ATOM 0 HG3 GLN A 422 116.320 -10.836 -5.601 1.00 0.00 H new ATOM 0 HE21 GLN A 422 118.273 -11.851 -3.224 1.00 0.00 H new ATOM 0 HE22 GLN A 422 119.784 -12.092 -4.108 1.00 0.00 H new ATOM 1658 N VAL A 423 116.907 -5.946 -4.027 1.00 0.00 N ATOM 1659 CA VAL A 423 116.903 -4.459 -4.127 1.00 0.00 C ATOM 1660 C VAL A 423 118.014 -3.872 -3.255 1.00 0.00 C ATOM 1661 O VAL A 423 118.680 -2.928 -3.633 1.00 0.00 O ATOM 1662 CB VAL A 423 115.528 -4.030 -3.618 1.00 0.00 C ATOM 1663 CG1 VAL A 423 115.481 -2.506 -3.500 1.00 0.00 C ATOM 1664 CG2 VAL A 423 114.452 -4.499 -4.600 1.00 0.00 C ATOM 0 H VAL A 423 116.063 -6.358 -3.630 1.00 0.00 H new ATOM 0 HA VAL A 423 117.082 -4.110 -5.144 1.00 0.00 H new ATOM 0 HB VAL A 423 115.347 -4.476 -2.640 1.00 0.00 H new ATOM 0 HG11 VAL A 423 114.500 -2.199 -3.137 1.00 0.00 H new ATOM 0 HG12 VAL A 423 116.248 -2.171 -2.801 1.00 0.00 H new ATOM 0 HG13 VAL A 423 115.662 -2.060 -4.478 1.00 0.00 H new ATOM 0 HG21 VAL A 423 113.471 -4.193 -4.238 1.00 0.00 H new ATOM 0 HG22 VAL A 423 114.633 -4.053 -5.578 1.00 0.00 H new ATOM 0 HG23 VAL A 423 114.485 -5.585 -4.685 1.00 0.00 H new ATOM 1674 N ALA A 424 118.246 -4.445 -2.108 1.00 0.00 N ATOM 1675 CA ALA A 424 119.346 -3.946 -1.234 1.00 0.00 C ATOM 1676 C ALA A 424 120.708 -4.217 -1.882 1.00 0.00 C ATOM 1677 O ALA A 424 121.619 -3.419 -1.797 1.00 0.00 O ATOM 1678 CB ALA A 424 119.203 -4.731 0.071 1.00 0.00 C ATOM 0 H ALA A 424 117.722 -5.238 -1.737 1.00 0.00 H new ATOM 0 HA ALA A 424 119.286 -2.870 -1.070 1.00 0.00 H new ATOM 0 HB1 ALA A 424 119.980 -4.420 0.770 1.00 0.00 H new ATOM 0 HB2 ALA A 424 118.223 -4.536 0.507 1.00 0.00 H new ATOM 0 HB3 ALA A 424 119.304 -5.797 -0.133 1.00 0.00 H new ATOM 1684 N ARG A 425 120.866 -5.362 -2.488 1.00 0.00 N ATOM 1685 CA ARG A 425 122.170 -5.724 -3.095 1.00 0.00 C ATOM 1686 C ARG A 425 122.478 -4.831 -4.306 1.00 0.00 C ATOM 1687 O ARG A 425 123.613 -4.472 -4.549 1.00 0.00 O ATOM 1688 CB ARG A 425 121.984 -7.193 -3.497 1.00 0.00 C ATOM 1689 CG ARG A 425 122.914 -7.546 -4.651 1.00 0.00 C ATOM 1690 CD ARG A 425 122.892 -9.057 -4.889 1.00 0.00 C ATOM 1691 NE ARG A 425 123.843 -9.284 -6.012 1.00 0.00 N ATOM 1692 CZ ARG A 425 124.161 -10.499 -6.370 1.00 0.00 C ATOM 1693 NH1 ARG A 425 123.650 -11.526 -5.743 1.00 0.00 N ATOM 1694 NH2 ARG A 425 124.995 -10.689 -7.356 1.00 0.00 N ATOM 0 H ARG A 425 120.136 -6.068 -2.587 1.00 0.00 H new ATOM 0 HA ARG A 425 123.013 -5.585 -2.419 1.00 0.00 H new ATOM 0 HB2 ARG A 425 122.190 -7.840 -2.644 1.00 0.00 H new ATOM 0 HB3 ARG A 425 120.949 -7.369 -3.788 1.00 0.00 H new ATOM 0 HG2 ARG A 425 122.603 -7.022 -5.555 1.00 0.00 H new ATOM 0 HG3 ARG A 425 123.929 -7.219 -4.426 1.00 0.00 H new ATOM 0 HD2 ARG A 425 123.199 -9.602 -3.996 1.00 0.00 H new ATOM 0 HD3 ARG A 425 121.890 -9.402 -5.144 1.00 0.00 H new ATOM 0 HE ARG A 425 124.248 -8.487 -6.504 1.00 0.00 H new ATOM 0 HH11 ARG A 425 123.000 -11.380 -4.971 1.00 0.00 H new ATOM 0 HH12 ARG A 425 123.901 -12.473 -6.026 1.00 0.00 H new ATOM 0 HH21 ARG A 425 125.397 -9.889 -7.845 1.00 0.00 H new ATOM 0 HH22 ARG A 425 125.245 -11.637 -7.637 1.00 0.00 H new ATOM 1708 N GLN A 426 121.472 -4.400 -5.007 1.00 0.00 N ATOM 1709 CA GLN A 426 121.700 -3.449 -6.129 1.00 0.00 C ATOM 1710 C GLN A 426 121.813 -2.018 -5.581 1.00 0.00 C ATOM 1711 O GLN A 426 122.120 -1.087 -6.298 1.00 0.00 O ATOM 1712 CB GLN A 426 120.474 -3.636 -7.039 1.00 0.00 C ATOM 1713 CG GLN A 426 120.126 -2.329 -7.752 1.00 0.00 C ATOM 1714 CD GLN A 426 119.434 -2.635 -9.080 1.00 0.00 C ATOM 1715 OE1 GLN A 426 118.420 -3.305 -9.111 1.00 0.00 O ATOM 1716 NE2 GLN A 426 119.941 -2.170 -10.189 1.00 0.00 N ATOM 0 H GLN A 426 120.499 -4.665 -4.853 1.00 0.00 H new ATOM 0 HA GLN A 426 122.625 -3.629 -6.677 1.00 0.00 H new ATOM 0 HB2 GLN A 426 120.676 -4.415 -7.774 1.00 0.00 H new ATOM 0 HB3 GLN A 426 119.623 -3.971 -6.446 1.00 0.00 H new ATOM 0 HG2 GLN A 426 119.475 -1.723 -7.123 1.00 0.00 H new ATOM 0 HG3 GLN A 426 121.031 -1.747 -7.928 1.00 0.00 H new ATOM 0 HE21 GLN A 426 120.792 -1.608 -10.164 1.00 0.00 H new ATOM 0 HE22 GLN A 426 119.487 -2.369 -11.080 1.00 0.00 H new ATOM 1725 N GLY A 427 121.631 -1.847 -4.303 1.00 0.00 N ATOM 1726 CA GLY A 427 121.796 -0.493 -3.704 1.00 0.00 C ATOM 1727 C GLY A 427 120.443 0.212 -3.670 1.00 0.00 C ATOM 1728 O GLY A 427 120.363 1.422 -3.585 1.00 0.00 O ATOM 0 H GLY A 427 121.375 -2.585 -3.647 1.00 0.00 H new ATOM 0 HA2 GLY A 427 122.201 -0.576 -2.696 1.00 0.00 H new ATOM 0 HA3 GLY A 427 122.509 0.091 -4.287 1.00 0.00 H new ATOM 1732 N ALA A 428 119.376 -0.537 -3.711 1.00 0.00 N ATOM 1733 CA ALA A 428 118.026 0.090 -3.656 1.00 0.00 C ATOM 1734 C ALA A 428 117.396 -0.169 -2.285 1.00 0.00 C ATOM 1735 O ALA A 428 117.874 -0.983 -1.520 1.00 0.00 O ATOM 1736 CB ALA A 428 117.224 -0.591 -4.763 1.00 0.00 C ATOM 0 H ALA A 428 119.381 -1.555 -3.780 1.00 0.00 H new ATOM 0 HA ALA A 428 118.058 1.171 -3.796 1.00 0.00 H new ATOM 0 HB1 ALA A 428 116.214 -0.181 -4.786 1.00 0.00 H new ATOM 0 HB2 ALA A 428 117.708 -0.416 -5.724 1.00 0.00 H new ATOM 0 HB3 ALA A 428 117.176 -1.663 -4.571 1.00 0.00 H new ATOM 1742 N THR A 429 116.370 0.557 -1.940 1.00 0.00 N ATOM 1743 CA THR A 429 115.772 0.392 -0.581 1.00 0.00 C ATOM 1744 C THR A 429 114.402 -0.269 -0.699 1.00 0.00 C ATOM 1745 O THR A 429 113.451 0.350 -1.127 1.00 0.00 O ATOM 1746 CB THR A 429 115.632 1.815 -0.039 1.00 0.00 C ATOM 1747 OG1 THR A 429 116.913 2.426 0.018 1.00 0.00 O ATOM 1748 CG2 THR A 429 115.022 1.770 1.364 1.00 0.00 C ATOM 0 H THR A 429 115.920 1.254 -2.534 1.00 0.00 H new ATOM 0 HA THR A 429 116.380 -0.235 0.071 1.00 0.00 H new ATOM 0 HB THR A 429 114.983 2.393 -0.696 1.00 0.00 H new ATOM 0 HG1 THR A 429 116.825 3.339 0.364 1.00 0.00 H new ATOM 0 HG21 THR A 429 114.922 2.784 1.750 1.00 0.00 H new ATOM 0 HG22 THR A 429 114.039 1.301 1.319 1.00 0.00 H new ATOM 0 HG23 THR A 429 115.669 1.193 2.024 1.00 0.00 H new ATOM 1756 N PRO A 430 114.344 -1.504 -0.308 1.00 0.00 N ATOM 1757 CA PRO A 430 113.069 -2.248 -0.356 1.00 0.00 C ATOM 1758 C PRO A 430 112.150 -1.816 0.788 1.00 0.00 C ATOM 1759 O PRO A 430 112.248 -2.318 1.891 1.00 0.00 O ATOM 1760 CB PRO A 430 113.490 -3.699 -0.178 1.00 0.00 C ATOM 1761 CG PRO A 430 114.812 -3.646 0.527 1.00 0.00 C ATOM 1762 CD PRO A 430 115.452 -2.319 0.198 1.00 0.00 C ATOM 0 HA PRO A 430 112.515 -2.076 -1.279 1.00 0.00 H new ATOM 0 HB2 PRO A 430 112.755 -4.253 0.406 1.00 0.00 H new ATOM 0 HB3 PRO A 430 113.578 -4.204 -1.140 1.00 0.00 H new ATOM 0 HG2 PRO A 430 114.676 -3.749 1.604 1.00 0.00 H new ATOM 0 HG3 PRO A 430 115.450 -4.469 0.206 1.00 0.00 H new ATOM 0 HD2 PRO A 430 115.909 -1.868 1.079 1.00 0.00 H new ATOM 0 HD3 PRO A 430 116.239 -2.430 -0.548 1.00 0.00 H new ATOM 1770 N LEU A 431 111.112 -1.097 0.472 1.00 0.00 N ATOM 1771 CA LEU A 431 110.033 -0.891 1.475 1.00 0.00 C ATOM 1772 C LEU A 431 108.972 -1.965 1.276 1.00 0.00 C ATOM 1773 O LEU A 431 108.522 -2.198 0.181 1.00 0.00 O ATOM 1774 CB LEU A 431 109.433 0.489 1.179 1.00 0.00 C ATOM 1775 CG LEU A 431 110.526 1.560 1.163 1.00 0.00 C ATOM 1776 CD1 LEU A 431 109.879 2.942 1.281 1.00 0.00 C ATOM 1777 CD2 LEU A 431 111.480 1.344 2.342 1.00 0.00 C ATOM 0 H LEU A 431 110.964 -0.646 -0.431 1.00 0.00 H new ATOM 0 HA LEU A 431 110.405 -0.948 2.498 1.00 0.00 H new ATOM 0 HB2 LEU A 431 108.921 0.470 0.217 1.00 0.00 H new ATOM 0 HB3 LEU A 431 108.686 0.736 1.933 1.00 0.00 H new ATOM 0 HG LEU A 431 111.086 1.492 0.230 1.00 0.00 H new ATOM 0 HD11 LEU A 431 110.654 3.709 1.270 1.00 0.00 H new ATOM 0 HD12 LEU A 431 109.201 3.099 0.442 1.00 0.00 H new ATOM 0 HD13 LEU A 431 109.321 3.004 2.215 1.00 0.00 H new ATOM 0 HD21 LEU A 431 112.257 2.109 2.327 1.00 0.00 H new ATOM 0 HD22 LEU A 431 110.924 1.410 3.277 1.00 0.00 H new ATOM 0 HD23 LEU A 431 111.939 0.359 2.262 1.00 0.00 H new ATOM 1789 N VAL A 432 108.517 -2.576 2.320 1.00 0.00 N ATOM 1790 CA VAL A 432 107.426 -3.572 2.157 1.00 0.00 C ATOM 1791 C VAL A 432 106.097 -2.936 2.543 1.00 0.00 C ATOM 1792 O VAL A 432 105.971 -2.327 3.585 1.00 0.00 O ATOM 1793 CB VAL A 432 107.772 -4.719 3.104 1.00 0.00 C ATOM 1794 CG1 VAL A 432 106.681 -5.788 3.026 1.00 0.00 C ATOM 1795 CG2 VAL A 432 109.111 -5.331 2.686 1.00 0.00 C ATOM 0 H VAL A 432 108.846 -2.435 3.275 1.00 0.00 H new ATOM 0 HA VAL A 432 107.334 -3.924 1.129 1.00 0.00 H new ATOM 0 HB VAL A 432 107.842 -4.343 4.125 1.00 0.00 H new ATOM 0 HG11 VAL A 432 106.926 -6.608 3.701 1.00 0.00 H new ATOM 0 HG12 VAL A 432 105.724 -5.353 3.315 1.00 0.00 H new ATOM 0 HG13 VAL A 432 106.614 -6.166 2.006 1.00 0.00 H new ATOM 0 HG21 VAL A 432 109.362 -6.151 3.359 1.00 0.00 H new ATOM 0 HG22 VAL A 432 109.036 -5.709 1.666 1.00 0.00 H new ATOM 0 HG23 VAL A 432 109.890 -4.570 2.734 1.00 0.00 H new ATOM 1805 N VAL A 433 105.086 -3.135 1.753 1.00 0.00 N ATOM 1806 CA VAL A 433 103.752 -2.616 2.130 1.00 0.00 C ATOM 1807 C VAL A 433 102.811 -3.787 2.357 1.00 0.00 C ATOM 1808 O VAL A 433 102.802 -4.743 1.610 1.00 0.00 O ATOM 1809 CB VAL A 433 103.289 -1.756 0.951 1.00 0.00 C ATOM 1810 CG1 VAL A 433 101.805 -1.423 1.112 1.00 0.00 C ATOM 1811 CG2 VAL A 433 104.091 -0.453 0.932 1.00 0.00 C ATOM 0 H VAL A 433 105.127 -3.634 0.864 1.00 0.00 H new ATOM 0 HA VAL A 433 103.774 -2.029 3.048 1.00 0.00 H new ATOM 0 HB VAL A 433 103.444 -2.303 0.021 1.00 0.00 H new ATOM 0 HG11 VAL A 433 101.476 -0.811 0.272 1.00 0.00 H new ATOM 0 HG12 VAL A 433 101.226 -2.346 1.137 1.00 0.00 H new ATOM 0 HG13 VAL A 433 101.654 -0.875 2.042 1.00 0.00 H new ATOM 0 HG21 VAL A 433 103.765 0.163 0.094 1.00 0.00 H new ATOM 0 HG22 VAL A 433 103.929 0.088 1.864 1.00 0.00 H new ATOM 0 HG23 VAL A 433 105.152 -0.680 0.824 1.00 0.00 H new ATOM 1821 N VAL A 434 102.036 -3.733 3.394 1.00 0.00 N ATOM 1822 CA VAL A 434 101.112 -4.853 3.684 1.00 0.00 C ATOM 1823 C VAL A 434 99.677 -4.362 3.609 1.00 0.00 C ATOM 1824 O VAL A 434 99.389 -3.211 3.869 1.00 0.00 O ATOM 1825 CB VAL A 434 101.432 -5.321 5.106 1.00 0.00 C ATOM 1826 CG1 VAL A 434 102.631 -6.267 5.082 1.00 0.00 C ATOM 1827 CG2 VAL A 434 101.747 -4.116 6.000 1.00 0.00 C ATOM 0 H VAL A 434 102.002 -2.958 4.057 1.00 0.00 H new ATOM 0 HA VAL A 434 101.229 -5.665 2.967 1.00 0.00 H new ATOM 0 HB VAL A 434 100.565 -5.845 5.507 1.00 0.00 H new ATOM 0 HG11 VAL A 434 102.854 -6.597 6.097 1.00 0.00 H new ATOM 0 HG12 VAL A 434 102.399 -7.133 4.462 1.00 0.00 H new ATOM 0 HG13 VAL A 434 103.496 -5.747 4.671 1.00 0.00 H new ATOM 0 HG21 VAL A 434 101.973 -4.461 7.009 1.00 0.00 H new ATOM 0 HG22 VAL A 434 102.607 -3.580 5.598 1.00 0.00 H new ATOM 0 HG23 VAL A 434 100.885 -3.449 6.029 1.00 0.00 H new ATOM 1837 N GLU A 435 98.771 -5.268 3.439 1.00 0.00 N ATOM 1838 CA GLU A 435 97.341 -4.924 3.551 1.00 0.00 C ATOM 1839 C GLU A 435 96.655 -6.026 4.375 1.00 0.00 C ATOM 1840 O GLU A 435 96.995 -7.189 4.268 1.00 0.00 O ATOM 1841 CB GLU A 435 96.864 -4.878 2.092 1.00 0.00 C ATOM 1842 CG GLU A 435 95.424 -5.383 1.977 1.00 0.00 C ATOM 1843 CD GLU A 435 95.010 -5.426 0.505 1.00 0.00 C ATOM 1844 OE1 GLU A 435 95.846 -5.128 -0.333 1.00 0.00 O ATOM 1845 OE2 GLU A 435 93.867 -5.757 0.240 1.00 0.00 O ATOM 0 H GLU A 435 98.964 -6.246 3.224 1.00 0.00 H new ATOM 0 HA GLU A 435 97.123 -3.981 4.053 1.00 0.00 H new ATOM 0 HB2 GLU A 435 96.928 -3.857 1.715 1.00 0.00 H new ATOM 0 HB3 GLU A 435 97.519 -5.488 1.471 1.00 0.00 H new ATOM 0 HG2 GLU A 435 95.340 -6.376 2.418 1.00 0.00 H new ATOM 0 HG3 GLU A 435 94.753 -4.729 2.535 1.00 0.00 H new ATOM 1852 N GLY A 436 95.895 -5.649 5.362 1.00 0.00 N ATOM 1853 CA GLY A 436 95.440 -6.656 6.357 1.00 0.00 C ATOM 1854 C GLY A 436 96.651 -7.154 7.154 1.00 0.00 C ATOM 1855 O GLY A 436 97.465 -6.376 7.610 1.00 0.00 O ATOM 0 H GLY A 436 95.571 -4.695 5.523 1.00 0.00 H new ATOM 0 HA2 GLY A 436 94.703 -6.215 7.028 1.00 0.00 H new ATOM 0 HA3 GLY A 436 94.953 -7.490 5.852 1.00 0.00 H new ATOM 1859 N SER A 437 96.781 -8.443 7.323 1.00 0.00 N ATOM 1860 CA SER A 437 97.947 -8.982 8.086 1.00 0.00 C ATOM 1861 C SER A 437 99.009 -9.548 7.140 1.00 0.00 C ATOM 1862 O SER A 437 99.923 -10.224 7.563 1.00 0.00 O ATOM 1863 CB SER A 437 97.376 -10.102 8.955 1.00 0.00 C ATOM 1864 OG SER A 437 96.769 -11.080 8.121 1.00 0.00 O ATOM 0 H SER A 437 96.133 -9.145 6.967 1.00 0.00 H new ATOM 0 HA SER A 437 98.431 -8.202 8.675 1.00 0.00 H new ATOM 0 HB2 SER A 437 98.168 -10.556 9.550 1.00 0.00 H new ATOM 0 HB3 SER A 437 96.644 -9.698 9.654 1.00 0.00 H new ATOM 0 HG SER A 437 96.403 -11.801 8.675 1.00 0.00 H new ATOM 1870 N ARG A 438 98.868 -9.352 5.861 1.00 0.00 N ATOM 1871 CA ARG A 438 99.837 -9.975 4.920 1.00 0.00 C ATOM 1872 C ARG A 438 100.539 -8.896 4.105 1.00 0.00 C ATOM 1873 O ARG A 438 100.171 -7.742 4.138 1.00 0.00 O ATOM 1874 CB ARG A 438 98.999 -10.871 4.010 1.00 0.00 C ATOM 1875 CG ARG A 438 98.176 -10.001 3.061 1.00 0.00 C ATOM 1876 CD ARG A 438 97.121 -10.864 2.364 1.00 0.00 C ATOM 1877 NE ARG A 438 96.463 -9.952 1.386 1.00 0.00 N ATOM 1878 CZ ARG A 438 95.585 -9.074 1.794 1.00 0.00 C ATOM 1879 NH1 ARG A 438 95.279 -8.987 3.061 1.00 0.00 N ATOM 1880 NH2 ARG A 438 95.013 -8.279 0.932 1.00 0.00 N ATOM 0 H ARG A 438 98.132 -8.793 5.429 1.00 0.00 H new ATOM 0 HA ARG A 438 100.610 -10.540 5.441 1.00 0.00 H new ATOM 0 HB2 ARG A 438 99.647 -11.538 3.441 1.00 0.00 H new ATOM 0 HB3 ARG A 438 98.340 -11.501 4.608 1.00 0.00 H new ATOM 0 HG2 ARG A 438 97.694 -9.195 3.615 1.00 0.00 H new ATOM 0 HG3 ARG A 438 98.827 -9.535 2.321 1.00 0.00 H new ATOM 0 HD2 ARG A 438 97.577 -11.718 1.863 1.00 0.00 H new ATOM 0 HD3 ARG A 438 96.401 -11.262 3.079 1.00 0.00 H new ATOM 0 HE ARG A 438 96.699 -10.013 0.395 1.00 0.00 H new ATOM 0 HH11 ARG A 438 95.726 -9.606 3.737 1.00 0.00 H new ATOM 0 HH12 ARG A 438 94.593 -8.300 3.374 1.00 0.00 H new ATOM 0 HH21 ARG A 438 95.251 -8.344 -0.058 1.00 0.00 H new ATOM 0 HH22 ARG A 438 94.327 -7.593 1.248 1.00 0.00 H new ATOM 1894 N VAL A 439 101.540 -9.267 3.368 1.00 0.00 N ATOM 1895 CA VAL A 439 102.259 -8.260 2.548 1.00 0.00 C ATOM 1896 C VAL A 439 101.654 -8.204 1.149 1.00 0.00 C ATOM 1897 O VAL A 439 101.428 -9.215 0.517 1.00 0.00 O ATOM 1898 CB VAL A 439 103.700 -8.761 2.482 1.00 0.00 C ATOM 1899 CG1 VAL A 439 104.579 -7.711 1.808 1.00 0.00 C ATOM 1900 CG2 VAL A 439 104.214 -9.029 3.897 1.00 0.00 C ATOM 0 H VAL A 439 101.892 -10.222 3.297 1.00 0.00 H new ATOM 0 HA VAL A 439 102.194 -7.257 2.970 1.00 0.00 H new ATOM 0 HB VAL A 439 103.735 -9.684 1.903 1.00 0.00 H new ATOM 0 HG11 VAL A 439 105.607 -8.072 1.763 1.00 0.00 H new ATOM 0 HG12 VAL A 439 104.214 -7.526 0.798 1.00 0.00 H new ATOM 0 HG13 VAL A 439 104.545 -6.785 2.382 1.00 0.00 H new ATOM 0 HG21 VAL A 439 105.243 -9.387 3.849 1.00 0.00 H new ATOM 0 HG22 VAL A 439 104.177 -8.108 4.478 1.00 0.00 H new ATOM 0 HG23 VAL A 439 103.589 -9.784 4.374 1.00 0.00 H new ATOM 1910 N LEU A 440 101.424 -7.029 0.647 1.00 0.00 N ATOM 1911 CA LEU A 440 100.876 -6.915 -0.733 1.00 0.00 C ATOM 1912 C LEU A 440 102.018 -6.729 -1.729 1.00 0.00 C ATOM 1913 O LEU A 440 101.938 -7.172 -2.858 1.00 0.00 O ATOM 1914 CB LEU A 440 99.901 -5.720 -0.755 1.00 0.00 C ATOM 1915 CG LEU A 440 100.451 -4.495 -0.023 1.00 0.00 C ATOM 1916 CD1 LEU A 440 101.574 -3.860 -0.842 1.00 0.00 C ATOM 1917 CD2 LEU A 440 99.331 -3.484 0.134 1.00 0.00 C ATOM 0 H LEU A 440 101.590 -6.144 1.127 1.00 0.00 H new ATOM 0 HA LEU A 440 100.342 -7.821 -1.020 1.00 0.00 H new ATOM 0 HB2 LEU A 440 99.684 -5.453 -1.789 1.00 0.00 H new ATOM 0 HB3 LEU A 440 98.957 -6.018 -0.298 1.00 0.00 H new ATOM 0 HG LEU A 440 100.839 -4.795 0.950 1.00 0.00 H new ATOM 0 HD11 LEU A 440 101.961 -2.988 -0.314 1.00 0.00 H new ATOM 0 HD12 LEU A 440 102.376 -4.584 -0.983 1.00 0.00 H new ATOM 0 HD13 LEU A 440 101.187 -3.554 -1.814 1.00 0.00 H new ATOM 0 HD21 LEU A 440 99.706 -2.603 0.655 1.00 0.00 H new ATOM 0 HD22 LEU A 440 98.962 -3.194 -0.850 1.00 0.00 H new ATOM 0 HD23 LEU A 440 98.519 -3.927 0.710 1.00 0.00 H new ATOM 1929 N GLY A 441 103.152 -6.262 -1.271 1.00 0.00 N ATOM 1930 CA GLY A 441 104.357 -6.282 -2.162 1.00 0.00 C ATOM 1931 C GLY A 441 105.489 -5.425 -1.575 1.00 0.00 C ATOM 1932 O GLY A 441 105.296 -4.702 -0.625 1.00 0.00 O ATOM 0 H GLY A 441 103.297 -5.875 -0.339 1.00 0.00 H new ATOM 0 HA2 GLY A 441 104.702 -7.308 -2.291 1.00 0.00 H new ATOM 0 HA3 GLY A 441 104.089 -5.910 -3.151 1.00 0.00 H new ATOM 1936 N VAL A 442 106.628 -5.404 -2.226 1.00 0.00 N ATOM 1937 CA VAL A 442 107.724 -4.475 -1.799 1.00 0.00 C ATOM 1938 C VAL A 442 107.867 -3.340 -2.810 1.00 0.00 C ATOM 1939 O VAL A 442 107.894 -3.562 -4.003 1.00 0.00 O ATOM 1940 CB VAL A 442 109.024 -5.294 -1.787 1.00 0.00 C ATOM 1941 CG1 VAL A 442 110.186 -4.406 -1.306 1.00 0.00 C ATOM 1942 CG2 VAL A 442 108.879 -6.496 -0.847 1.00 0.00 C ATOM 0 H VAL A 442 106.846 -5.988 -3.033 1.00 0.00 H new ATOM 0 HA VAL A 442 107.507 -4.048 -0.820 1.00 0.00 H new ATOM 0 HB VAL A 442 109.228 -5.652 -2.796 1.00 0.00 H new ATOM 0 HG11 VAL A 442 111.108 -4.987 -1.297 1.00 0.00 H new ATOM 0 HG12 VAL A 442 110.298 -3.557 -1.980 1.00 0.00 H new ATOM 0 HG13 VAL A 442 109.975 -4.045 -0.299 1.00 0.00 H new ATOM 0 HG21 VAL A 442 109.805 -7.070 -0.845 1.00 0.00 H new ATOM 0 HG22 VAL A 442 108.668 -6.145 0.163 1.00 0.00 H new ATOM 0 HG23 VAL A 442 108.060 -7.129 -1.189 1.00 0.00 H new ATOM 1952 N ILE A 443 108.145 -2.166 -2.334 1.00 0.00 N ATOM 1953 CA ILE A 443 108.503 -1.053 -3.247 1.00 0.00 C ATOM 1954 C ILE A 443 110.018 -0.868 -3.231 1.00 0.00 C ATOM 1955 O ILE A 443 110.590 -0.484 -2.237 1.00 0.00 O ATOM 1956 CB ILE A 443 107.814 0.170 -2.647 1.00 0.00 C ATOM 1957 CG1 ILE A 443 106.303 -0.067 -2.601 1.00 0.00 C ATOM 1958 CG2 ILE A 443 108.114 1.401 -3.505 1.00 0.00 C ATOM 1959 CD1 ILE A 443 105.624 1.116 -1.909 1.00 0.00 C ATOM 0 H ILE A 443 108.140 -1.926 -1.343 1.00 0.00 H new ATOM 0 HA ILE A 443 108.199 -1.227 -4.279 1.00 0.00 H new ATOM 0 HB ILE A 443 108.186 0.336 -1.636 1.00 0.00 H new ATOM 0 HG12 ILE A 443 105.911 -0.185 -3.611 1.00 0.00 H new ATOM 0 HG13 ILE A 443 106.085 -0.990 -2.065 1.00 0.00 H new ATOM 0 HG21 ILE A 443 107.621 2.273 -3.075 1.00 0.00 H new ATOM 0 HG22 ILE A 443 109.190 1.570 -3.535 1.00 0.00 H new ATOM 0 HG23 ILE A 443 107.744 1.238 -4.517 1.00 0.00 H new ATOM 0 HD11 ILE A 443 104.547 0.949 -1.875 1.00 0.00 H new ATOM 0 HD12 ILE A 443 106.008 1.213 -0.894 1.00 0.00 H new ATOM 0 HD13 ILE A 443 105.832 2.031 -2.464 1.00 0.00 H new ATOM 1971 N ALA A 444 110.677 -1.173 -4.309 1.00 0.00 N ATOM 1972 CA ALA A 444 112.158 -1.049 -4.322 1.00 0.00 C ATOM 1973 C ALA A 444 112.559 0.333 -4.825 1.00 0.00 C ATOM 1974 O ALA A 444 112.203 0.741 -5.913 1.00 0.00 O ATOM 1975 CB ALA A 444 112.642 -2.126 -5.288 1.00 0.00 C ATOM 0 H ALA A 444 110.257 -1.502 -5.179 1.00 0.00 H new ATOM 0 HA ALA A 444 112.591 -1.171 -3.329 1.00 0.00 H new ATOM 0 HB1 ALA A 444 113.730 -2.096 -5.351 1.00 0.00 H new ATOM 0 HB2 ALA A 444 112.326 -3.105 -4.929 1.00 0.00 H new ATOM 0 HB3 ALA A 444 112.217 -1.947 -6.276 1.00 0.00 H new ATOM 1981 N LEU A 445 113.226 1.085 -4.005 1.00 0.00 N ATOM 1982 CA LEU A 445 113.579 2.476 -4.388 1.00 0.00 C ATOM 1983 C LEU A 445 115.045 2.508 -4.822 1.00 0.00 C ATOM 1984 O LEU A 445 115.865 1.798 -4.284 1.00 0.00 O ATOM 1985 CB LEU A 445 113.380 3.319 -3.118 1.00 0.00 C ATOM 1986 CG LEU A 445 112.143 2.858 -2.318 1.00 0.00 C ATOM 1987 CD1 LEU A 445 112.412 3.081 -0.830 1.00 0.00 C ATOM 1988 CD2 LEU A 445 110.906 3.672 -2.713 1.00 0.00 C ATOM 0 H LEU A 445 113.545 0.796 -3.080 1.00 0.00 H new ATOM 0 HA LEU A 445 112.971 2.853 -5.210 1.00 0.00 H new ATOM 0 HB2 LEU A 445 114.268 3.247 -2.490 1.00 0.00 H new ATOM 0 HB3 LEU A 445 113.267 4.368 -3.391 1.00 0.00 H new ATOM 0 HG LEU A 445 111.959 1.805 -2.531 1.00 0.00 H new ATOM 0 HD11 LEU A 445 111.546 2.760 -0.252 1.00 0.00 H new ATOM 0 HD12 LEU A 445 113.285 2.503 -0.527 1.00 0.00 H new ATOM 0 HD13 LEU A 445 112.597 4.140 -0.648 1.00 0.00 H new ATOM 0 HD21 LEU A 445 110.046 3.330 -2.137 1.00 0.00 H new ATOM 0 HD22 LEU A 445 111.084 4.727 -2.507 1.00 0.00 H new ATOM 0 HD23 LEU A 445 110.707 3.538 -3.776 1.00 0.00 H new ATOM 2000 N LYS A 446 115.387 3.300 -5.793 1.00 0.00 N ATOM 2001 CA LYS A 446 116.808 3.323 -6.244 1.00 0.00 C ATOM 2002 C LYS A 446 117.457 4.669 -5.936 1.00 0.00 C ATOM 2003 O LYS A 446 116.792 5.657 -5.693 1.00 0.00 O ATOM 2004 CB LYS A 446 116.767 3.082 -7.747 1.00 0.00 C ATOM 2005 CG LYS A 446 116.345 1.639 -8.019 1.00 0.00 C ATOM 2006 CD LYS A 446 116.498 1.338 -9.508 1.00 0.00 C ATOM 2007 CE LYS A 446 116.170 -0.133 -9.762 1.00 0.00 C ATOM 2008 NZ LYS A 446 115.234 -0.125 -10.920 1.00 0.00 N ATOM 0 H LYS A 446 114.756 3.927 -6.292 1.00 0.00 H new ATOM 0 HA LYS A 446 117.400 2.567 -5.729 1.00 0.00 H new ATOM 0 HB2 LYS A 446 116.067 3.772 -8.218 1.00 0.00 H new ATOM 0 HB3 LYS A 446 117.747 3.274 -8.184 1.00 0.00 H new ATOM 0 HG2 LYS A 446 116.957 0.953 -7.433 1.00 0.00 H new ATOM 0 HG3 LYS A 446 115.311 1.487 -7.710 1.00 0.00 H new ATOM 0 HD2 LYS A 446 115.833 1.976 -10.090 1.00 0.00 H new ATOM 0 HD3 LYS A 446 117.515 1.557 -9.832 1.00 0.00 H new ATOM 0 HE2 LYS A 446 117.070 -0.705 -9.986 1.00 0.00 H new ATOM 0 HE3 LYS A 446 115.711 -0.592 -8.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 446 115.201 -1.073 -11.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 446 114.283 0.142 -10.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 446 115.564 0.561 -11.628 1.00 0.00 H new