USER MOD reduce.3.24.130724 H: found=0, std=0, add=578, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 581 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 424 THR OG1 : rot 142:sc= 1.2 USER MOD Set 1.2: A 426 ASN :FLIP amide:sc= 1.08 F(o=-1.7,f=2.3) USER MOD Set 2.1: A 394 LYS NZ :NH3+ -113:sc= -3.41! (180deg=-5.72!) USER MOD Set 2.2: A 396 HIS : no HE2:sc= -0.956 K(o=-4.4,f=-6) USER MOD Set 2.3: A 405 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 355 SER OG : rot 180:sc= 0.846 USER MOD Set 3.2: A 356 HIS : no HE2:sc= -0.263 K(o=0.58,f=-5.5!) USER MOD Single : A 357 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 362 THR OG1 : rot -61:sc= 0.714 USER MOD Single : A 363 GLN : amide:sc= -0.11 X(o=-0.11,f=-0.11) USER MOD Single : A 364 LYS NZ :NH3+ -167:sc= -0.0212 (180deg=-0.24) USER MOD Single : A 365 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 366 LYS NZ :NH3+ 167:sc= -0.0375 (180deg=-0.279) USER MOD Single : A 370 SER OG : rot -61:sc= 0.691 USER MOD Single : A 371 GLN :FLIP amide:sc= 0 F(o=-1.2!,f=0) USER MOD Single : A 372 GLN :FLIP amide:sc= 0 F(o=-1.1!,f=0) USER MOD Single : A 373 GLN : amide:sc=-0.00101 X(o=-0.001,f=0) USER MOD Single : A 377 THR OG1 : rot 180:sc= 0 USER MOD Single : A 380 SER OG : rot 180:sc= 0 USER MOD Single : A 382 ASN :FLIP amide:sc= -2.3 F(o=-6!,f=-2.3) USER MOD Single : A 383 LYS NZ :NH3+ 153:sc= -3.52! (180deg=-5.6!) USER MOD Single : A 384 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 386 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 387 ASN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 390 LYS NZ :NH3+ 167:sc= -0.0377 (180deg=-0.231) USER MOD Single : A 391 SER OG : rot 180:sc= 0 USER MOD Single : A 397 ASN : amide:sc= 0.448 K(o=0.45,f=-3.3!) USER MOD Single : A 401 ASN :FLIP amide:sc= -0.646 F(o=-4.1!,f=-0.65) USER MOD Single : A 402 LYS NZ :NH3+ 166:sc= -0.0522 (180deg=-0.291) USER MOD Single : A 403 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 408 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 412 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 413 LYS NZ :NH3+ 165:sc= -0.0419 (180deg=-0.319) USER MOD Single : A 418 THR OG1 : rot 4:sc= 0.621 USER MOD Single : A 420 LYS NZ :NH3+ 166:sc= -0.0301 (180deg=-0.282) USER MOD Single : A 423 LYS NZ :NH3+ -166:sc= -0.027 (180deg=-0.211) USER MOD Single : A 427 THR OG1 : rot 12:sc= 0.505 USER MOD Single : A 428 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 429 THR OG1 : rot 180:sc= 0 USER MOD Single : A 430 THR OG1 : rot 180:sc= 0 USER MOD Single : A 432 SER OG : rot 180:sc= 0 USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 354 26.658 -10.301 4.227 1.00 0.00 N ATOM 2 CA GLY A 354 25.463 -9.414 4.169 1.00 0.00 C ATOM 3 C GLY A 354 24.459 -9.858 3.123 1.00 0.00 C ATOM 4 O GLY A 354 23.930 -9.035 2.376 1.00 0.00 O ATOM 0 HA2 GLY A 354 24.980 -9.396 5.146 1.00 0.00 H new ATOM 0 HA3 GLY A 354 25.782 -8.394 3.952 1.00 0.00 H new ATOM 10 N SER A 355 24.200 -11.162 3.069 1.00 0.00 N ATOM 11 CA SER A 355 23.253 -11.721 2.107 1.00 0.00 C ATOM 12 C SER A 355 23.649 -11.340 0.678 1.00 0.00 C ATOM 13 O SER A 355 24.828 -11.379 0.327 1.00 0.00 O ATOM 14 CB SER A 355 21.834 -11.240 2.427 1.00 0.00 C ATOM 15 OG SER A 355 20.873 -11.907 1.624 1.00 0.00 O ATOM 0 H SER A 355 24.634 -11.853 3.681 1.00 0.00 H new ATOM 0 HA SER A 355 23.275 -12.808 2.183 1.00 0.00 H new ATOM 0 HB2 SER A 355 21.617 -11.416 3.481 1.00 0.00 H new ATOM 0 HB3 SER A 355 21.766 -10.165 2.263 1.00 0.00 H new ATOM 0 HG SER A 355 19.976 -11.582 1.850 1.00 0.00 H new ATOM 21 N HIS A 356 22.667 -10.971 -0.144 1.00 0.00 N ATOM 22 CA HIS A 356 22.934 -10.586 -1.526 1.00 0.00 C ATOM 23 C HIS A 356 23.789 -9.324 -1.583 1.00 0.00 C ATOM 24 O HIS A 356 23.468 -8.319 -0.947 1.00 0.00 O ATOM 25 CB HIS A 356 21.622 -10.358 -2.280 1.00 0.00 C ATOM 26 CG HIS A 356 20.749 -11.574 -2.358 1.00 0.00 C ATOM 27 ND1 HIS A 356 20.255 -12.219 -1.244 1.00 0.00 N ATOM 28 CD2 HIS A 356 20.279 -12.259 -3.427 1.00 0.00 C ATOM 29 CE1 HIS A 356 19.520 -13.249 -1.625 1.00 0.00 C ATOM 30 NE2 HIS A 356 19.517 -13.295 -2.944 1.00 0.00 N ATOM 0 H HIS A 356 21.683 -10.931 0.123 1.00 0.00 H new ATOM 0 HA HIS A 356 23.482 -11.399 -2.002 1.00 0.00 H new ATOM 0 HB2 HIS A 356 21.068 -9.556 -1.792 1.00 0.00 H new ATOM 0 HB3 HIS A 356 21.849 -10.020 -3.291 1.00 0.00 H new ATOM 0 HD1 HIS A 356 20.430 -11.944 -0.277 1.00 0.00 H new ATOM 0 HD2 HIS A 356 20.468 -12.033 -4.466 1.00 0.00 H new ATOM 0 HE1 HIS A 356 19.008 -13.937 -0.968 1.00 0.00 H new ATOM 39 N MET A 357 24.874 -9.381 -2.349 1.00 0.00 N ATOM 40 CA MET A 357 25.770 -8.237 -2.490 1.00 0.00 C ATOM 41 C MET A 357 25.248 -7.264 -3.546 1.00 0.00 C ATOM 42 O MET A 357 26.020 -6.691 -4.317 1.00 0.00 O ATOM 43 CB MET A 357 27.191 -8.696 -2.850 1.00 0.00 C ATOM 44 CG MET A 357 27.307 -9.387 -4.204 1.00 0.00 C ATOM 45 SD MET A 357 26.527 -11.013 -4.241 1.00 0.00 S ATOM 46 CE MET A 357 26.864 -11.512 -5.928 1.00 0.00 C ATOM 0 H MET A 357 25.154 -10.205 -2.881 1.00 0.00 H new ATOM 0 HA MET A 357 25.805 -7.721 -1.530 1.00 0.00 H new ATOM 0 HB2 MET A 357 27.853 -7.830 -2.840 1.00 0.00 H new ATOM 0 HB3 MET A 357 27.546 -9.377 -2.077 1.00 0.00 H new ATOM 0 HG2 MET A 357 26.852 -8.755 -4.967 1.00 0.00 H new ATOM 0 HG3 MET A 357 28.361 -9.491 -4.463 1.00 0.00 H new ATOM 0 HE1 MET A 357 26.443 -12.501 -6.106 1.00 0.00 H new ATOM 0 HE2 MET A 357 26.413 -10.797 -6.616 1.00 0.00 H new ATOM 0 HE3 MET A 357 27.941 -11.542 -6.090 1.00 0.00 H new ATOM 56 N LEU A 358 23.931 -7.082 -3.574 1.00 0.00 N ATOM 57 CA LEU A 358 23.301 -6.181 -4.533 1.00 0.00 C ATOM 58 C LEU A 358 23.736 -4.737 -4.300 1.00 0.00 C ATOM 59 O LEU A 358 23.762 -4.262 -3.164 1.00 0.00 O ATOM 60 CB LEU A 358 21.777 -6.288 -4.436 1.00 0.00 C ATOM 61 CG LEU A 358 21.202 -7.673 -4.743 1.00 0.00 C ATOM 62 CD1 LEU A 358 19.696 -7.683 -4.530 1.00 0.00 C ATOM 63 CD2 LEU A 358 21.539 -8.090 -6.168 1.00 0.00 C ATOM 0 H LEU A 358 23.279 -7.547 -2.943 1.00 0.00 H new ATOM 0 HA LEU A 358 23.620 -6.477 -5.532 1.00 0.00 H new ATOM 0 HB2 LEU A 358 21.471 -6.000 -3.430 1.00 0.00 H new ATOM 0 HB3 LEU A 358 21.333 -5.567 -5.123 1.00 0.00 H new ATOM 0 HG LEU A 358 21.654 -8.391 -4.059 1.00 0.00 H new ATOM 0 HD11 LEU A 358 19.304 -8.675 -4.753 1.00 0.00 H new ATOM 0 HD12 LEU A 358 19.473 -7.429 -3.494 1.00 0.00 H new ATOM 0 HD13 LEU A 358 19.230 -6.952 -5.191 1.00 0.00 H new ATOM 0 HD21 LEU A 358 21.122 -9.077 -6.367 1.00 0.00 H new ATOM 0 HD22 LEU A 358 21.116 -7.369 -6.868 1.00 0.00 H new ATOM 0 HD23 LEU A 358 22.622 -8.122 -6.291 1.00 0.00 H new ATOM 75 N GLU A 359 24.071 -4.045 -5.385 1.00 0.00 N ATOM 76 CA GLU A 359 24.499 -2.652 -5.304 1.00 0.00 C ATOM 77 C GLU A 359 23.380 -1.769 -4.762 1.00 0.00 C ATOM 78 O GLU A 359 22.216 -1.929 -5.130 1.00 0.00 O ATOM 79 CB GLU A 359 24.939 -2.150 -6.680 1.00 0.00 C ATOM 80 CG GLU A 359 26.132 -2.898 -7.258 1.00 0.00 C ATOM 81 CD GLU A 359 27.396 -2.715 -6.439 1.00 0.00 C ATOM 82 OE1 GLU A 359 27.404 -3.114 -5.255 1.00 0.00 O ATOM 83 OE2 GLU A 359 28.381 -2.173 -6.983 1.00 0.00 O ATOM 0 H GLU A 359 24.054 -4.426 -6.331 1.00 0.00 H new ATOM 0 HA GLU A 359 25.344 -2.598 -4.618 1.00 0.00 H new ATOM 0 HB2 GLU A 359 24.101 -2.234 -7.371 1.00 0.00 H new ATOM 0 HB3 GLU A 359 25.187 -1.091 -6.607 1.00 0.00 H new ATOM 0 HG2 GLU A 359 25.894 -3.960 -7.318 1.00 0.00 H new ATOM 0 HG3 GLU A 359 26.312 -2.554 -8.276 1.00 0.00 H new ATOM 90 N VAL A 360 23.737 -0.837 -3.888 1.00 0.00 N ATOM 91 CA VAL A 360 22.762 0.074 -3.300 1.00 0.00 C ATOM 92 C VAL A 360 22.157 0.992 -4.357 1.00 0.00 C ATOM 93 O VAL A 360 22.854 1.447 -5.266 1.00 0.00 O ATOM 94 CB VAL A 360 23.399 0.938 -2.193 1.00 0.00 C ATOM 95 CG1 VAL A 360 22.364 1.862 -1.569 1.00 0.00 C ATOM 96 CG2 VAL A 360 24.043 0.059 -1.132 1.00 0.00 C ATOM 0 H VAL A 360 24.695 -0.691 -3.570 1.00 0.00 H new ATOM 0 HA VAL A 360 21.975 -0.543 -2.866 1.00 0.00 H new ATOM 0 HB VAL A 360 24.176 1.554 -2.645 1.00 0.00 H new ATOM 0 HG11 VAL A 360 22.835 2.462 -0.791 1.00 0.00 H new ATOM 0 HG12 VAL A 360 21.954 2.519 -2.336 1.00 0.00 H new ATOM 0 HG13 VAL A 360 21.561 1.267 -1.133 1.00 0.00 H new ATOM 0 HG21 VAL A 360 24.487 0.687 -0.360 1.00 0.00 H new ATOM 0 HG22 VAL A 360 23.286 -0.585 -0.685 1.00 0.00 H new ATOM 0 HG23 VAL A 360 24.818 -0.555 -1.590 1.00 0.00 H new ATOM 106 N LEU A 361 20.858 1.263 -4.227 1.00 0.00 N ATOM 107 CA LEU A 361 20.145 2.136 -5.160 1.00 0.00 C ATOM 108 C LEU A 361 20.045 1.489 -6.542 1.00 0.00 C ATOM 109 O LEU A 361 20.978 0.822 -6.992 1.00 0.00 O ATOM 110 CB LEU A 361 20.848 3.503 -5.243 1.00 0.00 C ATOM 111 CG LEU A 361 20.030 4.657 -5.842 1.00 0.00 C ATOM 112 CD1 LEU A 361 19.830 4.477 -7.338 1.00 0.00 C ATOM 113 CD2 LEU A 361 18.686 4.783 -5.137 1.00 0.00 C ATOM 0 H LEU A 361 20.275 0.888 -3.479 1.00 0.00 H new ATOM 0 HA LEU A 361 19.131 2.288 -4.791 1.00 0.00 H new ATOM 0 HB2 LEU A 361 21.157 3.789 -4.238 1.00 0.00 H new ATOM 0 HB3 LEU A 361 21.756 3.385 -5.835 1.00 0.00 H new ATOM 0 HG LEU A 361 20.593 5.577 -5.688 1.00 0.00 H new ATOM 0 HD11 LEU A 361 19.247 5.311 -7.730 1.00 0.00 H new ATOM 0 HD12 LEU A 361 20.800 4.447 -7.834 1.00 0.00 H new ATOM 0 HD13 LEU A 361 19.299 3.544 -7.524 1.00 0.00 H new ATOM 0 HD21 LEU A 361 18.121 5.606 -5.575 1.00 0.00 H new ATOM 0 HD22 LEU A 361 18.126 3.855 -5.254 1.00 0.00 H new ATOM 0 HD23 LEU A 361 18.848 4.978 -4.077 1.00 0.00 H new ATOM 125 N THR A 362 18.899 1.691 -7.198 1.00 0.00 N ATOM 126 CA THR A 362 18.634 1.142 -8.533 1.00 0.00 C ATOM 127 C THR A 362 19.087 -0.312 -8.649 1.00 0.00 C ATOM 128 O THR A 362 19.716 -0.704 -9.634 1.00 0.00 O ATOM 129 CB THR A 362 19.287 1.987 -9.655 1.00 0.00 C ATOM 130 OG1 THR A 362 18.924 1.459 -10.936 1.00 0.00 O ATOM 131 CG2 THR A 362 20.805 2.017 -9.535 1.00 0.00 C ATOM 0 H THR A 362 18.127 2.240 -6.819 1.00 0.00 H new ATOM 0 HA THR A 362 17.553 1.181 -8.665 1.00 0.00 H new ATOM 0 HB THR A 362 18.920 3.008 -9.551 1.00 0.00 H new ATOM 0 HG1 THR A 362 19.248 0.537 -11.014 1.00 0.00 H new ATOM 0 HG21 THR A 362 21.222 2.620 -10.341 1.00 0.00 H new ATOM 0 HG22 THR A 362 21.086 2.451 -8.575 1.00 0.00 H new ATOM 0 HG23 THR A 362 21.195 1.002 -9.602 1.00 0.00 H new ATOM 139 N GLN A 363 18.753 -1.109 -7.638 1.00 0.00 N ATOM 140 CA GLN A 363 19.116 -2.523 -7.620 1.00 0.00 C ATOM 141 C GLN A 363 18.495 -3.216 -6.408 1.00 0.00 C ATOM 142 O GLN A 363 19.190 -3.844 -5.609 1.00 0.00 O ATOM 143 CB GLN A 363 20.641 -2.679 -7.600 1.00 0.00 C ATOM 144 CG GLN A 363 21.119 -4.113 -7.765 1.00 0.00 C ATOM 145 CD GLN A 363 20.700 -4.720 -9.090 1.00 0.00 C ATOM 146 OE1 GLN A 363 21.047 -4.211 -10.156 1.00 0.00 O ATOM 147 NE2 GLN A 363 19.950 -5.814 -9.030 1.00 0.00 N ATOM 0 H GLN A 363 18.230 -0.799 -6.819 1.00 0.00 H new ATOM 0 HA GLN A 363 18.729 -2.994 -8.524 1.00 0.00 H new ATOM 0 HB2 GLN A 363 21.069 -2.071 -8.397 1.00 0.00 H new ATOM 0 HB3 GLN A 363 21.024 -2.286 -6.658 1.00 0.00 H new ATOM 0 HG2 GLN A 363 22.206 -4.141 -7.684 1.00 0.00 H new ATOM 0 HG3 GLN A 363 20.723 -4.720 -6.951 1.00 0.00 H new ATOM 0 HE21 GLN A 363 19.686 -6.202 -8.125 1.00 0.00 H new ATOM 0 HE22 GLN A 363 19.638 -6.266 -9.889 1.00 0.00 H new ATOM 156 N LYS A 364 17.176 -3.088 -6.272 1.00 0.00 N ATOM 157 CA LYS A 364 16.459 -3.689 -5.160 1.00 0.00 C ATOM 158 C LYS A 364 15.242 -4.453 -5.666 1.00 0.00 C ATOM 159 O LYS A 364 15.096 -4.677 -6.867 1.00 0.00 O ATOM 160 CB LYS A 364 16.028 -2.609 -4.165 1.00 0.00 C ATOM 161 CG LYS A 364 17.182 -1.775 -3.633 1.00 0.00 C ATOM 162 CD LYS A 364 16.695 -0.687 -2.691 1.00 0.00 C ATOM 163 CE LYS A 364 17.847 0.165 -2.181 1.00 0.00 C ATOM 164 NZ LYS A 364 18.856 -0.645 -1.445 1.00 0.00 N ATOM 0 H LYS A 364 16.585 -2.571 -6.923 1.00 0.00 H new ATOM 0 HA LYS A 364 17.124 -4.389 -4.654 1.00 0.00 H new ATOM 0 HB2 LYS A 364 15.307 -1.950 -4.648 1.00 0.00 H new ATOM 0 HB3 LYS A 364 15.516 -3.082 -3.327 1.00 0.00 H new ATOM 0 HG2 LYS A 364 17.888 -2.420 -3.111 1.00 0.00 H new ATOM 0 HG3 LYS A 364 17.720 -1.322 -4.466 1.00 0.00 H new ATOM 0 HD2 LYS A 364 15.973 -0.054 -3.207 1.00 0.00 H new ATOM 0 HD3 LYS A 364 16.175 -1.141 -1.847 1.00 0.00 H new ATOM 0 HE2 LYS A 364 18.327 0.666 -3.022 1.00 0.00 H new ATOM 0 HE3 LYS A 364 17.459 0.944 -1.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 364 19.501 -0.012 -0.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 364 18.373 -1.271 -0.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 364 19.400 -1.219 -2.120 1.00 0.00 H new ATOM 178 N HIS A 365 14.374 -4.851 -4.742 1.00 0.00 N ATOM 179 CA HIS A 365 13.166 -5.591 -5.091 1.00 0.00 C ATOM 180 C HIS A 365 12.358 -4.864 -6.164 1.00 0.00 C ATOM 181 O HIS A 365 11.509 -5.465 -6.823 1.00 0.00 O ATOM 182 CB HIS A 365 12.299 -5.813 -3.850 1.00 0.00 C ATOM 183 CG HIS A 365 12.958 -6.654 -2.802 1.00 0.00 C ATOM 184 ND1 HIS A 365 13.360 -7.955 -3.023 1.00 0.00 N ATOM 185 CD2 HIS A 365 13.285 -6.375 -1.516 1.00 0.00 C ATOM 186 CE1 HIS A 365 13.904 -8.440 -1.920 1.00 0.00 C ATOM 187 NE2 HIS A 365 13.871 -7.501 -0.993 1.00 0.00 N ATOM 0 H HIS A 365 14.485 -4.673 -3.744 1.00 0.00 H new ATOM 0 HA HIS A 365 13.474 -6.557 -5.492 1.00 0.00 H new ATOM 0 HB2 HIS A 365 12.042 -4.846 -3.419 1.00 0.00 H new ATOM 0 HB3 HIS A 365 11.364 -6.287 -4.150 1.00 0.00 H new ATOM 0 HD2 HIS A 365 13.116 -5.442 -1.000 1.00 0.00 H new ATOM 0 HE1 HIS A 365 14.307 -9.435 -1.798 1.00 0.00 H new ATOM 0 HE2 HIS A 365 14.224 -7.597 -0.041 1.00 0.00 H new ATOM 196 N LYS A 366 12.627 -3.569 -6.337 1.00 0.00 N ATOM 197 CA LYS A 366 11.919 -2.769 -7.334 1.00 0.00 C ATOM 198 C LYS A 366 12.510 -1.359 -7.404 1.00 0.00 C ATOM 199 O LYS A 366 12.644 -0.685 -6.382 1.00 0.00 O ATOM 200 CB LYS A 366 10.423 -2.706 -6.993 1.00 0.00 C ATOM 201 CG LYS A 366 9.529 -2.282 -8.152 1.00 0.00 C ATOM 202 CD LYS A 366 9.663 -0.801 -8.471 1.00 0.00 C ATOM 203 CE LYS A 366 8.773 -0.400 -9.636 1.00 0.00 C ATOM 204 NZ LYS A 366 7.336 -0.674 -9.357 1.00 0.00 N ATOM 0 H LYS A 366 13.327 -3.055 -5.802 1.00 0.00 H new ATOM 0 HA LYS A 366 12.037 -3.240 -8.310 1.00 0.00 H new ATOM 0 HB2 LYS A 366 10.101 -3.687 -6.642 1.00 0.00 H new ATOM 0 HB3 LYS A 366 10.280 -2.009 -6.167 1.00 0.00 H new ATOM 0 HG2 LYS A 366 9.782 -2.866 -9.036 1.00 0.00 H new ATOM 0 HG3 LYS A 366 8.491 -2.507 -7.908 1.00 0.00 H new ATOM 0 HD2 LYS A 366 9.400 -0.213 -7.592 1.00 0.00 H new ATOM 0 HD3 LYS A 366 10.702 -0.571 -8.709 1.00 0.00 H new ATOM 0 HE2 LYS A 366 8.906 0.661 -9.846 1.00 0.00 H new ATOM 0 HE3 LYS A 366 9.079 -0.943 -10.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 366 6.747 -0.194 -10.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 366 7.163 -1.699 -9.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 366 7.093 -0.321 -8.409 1.00 0.00 H new ATOM 218 N PRO A 367 12.872 -0.892 -8.615 1.00 0.00 N ATOM 219 CA PRO A 367 13.451 0.439 -8.809 1.00 0.00 C ATOM 220 C PRO A 367 12.399 1.545 -8.812 1.00 0.00 C ATOM 221 O PRO A 367 11.361 1.425 -9.462 1.00 0.00 O ATOM 222 CB PRO A 367 14.109 0.326 -10.175 1.00 0.00 C ATOM 223 CG PRO A 367 13.276 -0.656 -10.915 1.00 0.00 C ATOM 224 CD PRO A 367 12.748 -1.626 -9.890 1.00 0.00 C ATOM 0 HA PRO A 367 14.134 0.710 -8.004 1.00 0.00 H new ATOM 0 HB2 PRO A 367 14.132 1.289 -10.684 1.00 0.00 H new ATOM 0 HB3 PRO A 367 15.141 -0.014 -10.090 1.00 0.00 H new ATOM 0 HG2 PRO A 367 12.458 -0.157 -11.435 1.00 0.00 H new ATOM 0 HG3 PRO A 367 13.866 -1.174 -11.671 1.00 0.00 H new ATOM 0 HD2 PRO A 367 11.713 -1.901 -10.095 1.00 0.00 H new ATOM 0 HD3 PRO A 367 13.326 -2.550 -9.878 1.00 0.00 H new ATOM 232 N ALA A 368 12.679 2.623 -8.088 1.00 0.00 N ATOM 233 CA ALA A 368 11.760 3.754 -8.010 1.00 0.00 C ATOM 234 C ALA A 368 12.408 4.941 -7.303 1.00 0.00 C ATOM 235 O ALA A 368 11.776 5.611 -6.485 1.00 0.00 O ATOM 236 CB ALA A 368 10.479 3.347 -7.296 1.00 0.00 C ATOM 0 H ALA A 368 13.535 2.738 -7.546 1.00 0.00 H new ATOM 0 HA ALA A 368 11.514 4.060 -9.027 1.00 0.00 H new ATOM 0 HB1 ALA A 368 9.804 4.201 -7.246 1.00 0.00 H new ATOM 0 HB2 ALA A 368 9.999 2.536 -7.844 1.00 0.00 H new ATOM 0 HB3 ALA A 368 10.716 3.012 -6.286 1.00 0.00 H new ATOM 242 N GLU A 369 13.672 5.194 -7.630 1.00 0.00 N ATOM 243 CA GLU A 369 14.415 6.301 -7.035 1.00 0.00 C ATOM 244 C GLU A 369 14.394 6.226 -5.510 1.00 0.00 C ATOM 245 O GLU A 369 14.313 7.250 -4.831 1.00 0.00 O ATOM 246 CB GLU A 369 13.837 7.638 -7.502 1.00 0.00 C ATOM 247 CG GLU A 369 13.904 7.837 -9.008 1.00 0.00 C ATOM 248 CD GLU A 369 13.348 9.177 -9.447 1.00 0.00 C ATOM 249 OE1 GLU A 369 12.900 9.951 -8.575 1.00 0.00 O ATOM 250 OE2 GLU A 369 13.360 9.454 -10.665 1.00 0.00 O ATOM 0 H GLU A 369 14.205 4.646 -8.306 1.00 0.00 H new ATOM 0 HA GLU A 369 15.451 6.224 -7.364 1.00 0.00 H new ATOM 0 HB2 GLU A 369 12.798 7.707 -7.181 1.00 0.00 H new ATOM 0 HB3 GLU A 369 14.377 8.449 -7.012 1.00 0.00 H new ATOM 0 HG2 GLU A 369 14.940 7.753 -9.335 1.00 0.00 H new ATOM 0 HG3 GLU A 369 13.349 7.039 -9.501 1.00 0.00 H new ATOM 257 N SER A 370 14.474 5.007 -4.980 1.00 0.00 N ATOM 258 CA SER A 370 14.470 4.794 -3.536 1.00 0.00 C ATOM 259 C SER A 370 13.274 5.480 -2.879 1.00 0.00 C ATOM 260 O SER A 370 13.420 6.177 -1.874 1.00 0.00 O ATOM 261 CB SER A 370 15.776 5.311 -2.923 1.00 0.00 C ATOM 262 OG SER A 370 15.815 5.074 -1.526 1.00 0.00 O ATOM 0 H SER A 370 14.542 4.151 -5.531 1.00 0.00 H new ATOM 0 HA SER A 370 14.387 3.723 -3.353 1.00 0.00 H new ATOM 0 HB2 SER A 370 16.624 4.822 -3.401 1.00 0.00 H new ATOM 0 HB3 SER A 370 15.874 6.379 -3.116 1.00 0.00 H new ATOM 0 HG SER A 370 15.072 5.544 -1.094 1.00 0.00 H new ATOM 268 N GLN A 371 12.090 5.279 -3.453 1.00 0.00 N ATOM 269 CA GLN A 371 10.872 5.882 -2.920 1.00 0.00 C ATOM 270 C GLN A 371 9.632 5.295 -3.585 1.00 0.00 C ATOM 271 O GLN A 371 9.608 5.069 -4.795 1.00 0.00 O ATOM 272 CB GLN A 371 10.897 7.400 -3.116 1.00 0.00 C ATOM 273 CG GLN A 371 9.665 8.106 -2.570 1.00 0.00 C ATOM 274 CD GLN A 371 9.694 9.611 -2.783 1.00 0.00 C ATOM 275 OE1 GLN A 371 10.764 10.113 -3.392 1.00 0.00 O flip ATOM 276 NE2 GLN A 371 8.761 10.316 -2.400 1.00 0.00 N flip ATOM 0 H GLN A 371 11.949 4.705 -4.284 1.00 0.00 H new ATOM 0 HA GLN A 371 10.829 5.660 -1.854 1.00 0.00 H new ATOM 0 HB2 GLN A 371 11.784 7.806 -2.629 1.00 0.00 H new ATOM 0 HB3 GLN A 371 10.989 7.619 -4.180 1.00 0.00 H new ATOM 0 HG2 GLN A 371 8.776 7.695 -3.049 1.00 0.00 H new ATOM 0 HG3 GLN A 371 9.578 7.898 -1.504 1.00 0.00 H new ATOM 0 HE21 GLN A 371 7.958 9.891 -1.937 1.00 0.00 H new ATOM 0 HE22 GLN A 371 8.791 11.325 -2.546 1.00 0.00 H new ATOM 285 N GLN A 372 8.601 5.052 -2.781 1.00 0.00 N ATOM 286 CA GLN A 372 7.349 4.493 -3.281 1.00 0.00 C ATOM 287 C GLN A 372 6.189 4.871 -2.367 1.00 0.00 C ATOM 288 O GLN A 372 6.321 4.863 -1.142 1.00 0.00 O ATOM 289 CB GLN A 372 7.450 2.970 -3.401 1.00 0.00 C ATOM 290 CG GLN A 372 7.758 2.271 -2.085 1.00 0.00 C ATOM 291 CD GLN A 372 7.855 0.761 -2.223 1.00 0.00 C ATOM 292 OE1 GLN A 372 7.704 0.255 -3.444 1.00 0.00 O flip ATOM 293 NE2 GLN A 372 8.068 0.052 -1.239 1.00 0.00 N flip ATOM 0 H GLN A 372 8.608 5.234 -1.777 1.00 0.00 H new ATOM 0 HA GLN A 372 7.162 4.910 -4.271 1.00 0.00 H new ATOM 0 HB2 GLN A 372 6.511 2.583 -3.797 1.00 0.00 H new ATOM 0 HB3 GLN A 372 8.227 2.722 -4.124 1.00 0.00 H new ATOM 0 HG2 GLN A 372 8.697 2.655 -1.687 1.00 0.00 H new ATOM 0 HG3 GLN A 372 6.981 2.515 -1.360 1.00 0.00 H new ATOM 0 HE21 GLN A 372 8.178 0.477 -0.318 1.00 0.00 H new ATOM 0 HE22 GLN A 372 8.134 -0.960 -1.345 1.00 0.00 H new ATOM 302 N GLN A 373 5.052 5.209 -2.968 1.00 0.00 N ATOM 303 CA GLN A 373 3.874 5.597 -2.210 1.00 0.00 C ATOM 304 C GLN A 373 2.628 4.873 -2.698 1.00 0.00 C ATOM 305 O GLN A 373 2.484 4.580 -3.885 1.00 0.00 O ATOM 306 CB GLN A 373 3.662 7.108 -2.280 1.00 0.00 C ATOM 307 CG GLN A 373 4.662 7.892 -1.452 1.00 0.00 C ATOM 308 CD GLN A 373 4.462 9.392 -1.554 1.00 0.00 C ATOM 309 OE1 GLN A 373 4.535 9.968 -2.640 1.00 0.00 O ATOM 310 NE2 GLN A 373 4.211 10.033 -0.419 1.00 0.00 N ATOM 0 H GLN A 373 4.925 5.221 -3.980 1.00 0.00 H new ATOM 0 HA GLN A 373 4.046 5.309 -1.173 1.00 0.00 H new ATOM 0 HB2 GLN A 373 3.729 7.430 -3.319 1.00 0.00 H new ATOM 0 HB3 GLN A 373 2.654 7.343 -1.938 1.00 0.00 H new ATOM 0 HG2 GLN A 373 4.579 7.589 -0.408 1.00 0.00 H new ATOM 0 HG3 GLN A 373 5.672 7.642 -1.777 1.00 0.00 H new ATOM 0 HE21 GLN A 373 4.159 9.515 0.458 1.00 0.00 H new ATOM 0 HE22 GLN A 373 4.070 11.043 -0.424 1.00 0.00 H new ATOM 319 N ALA A 374 1.730 4.593 -1.761 1.00 0.00 N ATOM 320 CA ALA A 374 0.483 3.905 -2.069 1.00 0.00 C ATOM 321 C ALA A 374 -0.342 4.692 -3.081 1.00 0.00 C ATOM 322 O ALA A 374 -0.337 5.923 -3.076 1.00 0.00 O ATOM 323 CB ALA A 374 -0.316 3.677 -0.796 1.00 0.00 C ATOM 0 H ALA A 374 1.844 4.834 -0.776 1.00 0.00 H new ATOM 0 HA ALA A 374 0.726 2.939 -2.512 1.00 0.00 H new ATOM 0 HB1 ALA A 374 -1.246 3.162 -1.037 1.00 0.00 H new ATOM 0 HB2 ALA A 374 0.267 3.068 -0.105 1.00 0.00 H new ATOM 0 HB3 ALA A 374 -0.543 4.637 -0.332 1.00 0.00 H new ATOM 329 N ALA A 375 -1.049 3.972 -3.948 1.00 0.00 N ATOM 330 CA ALA A 375 -1.884 4.599 -4.968 1.00 0.00 C ATOM 331 C ALA A 375 -3.198 5.081 -4.373 1.00 0.00 C ATOM 332 O ALA A 375 -4.279 4.655 -4.781 1.00 0.00 O ATOM 333 CB ALA A 375 -2.132 3.637 -6.121 1.00 0.00 C ATOM 0 H ALA A 375 -1.060 2.952 -3.964 1.00 0.00 H new ATOM 0 HA ALA A 375 -1.353 5.468 -5.356 1.00 0.00 H new ATOM 0 HB1 ALA A 375 -2.756 4.122 -6.872 1.00 0.00 H new ATOM 0 HB2 ALA A 375 -1.180 3.353 -6.569 1.00 0.00 H new ATOM 0 HB3 ALA A 375 -2.638 2.746 -5.749 1.00 0.00 H new ATOM 339 N GLU A 376 -3.086 5.968 -3.395 1.00 0.00 N ATOM 340 CA GLU A 376 -4.244 6.524 -2.710 1.00 0.00 C ATOM 341 C GLU A 376 -5.059 7.430 -3.620 1.00 0.00 C ATOM 342 O GLU A 376 -4.987 8.657 -3.542 1.00 0.00 O ATOM 343 CB GLU A 376 -3.799 7.285 -1.466 1.00 0.00 C ATOM 344 CG GLU A 376 -2.764 8.356 -1.758 1.00 0.00 C ATOM 345 CD GLU A 376 -2.161 8.952 -0.501 1.00 0.00 C ATOM 346 OE1 GLU A 376 -2.533 8.510 0.606 1.00 0.00 O ATOM 347 OE2 GLU A 376 -1.313 9.861 -0.623 1.00 0.00 O ATOM 0 H GLU A 376 -2.192 6.322 -3.054 1.00 0.00 H new ATOM 0 HA GLU A 376 -4.886 5.694 -2.415 1.00 0.00 H new ATOM 0 HB2 GLU A 376 -4.669 7.747 -1.000 1.00 0.00 H new ATOM 0 HB3 GLU A 376 -3.388 6.579 -0.744 1.00 0.00 H new ATOM 0 HG2 GLU A 376 -1.969 7.929 -2.369 1.00 0.00 H new ATOM 0 HG3 GLU A 376 -3.226 9.150 -2.345 1.00 0.00 H new ATOM 354 N THR A 377 -5.848 6.805 -4.469 1.00 0.00 N ATOM 355 CA THR A 377 -6.707 7.523 -5.394 1.00 0.00 C ATOM 356 C THR A 377 -8.035 6.807 -5.537 1.00 0.00 C ATOM 357 O THR A 377 -8.093 5.578 -5.548 1.00 0.00 O ATOM 358 CB THR A 377 -6.068 7.674 -6.784 1.00 0.00 C ATOM 359 OG1 THR A 377 -5.775 6.385 -7.334 1.00 0.00 O ATOM 360 CG2 THR A 377 -4.793 8.502 -6.710 1.00 0.00 C ATOM 0 H THR A 377 -5.914 5.790 -4.539 1.00 0.00 H new ATOM 0 HA THR A 377 -6.857 8.520 -4.979 1.00 0.00 H new ATOM 0 HB THR A 377 -6.779 8.190 -7.429 1.00 0.00 H new ATOM 0 HG1 THR A 377 -5.370 6.492 -8.220 1.00 0.00 H new ATOM 0 HG21 THR A 377 -4.361 8.594 -7.706 1.00 0.00 H new ATOM 0 HG22 THR A 377 -5.025 9.494 -6.322 1.00 0.00 H new ATOM 0 HG23 THR A 377 -4.079 8.012 -6.048 1.00 0.00 H new ATOM 368 N GLU A 378 -9.101 7.585 -5.639 1.00 0.00 N ATOM 369 CA GLU A 378 -10.437 7.027 -5.774 1.00 0.00 C ATOM 370 C GLU A 378 -10.497 6.094 -6.970 1.00 0.00 C ATOM 371 O GLU A 378 -11.148 5.051 -6.933 1.00 0.00 O ATOM 372 CB GLU A 378 -11.467 8.147 -5.932 1.00 0.00 C ATOM 373 CG GLU A 378 -12.904 7.654 -5.979 1.00 0.00 C ATOM 374 CD GLU A 378 -13.902 8.784 -6.142 1.00 0.00 C ATOM 375 OE1 GLU A 378 -13.818 9.508 -7.156 1.00 0.00 O ATOM 376 OE2 GLU A 378 -14.766 8.946 -5.254 1.00 0.00 O ATOM 0 H GLU A 378 -9.067 8.604 -5.631 1.00 0.00 H new ATOM 0 HA GLU A 378 -10.670 6.461 -4.872 1.00 0.00 H new ATOM 0 HB2 GLU A 378 -11.359 8.847 -5.103 1.00 0.00 H new ATOM 0 HB3 GLU A 378 -11.252 8.700 -6.846 1.00 0.00 H new ATOM 0 HG2 GLU A 378 -13.017 6.952 -6.805 1.00 0.00 H new ATOM 0 HG3 GLU A 378 -13.127 7.106 -5.063 1.00 0.00 H new ATOM 383 N GLY A 379 -9.812 6.488 -8.031 1.00 0.00 N ATOM 384 CA GLY A 379 -9.791 5.696 -9.241 1.00 0.00 C ATOM 385 C GLY A 379 -9.143 4.337 -9.071 1.00 0.00 C ATOM 386 O GLY A 379 -9.577 3.367 -9.687 1.00 0.00 O ATOM 0 H GLY A 379 -9.266 7.349 -8.075 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -10.814 5.559 -9.592 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -9.259 6.248 -10.016 1.00 0.00 H new ATOM 390 N SER A 380 -8.100 4.257 -8.252 1.00 0.00 N ATOM 391 CA SER A 380 -7.409 2.991 -8.042 1.00 0.00 C ATOM 392 C SER A 380 -8.189 2.070 -7.109 1.00 0.00 C ATOM 393 O SER A 380 -8.354 0.880 -7.384 1.00 0.00 O ATOM 394 CB SER A 380 -6.015 3.238 -7.479 1.00 0.00 C ATOM 395 OG SER A 380 -5.336 2.018 -7.236 1.00 0.00 O ATOM 0 H SER A 380 -7.718 5.044 -7.728 1.00 0.00 H new ATOM 0 HA SER A 380 -7.328 2.497 -9.010 1.00 0.00 H new ATOM 0 HB2 SER A 380 -5.440 3.844 -8.179 1.00 0.00 H new ATOM 0 HB3 SER A 380 -6.090 3.806 -6.552 1.00 0.00 H new ATOM 0 HG SER A 380 -4.444 2.206 -6.877 1.00 0.00 H new ATOM 401 N CYS A 381 -8.651 2.630 -6.001 1.00 0.00 N ATOM 402 CA CYS A 381 -9.395 1.870 -5.000 1.00 0.00 C ATOM 403 C CYS A 381 -10.645 1.214 -5.577 1.00 0.00 C ATOM 404 O CYS A 381 -10.889 0.029 -5.352 1.00 0.00 O ATOM 405 CB CYS A 381 -9.775 2.783 -3.841 1.00 0.00 C ATOM 406 SG CYS A 381 -8.345 3.488 -2.966 1.00 0.00 S ATOM 0 H CYS A 381 -8.524 3.615 -5.769 1.00 0.00 H new ATOM 0 HA CYS A 381 -8.745 1.069 -4.648 1.00 0.00 H new ATOM 0 HB2 CYS A 381 -10.395 3.596 -4.219 1.00 0.00 H new ATOM 0 HB3 CYS A 381 -10.383 2.221 -3.132 1.00 0.00 H new ATOM 411 N ASN A 382 -11.439 1.987 -6.310 1.00 0.00 N ATOM 412 CA ASN A 382 -12.668 1.470 -6.903 1.00 0.00 C ATOM 413 C ASN A 382 -12.393 0.217 -7.725 1.00 0.00 C ATOM 414 O ASN A 382 -13.240 -0.671 -7.823 1.00 0.00 O ATOM 415 CB ASN A 382 -13.326 2.533 -7.785 1.00 0.00 C ATOM 416 CG ASN A 382 -13.651 3.811 -7.032 1.00 0.00 C ATOM 417 OD1 ASN A 382 -13.342 3.842 -5.739 1.00 0.00 O flip ATOM 418 ND2 ASN A 382 -14.177 4.763 -7.608 1.00 0.00 N flip ATOM 0 H ASN A 382 -11.255 2.971 -6.508 1.00 0.00 H new ATOM 0 HA ASN A 382 -13.347 1.210 -6.090 1.00 0.00 H new ATOM 0 HB2 ASN A 382 -12.663 2.767 -8.618 1.00 0.00 H new ATOM 0 HB3 ASN A 382 -14.243 2.126 -8.212 1.00 0.00 H new ATOM 0 HD21 ASN A 382 -14.398 4.699 -8.602 1.00 0.00 H new ATOM 0 HD22 ASN A 382 -14.392 5.616 -7.092 1.00 0.00 H new ATOM 425 N LYS A 383 -11.206 0.156 -8.316 1.00 0.00 N ATOM 426 CA LYS A 383 -10.820 -0.984 -9.135 1.00 0.00 C ATOM 427 C LYS A 383 -10.483 -2.194 -8.272 1.00 0.00 C ATOM 428 O LYS A 383 -10.804 -3.329 -8.628 1.00 0.00 O ATOM 429 CB LYS A 383 -9.626 -0.613 -10.014 1.00 0.00 C ATOM 430 CG LYS A 383 -9.836 0.670 -10.803 1.00 0.00 C ATOM 431 CD LYS A 383 -11.051 0.592 -11.720 1.00 0.00 C ATOM 432 CE LYS A 383 -10.833 -0.368 -12.883 1.00 0.00 C ATOM 433 NZ LYS A 383 -10.707 -1.782 -12.434 1.00 0.00 N ATOM 0 H LYS A 383 -10.495 0.883 -8.243 1.00 0.00 H new ATOM 0 HA LYS A 383 -11.665 -1.250 -9.770 1.00 0.00 H new ATOM 0 HB2 LYS A 383 -8.741 -0.505 -9.386 1.00 0.00 H new ATOM 0 HB3 LYS A 383 -9.427 -1.430 -10.708 1.00 0.00 H new ATOM 0 HG2 LYS A 383 -9.958 1.504 -10.111 1.00 0.00 H new ATOM 0 HG3 LYS A 383 -8.947 0.878 -11.398 1.00 0.00 H new ATOM 0 HD2 LYS A 383 -11.919 0.271 -11.144 1.00 0.00 H new ATOM 0 HD3 LYS A 383 -11.276 1.585 -12.108 1.00 0.00 H new ATOM 0 HE2 LYS A 383 -11.666 -0.284 -13.581 1.00 0.00 H new ATOM 0 HE3 LYS A 383 -9.932 -0.080 -13.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 383 -11.013 -2.417 -13.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 383 -9.715 -1.983 -12.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 383 -11.304 -1.935 -11.597 1.00 0.00 H new ATOM 447 N LYS A 384 -9.816 -1.949 -7.146 1.00 0.00 N ATOM 448 CA LYS A 384 -9.417 -3.009 -6.243 1.00 0.00 C ATOM 449 C LYS A 384 -10.596 -3.842 -5.775 1.00 0.00 C ATOM 450 O LYS A 384 -11.738 -3.640 -6.188 1.00 0.00 O ATOM 451 CB LYS A 384 -8.713 -2.405 -5.037 1.00 0.00 C ATOM 452 CG LYS A 384 -7.629 -1.419 -5.416 1.00 0.00 C ATOM 453 CD LYS A 384 -6.550 -2.066 -6.268 1.00 0.00 C ATOM 454 CE LYS A 384 -6.858 -1.967 -7.755 1.00 0.00 C ATOM 455 NZ LYS A 384 -5.710 -2.414 -8.592 1.00 0.00 N ATOM 0 H LYS A 384 -9.542 -1.015 -6.842 1.00 0.00 H new ATOM 0 HA LYS A 384 -8.744 -3.671 -6.788 1.00 0.00 H new ATOM 0 HB2 LYS A 384 -9.448 -1.904 -4.408 1.00 0.00 H new ATOM 0 HB3 LYS A 384 -8.276 -3.205 -4.440 1.00 0.00 H new ATOM 0 HG2 LYS A 384 -8.071 -0.585 -5.961 1.00 0.00 H new ATOM 0 HG3 LYS A 384 -7.180 -1.007 -4.512 1.00 0.00 H new ATOM 0 HD2 LYS A 384 -5.592 -1.587 -6.064 1.00 0.00 H new ATOM 0 HD3 LYS A 384 -6.448 -3.115 -5.988 1.00 0.00 H new ATOM 0 HE2 LYS A 384 -7.733 -2.574 -7.985 1.00 0.00 H new ATOM 0 HE3 LYS A 384 -7.110 -0.937 -8.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 384 -5.961 -2.331 -9.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 384 -4.881 -1.818 -8.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 384 -5.485 -3.405 -8.372 1.00 0.00 H new ATOM 469 N ASP A 385 -10.291 -4.773 -4.892 1.00 0.00 N ATOM 470 CA ASP A 385 -11.286 -5.660 -4.316 1.00 0.00 C ATOM 471 C ASP A 385 -10.921 -5.962 -2.870 1.00 0.00 C ATOM 472 O ASP A 385 -10.238 -5.170 -2.225 1.00 0.00 O ATOM 473 CB ASP A 385 -11.373 -6.961 -5.118 1.00 0.00 C ATOM 474 CG ASP A 385 -11.879 -6.748 -6.533 1.00 0.00 C ATOM 475 OD1 ASP A 385 -11.184 -6.074 -7.320 1.00 0.00 O ATOM 476 OD2 ASP A 385 -12.974 -7.257 -6.852 1.00 0.00 O ATOM 0 H ASP A 385 -9.343 -4.937 -4.552 1.00 0.00 H new ATOM 0 HA ASP A 385 -12.259 -5.170 -4.349 1.00 0.00 H new ATOM 0 HB2 ASP A 385 -10.388 -7.426 -5.156 1.00 0.00 H new ATOM 0 HB3 ASP A 385 -12.034 -7.657 -4.602 1.00 0.00 H new ATOM 481 N GLN A 386 -11.356 -7.105 -2.360 1.00 0.00 N ATOM 482 CA GLN A 386 -11.041 -7.476 -0.989 1.00 0.00 C ATOM 483 C GLN A 386 -9.535 -7.649 -0.828 1.00 0.00 C ATOM 484 O GLN A 386 -8.899 -6.959 -0.030 1.00 0.00 O ATOM 485 CB GLN A 386 -11.765 -8.770 -0.609 1.00 0.00 C ATOM 486 CG GLN A 386 -11.574 -9.175 0.843 1.00 0.00 C ATOM 487 CD GLN A 386 -12.304 -10.459 1.189 1.00 0.00 C ATOM 488 OE1 GLN A 386 -12.028 -11.516 0.623 1.00 0.00 O ATOM 489 NE2 GLN A 386 -13.246 -10.372 2.121 1.00 0.00 N ATOM 0 H GLN A 386 -11.922 -7.785 -2.868 1.00 0.00 H new ATOM 0 HA GLN A 386 -11.378 -6.681 -0.324 1.00 0.00 H new ATOM 0 HB2 GLN A 386 -12.830 -8.651 -0.806 1.00 0.00 H new ATOM 0 HB3 GLN A 386 -11.410 -9.576 -1.251 1.00 0.00 H new ATOM 0 HG2 GLN A 386 -10.510 -9.300 1.045 1.00 0.00 H new ATOM 0 HG3 GLN A 386 -11.929 -8.373 1.490 1.00 0.00 H new ATOM 0 HE21 GLN A 386 -13.443 -9.475 2.565 1.00 0.00 H new ATOM 0 HE22 GLN A 386 -13.773 -11.202 2.393 1.00 0.00 H new ATOM 498 N ASN A 387 -8.974 -8.569 -1.606 1.00 0.00 N ATOM 499 CA ASN A 387 -7.552 -8.850 -1.577 1.00 0.00 C ATOM 500 C ASN A 387 -6.735 -7.753 -2.252 1.00 0.00 C ATOM 501 O ASN A 387 -5.567 -7.961 -2.581 1.00 0.00 O ATOM 502 CB ASN A 387 -7.298 -10.169 -2.290 1.00 0.00 C ATOM 503 CG ASN A 387 -7.688 -11.372 -1.458 1.00 0.00 C ATOM 504 OD1 ASN A 387 -8.838 -11.510 -1.038 1.00 0.00 O ATOM 505 ND2 ASN A 387 -6.726 -12.252 -1.223 1.00 0.00 N ATOM 0 H ASN A 387 -9.496 -9.138 -2.272 1.00 0.00 H new ATOM 0 HA ASN A 387 -7.240 -8.901 -0.534 1.00 0.00 H new ATOM 0 HB2 ASN A 387 -7.857 -10.184 -3.226 1.00 0.00 H new ATOM 0 HB3 ASN A 387 -6.241 -10.239 -2.548 1.00 0.00 H new ATOM 0 HD21 ASN A 387 -6.923 -13.088 -0.673 1.00 0.00 H new ATOM 0 HD22 ASN A 387 -5.789 -12.094 -1.592 1.00 0.00 H new ATOM 512 N GLU A 388 -7.343 -6.592 -2.465 1.00 0.00 N ATOM 513 CA GLU A 388 -6.641 -5.490 -3.111 1.00 0.00 C ATOM 514 C GLU A 388 -7.045 -4.149 -2.518 1.00 0.00 C ATOM 515 O GLU A 388 -6.508 -3.109 -2.902 1.00 0.00 O ATOM 516 CB GLU A 388 -6.905 -5.498 -4.619 1.00 0.00 C ATOM 517 CG GLU A 388 -6.538 -6.814 -5.292 1.00 0.00 C ATOM 518 CD GLU A 388 -6.619 -6.743 -6.805 1.00 0.00 C ATOM 519 OE1 GLU A 388 -6.967 -5.666 -7.333 1.00 0.00 O ATOM 520 OE2 GLU A 388 -6.335 -7.767 -7.461 1.00 0.00 O ATOM 0 H GLU A 388 -8.308 -6.390 -2.204 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.574 -5.630 -2.935 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -7.960 -5.290 -4.796 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.339 -4.691 -5.084 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -5.527 -7.097 -5.000 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -7.204 -7.598 -4.933 1.00 0.00 H new ATOM 527 N CYS A 389 -7.977 -4.168 -1.571 1.00 0.00 N ATOM 528 CA CYS A 389 -8.408 -2.934 -0.933 1.00 0.00 C ATOM 529 C CYS A 389 -7.254 -2.388 -0.098 1.00 0.00 C ATOM 530 O CYS A 389 -6.981 -2.872 1.001 1.00 0.00 O ATOM 531 CB CYS A 389 -9.651 -3.178 -0.073 1.00 0.00 C ATOM 532 SG CYS A 389 -10.586 -1.668 0.340 1.00 0.00 S ATOM 0 H CYS A 389 -8.441 -5.011 -1.234 1.00 0.00 H new ATOM 0 HA CYS A 389 -8.680 -2.199 -1.691 1.00 0.00 H new ATOM 0 HB2 CYS A 389 -10.312 -3.868 -0.598 1.00 0.00 H new ATOM 0 HB3 CYS A 389 -9.348 -3.668 0.852 1.00 0.00 H new ATOM 537 N LYS A 390 -6.552 -1.405 -0.655 1.00 0.00 N ATOM 538 CA LYS A 390 -5.386 -0.814 0.001 1.00 0.00 C ATOM 539 C LYS A 390 -5.759 0.018 1.224 1.00 0.00 C ATOM 540 O LYS A 390 -6.917 0.390 1.413 1.00 0.00 O ATOM 541 CB LYS A 390 -4.606 0.030 -1.001 1.00 0.00 C ATOM 542 CG LYS A 390 -4.072 -0.773 -2.179 1.00 0.00 C ATOM 543 CD LYS A 390 -3.313 0.106 -3.162 1.00 0.00 C ATOM 544 CE LYS A 390 -2.067 0.711 -2.532 1.00 0.00 C ATOM 545 NZ LYS A 390 -1.104 -0.333 -2.085 1.00 0.00 N ATOM 0 H LYS A 390 -6.771 -0.998 -1.564 1.00 0.00 H new ATOM 0 HA LYS A 390 -4.762 -1.632 0.359 1.00 0.00 H new ATOM 0 HB2 LYS A 390 -5.251 0.825 -1.375 1.00 0.00 H new ATOM 0 HB3 LYS A 390 -3.772 0.510 -0.489 1.00 0.00 H new ATOM 0 HG2 LYS A 390 -3.414 -1.562 -1.813 1.00 0.00 H new ATOM 0 HG3 LYS A 390 -4.901 -1.261 -2.692 1.00 0.00 H new ATOM 0 HD2 LYS A 390 -3.030 -0.484 -4.034 1.00 0.00 H new ATOM 0 HD3 LYS A 390 -3.966 0.904 -3.515 1.00 0.00 H new ATOM 0 HE2 LYS A 390 -1.580 1.369 -3.252 1.00 0.00 H new ATOM 0 HE3 LYS A 390 -2.354 1.327 -1.680 1.00 0.00 H new ATOM 0 HZ1 LYS A 390 -0.188 0.110 -1.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 390 -1.472 -0.803 -1.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 390 -0.978 -1.036 -2.841 1.00 0.00 H new ATOM 559 N SER A 391 -4.755 0.286 2.062 1.00 0.00 N ATOM 560 CA SER A 391 -4.943 1.056 3.291 1.00 0.00 C ATOM 561 C SER A 391 -5.682 2.370 3.034 1.00 0.00 C ATOM 562 O SER A 391 -6.696 2.640 3.678 1.00 0.00 O ATOM 563 CB SER A 391 -3.593 1.333 3.959 1.00 0.00 C ATOM 564 OG SER A 391 -3.758 2.078 5.154 1.00 0.00 O ATOM 0 H SER A 391 -3.795 -0.023 1.908 1.00 0.00 H new ATOM 0 HA SER A 391 -5.559 0.455 3.960 1.00 0.00 H new ATOM 0 HB2 SER A 391 -3.093 0.390 4.181 1.00 0.00 H new ATOM 0 HB3 SER A 391 -2.949 1.881 3.271 1.00 0.00 H new ATOM 0 HG SER A 391 -2.882 2.240 5.562 1.00 0.00 H new ATOM 570 N PRO A 392 -5.211 3.209 2.085 1.00 0.00 N ATOM 571 CA PRO A 392 -5.870 4.478 1.768 1.00 0.00 C ATOM 572 C PRO A 392 -7.333 4.259 1.419 1.00 0.00 C ATOM 573 O PRO A 392 -8.188 5.108 1.675 1.00 0.00 O ATOM 574 CB PRO A 392 -5.095 4.984 0.541 1.00 0.00 C ATOM 575 CG PRO A 392 -4.383 3.789 0.017 1.00 0.00 C ATOM 576 CD PRO A 392 -4.026 3.008 1.233 1.00 0.00 C ATOM 0 HA PRO A 392 -5.861 5.179 2.603 1.00 0.00 H new ATOM 0 HB2 PRO A 392 -5.769 5.402 -0.207 1.00 0.00 H new ATOM 0 HB3 PRO A 392 -4.394 5.773 0.814 1.00 0.00 H new ATOM 0 HG2 PRO A 392 -5.018 3.211 -0.654 1.00 0.00 H new ATOM 0 HG3 PRO A 392 -3.495 4.072 -0.549 1.00 0.00 H new ATOM 0 HD2 PRO A 392 -3.860 1.955 1.007 1.00 0.00 H new ATOM 0 HD3 PRO A 392 -3.117 3.380 1.705 1.00 0.00 H new ATOM 584 N CYS A 393 -7.599 3.103 0.827 1.00 0.00 N ATOM 585 CA CYS A 393 -8.943 2.728 0.422 1.00 0.00 C ATOM 586 C CYS A 393 -9.751 2.212 1.608 1.00 0.00 C ATOM 587 O CYS A 393 -9.206 1.606 2.530 1.00 0.00 O ATOM 588 CB CYS A 393 -8.875 1.641 -0.642 1.00 0.00 C ATOM 589 SG CYS A 393 -7.613 1.922 -1.924 1.00 0.00 S ATOM 0 H CYS A 393 -6.890 2.401 0.615 1.00 0.00 H new ATOM 0 HA CYS A 393 -9.434 3.615 0.022 1.00 0.00 H new ATOM 0 HB2 CYS A 393 -8.676 0.686 -0.156 1.00 0.00 H new ATOM 0 HB3 CYS A 393 -9.850 1.557 -1.121 1.00 0.00 H new ATOM 594 N LYS A 394 -11.058 2.437 1.561 1.00 0.00 N ATOM 595 CA LYS A 394 -11.954 1.974 2.614 1.00 0.00 C ATOM 596 C LYS A 394 -12.686 0.717 2.172 1.00 0.00 C ATOM 597 O LYS A 394 -13.363 0.711 1.144 1.00 0.00 O ATOM 598 CB LYS A 394 -12.973 3.054 2.982 1.00 0.00 C ATOM 599 CG LYS A 394 -12.382 4.250 3.705 1.00 0.00 C ATOM 600 CD LYS A 394 -13.465 5.190 4.222 1.00 0.00 C ATOM 601 CE LYS A 394 -14.254 5.837 3.090 1.00 0.00 C ATOM 602 NZ LYS A 394 -15.122 4.862 2.372 1.00 0.00 N ATOM 0 H LYS A 394 -11.522 2.938 0.804 1.00 0.00 H new ATOM 0 HA LYS A 394 -11.348 1.750 3.492 1.00 0.00 H new ATOM 0 HB2 LYS A 394 -13.463 3.400 2.072 1.00 0.00 H new ATOM 0 HB3 LYS A 394 -13.745 2.610 3.610 1.00 0.00 H new ATOM 0 HG2 LYS A 394 -11.771 3.905 4.539 1.00 0.00 H new ATOM 0 HG3 LYS A 394 -11.721 4.793 3.029 1.00 0.00 H new ATOM 0 HD2 LYS A 394 -14.147 4.636 4.867 1.00 0.00 H new ATOM 0 HD3 LYS A 394 -13.007 5.967 4.834 1.00 0.00 H new ATOM 0 HE2 LYS A 394 -14.871 6.640 3.494 1.00 0.00 H new ATOM 0 HE3 LYS A 394 -13.561 6.292 2.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 394 -14.772 4.735 1.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 394 -15.103 3.949 2.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 394 -16.098 5.221 2.344 1.00 0.00 H new ATOM 616 N TRP A 395 -12.554 -0.346 2.956 1.00 0.00 N ATOM 617 CA TRP A 395 -13.215 -1.602 2.639 1.00 0.00 C ATOM 618 C TRP A 395 -14.668 -1.576 3.103 1.00 0.00 C ATOM 619 O TRP A 395 -14.970 -1.097 4.196 1.00 0.00 O ATOM 620 CB TRP A 395 -12.479 -2.779 3.279 1.00 0.00 C ATOM 621 CG TRP A 395 -13.083 -4.109 2.942 1.00 0.00 C ATOM 622 CD1 TRP A 395 -13.441 -5.091 3.819 1.00 0.00 C ATOM 623 CD2 TRP A 395 -13.398 -4.604 1.633 1.00 0.00 C ATOM 624 NE1 TRP A 395 -13.964 -6.164 3.139 1.00 0.00 N ATOM 625 CE2 TRP A 395 -13.946 -5.891 1.796 1.00 0.00 C ATOM 626 CE3 TRP A 395 -13.270 -4.086 0.338 1.00 0.00 C ATOM 627 CZ2 TRP A 395 -14.366 -6.664 0.718 1.00 0.00 C ATOM 628 CZ3 TRP A 395 -13.688 -4.856 -0.730 1.00 0.00 C ATOM 629 CH2 TRP A 395 -14.230 -6.132 -0.535 1.00 0.00 C ATOM 0 H TRP A 395 -11.998 -0.362 3.811 1.00 0.00 H new ATOM 0 HA TRP A 395 -13.196 -1.729 1.557 1.00 0.00 H new ATOM 0 HB2 TRP A 395 -11.438 -2.768 2.955 1.00 0.00 H new ATOM 0 HB3 TRP A 395 -12.477 -2.652 4.362 1.00 0.00 H new ATOM 0 HD1 TRP A 395 -13.329 -5.033 4.892 1.00 0.00 H new ATOM 0 HE1 TRP A 395 -14.310 -7.024 3.564 1.00 0.00 H new ATOM 0 HE3 TRP A 395 -12.852 -3.103 0.177 1.00 0.00 H new ATOM 0 HZ2 TRP A 395 -14.784 -7.649 0.865 1.00 0.00 H new ATOM 0 HZ3 TRP A 395 -13.595 -4.467 -1.733 1.00 0.00 H new ATOM 0 HH2 TRP A 395 -14.547 -6.708 -1.391 1.00 0.00 H new ATOM 640 N HIS A 396 -15.563 -2.095 2.268 1.00 0.00 N ATOM 641 CA HIS A 396 -16.982 -2.130 2.602 1.00 0.00 C ATOM 642 C HIS A 396 -17.541 -3.540 2.458 1.00 0.00 C ATOM 643 O HIS A 396 -17.595 -4.092 1.356 1.00 0.00 O ATOM 644 CB HIS A 396 -17.758 -1.159 1.711 1.00 0.00 C ATOM 645 CG HIS A 396 -17.343 0.268 1.884 1.00 0.00 C ATOM 646 ND1 HIS A 396 -17.436 0.937 3.088 1.00 0.00 N ATOM 647 CD2 HIS A 396 -16.826 1.156 1.003 1.00 0.00 C ATOM 648 CE1 HIS A 396 -16.997 2.173 2.938 1.00 0.00 C ATOM 649 NE2 HIS A 396 -16.620 2.332 1.683 1.00 0.00 N ATOM 0 H HIS A 396 -15.332 -2.495 1.359 1.00 0.00 H new ATOM 0 HA HIS A 396 -17.095 -1.824 3.642 1.00 0.00 H new ATOM 0 HB2 HIS A 396 -17.621 -1.446 0.668 1.00 0.00 H new ATOM 0 HB3 HIS A 396 -18.822 -1.249 1.929 1.00 0.00 H new ATOM 0 HD1 HIS A 396 -17.789 0.538 3.958 1.00 0.00 H new ATOM 0 HD2 HIS A 396 -16.615 0.974 -0.040 1.00 0.00 H new ATOM 0 HE1 HIS A 396 -16.954 2.926 3.711 1.00 0.00 H new ATOM 658 N ASN A 397 -17.952 -4.116 3.585 1.00 0.00 N ATOM 659 CA ASN A 397 -18.508 -5.463 3.609 1.00 0.00 C ATOM 660 C ASN A 397 -20.010 -5.444 3.345 1.00 0.00 C ATOM 661 O ASN A 397 -20.720 -4.548 3.804 1.00 0.00 O ATOM 662 CB ASN A 397 -18.223 -6.129 4.956 1.00 0.00 C ATOM 663 CG ASN A 397 -18.821 -5.361 6.119 1.00 0.00 C ATOM 664 OD1 ASN A 397 -18.485 -4.199 6.348 1.00 0.00 O ATOM 665 ND2 ASN A 397 -19.712 -6.009 6.861 1.00 0.00 N ATOM 0 H ASN A 397 -17.909 -3.665 4.499 1.00 0.00 H new ATOM 0 HA ASN A 397 -18.030 -6.038 2.816 1.00 0.00 H new ATOM 0 HB2 ASN A 397 -18.624 -7.143 4.949 1.00 0.00 H new ATOM 0 HB3 ASN A 397 -17.145 -6.213 5.096 1.00 0.00 H new ATOM 0 HD21 ASN A 397 -20.148 -5.544 7.657 1.00 0.00 H new ATOM 0 HD22 ASN A 397 -19.961 -6.972 6.634 1.00 0.00 H new ATOM 672 N ASP A 398 -20.485 -6.441 2.604 1.00 0.00 N ATOM 673 CA ASP A 398 -21.902 -6.554 2.271 1.00 0.00 C ATOM 674 C ASP A 398 -22.378 -5.305 1.533 1.00 0.00 C ATOM 675 O ASP A 398 -23.490 -4.822 1.747 1.00 0.00 O ATOM 676 CB ASP A 398 -22.731 -6.775 3.542 1.00 0.00 C ATOM 677 CG ASP A 398 -24.112 -7.337 3.255 1.00 0.00 C ATOM 678 OD1 ASP A 398 -24.897 -6.671 2.548 1.00 0.00 O ATOM 679 OD2 ASP A 398 -24.409 -8.450 3.738 1.00 0.00 O ATOM 0 H ASP A 398 -19.905 -7.187 2.220 1.00 0.00 H new ATOM 0 HA ASP A 398 -22.037 -7.414 1.615 1.00 0.00 H new ATOM 0 HB2 ASP A 398 -22.197 -7.457 4.204 1.00 0.00 H new ATOM 0 HB3 ASP A 398 -22.832 -5.829 4.073 1.00 0.00 H new ATOM 684 N ALA A 399 -21.526 -4.791 0.654 1.00 0.00 N ATOM 685 CA ALA A 399 -21.852 -3.606 -0.129 1.00 0.00 C ATOM 686 C ALA A 399 -22.640 -3.988 -1.372 1.00 0.00 C ATOM 687 O ALA A 399 -22.370 -3.491 -2.467 1.00 0.00 O ATOM 688 CB ALA A 399 -20.582 -2.878 -0.520 1.00 0.00 C ATOM 0 H ALA A 399 -20.601 -5.178 0.465 1.00 0.00 H new ATOM 0 HA ALA A 399 -22.468 -2.945 0.481 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -20.835 -1.994 -1.105 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -20.044 -2.577 0.379 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -19.952 -3.539 -1.116 1.00 0.00 H new ATOM 694 N GLU A 400 -23.591 -4.901 -1.194 1.00 0.00 N ATOM 695 CA GLU A 400 -24.418 -5.403 -2.289 1.00 0.00 C ATOM 696 C GLU A 400 -23.607 -6.366 -3.149 1.00 0.00 C ATOM 697 O GLU A 400 -24.161 -7.201 -3.865 1.00 0.00 O ATOM 698 CB GLU A 400 -24.970 -4.256 -3.142 1.00 0.00 C ATOM 699 CG GLU A 400 -25.833 -3.274 -2.363 1.00 0.00 C ATOM 700 CD GLU A 400 -27.092 -3.910 -1.801 1.00 0.00 C ATOM 701 OE1 GLU A 400 -26.973 -4.834 -0.970 1.00 0.00 O ATOM 702 OE2 GLU A 400 -28.197 -3.482 -2.193 1.00 0.00 O ATOM 0 H GLU A 400 -23.810 -5.314 -0.287 1.00 0.00 H new ATOM 0 HA GLU A 400 -25.268 -5.934 -1.861 1.00 0.00 H new ATOM 0 HB2 GLU A 400 -24.137 -3.716 -3.592 1.00 0.00 H new ATOM 0 HB3 GLU A 400 -25.558 -4.673 -3.959 1.00 0.00 H new ATOM 0 HG2 GLU A 400 -25.248 -2.854 -1.545 1.00 0.00 H new ATOM 0 HG3 GLU A 400 -26.110 -2.446 -3.015 1.00 0.00 H new ATOM 709 N ASN A 401 -22.286 -6.238 -3.053 1.00 0.00 N ATOM 710 CA ASN A 401 -21.359 -7.080 -3.792 1.00 0.00 C ATOM 711 C ASN A 401 -19.923 -6.694 -3.451 1.00 0.00 C ATOM 712 O ASN A 401 -19.017 -6.836 -4.271 1.00 0.00 O ATOM 713 CB ASN A 401 -21.605 -6.950 -5.297 1.00 0.00 C ATOM 714 CG ASN A 401 -21.409 -5.536 -5.824 1.00 0.00 C ATOM 715 OD1 ASN A 401 -21.133 -4.587 -4.934 1.00 0.00 O flip ATOM 716 ND2 ASN A 401 -21.515 -5.296 -7.027 1.00 0.00 N flip ATOM 0 H ASN A 401 -21.831 -5.545 -2.459 1.00 0.00 H new ATOM 0 HA ASN A 401 -21.521 -8.119 -3.507 1.00 0.00 H new ATOM 0 HB2 ASN A 401 -20.931 -7.623 -5.827 1.00 0.00 H new ATOM 0 HB3 ASN A 401 -22.621 -7.275 -5.520 1.00 0.00 H new ATOM 0 HD21 ASN A 401 -21.728 -6.050 -7.681 1.00 0.00 H new ATOM 0 HD22 ASN A 401 -21.390 -4.344 -7.370 1.00 0.00 H new ATOM 723 N LYS A 402 -19.739 -6.198 -2.224 1.00 0.00 N ATOM 724 CA LYS A 402 -18.429 -5.771 -1.740 1.00 0.00 C ATOM 725 C LYS A 402 -17.891 -4.611 -2.572 1.00 0.00 C ATOM 726 O LYS A 402 -17.968 -4.630 -3.800 1.00 0.00 O ATOM 727 CB LYS A 402 -17.440 -6.940 -1.765 1.00 0.00 C ATOM 728 CG LYS A 402 -17.861 -8.115 -0.896 1.00 0.00 C ATOM 729 CD LYS A 402 -17.998 -7.713 0.565 1.00 0.00 C ATOM 730 CE LYS A 402 -18.399 -8.895 1.434 1.00 0.00 C ATOM 731 NZ LYS A 402 -17.397 -9.995 1.374 1.00 0.00 N ATOM 0 H LYS A 402 -20.491 -6.083 -1.544 1.00 0.00 H new ATOM 0 HA LYS A 402 -18.546 -5.431 -0.711 1.00 0.00 H new ATOM 0 HB2 LYS A 402 -17.323 -7.283 -2.793 1.00 0.00 H new ATOM 0 HB3 LYS A 402 -16.464 -6.586 -1.434 1.00 0.00 H new ATOM 0 HG2 LYS A 402 -18.811 -8.511 -1.255 1.00 0.00 H new ATOM 0 HG3 LYS A 402 -17.127 -8.916 -0.986 1.00 0.00 H new ATOM 0 HD2 LYS A 402 -17.053 -7.303 0.921 1.00 0.00 H new ATOM 0 HD3 LYS A 402 -18.743 -6.923 0.658 1.00 0.00 H new ATOM 0 HE2 LYS A 402 -18.513 -8.564 2.466 1.00 0.00 H new ATOM 0 HE3 LYS A 402 -19.370 -9.270 1.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 402 -17.576 -10.670 2.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 402 -17.474 -10.485 0.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 402 -16.441 -9.599 1.475 1.00 0.00 H new ATOM 745 N LYS A 403 -17.344 -3.596 -1.905 1.00 0.00 N ATOM 746 CA LYS A 403 -16.803 -2.443 -2.618 1.00 0.00 C ATOM 747 C LYS A 403 -15.673 -1.773 -1.845 1.00 0.00 C ATOM 748 O LYS A 403 -15.697 -1.697 -0.616 1.00 0.00 O ATOM 749 CB LYS A 403 -17.899 -1.415 -2.910 1.00 0.00 C ATOM 750 CG LYS A 403 -18.383 -0.664 -1.679 1.00 0.00 C ATOM 751 CD LYS A 403 -19.363 0.442 -2.043 1.00 0.00 C ATOM 752 CE LYS A 403 -20.603 -0.104 -2.735 1.00 0.00 C ATOM 753 NZ LYS A 403 -21.545 0.982 -3.122 1.00 0.00 N ATOM 0 H LYS A 403 -17.265 -3.549 -0.889 1.00 0.00 H new ATOM 0 HA LYS A 403 -16.400 -2.818 -3.558 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -17.524 -0.696 -3.638 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -18.747 -1.923 -3.370 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -18.861 -1.362 -0.992 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -17.529 -0.235 -1.155 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -19.657 0.978 -1.141 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -18.871 1.163 -2.696 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -20.307 -0.662 -3.623 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -21.110 -0.805 -2.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -22.377 0.569 -3.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -21.847 1.499 -2.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -21.070 1.638 -3.775 1.00 0.00 H new ATOM 767 N CYS A 404 -14.692 -1.272 -2.588 1.00 0.00 N ATOM 768 CA CYS A 404 -13.548 -0.583 -2.006 1.00 0.00 C ATOM 769 C CYS A 404 -13.392 0.783 -2.674 1.00 0.00 C ATOM 770 O CYS A 404 -13.311 0.874 -3.898 1.00 0.00 O ATOM 771 CB CYS A 404 -12.280 -1.424 -2.193 1.00 0.00 C ATOM 772 SG CYS A 404 -10.781 -0.709 -1.446 1.00 0.00 S ATOM 0 H CYS A 404 -14.668 -1.332 -3.606 1.00 0.00 H new ATOM 0 HA CYS A 404 -13.708 -0.440 -0.937 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -12.448 -2.412 -1.764 1.00 0.00 H new ATOM 0 HB3 CYS A 404 -12.107 -1.565 -3.260 1.00 0.00 H new ATOM 777 N THR A 405 -13.374 1.846 -1.871 1.00 0.00 N ATOM 778 CA THR A 405 -13.257 3.201 -2.407 1.00 0.00 C ATOM 779 C THR A 405 -12.302 4.061 -1.583 1.00 0.00 C ATOM 780 O THR A 405 -12.318 4.027 -0.355 1.00 0.00 O ATOM 781 CB THR A 405 -14.630 3.895 -2.466 1.00 0.00 C ATOM 782 OG1 THR A 405 -15.208 3.949 -1.157 1.00 0.00 O ATOM 783 CG2 THR A 405 -15.569 3.157 -3.411 1.00 0.00 C ATOM 0 H THR A 405 -13.438 1.796 -0.854 1.00 0.00 H new ATOM 0 HA THR A 405 -12.855 3.100 -3.415 1.00 0.00 H new ATOM 0 HB THR A 405 -14.485 4.908 -2.841 1.00 0.00 H new ATOM 0 HG1 THR A 405 -16.080 4.393 -1.203 1.00 0.00 H new ATOM 0 HG21 THR A 405 -16.533 3.665 -3.437 1.00 0.00 H new ATOM 0 HG22 THR A 405 -15.140 3.143 -4.413 1.00 0.00 H new ATOM 0 HG23 THR A 405 -15.708 2.134 -3.061 1.00 0.00 H new ATOM 791 N LEU A 406 -11.471 4.831 -2.281 1.00 0.00 N ATOM 792 CA LEU A 406 -10.492 5.703 -1.643 1.00 0.00 C ATOM 793 C LEU A 406 -11.158 6.725 -0.735 1.00 0.00 C ATOM 794 O LEU A 406 -12.214 7.271 -1.053 1.00 0.00 O ATOM 795 CB LEU A 406 -9.657 6.416 -2.709 1.00 0.00 C ATOM 796 CG LEU A 406 -8.405 7.148 -2.209 1.00 0.00 C ATOM 797 CD1 LEU A 406 -8.757 8.490 -1.588 1.00 0.00 C ATOM 798 CD2 LEU A 406 -7.642 6.286 -1.219 1.00 0.00 C ATOM 0 H LEU A 406 -11.458 4.867 -3.300 1.00 0.00 H new ATOM 0 HA LEU A 406 -9.843 5.082 -1.025 1.00 0.00 H new ATOM 0 HB2 LEU A 406 -9.350 5.681 -3.453 1.00 0.00 H new ATOM 0 HB3 LEU A 406 -10.295 7.138 -3.219 1.00 0.00 H new ATOM 0 HG LEU A 406 -7.765 7.338 -3.071 1.00 0.00 H new ATOM 0 HD11 LEU A 406 -7.847 8.982 -1.244 1.00 0.00 H new ATOM 0 HD12 LEU A 406 -9.250 9.117 -2.331 1.00 0.00 H new ATOM 0 HD13 LEU A 406 -9.427 8.335 -0.742 1.00 0.00 H new ATOM 0 HD21 LEU A 406 -6.757 6.822 -0.876 1.00 0.00 H new ATOM 0 HD22 LEU A 406 -8.282 6.058 -0.366 1.00 0.00 H new ATOM 0 HD23 LEU A 406 -7.338 5.358 -1.703 1.00 0.00 H new ATOM 810 N ASP A 407 -10.509 6.985 0.388 1.00 0.00 N ATOM 811 CA ASP A 407 -10.999 7.955 1.359 1.00 0.00 C ATOM 812 C ASP A 407 -9.990 9.082 1.523 1.00 0.00 C ATOM 813 O ASP A 407 -8.793 8.834 1.667 1.00 0.00 O ATOM 814 CB ASP A 407 -11.247 7.281 2.709 1.00 0.00 C ATOM 815 CG ASP A 407 -11.848 8.227 3.735 1.00 0.00 C ATOM 816 OD1 ASP A 407 -12.135 9.389 3.380 1.00 0.00 O ATOM 817 OD2 ASP A 407 -12.035 7.801 4.894 1.00 0.00 O ATOM 0 H ASP A 407 -9.633 6.534 0.653 1.00 0.00 H new ATOM 0 HA ASP A 407 -11.940 8.366 0.994 1.00 0.00 H new ATOM 0 HB2 ASP A 407 -11.915 6.431 2.569 1.00 0.00 H new ATOM 0 HB3 ASP A 407 -10.306 6.887 3.092 1.00 0.00 H new ATOM 822 N LYS A 408 -10.471 10.318 1.497 1.00 0.00 N ATOM 823 CA LYS A 408 -9.595 11.472 1.643 1.00 0.00 C ATOM 824 C LYS A 408 -8.906 11.462 3.004 1.00 0.00 C ATOM 825 O LYS A 408 -7.709 11.725 3.103 1.00 0.00 O ATOM 826 CB LYS A 408 -10.381 12.769 1.451 1.00 0.00 C ATOM 827 CG LYS A 408 -11.528 12.948 2.435 1.00 0.00 C ATOM 828 CD LYS A 408 -12.346 14.193 2.120 1.00 0.00 C ATOM 829 CE LYS A 408 -11.505 15.457 2.202 1.00 0.00 C ATOM 830 NZ LYS A 408 -12.296 16.675 1.874 1.00 0.00 N ATOM 0 H LYS A 408 -11.458 10.546 1.377 1.00 0.00 H new ATOM 0 HA LYS A 408 -8.827 11.415 0.872 1.00 0.00 H new ATOM 0 HB2 LYS A 408 -9.698 13.613 1.547 1.00 0.00 H new ATOM 0 HB3 LYS A 408 -10.779 12.794 0.436 1.00 0.00 H new ATOM 0 HG2 LYS A 408 -12.174 12.070 2.406 1.00 0.00 H new ATOM 0 HG3 LYS A 408 -11.132 13.019 3.448 1.00 0.00 H new ATOM 0 HD2 LYS A 408 -12.773 14.104 1.121 1.00 0.00 H new ATOM 0 HD3 LYS A 408 -13.180 14.266 2.818 1.00 0.00 H new ATOM 0 HE2 LYS A 408 -11.091 15.553 3.206 1.00 0.00 H new ATOM 0 HE3 LYS A 408 -10.662 15.377 1.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 -11.685 17.514 1.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 -12.670 16.596 0.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 -13.086 16.767 2.544 1.00 0.00 H new ATOM 844 N GLU A 409 -9.669 11.150 4.049 1.00 0.00 N ATOM 845 CA GLU A 409 -9.130 11.100 5.401 1.00 0.00 C ATOM 846 C GLU A 409 -8.050 10.027 5.516 1.00 0.00 C ATOM 847 O GLU A 409 -6.957 10.285 6.022 1.00 0.00 O ATOM 848 CB GLU A 409 -10.255 10.825 6.401 1.00 0.00 C ATOM 849 CG GLU A 409 -9.783 10.732 7.841 1.00 0.00 C ATOM 850 CD GLU A 409 -9.235 12.045 8.373 1.00 0.00 C ATOM 851 OE1 GLU A 409 -9.268 13.050 7.632 1.00 0.00 O ATOM 852 OE2 GLU A 409 -8.776 12.066 9.535 1.00 0.00 O ATOM 0 H GLU A 409 -10.662 10.928 3.983 1.00 0.00 H new ATOM 0 HA GLU A 409 -8.677 12.065 5.628 1.00 0.00 H new ATOM 0 HB2 GLU A 409 -11.000 11.617 6.323 1.00 0.00 H new ATOM 0 HB3 GLU A 409 -10.751 9.893 6.130 1.00 0.00 H new ATOM 0 HG2 GLU A 409 -10.613 10.410 8.469 1.00 0.00 H new ATOM 0 HG3 GLU A 409 -9.011 9.966 7.916 1.00 0.00 H new ATOM 859 N GLU A 410 -8.363 8.827 5.036 1.00 0.00 N ATOM 860 CA GLU A 410 -7.416 7.717 5.075 1.00 0.00 C ATOM 861 C GLU A 410 -6.165 8.055 4.275 1.00 0.00 C ATOM 862 O GLU A 410 -5.046 7.767 4.699 1.00 0.00 O ATOM 863 CB GLU A 410 -8.061 6.445 4.521 1.00 0.00 C ATOM 864 CG GLU A 410 -9.249 5.954 5.335 1.00 0.00 C ATOM 865 CD GLU A 410 -8.865 5.504 6.732 1.00 0.00 C ATOM 866 OE1 GLU A 410 -7.658 5.529 7.056 1.00 0.00 O ATOM 867 OE2 GLU A 410 -9.771 5.120 7.501 1.00 0.00 O ATOM 0 H GLU A 410 -9.264 8.598 4.616 1.00 0.00 H new ATOM 0 HA GLU A 410 -7.133 7.545 6.114 1.00 0.00 H new ATOM 0 HB2 GLU A 410 -8.386 6.630 3.497 1.00 0.00 H new ATOM 0 HB3 GLU A 410 -7.310 5.656 4.480 1.00 0.00 H new ATOM 0 HG2 GLU A 410 -9.988 6.752 5.407 1.00 0.00 H new ATOM 0 HG3 GLU A 410 -9.724 5.125 4.810 1.00 0.00 H new ATOM 874 N ALA A 411 -6.367 8.672 3.116 1.00 0.00 N ATOM 875 CA ALA A 411 -5.264 9.061 2.248 1.00 0.00 C ATOM 876 C ALA A 411 -4.331 10.031 2.963 1.00 0.00 C ATOM 877 O ALA A 411 -3.111 9.938 2.841 1.00 0.00 O ATOM 878 CB ALA A 411 -5.801 9.678 0.965 1.00 0.00 C ATOM 0 H ALA A 411 -7.290 8.914 2.755 1.00 0.00 H new ATOM 0 HA ALA A 411 -4.691 8.170 1.993 1.00 0.00 H new ATOM 0 HB1 ALA A 411 -4.968 9.965 0.323 1.00 0.00 H new ATOM 0 HB2 ALA A 411 -6.426 8.951 0.445 1.00 0.00 H new ATOM 0 HB3 ALA A 411 -6.394 10.560 1.206 1.00 0.00 H new ATOM 884 N LYS A 412 -4.918 10.956 3.715 1.00 0.00 N ATOM 885 CA LYS A 412 -4.147 11.941 4.464 1.00 0.00 C ATOM 886 C LYS A 412 -3.217 11.254 5.458 1.00 0.00 C ATOM 887 O LYS A 412 -2.064 11.650 5.619 1.00 0.00 O ATOM 888 CB LYS A 412 -5.087 12.893 5.206 1.00 0.00 C ATOM 889 CG LYS A 412 -5.911 13.781 4.285 1.00 0.00 C ATOM 890 CD LYS A 412 -7.007 14.515 5.045 1.00 0.00 C ATOM 891 CE LYS A 412 -6.439 15.431 6.119 1.00 0.00 C ATOM 892 NZ LYS A 412 -7.513 16.135 6.872 1.00 0.00 N ATOM 0 H LYS A 412 -5.929 11.044 3.822 1.00 0.00 H new ATOM 0 HA LYS A 412 -3.543 12.512 3.758 1.00 0.00 H new ATOM 0 HB2 LYS A 412 -5.762 12.309 5.832 1.00 0.00 H new ATOM 0 HB3 LYS A 412 -4.499 13.523 5.873 1.00 0.00 H new ATOM 0 HG2 LYS A 412 -5.258 14.505 3.798 1.00 0.00 H new ATOM 0 HG3 LYS A 412 -6.358 13.174 3.498 1.00 0.00 H new ATOM 0 HD2 LYS A 412 -7.603 15.102 4.346 1.00 0.00 H new ATOM 0 HD3 LYS A 412 -7.678 13.789 5.505 1.00 0.00 H new ATOM 0 HE2 LYS A 412 -5.833 14.847 6.812 1.00 0.00 H new ATOM 0 HE3 LYS A 412 -5.778 16.165 5.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 412 -7.085 16.749 7.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 412 -8.076 16.713 6.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 412 -8.129 15.436 7.333 1.00 0.00 H new ATOM 906 N LYS A 413 -3.731 10.226 6.125 1.00 0.00 N ATOM 907 CA LYS A 413 -2.954 9.480 7.111 1.00 0.00 C ATOM 908 C LYS A 413 -1.807 8.719 6.447 1.00 0.00 C ATOM 909 O LYS A 413 -0.678 8.727 6.938 1.00 0.00 O ATOM 910 CB LYS A 413 -3.859 8.501 7.863 1.00 0.00 C ATOM 911 CG LYS A 413 -5.067 9.165 8.509 1.00 0.00 C ATOM 912 CD LYS A 413 -5.945 8.154 9.231 1.00 0.00 C ATOM 913 CE LYS A 413 -5.226 7.529 10.417 1.00 0.00 C ATOM 914 NZ LYS A 413 -4.822 8.550 11.422 1.00 0.00 N ATOM 0 H LYS A 413 -4.686 9.889 6.001 1.00 0.00 H new ATOM 0 HA LYS A 413 -2.529 10.194 7.816 1.00 0.00 H new ATOM 0 HB2 LYS A 413 -4.203 7.732 7.171 1.00 0.00 H new ATOM 0 HB3 LYS A 413 -3.275 7.998 8.634 1.00 0.00 H new ATOM 0 HG2 LYS A 413 -4.731 9.925 9.215 1.00 0.00 H new ATOM 0 HG3 LYS A 413 -5.653 9.676 7.745 1.00 0.00 H new ATOM 0 HD2 LYS A 413 -6.856 8.643 9.575 1.00 0.00 H new ATOM 0 HD3 LYS A 413 -6.247 7.371 8.535 1.00 0.00 H new ATOM 0 HE2 LYS A 413 -5.876 6.793 10.889 1.00 0.00 H new ATOM 0 HE3 LYS A 413 -4.343 6.996 10.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 413 -4.571 8.078 12.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 413 -4.001 9.080 11.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 413 -5.612 9.206 11.588 1.00 0.00 H new ATOM 928 N VAL A 414 -2.110 8.057 5.334 1.00 0.00 N ATOM 929 CA VAL A 414 -1.113 7.281 4.600 1.00 0.00 C ATOM 930 C VAL A 414 -0.004 8.173 4.047 1.00 0.00 C ATOM 931 O VAL A 414 1.167 7.794 4.041 1.00 0.00 O ATOM 932 CB VAL A 414 -1.757 6.504 3.435 1.00 0.00 C ATOM 933 CG1 VAL A 414 -0.727 5.638 2.726 1.00 0.00 C ATOM 934 CG2 VAL A 414 -2.919 5.659 3.935 1.00 0.00 C ATOM 0 H VAL A 414 -3.042 8.042 4.919 1.00 0.00 H new ATOM 0 HA VAL A 414 -0.682 6.576 5.310 1.00 0.00 H new ATOM 0 HB VAL A 414 -2.142 7.226 2.715 1.00 0.00 H new ATOM 0 HG11 VAL A 414 -1.206 5.100 1.908 1.00 0.00 H new ATOM 0 HG12 VAL A 414 0.068 6.269 2.329 1.00 0.00 H new ATOM 0 HG13 VAL A 414 -0.304 4.924 3.432 1.00 0.00 H new ATOM 0 HG21 VAL A 414 -3.361 5.118 3.099 1.00 0.00 H new ATOM 0 HG22 VAL A 414 -2.558 4.948 4.678 1.00 0.00 H new ATOM 0 HG23 VAL A 414 -3.671 6.306 4.387 1.00 0.00 H new ATOM 944 N ALA A 415 -0.381 9.352 3.571 1.00 0.00 N ATOM 945 CA ALA A 415 0.580 10.292 3.006 1.00 0.00 C ATOM 946 C ALA A 415 1.366 11.019 4.090 1.00 0.00 C ATOM 947 O ALA A 415 2.559 11.284 3.934 1.00 0.00 O ATOM 948 CB ALA A 415 -0.133 11.303 2.124 1.00 0.00 C ATOM 0 H ALA A 415 -1.346 9.681 3.565 1.00 0.00 H new ATOM 0 HA ALA A 415 1.287 9.717 2.408 1.00 0.00 H new ATOM 0 HB1 ALA A 415 0.595 12.000 1.708 1.00 0.00 H new ATOM 0 HB2 ALA A 415 -0.643 10.783 1.313 1.00 0.00 H new ATOM 0 HB3 ALA A 415 -0.863 11.853 2.718 1.00 0.00 H new ATOM 954 N ASP A 416 0.686 11.358 5.179 1.00 0.00 N ATOM 955 CA ASP A 416 1.311 12.077 6.279 1.00 0.00 C ATOM 956 C ASP A 416 1.738 11.137 7.402 1.00 0.00 C ATOM 957 O ASP A 416 1.502 11.416 8.578 1.00 0.00 O ATOM 958 CB ASP A 416 0.357 13.134 6.830 1.00 0.00 C ATOM 959 CG ASP A 416 -0.027 14.170 5.792 1.00 0.00 C ATOM 960 OD1 ASP A 416 0.879 14.857 5.274 1.00 0.00 O ATOM 961 OD2 ASP A 416 -1.235 14.294 5.496 1.00 0.00 O ATOM 0 H ASP A 416 -0.301 11.145 5.322 1.00 0.00 H new ATOM 0 HA ASP A 416 2.205 12.560 5.885 1.00 0.00 H new ATOM 0 HB2 ASP A 416 -0.544 12.646 7.202 1.00 0.00 H new ATOM 0 HB3 ASP A 416 0.824 13.632 7.680 1.00 0.00 H new ATOM 966 N GLU A 417 2.372 10.031 7.038 1.00 0.00 N ATOM 967 CA GLU A 417 2.837 9.061 8.028 1.00 0.00 C ATOM 968 C GLU A 417 4.010 9.615 8.836 1.00 0.00 C ATOM 969 O GLU A 417 4.717 8.861 9.506 1.00 0.00 O ATOM 970 CB GLU A 417 3.254 7.753 7.353 1.00 0.00 C ATOM 971 CG GLU A 417 2.103 6.989 6.722 1.00 0.00 C ATOM 972 CD GLU A 417 2.552 5.695 6.073 1.00 0.00 C ATOM 973 OE1 GLU A 417 3.107 4.834 6.788 1.00 0.00 O ATOM 974 OE2 GLU A 417 2.349 5.541 4.851 1.00 0.00 O ATOM 0 H GLU A 417 2.577 9.781 6.071 1.00 0.00 H new ATOM 0 HA GLU A 417 2.007 8.864 8.706 1.00 0.00 H new ATOM 0 HB2 GLU A 417 3.995 7.973 6.585 1.00 0.00 H new ATOM 0 HB3 GLU A 417 3.740 7.114 8.091 1.00 0.00 H new ATOM 0 HG2 GLU A 417 1.356 6.769 7.484 1.00 0.00 H new ATOM 0 HG3 GLU A 417 1.620 7.618 5.974 1.00 0.00 H new ATOM 981 N THR A 418 4.207 10.932 8.772 1.00 0.00 N ATOM 982 CA THR A 418 5.289 11.590 9.497 1.00 0.00 C ATOM 983 C THR A 418 6.611 10.858 9.295 1.00 0.00 C ATOM 984 O THR A 418 7.356 10.624 10.247 1.00 0.00 O ATOM 985 CB THR A 418 4.981 11.685 11.005 1.00 0.00 C ATOM 986 OG1 THR A 418 4.878 10.373 11.573 1.00 0.00 O ATOM 987 CG2 THR A 418 3.685 12.446 11.242 1.00 0.00 C ATOM 0 H THR A 418 3.627 11.565 8.222 1.00 0.00 H new ATOM 0 HA THR A 418 5.375 12.599 9.093 1.00 0.00 H new ATOM 0 HB THR A 418 5.798 12.223 11.486 1.00 0.00 H new ATOM 0 HG1 THR A 418 5.096 9.703 10.891 1.00 0.00 H new ATOM 0 HG21 THR A 418 3.486 12.502 12.312 1.00 0.00 H new ATOM 0 HG22 THR A 418 3.776 13.454 10.837 1.00 0.00 H new ATOM 0 HG23 THR A 418 2.863 11.928 10.747 1.00 0.00 H new ATOM 995 N ALA A 419 6.895 10.498 8.046 1.00 0.00 N ATOM 996 CA ALA A 419 8.124 9.788 7.715 1.00 0.00 C ATOM 997 C ALA A 419 8.334 9.724 6.206 1.00 0.00 C ATOM 998 O ALA A 419 9.383 10.120 5.697 1.00 0.00 O ATOM 999 CB ALA A 419 8.089 8.385 8.299 1.00 0.00 C ATOM 0 H ALA A 419 6.289 10.687 7.247 1.00 0.00 H new ATOM 0 HA ALA A 419 8.960 10.336 8.149 1.00 0.00 H new ATOM 0 HB1 ALA A 419 9.012 7.863 8.046 1.00 0.00 H new ATOM 0 HB2 ALA A 419 7.991 8.444 9.383 1.00 0.00 H new ATOM 0 HB3 ALA A 419 7.239 7.841 7.887 1.00 0.00 H new ATOM 1005 N LYS A 420 7.329 9.220 5.496 1.00 0.00 N ATOM 1006 CA LYS A 420 7.400 9.102 4.045 1.00 0.00 C ATOM 1007 C LYS A 420 7.052 10.426 3.369 1.00 0.00 C ATOM 1008 O LYS A 420 6.333 10.453 2.369 1.00 0.00 O ATOM 1009 CB LYS A 420 6.463 7.997 3.547 1.00 0.00 C ATOM 1010 CG LYS A 420 6.883 6.592 3.961 1.00 0.00 C ATOM 1011 CD LYS A 420 6.771 6.382 5.463 1.00 0.00 C ATOM 1012 CE LYS A 420 7.204 4.981 5.862 1.00 0.00 C ATOM 1013 NZ LYS A 420 8.623 4.714 5.498 1.00 0.00 N ATOM 0 H LYS A 420 6.455 8.887 5.903 1.00 0.00 H new ATOM 0 HA LYS A 420 8.425 8.840 3.782 1.00 0.00 H new ATOM 0 HB2 LYS A 420 5.459 8.190 3.924 1.00 0.00 H new ATOM 0 HB3 LYS A 420 6.410 8.043 2.459 1.00 0.00 H new ATOM 0 HG2 LYS A 420 6.260 5.861 3.446 1.00 0.00 H new ATOM 0 HG3 LYS A 420 7.911 6.414 3.646 1.00 0.00 H new ATOM 0 HD2 LYS A 420 7.388 7.116 5.981 1.00 0.00 H new ATOM 0 HD3 LYS A 420 5.742 6.550 5.779 1.00 0.00 H new ATOM 0 HE2 LYS A 420 7.075 4.853 6.937 1.00 0.00 H new ATOM 0 HE3 LYS A 420 6.560 4.249 5.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 420 8.952 3.857 5.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 420 8.698 4.576 4.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 420 9.212 5.522 5.782 1.00 0.00 H new ATOM 1027 N ASP A 421 7.566 11.522 3.920 1.00 0.00 N ATOM 1028 CA ASP A 421 7.310 12.846 3.367 1.00 0.00 C ATOM 1029 C ASP A 421 7.898 12.971 1.965 1.00 0.00 C ATOM 1030 O ASP A 421 7.225 13.420 1.038 1.00 0.00 O ATOM 1031 CB ASP A 421 7.899 13.923 4.278 1.00 0.00 C ATOM 1032 CG ASP A 421 7.300 13.891 5.671 1.00 0.00 C ATOM 1033 OD1 ASP A 421 6.069 14.058 5.792 1.00 0.00 O ATOM 1034 OD2 ASP A 421 8.064 13.699 6.641 1.00 0.00 O ATOM 0 H ASP A 421 8.162 11.518 4.748 1.00 0.00 H new ATOM 0 HA ASP A 421 6.231 12.985 3.303 1.00 0.00 H new ATOM 0 HB2 ASP A 421 8.978 13.787 4.346 1.00 0.00 H new ATOM 0 HB3 ASP A 421 7.728 14.904 3.834 1.00 0.00 H new ATOM 1039 N GLY A 422 9.157 12.568 1.822 1.00 0.00 N ATOM 1040 CA GLY A 422 9.827 12.638 0.536 1.00 0.00 C ATOM 1041 C GLY A 422 10.283 14.043 0.190 1.00 0.00 C ATOM 1042 O GLY A 422 11.453 14.261 -0.125 1.00 0.00 O ATOM 0 H GLY A 422 9.728 12.192 2.579 1.00 0.00 H new ATOM 0 HA2 GLY A 422 10.690 11.972 0.543 1.00 0.00 H new ATOM 0 HA3 GLY A 422 9.153 12.278 -0.241 1.00 0.00 H new ATOM 1046 N LYS A 423 9.362 14.998 0.253 1.00 0.00 N ATOM 1047 CA LYS A 423 9.677 16.388 -0.051 1.00 0.00 C ATOM 1048 C LYS A 423 10.559 16.990 1.038 1.00 0.00 C ATOM 1049 O LYS A 423 10.343 16.750 2.226 1.00 0.00 O ATOM 1050 CB LYS A 423 8.389 17.203 -0.197 1.00 0.00 C ATOM 1051 CG LYS A 423 7.438 16.656 -1.253 1.00 0.00 C ATOM 1052 CD LYS A 423 8.067 16.655 -2.640 1.00 0.00 C ATOM 1053 CE LYS A 423 8.377 18.065 -3.119 1.00 0.00 C ATOM 1054 NZ LYS A 423 7.147 18.898 -3.233 1.00 0.00 N ATOM 0 H LYS A 423 8.389 14.834 0.512 1.00 0.00 H new ATOM 0 HA LYS A 423 10.223 16.419 -0.994 1.00 0.00 H new ATOM 0 HB2 LYS A 423 7.875 17.230 0.764 1.00 0.00 H new ATOM 0 HB3 LYS A 423 8.646 18.232 -0.450 1.00 0.00 H new ATOM 0 HG2 LYS A 423 7.146 15.640 -0.987 1.00 0.00 H new ATOM 0 HG3 LYS A 423 6.528 17.256 -1.268 1.00 0.00 H new ATOM 0 HD2 LYS A 423 8.984 16.067 -2.623 1.00 0.00 H new ATOM 0 HD3 LYS A 423 7.391 16.171 -3.346 1.00 0.00 H new ATOM 0 HE2 LYS A 423 9.073 18.539 -2.426 1.00 0.00 H new ATOM 0 HE3 LYS A 423 8.874 18.018 -4.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 7.359 19.758 -3.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 6.404 18.355 -3.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 6.818 19.163 -2.283 1.00 0.00 H new ATOM 1068 N THR A 424 11.555 17.770 0.625 1.00 0.00 N ATOM 1069 CA THR A 424 12.470 18.404 1.568 1.00 0.00 C ATOM 1070 C THR A 424 11.716 19.265 2.577 1.00 0.00 C ATOM 1071 O THR A 424 10.902 20.110 2.203 1.00 0.00 O ATOM 1072 CB THR A 424 13.507 19.277 0.838 1.00 0.00 C ATOM 1073 OG1 THR A 424 12.843 20.249 0.023 1.00 0.00 O ATOM 1074 CG2 THR A 424 14.422 18.422 -0.026 1.00 0.00 C ATOM 0 H THR A 424 11.748 17.977 -0.355 1.00 0.00 H new ATOM 0 HA THR A 424 12.985 17.602 2.097 1.00 0.00 H new ATOM 0 HB THR A 424 14.113 19.786 1.588 1.00 0.00 H new ATOM 0 HG1 THR A 424 13.339 21.094 0.052 1.00 0.00 H new ATOM 0 HG21 THR A 424 15.146 19.061 -0.532 1.00 0.00 H new ATOM 0 HG22 THR A 424 14.948 17.703 0.602 1.00 0.00 H new ATOM 0 HG23 THR A 424 13.828 17.889 -0.768 1.00 0.00 H new ATOM 1082 N GLY A 425 11.992 19.041 3.858 1.00 0.00 N ATOM 1083 CA GLY A 425 11.334 19.796 4.908 1.00 0.00 C ATOM 1084 C GLY A 425 11.992 21.138 5.176 1.00 0.00 C ATOM 1085 O GLY A 425 12.262 21.479 6.328 1.00 0.00 O ATOM 0 H GLY A 425 12.663 18.347 4.188 1.00 0.00 H new ATOM 0 HA2 GLY A 425 10.292 19.957 4.633 1.00 0.00 H new ATOM 0 HA3 GLY A 425 11.334 19.208 5.826 1.00 0.00 H new ATOM 1089 N ASN A 426 12.250 21.900 4.116 1.00 0.00 N ATOM 1090 CA ASN A 426 12.881 23.211 4.258 1.00 0.00 C ATOM 1091 C ASN A 426 12.031 24.137 5.122 1.00 0.00 C ATOM 1092 O ASN A 426 10.810 24.182 4.981 1.00 0.00 O ATOM 1093 CB ASN A 426 13.113 23.849 2.887 1.00 0.00 C ATOM 1094 CG ASN A 426 14.053 23.037 2.018 1.00 0.00 C ATOM 1095 OD1 ASN A 426 13.586 22.662 0.834 1.00 0.00 O flip ATOM 1096 ND2 ASN A 426 15.187 22.757 2.405 1.00 0.00 N flip ATOM 0 H ASN A 426 12.034 21.635 3.155 1.00 0.00 H new ATOM 0 HA ASN A 426 13.843 23.065 4.749 1.00 0.00 H new ATOM 0 HB2 ASN A 426 12.157 23.961 2.376 1.00 0.00 H new ATOM 0 HB3 ASN A 426 13.522 24.851 3.021 1.00 0.00 H new ATOM 0 HD21 ASN A 426 15.503 23.067 3.324 1.00 0.00 H new ATOM 0 HD22 ASN A 426 15.811 22.215 1.807 1.00 0.00 H new ATOM 1103 N THR A 427 12.692 24.871 6.016 1.00 0.00 N ATOM 1104 CA THR A 427 12.013 25.805 6.911 1.00 0.00 C ATOM 1105 C THR A 427 10.829 25.138 7.615 1.00 0.00 C ATOM 1106 O THR A 427 10.936 24.001 8.075 1.00 0.00 O ATOM 1107 CB THR A 427 11.532 27.062 6.155 1.00 0.00 C ATOM 1108 OG1 THR A 427 10.581 26.704 5.146 1.00 0.00 O ATOM 1109 CG2 THR A 427 12.707 27.788 5.515 1.00 0.00 C ATOM 0 H THR A 427 13.704 24.836 6.139 1.00 0.00 H new ATOM 0 HA THR A 427 12.740 26.111 7.664 1.00 0.00 H new ATOM 0 HB THR A 427 11.057 27.728 6.875 1.00 0.00 H new ATOM 0 HG1 THR A 427 10.302 25.774 5.275 1.00 0.00 H new ATOM 0 HG21 THR A 427 12.346 28.671 4.987 1.00 0.00 H new ATOM 0 HG22 THR A 427 13.412 28.091 6.289 1.00 0.00 H new ATOM 0 HG23 THR A 427 13.205 27.123 4.810 1.00 0.00 H new ATOM 1117 N ASN A 428 9.703 25.847 7.695 1.00 0.00 N ATOM 1118 CA ASN A 428 8.507 25.325 8.338 1.00 0.00 C ATOM 1119 C ASN A 428 7.349 26.304 8.186 1.00 0.00 C ATOM 1120 O ASN A 428 6.219 25.907 7.900 1.00 0.00 O ATOM 1121 CB ASN A 428 8.766 25.048 9.821 1.00 0.00 C ATOM 1122 CG ASN A 428 7.546 24.493 10.527 1.00 0.00 C ATOM 1123 OD1 ASN A 428 7.025 23.442 10.156 1.00 0.00 O ATOM 1124 ND2 ASN A 428 7.082 25.199 11.552 1.00 0.00 N ATOM 0 H ASN A 428 9.599 26.789 7.319 1.00 0.00 H new ATOM 0 HA ASN A 428 8.242 24.387 7.850 1.00 0.00 H new ATOM 0 HB2 ASN A 428 9.591 24.342 9.917 1.00 0.00 H new ATOM 0 HB3 ASN A 428 9.078 25.970 10.311 1.00 0.00 H new ATOM 0 HD21 ASN A 428 6.262 24.875 12.065 1.00 0.00 H new ATOM 0 HD22 ASN A 428 7.545 26.066 11.826 1.00 0.00 H new ATOM 1131 N THR A 429 7.643 27.586 8.372 1.00 0.00 N ATOM 1132 CA THR A 429 6.635 28.631 8.248 1.00 0.00 C ATOM 1133 C THR A 429 6.099 28.705 6.822 1.00 0.00 C ATOM 1134 O THR A 429 6.384 27.836 5.997 1.00 0.00 O ATOM 1135 CB THR A 429 7.199 30.009 8.645 1.00 0.00 C ATOM 1136 OG1 THR A 429 8.309 30.344 7.803 1.00 0.00 O ATOM 1137 CG2 THR A 429 7.643 30.016 10.101 1.00 0.00 C ATOM 0 H THR A 429 8.574 27.927 8.610 1.00 0.00 H new ATOM 0 HA THR A 429 5.824 28.372 8.928 1.00 0.00 H new ATOM 0 HB THR A 429 6.409 30.749 8.519 1.00 0.00 H new ATOM 0 HG1 THR A 429 8.661 31.222 8.060 1.00 0.00 H new ATOM 0 HG21 THR A 429 8.037 31.000 10.356 1.00 0.00 H new ATOM 0 HG22 THR A 429 6.791 29.789 10.742 1.00 0.00 H new ATOM 0 HG23 THR A 429 8.419 29.265 10.248 1.00 0.00 H new ATOM 1145 N THR A 430 5.321 29.745 6.537 1.00 0.00 N ATOM 1146 CA THR A 430 4.746 29.933 5.210 1.00 0.00 C ATOM 1147 C THR A 430 5.790 30.481 4.235 1.00 0.00 C ATOM 1148 O THR A 430 5.562 31.484 3.557 1.00 0.00 O ATOM 1149 CB THR A 430 3.534 30.887 5.256 1.00 0.00 C ATOM 1150 OG1 THR A 430 2.634 30.483 6.295 1.00 0.00 O ATOM 1151 CG2 THR A 430 2.794 30.896 3.924 1.00 0.00 C ATOM 0 H THR A 430 5.074 30.472 7.209 1.00 0.00 H new ATOM 0 HA THR A 430 4.410 28.956 4.861 1.00 0.00 H new ATOM 0 HB THR A 430 3.903 31.893 5.457 1.00 0.00 H new ATOM 0 HG1 THR A 430 1.868 31.094 6.320 1.00 0.00 H new ATOM 0 HG21 THR A 430 1.945 31.576 3.984 1.00 0.00 H new ATOM 0 HG22 THR A 430 3.469 31.227 3.135 1.00 0.00 H new ATOM 0 HG23 THR A 430 2.438 29.891 3.699 1.00 0.00 H new ATOM 1159 N GLY A 431 6.942 29.817 4.170 1.00 0.00 N ATOM 1160 CA GLY A 431 7.998 30.251 3.277 1.00 0.00 C ATOM 1161 C GLY A 431 7.665 29.977 1.827 1.00 0.00 C ATOM 1162 O GLY A 431 7.222 28.881 1.483 1.00 0.00 O ATOM 0 H GLY A 431 7.161 28.987 4.721 1.00 0.00 H new ATOM 0 HA2 GLY A 431 8.172 31.318 3.413 1.00 0.00 H new ATOM 0 HA3 GLY A 431 8.925 29.741 3.538 1.00 0.00 H new ATOM 1166 N SER A 432 7.876 30.971 0.972 1.00 0.00 N ATOM 1167 CA SER A 432 7.590 30.821 -0.447 1.00 0.00 C ATOM 1168 C SER A 432 8.437 29.709 -1.056 1.00 0.00 C ATOM 1169 O SER A 432 9.655 29.840 -1.183 1.00 0.00 O ATOM 1170 CB SER A 432 7.847 32.134 -1.185 1.00 0.00 C ATOM 1171 OG SER A 432 7.584 31.999 -2.571 1.00 0.00 O ATOM 0 H SER A 432 8.243 31.885 1.237 1.00 0.00 H new ATOM 0 HA SER A 432 6.538 30.555 -0.553 1.00 0.00 H new ATOM 0 HB2 SER A 432 7.217 32.919 -0.767 1.00 0.00 H new ATOM 0 HB3 SER A 432 8.882 32.442 -1.036 1.00 0.00 H new ATOM 0 HG SER A 432 7.754 32.853 -3.021 1.00 0.00 H new ATOM 1177 N SER A 433 7.781 28.617 -1.431 1.00 0.00 N ATOM 1178 CA SER A 433 8.466 27.477 -2.030 1.00 0.00 C ATOM 1179 C SER A 433 9.163 27.879 -3.326 1.00 0.00 C ATOM 1180 O SER A 433 10.099 27.162 -3.740 1.00 0.00 O ATOM 1181 CB SER A 433 7.472 26.347 -2.303 1.00 0.00 C ATOM 1182 OG SER A 433 8.112 25.240 -2.913 1.00 0.00 O ATOM 1183 OXT SER A 433 8.767 28.906 -3.917 1.00 0.00 O ATOM 0 H SER A 433 6.773 28.497 -1.331 1.00 0.00 H new ATOM 0 HA SER A 433 9.221 27.128 -1.326 1.00 0.00 H new ATOM 0 HB2 SER A 433 7.008 26.033 -1.368 1.00 0.00 H new ATOM 0 HB3 SER A 433 6.673 26.710 -2.949 1.00 0.00 H new ATOM 0 HG SER A 433 7.455 24.531 -3.075 1.00 0.00 H new TER 1189 SER A 433