USER MOD reduce.3.24.130724 H: found=0, std=0, add=578, rem=0, adj=31 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 396 HIS : no HE2:sc= 0.626 K(o=1.3,f=-3.6!) USER MOD Set 1.2: A 405 THR OG1 : rot -97:sc= 0.714 USER MOD Set 2.1: A 377 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 380 SER OG : rot -23:sc= -0.494! USER MOD Set 3.1: A 356 HIS : no HD1:sc= -0.215 X(o=-0.43,f=0) USER MOD Set 3.2: A 372 GLN : amide:sc= -0.218 X(o=-0.43,f=-0.72) USER MOD Set 4.1: A 371 GLN :FLIP amide:sc= 0 F(o=-1!,f=0.34) USER MOD Set 4.2: A 390 LYS NZ :NH3+ -133:sc= 0.336 (180deg=-0.225) USER MOD Set 5.1: A 362 THR OG1 : rot -55:sc= 1.91 USER MOD Set 5.2: A 364 LYS NZ :NH3+ 152:sc= 0.552 (180deg=-0.19) USER MOD Set 5.3: A 366 LYS NZ :NH3+ 141:sc= 0.29 (180deg=0) USER MOD Single : A 355 SER OG : rot 180:sc= 0 USER MOD Single : A 357 MET CE :methyl -143:sc= -0.191 (180deg=-0.993) USER MOD Single : A 363 GLN :FLIP amide:sc= -0.438 F(o=-2.8!,f=-0.44) USER MOD Single : A 365 HIS : no HD1:sc= -0.128 X(o=-0.13,f=0) USER MOD Single : A 370 SER OG : rot 180:sc= 0.231 USER MOD Single : A 373 GLN :FLIP amide:sc= 0.552 F(o=-0.8,f=0.55) USER MOD Single : A 382 ASN :FLIP amide:sc= -1.09 F(o=-5.1!,f=-1.1) USER MOD Single : A 383 LYS NZ :NH3+ -166:sc= -0.047 (180deg=-0.288) USER MOD Single : A 384 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 386 GLN : amide:sc= 0.0369 X(o=0.037,f=0) USER MOD Single : A 387 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 391 SER OG : rot 170:sc= 0 USER MOD Single : A 394 LYS NZ :NH3+ 157:sc= -0.276 (180deg=-1.47) USER MOD Single : A 397 ASN : amide:sc= -1.64 K(o=-1.6,f=-5.6!) USER MOD Single : A 401 ASN : amide:sc= -2.23 X(o=-2.2,f=-2) USER MOD Single : A 402 LYS NZ :NH3+ 167:sc= -0.0342 (180deg=-0.211) USER MOD Single : A 403 LYS NZ :NH3+ 166:sc= -0.0198 (180deg=-0.238) USER MOD Single : A 408 LYS NZ :NH3+ 168:sc= -0.0369 (180deg=-0.266) USER MOD Single : A 412 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 413 LYS NZ :NH3+ -167:sc= -0.0321 (180deg=-0.223) USER MOD Single : A 418 THR OG1 : rot 10:sc= 0.542 USER MOD Single : A 420 LYS NZ :NH3+ 140:sc= -3.53! (180deg=-5.84!) USER MOD Single : A 423 LYS NZ :NH3+ -168:sc= -0.023 (180deg=-0.198) USER MOD Single : A 424 THR OG1 : rot -16:sc= 0.693 USER MOD Single : A 426 ASN : amide:sc= -0.626 K(o=-0.63,f=-1.5) USER MOD Single : A 427 THR OG1 : rot 180:sc= 0 USER MOD Single : A 428 ASN : amide:sc= -2.58! C(o=-2.6!,f=-8.9!) 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 -13:sc= 0.848 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 354 6.598 6.170 -10.437 1.00 0.00 N ATOM 2 CA GLY A 354 7.474 5.072 -10.933 1.00 0.00 C ATOM 3 C GLY A 354 8.940 5.459 -10.939 1.00 0.00 C ATOM 4 O GLY A 354 9.662 5.164 -11.891 1.00 0.00 O ATOM 0 HA2 GLY A 354 7.336 4.190 -10.307 1.00 0.00 H new ATOM 0 HA3 GLY A 354 7.170 4.796 -11.943 1.00 0.00 H new ATOM 10 N SER A 355 9.379 6.120 -9.870 1.00 0.00 N ATOM 11 CA SER A 355 10.769 6.549 -9.750 1.00 0.00 C ATOM 12 C SER A 355 11.040 7.127 -8.364 1.00 0.00 C ATOM 13 O SER A 355 11.680 8.170 -8.228 1.00 0.00 O ATOM 14 CB SER A 355 11.101 7.589 -10.823 1.00 0.00 C ATOM 15 OG SER A 355 10.273 8.732 -10.701 1.00 0.00 O ATOM 0 H SER A 355 8.791 6.370 -9.075 1.00 0.00 H new ATOM 0 HA SER A 355 11.406 5.676 -9.893 1.00 0.00 H new ATOM 0 HB2 SER A 355 12.147 7.883 -10.737 1.00 0.00 H new ATOM 0 HB3 SER A 355 10.974 7.149 -11.812 1.00 0.00 H new ATOM 0 HG SER A 355 10.507 9.381 -11.397 1.00 0.00 H new ATOM 21 N HIS A 356 10.548 6.439 -7.338 1.00 0.00 N ATOM 22 CA HIS A 356 10.736 6.880 -5.960 1.00 0.00 C ATOM 23 C HIS A 356 12.217 6.903 -5.594 1.00 0.00 C ATOM 24 O HIS A 356 12.951 5.956 -5.875 1.00 0.00 O ATOM 25 CB HIS A 356 9.975 5.964 -5.000 1.00 0.00 C ATOM 26 CG HIS A 356 8.494 5.956 -5.226 1.00 0.00 C ATOM 27 ND1 HIS A 356 7.712 7.089 -5.131 1.00 0.00 N ATOM 28 CD2 HIS A 356 7.650 4.945 -5.544 1.00 0.00 C ATOM 29 CE1 HIS A 356 6.453 6.774 -5.378 1.00 0.00 C ATOM 30 NE2 HIS A 356 6.389 5.481 -5.631 1.00 0.00 N ATOM 0 H HIS A 356 10.016 5.574 -7.435 1.00 0.00 H new ATOM 0 HA HIS A 356 10.342 7.893 -5.872 1.00 0.00 H new ATOM 0 HB2 HIS A 356 10.355 4.948 -5.103 1.00 0.00 H new ATOM 0 HB3 HIS A 356 10.176 6.278 -3.976 1.00 0.00 H new ATOM 0 HD2 HIS A 356 7.919 3.911 -5.700 1.00 0.00 H new ATOM 0 HE1 HIS A 356 5.618 7.459 -5.374 1.00 0.00 H new ATOM 0 HE2 HIS A 356 5.540 4.963 -5.855 1.00 0.00 H new ATOM 39 N MET A 357 12.647 7.996 -4.970 1.00 0.00 N ATOM 40 CA MET A 357 14.041 8.151 -4.566 1.00 0.00 C ATOM 41 C MET A 357 14.459 7.054 -3.589 1.00 0.00 C ATOM 42 O MET A 357 15.616 6.631 -3.582 1.00 0.00 O ATOM 43 CB MET A 357 14.284 9.536 -3.952 1.00 0.00 C ATOM 44 CG MET A 357 13.475 9.819 -2.694 1.00 0.00 C ATOM 45 SD MET A 357 11.706 9.980 -3.008 1.00 0.00 S ATOM 46 CE MET A 357 11.685 11.345 -4.168 1.00 0.00 C ATOM 0 H MET A 357 12.050 8.788 -4.733 1.00 0.00 H new ATOM 0 HA MET A 357 14.655 8.059 -5.462 1.00 0.00 H new ATOM 0 HB2 MET A 357 15.344 9.635 -3.717 1.00 0.00 H new ATOM 0 HB3 MET A 357 14.051 10.296 -4.698 1.00 0.00 H new ATOM 0 HG2 MET A 357 13.638 9.015 -1.976 1.00 0.00 H new ATOM 0 HG3 MET A 357 13.841 10.737 -2.233 1.00 0.00 H new ATOM 0 HE1 MET A 357 10.815 11.973 -3.975 1.00 0.00 H new ATOM 0 HE2 MET A 357 12.593 11.936 -4.051 1.00 0.00 H new ATOM 0 HE3 MET A 357 11.634 10.957 -5.185 1.00 0.00 H new ATOM 56 N LEU A 358 13.516 6.594 -2.768 1.00 0.00 N ATOM 57 CA LEU A 358 13.797 5.539 -1.794 1.00 0.00 C ATOM 58 C LEU A 358 14.120 4.218 -2.497 1.00 0.00 C ATOM 59 O LEU A 358 14.778 4.205 -3.539 1.00 0.00 O ATOM 60 CB LEU A 358 12.608 5.348 -0.841 1.00 0.00 C ATOM 61 CG LEU A 358 12.403 6.456 0.201 1.00 0.00 C ATOM 62 CD1 LEU A 358 13.658 6.645 1.038 1.00 0.00 C ATOM 63 CD2 LEU A 358 12.002 7.761 -0.467 1.00 0.00 C ATOM 0 H LEU A 358 12.554 6.933 -2.757 1.00 0.00 H new ATOM 0 HA LEU A 358 14.667 5.846 -1.213 1.00 0.00 H new ATOM 0 HB2 LEU A 358 11.699 5.263 -1.437 1.00 0.00 H new ATOM 0 HB3 LEU A 358 12.735 4.401 -0.317 1.00 0.00 H new ATOM 0 HG LEU A 358 11.592 6.152 0.863 1.00 0.00 H new ATOM 0 HD11 LEU A 358 13.491 7.435 1.770 1.00 0.00 H new ATOM 0 HD12 LEU A 358 13.894 5.715 1.555 1.00 0.00 H new ATOM 0 HD13 LEU A 358 14.490 6.921 0.390 1.00 0.00 H new ATOM 0 HD21 LEU A 358 11.863 8.531 0.292 1.00 0.00 H new ATOM 0 HD22 LEU A 358 12.785 8.071 -1.159 1.00 0.00 H new ATOM 0 HD23 LEU A 358 11.070 7.618 -1.014 1.00 0.00 H new ATOM 75 N GLU A 359 13.655 3.108 -1.926 1.00 0.00 N ATOM 76 CA GLU A 359 13.896 1.789 -2.502 1.00 0.00 C ATOM 77 C GLU A 359 13.135 0.714 -1.742 1.00 0.00 C ATOM 78 O GLU A 359 12.543 -0.188 -2.334 1.00 0.00 O ATOM 79 CB GLU A 359 15.394 1.469 -2.496 1.00 0.00 C ATOM 80 CG GLU A 359 15.731 0.113 -3.097 1.00 0.00 C ATOM 81 CD GLU A 359 15.297 -0.009 -4.544 1.00 0.00 C ATOM 82 OE1 GLU A 359 15.765 0.797 -5.375 1.00 0.00 O ATOM 83 OE2 GLU A 359 14.490 -0.914 -4.847 1.00 0.00 O ATOM 0 H GLU A 359 13.109 3.097 -1.064 1.00 0.00 H new ATOM 0 HA GLU A 359 13.538 1.803 -3.531 1.00 0.00 H new ATOM 0 HB2 GLU A 359 15.924 2.244 -3.049 1.00 0.00 H new ATOM 0 HB3 GLU A 359 15.760 1.503 -1.470 1.00 0.00 H new ATOM 0 HG2 GLU A 359 16.806 -0.053 -3.029 1.00 0.00 H new ATOM 0 HG3 GLU A 359 15.250 -0.670 -2.510 1.00 0.00 H new ATOM 90 N VAL A 360 13.159 0.825 -0.426 1.00 0.00 N ATOM 91 CA VAL A 360 12.477 -0.128 0.443 1.00 0.00 C ATOM 92 C VAL A 360 10.964 -0.041 0.273 1.00 0.00 C ATOM 93 O VAL A 360 10.389 1.047 0.307 1.00 0.00 O ATOM 94 CB VAL A 360 12.835 0.108 1.923 1.00 0.00 C ATOM 95 CG1 VAL A 360 12.169 -0.934 2.810 1.00 0.00 C ATOM 96 CG2 VAL A 360 14.344 0.095 2.115 1.00 0.00 C ATOM 0 H VAL A 360 13.646 1.570 0.071 1.00 0.00 H new ATOM 0 HA VAL A 360 12.814 -1.123 0.151 1.00 0.00 H new ATOM 0 HB VAL A 360 12.462 1.090 2.215 1.00 0.00 H new ATOM 0 HG11 VAL A 360 12.435 -0.749 3.851 1.00 0.00 H new ATOM 0 HG12 VAL A 360 11.087 -0.871 2.695 1.00 0.00 H new ATOM 0 HG13 VAL A 360 12.508 -1.929 2.520 1.00 0.00 H new ATOM 0 HG21 VAL A 360 14.579 0.263 3.166 1.00 0.00 H new ATOM 0 HG22 VAL A 360 14.742 -0.871 1.805 1.00 0.00 H new ATOM 0 HG23 VAL A 360 14.794 0.884 1.512 1.00 0.00 H new ATOM 106 N LEU A 361 10.325 -1.193 0.092 1.00 0.00 N ATOM 107 CA LEU A 361 8.876 -1.247 -0.082 1.00 0.00 C ATOM 108 C LEU A 361 8.156 -0.904 1.218 1.00 0.00 C ATOM 109 O LEU A 361 7.360 0.034 1.268 1.00 0.00 O ATOM 110 CB LEU A 361 8.443 -2.634 -0.568 1.00 0.00 C ATOM 111 CG LEU A 361 8.846 -2.989 -2.005 1.00 0.00 C ATOM 112 CD1 LEU A 361 10.359 -3.056 -2.151 1.00 0.00 C ATOM 113 CD2 LEU A 361 8.214 -4.308 -2.422 1.00 0.00 C ATOM 0 H LEU A 361 10.787 -2.102 0.062 1.00 0.00 H new ATOM 0 HA LEU A 361 8.603 -0.507 -0.834 1.00 0.00 H new ATOM 0 HB2 LEU A 361 8.864 -3.382 0.104 1.00 0.00 H new ATOM 0 HB3 LEU A 361 7.358 -2.706 -0.486 1.00 0.00 H new ATOM 0 HG LEU A 361 8.479 -2.200 -2.662 1.00 0.00 H new ATOM 0 HD11 LEU A 361 10.614 -3.310 -3.180 1.00 0.00 H new ATOM 0 HD12 LEU A 361 10.792 -2.088 -1.897 1.00 0.00 H new ATOM 0 HD13 LEU A 361 10.756 -3.818 -1.480 1.00 0.00 H new ATOM 0 HD21 LEU A 361 8.509 -4.546 -3.444 1.00 0.00 H new ATOM 0 HD22 LEU A 361 8.550 -5.100 -1.753 1.00 0.00 H new ATOM 0 HD23 LEU A 361 7.129 -4.224 -2.368 1.00 0.00 H new ATOM 125 N THR A 362 8.446 -1.668 2.270 1.00 0.00 N ATOM 126 CA THR A 362 7.830 -1.447 3.575 1.00 0.00 C ATOM 127 C THR A 362 8.422 -2.386 4.626 1.00 0.00 C ATOM 128 O THR A 362 7.701 -2.950 5.450 1.00 0.00 O ATOM 129 CB THR A 362 6.299 -1.643 3.513 1.00 0.00 C ATOM 130 OG1 THR A 362 5.722 -1.438 4.808 1.00 0.00 O ATOM 131 CG2 THR A 362 5.947 -3.035 3.007 1.00 0.00 C ATOM 0 H THR A 362 9.105 -2.446 2.243 1.00 0.00 H new ATOM 0 HA THR A 362 8.040 -0.416 3.860 1.00 0.00 H new ATOM 0 HB THR A 362 5.893 -0.910 2.817 1.00 0.00 H new ATOM 0 HG1 THR A 362 6.156 -2.031 5.457 1.00 0.00 H new ATOM 0 HG21 THR A 362 4.863 -3.147 2.973 1.00 0.00 H new ATOM 0 HG22 THR A 362 6.358 -3.173 2.007 1.00 0.00 H new ATOM 0 HG23 THR A 362 6.368 -3.783 3.678 1.00 0.00 H new ATOM 139 N GLN A 363 9.741 -2.547 4.591 1.00 0.00 N ATOM 140 CA GLN A 363 10.429 -3.416 5.539 1.00 0.00 C ATOM 141 C GLN A 363 10.353 -2.851 6.954 1.00 0.00 C ATOM 142 O GLN A 363 11.051 -1.894 7.289 1.00 0.00 O ATOM 143 CB GLN A 363 11.894 -3.600 5.132 1.00 0.00 C ATOM 144 CG GLN A 363 12.676 -4.521 6.058 1.00 0.00 C ATOM 145 CD GLN A 363 12.197 -5.965 6.020 1.00 0.00 C ATOM 146 OE1 GLN A 363 11.267 -6.271 5.119 1.00 0.00 O flip ATOM 147 NE2 GLN A 363 12.669 -6.802 6.789 1.00 0.00 N flip ATOM 0 H GLN A 363 10.354 -2.088 3.917 1.00 0.00 H new ATOM 0 HA GLN A 363 9.931 -4.385 5.525 1.00 0.00 H new ATOM 0 HB2 GLN A 363 11.933 -4.000 4.119 1.00 0.00 H new ATOM 0 HB3 GLN A 363 12.380 -2.625 5.108 1.00 0.00 H new ATOM 0 HG2 GLN A 363 13.731 -4.489 5.785 1.00 0.00 H new ATOM 0 HG3 GLN A 363 12.600 -4.147 7.079 1.00 0.00 H new ATOM 0 HE21 GLN A 363 13.381 -6.528 7.466 1.00 0.00 H new ATOM 0 HE22 GLN A 363 12.348 -7.769 6.749 1.00 0.00 H new ATOM 156 N LYS A 364 9.505 -3.456 7.779 1.00 0.00 N ATOM 157 CA LYS A 364 9.338 -3.026 9.163 1.00 0.00 C ATOM 158 C LYS A 364 8.741 -4.147 10.008 1.00 0.00 C ATOM 159 O LYS A 364 8.632 -5.286 9.552 1.00 0.00 O ATOM 160 CB LYS A 364 8.455 -1.777 9.234 1.00 0.00 C ATOM 161 CG LYS A 364 7.121 -1.930 8.520 1.00 0.00 C ATOM 162 CD LYS A 364 6.278 -0.667 8.629 1.00 0.00 C ATOM 163 CE LYS A 364 6.988 0.538 8.027 1.00 0.00 C ATOM 164 NZ LYS A 364 7.325 0.327 6.592 1.00 0.00 N ATOM 0 H LYS A 364 8.921 -4.248 7.512 1.00 0.00 H new ATOM 0 HA LYS A 364 10.321 -2.780 9.564 1.00 0.00 H new ATOM 0 HB2 LYS A 364 8.271 -1.532 10.280 1.00 0.00 H new ATOM 0 HB3 LYS A 364 8.995 -0.936 8.800 1.00 0.00 H new ATOM 0 HG2 LYS A 364 7.295 -2.162 7.469 1.00 0.00 H new ATOM 0 HG3 LYS A 364 6.574 -2.771 8.946 1.00 0.00 H new ATOM 0 HD2 LYS A 364 5.326 -0.820 8.121 1.00 0.00 H new ATOM 0 HD3 LYS A 364 6.052 -0.470 9.677 1.00 0.00 H new ATOM 0 HE2 LYS A 364 6.353 1.419 8.125 1.00 0.00 H new ATOM 0 HE3 LYS A 364 7.901 0.739 8.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 364 7.353 1.245 6.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 364 8.254 -0.134 6.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 364 6.603 -0.278 6.151 1.00 0.00 H new ATOM 178 N HIS A 365 8.358 -3.821 11.239 1.00 0.00 N ATOM 179 CA HIS A 365 7.773 -4.808 12.142 1.00 0.00 C ATOM 180 C HIS A 365 6.298 -5.047 11.826 1.00 0.00 C ATOM 181 O HIS A 365 5.495 -5.306 12.722 1.00 0.00 O ATOM 182 CB HIS A 365 7.929 -4.354 13.596 1.00 0.00 C ATOM 183 CG HIS A 365 9.355 -4.242 14.047 1.00 0.00 C ATOM 184 ND1 HIS A 365 9.709 -3.856 15.323 1.00 0.00 N ATOM 185 CD2 HIS A 365 10.519 -4.471 13.390 1.00 0.00 C ATOM 186 CE1 HIS A 365 11.027 -3.851 15.431 1.00 0.00 C ATOM 187 NE2 HIS A 365 11.541 -4.221 14.273 1.00 0.00 N ATOM 0 H HIS A 365 8.442 -2.884 11.634 1.00 0.00 H new ATOM 0 HA HIS A 365 8.306 -5.748 11.999 1.00 0.00 H new ATOM 0 HB2 HIS A 365 7.442 -3.387 13.719 1.00 0.00 H new ATOM 0 HB3 HIS A 365 7.407 -5.058 14.244 1.00 0.00 H new ATOM 0 HD2 HIS A 365 10.623 -4.790 12.364 1.00 0.00 H new ATOM 0 HE1 HIS A 365 11.587 -3.589 16.316 1.00 0.00 H new ATOM 0 HE2 HIS A 365 12.536 -4.307 14.067 1.00 0.00 H new ATOM 196 N LYS A 366 5.947 -4.966 10.546 1.00 0.00 N ATOM 197 CA LYS A 366 4.573 -5.181 10.112 1.00 0.00 C ATOM 198 C LYS A 366 4.283 -6.674 9.966 1.00 0.00 C ATOM 199 O LYS A 366 5.097 -7.415 9.414 1.00 0.00 O ATOM 200 CB LYS A 366 4.318 -4.465 8.783 1.00 0.00 C ATOM 201 CG LYS A 366 2.892 -4.608 8.274 1.00 0.00 C ATOM 202 CD LYS A 366 2.701 -3.910 6.935 1.00 0.00 C ATOM 203 CE LYS A 366 2.937 -2.412 7.040 1.00 0.00 C ATOM 204 NZ LYS A 366 2.749 -1.728 5.731 1.00 0.00 N ATOM 0 H LYS A 366 6.598 -4.752 9.790 1.00 0.00 H new ATOM 0 HA LYS A 366 3.906 -4.769 10.869 1.00 0.00 H new ATOM 0 HB2 LYS A 366 4.547 -3.406 8.901 1.00 0.00 H new ATOM 0 HB3 LYS A 366 5.003 -4.858 8.032 1.00 0.00 H new ATOM 0 HG2 LYS A 366 2.646 -5.665 8.172 1.00 0.00 H new ATOM 0 HG3 LYS A 366 2.201 -4.189 9.005 1.00 0.00 H new ATOM 0 HD2 LYS A 366 3.387 -4.335 6.202 1.00 0.00 H new ATOM 0 HD3 LYS A 366 1.690 -4.094 6.570 1.00 0.00 H new ATOM 0 HE2 LYS A 366 2.252 -1.987 7.774 1.00 0.00 H new ATOM 0 HE3 LYS A 366 3.948 -2.228 7.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 366 2.274 -0.815 5.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 366 3.676 -1.567 5.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 366 2.166 -2.323 5.109 1.00 0.00 H new ATOM 218 N PRO A 367 3.116 -7.141 10.451 1.00 0.00 N ATOM 219 CA PRO A 367 2.736 -8.551 10.359 1.00 0.00 C ATOM 220 C PRO A 367 2.241 -8.927 8.964 1.00 0.00 C ATOM 221 O PRO A 367 1.297 -9.704 8.817 1.00 0.00 O ATOM 222 CB PRO A 367 1.614 -8.671 11.378 1.00 0.00 C ATOM 223 CG PRO A 367 0.980 -7.328 11.405 1.00 0.00 C ATOM 224 CD PRO A 367 2.076 -6.334 11.121 1.00 0.00 C ATOM 0 HA PRO A 367 3.576 -9.219 10.548 1.00 0.00 H new ATOM 0 HB2 PRO A 367 0.898 -9.441 11.089 1.00 0.00 H new ATOM 0 HB3 PRO A 367 1.999 -8.946 12.360 1.00 0.00 H new ATOM 0 HG2 PRO A 367 0.189 -7.257 10.659 1.00 0.00 H new ATOM 0 HG3 PRO A 367 0.522 -7.134 12.375 1.00 0.00 H new ATOM 0 HD2 PRO A 367 1.725 -5.523 10.483 1.00 0.00 H new ATOM 0 HD3 PRO A 367 2.451 -5.879 12.038 1.00 0.00 H new ATOM 232 N ALA A 368 2.890 -8.367 7.945 1.00 0.00 N ATOM 233 CA ALA A 368 2.529 -8.629 6.555 1.00 0.00 C ATOM 234 C ALA A 368 3.479 -7.906 5.605 1.00 0.00 C ATOM 235 O ALA A 368 3.901 -6.781 5.873 1.00 0.00 O ATOM 236 CB ALA A 368 1.092 -8.206 6.287 1.00 0.00 C ATOM 0 H ALA A 368 3.674 -7.724 8.059 1.00 0.00 H new ATOM 0 HA ALA A 368 2.615 -9.701 6.378 1.00 0.00 H new ATOM 0 HB1 ALA A 368 0.841 -8.409 5.246 1.00 0.00 H new ATOM 0 HB2 ALA A 368 0.420 -8.766 6.938 1.00 0.00 H new ATOM 0 HB3 ALA A 368 0.984 -7.140 6.485 1.00 0.00 H new ATOM 242 N GLU A 369 3.811 -8.557 4.494 1.00 0.00 N ATOM 243 CA GLU A 369 4.713 -7.974 3.506 1.00 0.00 C ATOM 244 C GLU A 369 4.232 -8.269 2.089 1.00 0.00 C ATOM 245 O GLU A 369 3.847 -9.397 1.776 1.00 0.00 O ATOM 246 CB GLU A 369 6.133 -8.509 3.695 1.00 0.00 C ATOM 247 CG GLU A 369 6.738 -8.168 5.047 1.00 0.00 C ATOM 248 CD GLU A 369 8.153 -8.693 5.206 1.00 0.00 C ATOM 249 OE1 GLU A 369 8.668 -9.315 4.252 1.00 0.00 O ATOM 250 OE2 GLU A 369 8.746 -8.481 6.284 1.00 0.00 O ATOM 0 H GLU A 369 3.469 -9.488 4.255 1.00 0.00 H new ATOM 0 HA GLU A 369 4.719 -6.894 3.653 1.00 0.00 H new ATOM 0 HB2 GLU A 369 6.123 -9.592 3.574 1.00 0.00 H new ATOM 0 HB3 GLU A 369 6.772 -8.106 2.909 1.00 0.00 H new ATOM 0 HG2 GLU A 369 6.740 -7.086 5.177 1.00 0.00 H new ATOM 0 HG3 GLU A 369 6.110 -8.583 5.836 1.00 0.00 H new ATOM 257 N SER A 370 4.259 -7.247 1.238 1.00 0.00 N ATOM 258 CA SER A 370 3.827 -7.387 -0.150 1.00 0.00 C ATOM 259 C SER A 370 4.067 -6.084 -0.914 1.00 0.00 C ATOM 260 O SER A 370 5.133 -5.480 -0.796 1.00 0.00 O ATOM 261 CB SER A 370 2.346 -7.781 -0.205 1.00 0.00 C ATOM 262 OG SER A 370 1.935 -8.051 -1.535 1.00 0.00 O ATOM 0 H SER A 370 4.576 -6.310 1.486 1.00 0.00 H new ATOM 0 HA SER A 370 4.412 -8.175 -0.623 1.00 0.00 H new ATOM 0 HB2 SER A 370 2.178 -8.661 0.416 1.00 0.00 H new ATOM 0 HB3 SER A 370 1.738 -6.977 0.210 1.00 0.00 H new ATOM 0 HG SER A 370 0.987 -8.301 -1.540 1.00 0.00 H new ATOM 268 N GLN A 371 3.077 -5.648 -1.693 1.00 0.00 N ATOM 269 CA GLN A 371 3.199 -4.415 -2.460 1.00 0.00 C ATOM 270 C GLN A 371 3.385 -3.221 -1.532 1.00 0.00 C ATOM 271 O GLN A 371 2.668 -3.078 -0.542 1.00 0.00 O ATOM 272 CB GLN A 371 1.958 -4.212 -3.335 1.00 0.00 C ATOM 273 CG GLN A 371 1.744 -5.318 -4.354 1.00 0.00 C ATOM 274 CD GLN A 371 0.486 -5.130 -5.187 1.00 0.00 C ATOM 275 OE1 GLN A 371 -0.270 -4.073 -4.908 1.00 0.00 O flip ATOM 276 NE2 GLN A 371 0.194 -5.934 -6.074 1.00 0.00 N flip ATOM 0 H GLN A 371 2.186 -6.131 -1.807 1.00 0.00 H new ATOM 0 HA GLN A 371 4.077 -4.495 -3.102 1.00 0.00 H new ATOM 0 HB2 GLN A 371 1.079 -4.145 -2.694 1.00 0.00 H new ATOM 0 HB3 GLN A 371 2.044 -3.260 -3.858 1.00 0.00 H new ATOM 0 HG2 GLN A 371 2.608 -5.364 -5.017 1.00 0.00 H new ATOM 0 HG3 GLN A 371 1.689 -6.275 -3.835 1.00 0.00 H new ATOM 0 HE21 GLN A 371 0.801 -6.733 -6.258 1.00 0.00 H new ATOM 0 HE22 GLN A 371 -0.654 -5.800 -6.624 1.00 0.00 H new ATOM 285 N GLN A 372 4.353 -2.367 -1.855 1.00 0.00 N ATOM 286 CA GLN A 372 4.632 -1.188 -1.045 1.00 0.00 C ATOM 287 C GLN A 372 3.386 -0.318 -0.905 1.00 0.00 C ATOM 288 O GLN A 372 2.709 -0.022 -1.890 1.00 0.00 O ATOM 289 CB GLN A 372 5.778 -0.378 -1.658 1.00 0.00 C ATOM 290 CG GLN A 372 5.509 0.088 -3.081 1.00 0.00 C ATOM 291 CD GLN A 372 6.673 0.861 -3.670 1.00 0.00 C ATOM 292 OE1 GLN A 372 7.784 0.343 -3.782 1.00 0.00 O ATOM 293 NE2 GLN A 372 6.424 2.108 -4.051 1.00 0.00 N ATOM 0 H GLN A 372 4.956 -2.471 -2.671 1.00 0.00 H new ATOM 0 HA GLN A 372 4.930 -1.521 -0.051 1.00 0.00 H new ATOM 0 HB2 GLN A 372 5.971 0.493 -1.031 1.00 0.00 H new ATOM 0 HB3 GLN A 372 6.684 -0.984 -1.649 1.00 0.00 H new ATOM 0 HG2 GLN A 372 5.297 -0.777 -3.709 1.00 0.00 H new ATOM 0 HG3 GLN A 372 4.618 0.716 -3.092 1.00 0.00 H new ATOM 0 HE21 GLN A 372 5.488 2.498 -3.940 1.00 0.00 H new ATOM 0 HE22 GLN A 372 7.169 2.676 -4.455 1.00 0.00 H new ATOM 302 N GLN A 373 3.086 0.082 0.327 1.00 0.00 N ATOM 303 CA GLN A 373 1.917 0.911 0.600 1.00 0.00 C ATOM 304 C GLN A 373 2.040 2.268 -0.086 1.00 0.00 C ATOM 305 O GLN A 373 2.876 3.090 0.289 1.00 0.00 O ATOM 306 CB GLN A 373 1.748 1.102 2.108 1.00 0.00 C ATOM 307 CG GLN A 373 0.505 1.888 2.490 1.00 0.00 C ATOM 308 CD GLN A 373 0.394 2.105 3.986 1.00 0.00 C ATOM 309 OE1 GLN A 373 -0.663 1.570 4.585 1.00 0.00 O flip ATOM 310 NE2 GLN A 373 1.252 2.742 4.598 1.00 0.00 N flip ATOM 0 H GLN A 373 3.637 -0.155 1.152 1.00 0.00 H new ATOM 0 HA GLN A 373 1.038 0.403 0.202 1.00 0.00 H new ATOM 0 HB2 GLN A 373 1.710 0.124 2.587 1.00 0.00 H new ATOM 0 HB3 GLN A 373 2.626 1.615 2.501 1.00 0.00 H new ATOM 0 HG2 GLN A 373 0.521 2.854 1.986 1.00 0.00 H new ATOM 0 HG3 GLN A 373 -0.379 1.358 2.136 1.00 0.00 H new ATOM 0 HE21 GLN A 373 2.049 3.136 4.097 1.00 0.00 H new ATOM 0 HE22 GLN A 373 1.166 2.876 5.606 1.00 0.00 H new ATOM 319 N ALA A 374 1.199 2.496 -1.090 1.00 0.00 N ATOM 320 CA ALA A 374 1.211 3.754 -1.825 1.00 0.00 C ATOM 321 C ALA A 374 -0.179 4.384 -1.861 1.00 0.00 C ATOM 322 O ALA A 374 -1.169 3.702 -2.122 1.00 0.00 O ATOM 323 CB ALA A 374 1.731 3.535 -3.237 1.00 0.00 C ATOM 0 H ALA A 374 0.501 1.826 -1.412 1.00 0.00 H new ATOM 0 HA ALA A 374 1.879 4.442 -1.307 1.00 0.00 H new ATOM 0 HB1 ALA A 374 1.734 4.483 -3.775 1.00 0.00 H new ATOM 0 HB2 ALA A 374 2.745 3.139 -3.194 1.00 0.00 H new ATOM 0 HB3 ALA A 374 1.086 2.826 -3.756 1.00 0.00 H new ATOM 329 N ALA A 375 -0.243 5.687 -1.605 1.00 0.00 N ATOM 330 CA ALA A 375 -1.512 6.405 -1.617 1.00 0.00 C ATOM 331 C ALA A 375 -2.178 6.302 -2.985 1.00 0.00 C ATOM 332 O ALA A 375 -1.840 7.042 -3.909 1.00 0.00 O ATOM 333 CB ALA A 375 -1.298 7.864 -1.241 1.00 0.00 C ATOM 0 H ALA A 375 0.568 6.266 -1.387 1.00 0.00 H new ATOM 0 HA ALA A 375 -2.172 5.947 -0.880 1.00 0.00 H new ATOM 0 HB1 ALA A 375 -2.254 8.387 -1.254 1.00 0.00 H new ATOM 0 HB2 ALA A 375 -0.866 7.923 -0.242 1.00 0.00 H new ATOM 0 HB3 ALA A 375 -0.620 8.329 -1.957 1.00 0.00 H new ATOM 339 N GLU A 376 -3.119 5.374 -3.105 1.00 0.00 N ATOM 340 CA GLU A 376 -3.833 5.159 -4.356 1.00 0.00 C ATOM 341 C GLU A 376 -4.794 6.313 -4.643 1.00 0.00 C ATOM 342 O GLU A 376 -4.560 7.445 -4.220 1.00 0.00 O ATOM 343 CB GLU A 376 -4.591 3.829 -4.293 1.00 0.00 C ATOM 344 CG GLU A 376 -3.722 2.650 -3.882 1.00 0.00 C ATOM 345 CD GLU A 376 -2.633 2.339 -4.893 1.00 0.00 C ATOM 346 OE1 GLU A 376 -1.760 3.203 -5.116 1.00 0.00 O ATOM 347 OE2 GLU A 376 -2.654 1.226 -5.463 1.00 0.00 O ATOM 0 H GLU A 376 -3.406 4.755 -2.346 1.00 0.00 H new ATOM 0 HA GLU A 376 -3.109 5.120 -5.170 1.00 0.00 H new ATOM 0 HB2 GLU A 376 -5.416 3.924 -3.588 1.00 0.00 H new ATOM 0 HB3 GLU A 376 -5.029 3.624 -5.270 1.00 0.00 H new ATOM 0 HG2 GLU A 376 -3.264 2.862 -2.916 1.00 0.00 H new ATOM 0 HG3 GLU A 376 -4.351 1.770 -3.751 1.00 0.00 H new ATOM 354 N THR A 377 -5.873 6.017 -5.364 1.00 0.00 N ATOM 355 CA THR A 377 -6.871 7.020 -5.715 1.00 0.00 C ATOM 356 C THR A 377 -8.245 6.383 -5.845 1.00 0.00 C ATOM 357 O THR A 377 -8.359 5.177 -6.047 1.00 0.00 O ATOM 358 CB THR A 377 -6.520 7.735 -7.036 1.00 0.00 C ATOM 359 OG1 THR A 377 -6.474 6.787 -8.108 1.00 0.00 O ATOM 360 CG2 THR A 377 -5.181 8.450 -6.928 1.00 0.00 C ATOM 0 H THR A 377 -6.078 5.083 -5.718 1.00 0.00 H new ATOM 0 HA THR A 377 -6.880 7.757 -4.912 1.00 0.00 H new ATOM 0 HB THR A 377 -7.293 8.476 -7.238 1.00 0.00 H new ATOM 0 HG1 THR A 377 -6.252 7.249 -8.944 1.00 0.00 H new ATOM 0 HG21 THR A 377 -4.956 8.946 -7.872 1.00 0.00 H new ATOM 0 HG22 THR A 377 -5.228 9.192 -6.130 1.00 0.00 H new ATOM 0 HG23 THR A 377 -4.398 7.725 -6.704 1.00 0.00 H new ATOM 368 N GLU A 378 -9.286 7.199 -5.709 1.00 0.00 N ATOM 369 CA GLU A 378 -10.656 6.709 -5.792 1.00 0.00 C ATOM 370 C GLU A 378 -10.852 5.825 -7.015 1.00 0.00 C ATOM 371 O GLU A 378 -11.534 4.803 -6.953 1.00 0.00 O ATOM 372 CB GLU A 378 -11.637 7.879 -5.834 1.00 0.00 C ATOM 373 CG GLU A 378 -13.092 7.452 -5.740 1.00 0.00 C ATOM 374 CD GLU A 378 -14.054 8.621 -5.829 1.00 0.00 C ATOM 375 OE1 GLU A 378 -13.584 9.771 -5.959 1.00 0.00 O ATOM 376 OE2 GLU A 378 -15.280 8.386 -5.768 1.00 0.00 O ATOM 0 H GLU A 378 -9.206 8.202 -5.541 1.00 0.00 H new ATOM 0 HA GLU A 378 -10.850 6.110 -4.902 1.00 0.00 H new ATOM 0 HB2 GLU A 378 -11.413 8.561 -5.014 1.00 0.00 H new ATOM 0 HB3 GLU A 378 -11.488 8.435 -6.760 1.00 0.00 H new ATOM 0 HG2 GLU A 378 -13.311 6.745 -6.540 1.00 0.00 H new ATOM 0 HG3 GLU A 378 -13.252 6.927 -4.798 1.00 0.00 H new ATOM 383 N GLY A 379 -10.253 6.230 -8.125 1.00 0.00 N ATOM 384 CA GLY A 379 -10.374 5.469 -9.353 1.00 0.00 C ATOM 385 C GLY A 379 -9.759 4.087 -9.265 1.00 0.00 C ATOM 386 O GLY A 379 -10.311 3.124 -9.797 1.00 0.00 O ATOM 0 H GLY A 379 -9.684 7.073 -8.198 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -11.429 5.374 -9.611 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -9.896 6.021 -10.163 1.00 0.00 H new ATOM 390 N SER A 380 -8.611 3.985 -8.606 1.00 0.00 N ATOM 391 CA SER A 380 -7.925 2.701 -8.475 1.00 0.00 C ATOM 392 C SER A 380 -8.608 1.799 -7.449 1.00 0.00 C ATOM 393 O SER A 380 -8.797 0.607 -7.690 1.00 0.00 O ATOM 394 CB SER A 380 -6.462 2.917 -8.086 1.00 0.00 C ATOM 395 OG SER A 380 -6.355 3.601 -6.852 1.00 0.00 O ATOM 0 H SER A 380 -8.137 4.768 -8.156 1.00 0.00 H new ATOM 0 HA SER A 380 -7.972 2.204 -9.444 1.00 0.00 H new ATOM 0 HB2 SER A 380 -5.956 1.954 -8.016 1.00 0.00 H new ATOM 0 HB3 SER A 380 -5.956 3.487 -8.865 1.00 0.00 H new ATOM 0 HG SER A 380 -7.177 4.108 -6.687 1.00 0.00 H new ATOM 401 N CYS A 381 -8.964 2.373 -6.306 1.00 0.00 N ATOM 402 CA CYS A 381 -9.612 1.623 -5.232 1.00 0.00 C ATOM 403 C CYS A 381 -10.855 0.887 -5.719 1.00 0.00 C ATOM 404 O CYS A 381 -11.031 -0.299 -5.436 1.00 0.00 O ATOM 405 CB CYS A 381 -9.986 2.564 -4.089 1.00 0.00 C ATOM 406 SG CYS A 381 -8.555 3.322 -3.257 1.00 0.00 S ATOM 0 H CYS A 381 -8.815 3.360 -6.097 1.00 0.00 H new ATOM 0 HA CYS A 381 -8.900 0.877 -4.879 1.00 0.00 H new ATOM 0 HB2 CYS A 381 -10.628 3.354 -4.478 1.00 0.00 H new ATOM 0 HB3 CYS A 381 -10.571 2.011 -3.353 1.00 0.00 H new ATOM 411 N ASN A 382 -11.713 1.592 -6.447 1.00 0.00 N ATOM 412 CA ASN A 382 -12.942 0.999 -6.964 1.00 0.00 C ATOM 413 C ASN A 382 -12.637 -0.275 -7.739 1.00 0.00 C ATOM 414 O ASN A 382 -13.389 -1.249 -7.682 1.00 0.00 O ATOM 415 CB ASN A 382 -13.672 1.989 -7.877 1.00 0.00 C ATOM 416 CG ASN A 382 -14.009 3.301 -7.187 1.00 0.00 C ATOM 417 OD1 ASN A 382 -13.629 3.432 -5.920 1.00 0.00 O flip ATOM 418 ND2 ASN A 382 -14.605 4.192 -7.792 1.00 0.00 N flip ATOM 0 H ASN A 382 -11.581 2.573 -6.693 1.00 0.00 H new ATOM 0 HA ASN A 382 -13.582 0.755 -6.116 1.00 0.00 H new ATOM 0 HB2 ASN A 382 -13.052 2.193 -8.750 1.00 0.00 H new ATOM 0 HB3 ASN A 382 -14.592 1.529 -8.239 1.00 0.00 H new ATOM 0 HD21 ASN A 382 -14.880 4.053 -8.764 1.00 0.00 H new ATOM 0 HD22 ASN A 382 -14.824 5.070 -7.321 1.00 0.00 H new ATOM 425 N LYS A 383 -11.533 -0.251 -8.471 1.00 0.00 N ATOM 426 CA LYS A 383 -11.118 -1.389 -9.275 1.00 0.00 C ATOM 427 C LYS A 383 -10.464 -2.471 -8.417 1.00 0.00 C ATOM 428 O LYS A 383 -10.565 -3.659 -8.722 1.00 0.00 O ATOM 429 CB LYS A 383 -10.148 -0.927 -10.362 1.00 0.00 C ATOM 430 CG LYS A 383 -10.634 0.299 -11.125 1.00 0.00 C ATOM 431 CD LYS A 383 -11.980 0.057 -11.792 1.00 0.00 C ATOM 432 CE LYS A 383 -11.897 -1.035 -12.847 1.00 0.00 C ATOM 433 NZ LYS A 383 -10.929 -0.692 -13.925 1.00 0.00 N ATOM 0 H LYS A 383 -10.905 0.551 -8.524 1.00 0.00 H new ATOM 0 HA LYS A 383 -12.007 -1.820 -9.736 1.00 0.00 H new ATOM 0 HB2 LYS A 383 -9.183 -0.704 -9.907 1.00 0.00 H new ATOM 0 HB3 LYS A 383 -9.987 -1.744 -11.066 1.00 0.00 H new ATOM 0 HG2 LYS A 383 -10.715 1.144 -10.441 1.00 0.00 H new ATOM 0 HG3 LYS A 383 -9.898 0.571 -11.882 1.00 0.00 H new ATOM 0 HD2 LYS A 383 -12.715 -0.222 -11.037 1.00 0.00 H new ATOM 0 HD3 LYS A 383 -12.330 0.981 -12.252 1.00 0.00 H new ATOM 0 HE2 LYS A 383 -11.600 -1.972 -12.377 1.00 0.00 H new ATOM 0 HE3 LYS A 383 -12.883 -1.195 -13.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 383 -11.069 -1.331 -14.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 383 -11.082 0.291 -14.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 383 -9.958 -0.796 -13.566 1.00 0.00 H new ATOM 447 N LYS A 384 -9.772 -2.054 -7.357 1.00 0.00 N ATOM 448 CA LYS A 384 -9.087 -2.985 -6.483 1.00 0.00 C ATOM 449 C LYS A 384 -10.035 -3.963 -5.820 1.00 0.00 C ATOM 450 O LYS A 384 -11.088 -3.590 -5.302 1.00 0.00 O ATOM 451 CB LYS A 384 -8.290 -2.225 -5.432 1.00 0.00 C ATOM 452 CG LYS A 384 -7.203 -1.413 -6.058 1.00 0.00 C ATOM 453 CD LYS A 384 -6.190 -2.317 -6.682 1.00 0.00 C ATOM 454 CE LYS A 384 -5.639 -1.685 -7.924 1.00 0.00 C ATOM 455 NZ LYS A 384 -4.302 -1.068 -7.704 1.00 0.00 N ATOM 0 H LYS A 384 -9.675 -1.075 -7.089 1.00 0.00 H new ATOM 0 HA LYS A 384 -8.408 -3.571 -7.103 1.00 0.00 H new ATOM 0 HB2 LYS A 384 -8.957 -1.572 -4.869 1.00 0.00 H new ATOM 0 HB3 LYS A 384 -7.858 -2.929 -4.721 1.00 0.00 H new ATOM 0 HG2 LYS A 384 -7.623 -0.747 -6.812 1.00 0.00 H new ATOM 0 HG3 LYS A 384 -6.728 -0.784 -5.306 1.00 0.00 H new ATOM 0 HD2 LYS A 384 -5.384 -2.516 -5.976 1.00 0.00 H new ATOM 0 HD3 LYS A 384 -6.646 -3.277 -6.924 1.00 0.00 H new ATOM 0 HE2 LYS A 384 -5.564 -2.438 -8.708 1.00 0.00 H new ATOM 0 HE3 LYS A 384 -6.333 -0.923 -8.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 384 -3.965 -0.645 -8.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 384 -4.376 -0.330 -6.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 384 -3.630 -1.798 -7.391 1.00 0.00 H new ATOM 469 N ASP A 385 -9.629 -5.217 -5.836 1.00 0.00 N ATOM 470 CA ASP A 385 -10.405 -6.293 -5.229 1.00 0.00 C ATOM 471 C ASP A 385 -10.294 -6.226 -3.712 1.00 0.00 C ATOM 472 O ASP A 385 -9.597 -5.367 -3.180 1.00 0.00 O ATOM 473 CB ASP A 385 -9.923 -7.656 -5.732 1.00 0.00 C ATOM 474 CG ASP A 385 -10.089 -7.813 -7.231 1.00 0.00 C ATOM 475 OD1 ASP A 385 -10.588 -6.867 -7.877 1.00 0.00 O ATOM 476 OD2 ASP A 385 -9.723 -8.884 -7.760 1.00 0.00 O ATOM 0 H ASP A 385 -8.757 -5.523 -6.267 1.00 0.00 H new ATOM 0 HA ASP A 385 -11.450 -6.169 -5.515 1.00 0.00 H new ATOM 0 HB2 ASP A 385 -8.873 -7.786 -5.470 1.00 0.00 H new ATOM 0 HB3 ASP A 385 -10.478 -8.444 -5.224 1.00 0.00 H new ATOM 481 N GLN A 386 -10.979 -7.132 -3.019 1.00 0.00 N ATOM 482 CA GLN A 386 -10.948 -7.159 -1.558 1.00 0.00 C ATOM 483 C GLN A 386 -9.515 -7.082 -1.041 1.00 0.00 C ATOM 484 O GLN A 386 -9.176 -6.196 -0.257 1.00 0.00 O ATOM 485 CB GLN A 386 -11.622 -8.430 -1.038 1.00 0.00 C ATOM 486 CG GLN A 386 -11.656 -8.522 0.479 1.00 0.00 C ATOM 487 CD GLN A 386 -12.367 -9.768 0.971 1.00 0.00 C ATOM 488 OE1 GLN A 386 -11.950 -10.889 0.682 1.00 0.00 O ATOM 489 NE2 GLN A 386 -13.449 -9.575 1.717 1.00 0.00 N ATOM 0 H GLN A 386 -11.560 -7.855 -3.443 1.00 0.00 H new ATOM 0 HA GLN A 386 -11.493 -6.289 -1.192 1.00 0.00 H new ATOM 0 HB2 GLN A 386 -12.642 -8.473 -1.419 1.00 0.00 H new ATOM 0 HB3 GLN A 386 -11.097 -9.299 -1.435 1.00 0.00 H new ATOM 0 HG2 GLN A 386 -10.636 -8.515 0.863 1.00 0.00 H new ATOM 0 HG3 GLN A 386 -12.155 -7.640 0.882 1.00 0.00 H new ATOM 0 HE21 GLN A 386 -13.758 -8.627 1.931 1.00 0.00 H new ATOM 0 HE22 GLN A 386 -13.971 -10.375 2.075 1.00 0.00 H new ATOM 498 N ASN A 387 -8.677 -8.005 -1.496 1.00 0.00 N ATOM 499 CA ASN A 387 -7.281 -8.035 -1.092 1.00 0.00 C ATOM 500 C ASN A 387 -6.532 -6.825 -1.642 1.00 0.00 C ATOM 501 O ASN A 387 -5.597 -6.323 -1.019 1.00 0.00 O ATOM 502 CB ASN A 387 -6.623 -9.326 -1.579 1.00 0.00 C ATOM 503 CG ASN A 387 -5.137 -9.354 -1.306 1.00 0.00 C ATOM 504 OD1 ASN A 387 -4.701 -9.306 -0.156 1.00 0.00 O ATOM 505 ND2 ASN A 387 -4.350 -9.430 -2.369 1.00 0.00 N ATOM 0 H ASN A 387 -8.943 -8.744 -2.147 1.00 0.00 H new ATOM 0 HA ASN A 387 -7.237 -8.000 -0.003 1.00 0.00 H new ATOM 0 HB2 ASN A 387 -7.095 -10.178 -1.090 1.00 0.00 H new ATOM 0 HB3 ASN A 387 -6.795 -9.437 -2.650 1.00 0.00 H new ATOM 0 HD21 ASN A 387 -3.337 -9.451 -2.253 1.00 0.00 H new ATOM 0 HD22 ASN A 387 -4.757 -9.468 -3.303 1.00 0.00 H new ATOM 512 N GLU A 388 -6.953 -6.364 -2.816 1.00 0.00 N ATOM 513 CA GLU A 388 -6.329 -5.217 -3.463 1.00 0.00 C ATOM 514 C GLU A 388 -6.749 -3.912 -2.803 1.00 0.00 C ATOM 515 O GLU A 388 -6.103 -2.882 -2.991 1.00 0.00 O ATOM 516 CB GLU A 388 -6.675 -5.191 -4.951 1.00 0.00 C ATOM 517 CG GLU A 388 -6.167 -6.402 -5.715 1.00 0.00 C ATOM 518 CD GLU A 388 -6.518 -6.348 -7.189 1.00 0.00 C ATOM 519 OE1 GLU A 388 -6.101 -5.384 -7.864 1.00 0.00 O ATOM 520 OE2 GLU A 388 -7.211 -7.270 -7.668 1.00 0.00 O ATOM 0 H GLU A 388 -7.728 -6.770 -3.340 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.249 -5.319 -3.352 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -7.758 -5.129 -5.063 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.257 -4.289 -5.397 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -5.085 -6.469 -5.605 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -6.589 -7.307 -5.277 1.00 0.00 H new ATOM 527 N CYS A 389 -7.830 -3.955 -2.027 1.00 0.00 N ATOM 528 CA CYS A 389 -8.308 -2.763 -1.345 1.00 0.00 C ATOM 529 C CYS A 389 -7.193 -2.227 -0.455 1.00 0.00 C ATOM 530 O CYS A 389 -6.965 -2.723 0.649 1.00 0.00 O ATOM 531 CB CYS A 389 -9.564 -3.080 -0.527 1.00 0.00 C ATOM 532 SG CYS A 389 -10.524 -1.613 -0.027 1.00 0.00 S ATOM 0 H CYS A 389 -8.384 -4.795 -1.858 1.00 0.00 H new ATOM 0 HA CYS A 389 -8.579 -2.002 -2.077 1.00 0.00 H new ATOM 0 HB2 CYS A 389 -10.207 -3.739 -1.111 1.00 0.00 H new ATOM 0 HB3 CYS A 389 -9.272 -3.630 0.367 1.00 0.00 H new ATOM 537 N LYS A 390 -6.471 -1.240 -0.973 1.00 0.00 N ATOM 538 CA LYS A 390 -5.334 -0.654 -0.268 1.00 0.00 C ATOM 539 C LYS A 390 -5.759 0.159 0.953 1.00 0.00 C ATOM 540 O LYS A 390 -6.926 0.517 1.103 1.00 0.00 O ATOM 541 CB LYS A 390 -4.523 0.206 -1.230 1.00 0.00 C ATOM 542 CG LYS A 390 -3.906 -0.591 -2.373 1.00 0.00 C ATOM 543 CD LYS A 390 -2.829 -1.541 -1.874 1.00 0.00 C ATOM 544 CE LYS A 390 -2.187 -2.305 -3.020 1.00 0.00 C ATOM 545 NZ LYS A 390 -3.184 -3.104 -3.786 1.00 0.00 N ATOM 0 H LYS A 390 -6.654 -0.825 -1.887 1.00 0.00 H new ATOM 0 HA LYS A 390 -4.717 -1.472 0.102 1.00 0.00 H new ATOM 0 HB2 LYS A 390 -5.166 0.983 -1.643 1.00 0.00 H new ATOM 0 HB3 LYS A 390 -3.730 0.709 -0.677 1.00 0.00 H new ATOM 0 HG2 LYS A 390 -4.684 -1.158 -2.884 1.00 0.00 H new ATOM 0 HG3 LYS A 390 -3.478 0.093 -3.105 1.00 0.00 H new ATOM 0 HD2 LYS A 390 -2.065 -0.978 -1.338 1.00 0.00 H new ATOM 0 HD3 LYS A 390 -3.263 -2.245 -1.164 1.00 0.00 H new ATOM 0 HE2 LYS A 390 -1.692 -1.603 -3.691 1.00 0.00 H new ATOM 0 HE3 LYS A 390 -1.416 -2.968 -2.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 390 -2.818 -4.066 -3.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 390 -4.075 -3.151 -3.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 390 -3.356 -2.654 -4.708 1.00 0.00 H new ATOM 559 N SER A 391 -4.792 0.425 1.832 1.00 0.00 N ATOM 560 CA SER A 391 -5.044 1.174 3.062 1.00 0.00 C ATOM 561 C SER A 391 -5.735 2.510 2.779 1.00 0.00 C ATOM 562 O SER A 391 -6.788 2.789 3.354 1.00 0.00 O ATOM 563 CB SER A 391 -3.740 1.407 3.828 1.00 0.00 C ATOM 564 OG SER A 391 -3.973 2.122 5.029 1.00 0.00 O ATOM 0 H SER A 391 -3.823 0.131 1.713 1.00 0.00 H new ATOM 0 HA SER A 391 -5.715 0.574 3.677 1.00 0.00 H new ATOM 0 HB2 SER A 391 -3.273 0.449 4.057 1.00 0.00 H new ATOM 0 HB3 SER A 391 -3.041 1.961 3.201 1.00 0.00 H new ATOM 0 HG SER A 391 -3.159 2.118 5.575 1.00 0.00 H new ATOM 570 N PRO A 392 -5.172 3.359 1.888 1.00 0.00 N ATOM 571 CA PRO A 392 -5.773 4.648 1.554 1.00 0.00 C ATOM 572 C PRO A 392 -7.241 4.495 1.190 1.00 0.00 C ATOM 573 O PRO A 392 -8.060 5.373 1.460 1.00 0.00 O ATOM 574 CB PRO A 392 -4.966 5.122 0.333 1.00 0.00 C ATOM 575 CG PRO A 392 -4.173 3.941 -0.107 1.00 0.00 C ATOM 576 CD PRO A 392 -3.931 3.150 1.132 1.00 0.00 C ATOM 0 HA PRO A 392 -5.742 5.348 2.389 1.00 0.00 H new ATOM 0 HB2 PRO A 392 -5.626 5.469 -0.462 1.00 0.00 H new ATOM 0 HB3 PRO A 392 -4.315 5.956 0.594 1.00 0.00 H new ATOM 0 HG2 PRO A 392 -4.717 3.355 -0.848 1.00 0.00 H new ATOM 0 HG3 PRO A 392 -3.234 4.247 -0.569 1.00 0.00 H new ATOM 0 HD2 PRO A 392 -3.761 2.096 0.914 1.00 0.00 H new ATOM 0 HD3 PRO A 392 -3.058 3.507 1.678 1.00 0.00 H new ATOM 584 N CYS A 393 -7.560 3.363 0.571 1.00 0.00 N ATOM 585 CA CYS A 393 -8.921 3.065 0.156 1.00 0.00 C ATOM 586 C CYS A 393 -9.848 2.916 1.357 1.00 0.00 C ATOM 587 O CYS A 393 -9.580 3.443 2.437 1.00 0.00 O ATOM 588 CB CYS A 393 -8.935 1.783 -0.676 1.00 0.00 C ATOM 589 SG CYS A 393 -7.821 1.817 -2.117 1.00 0.00 S ATOM 0 H CYS A 393 -6.885 2.632 0.345 1.00 0.00 H new ATOM 0 HA CYS A 393 -9.284 3.898 -0.446 1.00 0.00 H new ATOM 0 HB2 CYS A 393 -8.658 0.945 -0.036 1.00 0.00 H new ATOM 0 HB3 CYS A 393 -9.952 1.598 -1.021 1.00 0.00 H new ATOM 594 N LYS A 394 -10.939 2.190 1.155 1.00 0.00 N ATOM 595 CA LYS A 394 -11.916 1.958 2.211 1.00 0.00 C ATOM 596 C LYS A 394 -12.792 0.766 1.857 1.00 0.00 C ATOM 597 O LYS A 394 -13.552 0.804 0.889 1.00 0.00 O ATOM 598 CB LYS A 394 -12.782 3.204 2.412 1.00 0.00 C ATOM 599 CG LYS A 394 -13.702 3.126 3.620 1.00 0.00 C ATOM 600 CD LYS A 394 -12.919 3.175 4.920 1.00 0.00 C ATOM 601 CE LYS A 394 -12.249 4.523 5.111 1.00 0.00 C ATOM 602 NZ LYS A 394 -13.241 5.625 5.237 1.00 0.00 N ATOM 0 H LYS A 394 -11.171 1.749 0.265 1.00 0.00 H new ATOM 0 HA LYS A 394 -11.386 1.745 3.140 1.00 0.00 H new ATOM 0 HB2 LYS A 394 -12.132 4.073 2.518 1.00 0.00 H new ATOM 0 HB3 LYS A 394 -13.385 3.364 1.518 1.00 0.00 H new ATOM 0 HG2 LYS A 394 -14.413 3.952 3.591 1.00 0.00 H new ATOM 0 HG3 LYS A 394 -14.282 2.204 3.578 1.00 0.00 H new ATOM 0 HD2 LYS A 394 -13.588 2.977 5.757 1.00 0.00 H new ATOM 0 HD3 LYS A 394 -12.165 2.388 4.922 1.00 0.00 H new ATOM 0 HE2 LYS A 394 -11.624 4.494 6.003 1.00 0.00 H new ATOM 0 HE3 LYS A 394 -11.590 4.723 4.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 394 -12.807 6.427 5.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 394 -13.543 5.931 4.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 394 -14.067 5.289 5.772 1.00 0.00 H new ATOM 616 N TRP A 395 -12.670 -0.299 2.639 1.00 0.00 N ATOM 617 CA TRP A 395 -13.439 -1.510 2.397 1.00 0.00 C ATOM 618 C TRP A 395 -14.877 -1.362 2.881 1.00 0.00 C ATOM 619 O TRP A 395 -15.127 -0.851 3.972 1.00 0.00 O ATOM 620 CB TRP A 395 -12.780 -2.706 3.084 1.00 0.00 C ATOM 621 CG TRP A 395 -13.408 -4.017 2.721 1.00 0.00 C ATOM 622 CD1 TRP A 395 -13.910 -4.951 3.581 1.00 0.00 C ATOM 623 CD2 TRP A 395 -13.594 -4.543 1.402 1.00 0.00 C ATOM 624 NE1 TRP A 395 -14.402 -6.024 2.877 1.00 0.00 N ATOM 625 CE2 TRP A 395 -14.218 -5.798 1.538 1.00 0.00 C ATOM 626 CE3 TRP A 395 -13.295 -4.075 0.117 1.00 0.00 C ATOM 627 CZ2 TRP A 395 -14.549 -6.588 0.440 1.00 0.00 C ATOM 628 CZ3 TRP A 395 -13.623 -4.862 -0.970 1.00 0.00 C ATOM 629 CH2 TRP A 395 -14.244 -6.106 -0.803 1.00 0.00 C ATOM 0 H TRP A 395 -12.046 -0.348 3.445 1.00 0.00 H new ATOM 0 HA TRP A 395 -13.458 -1.680 1.320 1.00 0.00 H new ATOM 0 HB2 TRP A 395 -11.723 -2.731 2.819 1.00 0.00 H new ATOM 0 HB3 TRP A 395 -12.835 -2.571 4.164 1.00 0.00 H new ATOM 0 HD1 TRP A 395 -13.919 -4.860 4.657 1.00 0.00 H new ATOM 0 HE1 TRP A 395 -14.834 -6.853 3.285 1.00 0.00 H new ATOM 0 HE3 TRP A 395 -12.817 -3.117 -0.022 1.00 0.00 H new ATOM 0 HZ2 TRP A 395 -15.029 -7.547 0.566 1.00 0.00 H new ATOM 0 HZ3 TRP A 395 -13.396 -4.512 -1.966 1.00 0.00 H new ATOM 0 HH2 TRP A 395 -14.487 -6.697 -1.674 1.00 0.00 H new ATOM 640 N HIS A 396 -15.819 -1.826 2.064 1.00 0.00 N ATOM 641 CA HIS A 396 -17.232 -1.759 2.413 1.00 0.00 C ATOM 642 C HIS A 396 -17.831 -3.158 2.492 1.00 0.00 C ATOM 643 O HIS A 396 -18.007 -3.830 1.472 1.00 0.00 O ATOM 644 CB HIS A 396 -17.999 -0.916 1.393 1.00 0.00 C ATOM 645 CG HIS A 396 -17.544 0.509 1.334 1.00 0.00 C ATOM 646 ND1 HIS A 396 -17.553 1.346 2.430 1.00 0.00 N ATOM 647 CD2 HIS A 396 -17.066 1.247 0.305 1.00 0.00 C ATOM 648 CE1 HIS A 396 -17.102 2.536 2.077 1.00 0.00 C ATOM 649 NE2 HIS A 396 -16.799 2.502 0.792 1.00 0.00 N ATOM 0 H HIS A 396 -15.628 -2.252 1.157 1.00 0.00 H new ATOM 0 HA HIS A 396 -17.318 -1.286 3.391 1.00 0.00 H new ATOM 0 HB2 HIS A 396 -17.889 -1.365 0.406 1.00 0.00 H new ATOM 0 HB3 HIS A 396 -19.061 -0.940 1.638 1.00 0.00 H new ATOM 0 HD1 HIS A 396 -17.860 1.086 3.367 1.00 0.00 H new ATOM 0 HD2 HIS A 396 -16.921 0.911 -0.711 1.00 0.00 H new ATOM 0 HE1 HIS A 396 -16.999 3.391 2.728 1.00 0.00 H new ATOM 658 N ASN A 397 -18.137 -3.584 3.715 1.00 0.00 N ATOM 659 CA ASN A 397 -18.715 -4.902 3.959 1.00 0.00 C ATOM 660 C ASN A 397 -20.216 -4.901 3.680 1.00 0.00 C ATOM 661 O ASN A 397 -20.912 -3.930 3.979 1.00 0.00 O ATOM 662 CB ASN A 397 -18.440 -5.335 5.402 1.00 0.00 C ATOM 663 CG ASN A 397 -18.972 -6.721 5.709 1.00 0.00 C ATOM 664 OD1 ASN A 397 -20.179 -6.954 5.689 1.00 0.00 O ATOM 665 ND2 ASN A 397 -18.068 -7.652 5.993 1.00 0.00 N ATOM 0 H ASN A 397 -17.992 -3.030 4.559 1.00 0.00 H new ATOM 0 HA ASN A 397 -18.247 -5.614 3.279 1.00 0.00 H new ATOM 0 HB2 ASN A 397 -17.366 -5.314 5.585 1.00 0.00 H new ATOM 0 HB3 ASN A 397 -18.893 -4.617 6.085 1.00 0.00 H new ATOM 0 HD21 ASN A 397 -18.366 -8.604 6.206 1.00 0.00 H new ATOM 0 HD22 ASN A 397 -17.076 -7.415 5.998 1.00 0.00 H new ATOM 672 N ASP A 398 -20.701 -5.995 3.098 1.00 0.00 N ATOM 673 CA ASP A 398 -22.117 -6.132 2.764 1.00 0.00 C ATOM 674 C ASP A 398 -22.580 -5.001 1.854 1.00 0.00 C ATOM 675 O ASP A 398 -23.714 -4.532 1.954 1.00 0.00 O ATOM 676 CB ASP A 398 -22.972 -6.170 4.034 1.00 0.00 C ATOM 677 CG ASP A 398 -22.792 -7.454 4.821 1.00 0.00 C ATOM 678 OD1 ASP A 398 -22.029 -8.331 4.361 1.00 0.00 O ATOM 679 OD2 ASP A 398 -23.415 -7.586 5.895 1.00 0.00 O ATOM 0 H ASP A 398 -20.132 -6.803 2.847 1.00 0.00 H new ATOM 0 HA ASP A 398 -22.241 -7.074 2.229 1.00 0.00 H new ATOM 0 HB2 ASP A 398 -22.713 -5.321 4.667 1.00 0.00 H new ATOM 0 HB3 ASP A 398 -24.022 -6.058 3.764 1.00 0.00 H new ATOM 684 N ALA A 399 -21.697 -4.575 0.954 1.00 0.00 N ATOM 685 CA ALA A 399 -22.016 -3.510 0.012 1.00 0.00 C ATOM 686 C ALA A 399 -22.792 -4.063 -1.177 1.00 0.00 C ATOM 687 O ALA A 399 -22.586 -3.642 -2.317 1.00 0.00 O ATOM 688 CB ALA A 399 -20.745 -2.829 -0.460 1.00 0.00 C ATOM 0 H ALA A 399 -20.754 -4.953 0.859 1.00 0.00 H new ATOM 0 HA ALA A 399 -22.640 -2.774 0.519 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -20.997 -2.035 -1.163 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -20.221 -2.403 0.396 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -20.102 -3.559 -0.952 1.00 0.00 H new ATOM 694 N GLU A 400 -23.664 -5.028 -0.891 1.00 0.00 N ATOM 695 CA GLU A 400 -24.480 -5.694 -1.905 1.00 0.00 C ATOM 696 C GLU A 400 -23.639 -6.707 -2.670 1.00 0.00 C ATOM 697 O GLU A 400 -24.138 -7.747 -3.100 1.00 0.00 O ATOM 698 CB GLU A 400 -25.103 -4.682 -2.872 1.00 0.00 C ATOM 699 CG GLU A 400 -25.989 -3.654 -2.187 1.00 0.00 C ATOM 700 CD GLU A 400 -26.595 -2.663 -3.163 1.00 0.00 C ATOM 701 OE1 GLU A 400 -27.332 -3.099 -4.071 1.00 0.00 O ATOM 702 OE2 GLU A 400 -26.332 -1.451 -3.018 1.00 0.00 O ATOM 0 H GLU A 400 -23.825 -5.372 0.056 1.00 0.00 H new ATOM 0 HA GLU A 400 -25.292 -6.214 -1.397 1.00 0.00 H new ATOM 0 HB2 GLU A 400 -24.306 -4.165 -3.407 1.00 0.00 H new ATOM 0 HB3 GLU A 400 -25.691 -5.218 -3.617 1.00 0.00 H new ATOM 0 HG2 GLU A 400 -26.789 -4.167 -1.653 1.00 0.00 H new ATOM 0 HG3 GLU A 400 -25.404 -3.114 -1.443 1.00 0.00 H new ATOM 709 N ASN A 401 -22.358 -6.389 -2.823 1.00 0.00 N ATOM 710 CA ASN A 401 -21.415 -7.244 -3.529 1.00 0.00 C ATOM 711 C ASN A 401 -19.988 -6.841 -3.179 1.00 0.00 C ATOM 712 O ASN A 401 -19.059 -7.064 -3.957 1.00 0.00 O ATOM 713 CB ASN A 401 -21.630 -7.108 -5.031 1.00 0.00 C ATOM 714 CG ASN A 401 -22.906 -7.772 -5.503 1.00 0.00 C ATOM 715 OD1 ASN A 401 -22.995 -8.998 -5.579 1.00 0.00 O ATOM 716 ND2 ASN A 401 -23.912 -6.961 -5.793 1.00 0.00 N ATOM 0 H ASN A 401 -21.945 -5.530 -2.460 1.00 0.00 H new ATOM 0 HA ASN A 401 -21.577 -8.280 -3.231 1.00 0.00 H new ATOM 0 HB2 ASN A 401 -21.657 -6.051 -5.295 1.00 0.00 H new ATOM 0 HB3 ASN A 401 -20.782 -7.547 -5.556 1.00 0.00 H new ATOM 0 HD21 ASN A 401 -24.807 -7.346 -6.094 1.00 0.00 H new ATOM 0 HD22 ASN A 401 -23.792 -5.951 -5.715 1.00 0.00 H new ATOM 723 N LYS A 402 -19.834 -6.234 -2.003 1.00 0.00 N ATOM 724 CA LYS A 402 -18.531 -5.772 -1.525 1.00 0.00 C ATOM 725 C LYS A 402 -18.000 -4.653 -2.418 1.00 0.00 C ATOM 726 O LYS A 402 -18.019 -4.768 -3.644 1.00 0.00 O ATOM 727 CB LYS A 402 -17.530 -6.931 -1.481 1.00 0.00 C ATOM 728 CG LYS A 402 -17.977 -8.091 -0.603 1.00 0.00 C ATOM 729 CD LYS A 402 -18.123 -7.672 0.852 1.00 0.00 C ATOM 730 CE LYS A 402 -18.613 -8.824 1.715 1.00 0.00 C ATOM 731 NZ LYS A 402 -17.690 -9.992 1.661 1.00 0.00 N ATOM 0 H LYS A 402 -20.603 -6.049 -1.359 1.00 0.00 H new ATOM 0 HA LYS A 402 -18.657 -5.383 -0.514 1.00 0.00 H new ATOM 0 HB2 LYS A 402 -17.365 -7.296 -2.495 1.00 0.00 H new ATOM 0 HB3 LYS A 402 -16.572 -6.559 -1.117 1.00 0.00 H new ATOM 0 HG2 LYS A 402 -18.929 -8.478 -0.968 1.00 0.00 H new ATOM 0 HG3 LYS A 402 -17.254 -8.903 -0.677 1.00 0.00 H new ATOM 0 HD2 LYS A 402 -17.164 -7.316 1.228 1.00 0.00 H new ATOM 0 HD3 LYS A 402 -18.822 -6.839 0.924 1.00 0.00 H new ATOM 0 HE2 LYS A 402 -18.712 -8.487 2.747 1.00 0.00 H new ATOM 0 HE3 LYS A 402 -19.605 -9.130 1.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 402 -17.933 -10.662 2.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 402 -17.781 -10.464 0.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 402 -16.710 -9.667 1.788 1.00 0.00 H new ATOM 745 N LYS A 403 -17.539 -3.563 -1.807 1.00 0.00 N ATOM 746 CA LYS A 403 -17.029 -2.430 -2.577 1.00 0.00 C ATOM 747 C LYS A 403 -15.866 -1.730 -1.873 1.00 0.00 C ATOM 748 O LYS A 403 -15.881 -1.541 -0.658 1.00 0.00 O ATOM 749 CB LYS A 403 -18.149 -1.419 -2.833 1.00 0.00 C ATOM 750 CG LYS A 403 -19.360 -2.013 -3.537 1.00 0.00 C ATOM 751 CD LYS A 403 -20.400 -0.951 -3.860 1.00 0.00 C ATOM 752 CE LYS A 403 -19.871 0.071 -4.853 1.00 0.00 C ATOM 753 NZ LYS A 403 -19.508 -0.555 -6.155 1.00 0.00 N ATOM 0 H LYS A 403 -17.508 -3.440 -0.795 1.00 0.00 H new ATOM 0 HA LYS A 403 -16.660 -2.826 -3.523 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -18.466 -0.993 -1.881 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -17.756 -0.599 -3.434 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -19.042 -2.503 -4.457 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -19.808 -2.781 -2.906 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -21.292 -1.427 -4.268 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -20.700 -0.445 -2.942 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -20.625 0.841 -5.018 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -18.996 0.567 -4.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -19.380 0.186 -6.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -18.622 -1.090 -6.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -20.268 -1.199 -6.454 1.00 0.00 H new ATOM 767 N CYS A 404 -14.866 -1.331 -2.660 1.00 0.00 N ATOM 768 CA CYS A 404 -13.697 -0.628 -2.136 1.00 0.00 C ATOM 769 C CYS A 404 -13.597 0.758 -2.775 1.00 0.00 C ATOM 770 O CYS A 404 -13.734 0.897 -3.989 1.00 0.00 O ATOM 771 CB CYS A 404 -12.419 -1.428 -2.414 1.00 0.00 C ATOM 772 SG CYS A 404 -10.895 -0.649 -1.783 1.00 0.00 S ATOM 0 H CYS A 404 -14.844 -1.484 -3.668 1.00 0.00 H new ATOM 0 HA CYS A 404 -13.808 -0.519 -1.057 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -12.519 -2.417 -1.968 1.00 0.00 H new ATOM 0 HB3 CYS A 404 -12.321 -1.572 -3.490 1.00 0.00 H new ATOM 777 N THR A 405 -13.369 1.781 -1.953 1.00 0.00 N ATOM 778 CA THR A 405 -13.269 3.152 -2.451 1.00 0.00 C ATOM 779 C THR A 405 -12.236 3.958 -1.671 1.00 0.00 C ATOM 780 O THR A 405 -12.084 3.787 -0.463 1.00 0.00 O ATOM 781 CB THR A 405 -14.625 3.880 -2.377 1.00 0.00 C ATOM 782 OG1 THR A 405 -15.071 3.949 -1.017 1.00 0.00 O ATOM 783 CG2 THR A 405 -15.673 3.169 -3.220 1.00 0.00 C ATOM 0 H THR A 405 -13.251 1.688 -0.944 1.00 0.00 H new ATOM 0 HA THR A 405 -12.956 3.079 -3.492 1.00 0.00 H new ATOM 0 HB THR A 405 -14.489 4.888 -2.769 1.00 0.00 H new ATOM 0 HG1 THR A 405 -15.698 3.217 -0.841 1.00 0.00 H new ATOM 0 HG21 THR A 405 -16.620 3.704 -3.150 1.00 0.00 H new ATOM 0 HG22 THR A 405 -15.347 3.143 -4.260 1.00 0.00 H new ATOM 0 HG23 THR A 405 -15.804 2.150 -2.855 1.00 0.00 H new ATOM 791 N LEU A 406 -11.527 4.838 -2.374 1.00 0.00 N ATOM 792 CA LEU A 406 -10.505 5.672 -1.757 1.00 0.00 C ATOM 793 C LEU A 406 -11.123 6.648 -0.769 1.00 0.00 C ATOM 794 O LEU A 406 -12.208 7.183 -1.000 1.00 0.00 O ATOM 795 CB LEU A 406 -9.717 6.418 -2.834 1.00 0.00 C ATOM 796 CG LEU A 406 -8.430 7.113 -2.378 1.00 0.00 C ATOM 797 CD1 LEU A 406 -8.733 8.438 -1.704 1.00 0.00 C ATOM 798 CD2 LEU A 406 -7.625 6.210 -1.456 1.00 0.00 C ATOM 0 H LEU A 406 -11.644 4.990 -3.376 1.00 0.00 H new ATOM 0 HA LEU A 406 -9.820 5.028 -1.205 1.00 0.00 H new ATOM 0 HB2 LEU A 406 -9.462 5.710 -3.623 1.00 0.00 H new ATOM 0 HB3 LEU A 406 -10.371 7.168 -3.278 1.00 0.00 H new ATOM 0 HG LEU A 406 -7.829 7.318 -3.264 1.00 0.00 H new ATOM 0 HD11 LEU A 406 -7.801 8.909 -1.391 1.00 0.00 H new ATOM 0 HD12 LEU A 406 -9.252 9.092 -2.404 1.00 0.00 H new ATOM 0 HD13 LEU A 406 -9.364 8.267 -0.832 1.00 0.00 H new ATOM 0 HD21 LEU A 406 -6.716 6.725 -1.145 1.00 0.00 H new ATOM 0 HD22 LEU A 406 -8.221 5.963 -0.577 1.00 0.00 H new ATOM 0 HD23 LEU A 406 -7.361 5.294 -1.984 1.00 0.00 H new ATOM 810 N ASP A 407 -10.421 6.871 0.330 1.00 0.00 N ATOM 811 CA ASP A 407 -10.889 7.783 1.366 1.00 0.00 C ATOM 812 C ASP A 407 -9.878 8.900 1.580 1.00 0.00 C ATOM 813 O ASP A 407 -8.682 8.646 1.716 1.00 0.00 O ATOM 814 CB ASP A 407 -11.121 7.026 2.678 1.00 0.00 C ATOM 815 CG ASP A 407 -11.746 7.904 3.745 1.00 0.00 C ATOM 816 OD1 ASP A 407 -12.869 8.403 3.519 1.00 0.00 O ATOM 817 OD2 ASP A 407 -11.113 8.094 4.804 1.00 0.00 O ATOM 0 H ASP A 407 -9.522 6.432 0.530 1.00 0.00 H new ATOM 0 HA ASP A 407 -11.834 8.220 1.042 1.00 0.00 H new ATOM 0 HB2 ASP A 407 -11.768 6.169 2.491 1.00 0.00 H new ATOM 0 HB3 ASP A 407 -10.171 6.635 3.042 1.00 0.00 H new ATOM 822 N LYS A 408 -10.359 10.138 1.602 1.00 0.00 N ATOM 823 CA LYS A 408 -9.485 11.288 1.792 1.00 0.00 C ATOM 824 C LYS A 408 -8.827 11.257 3.168 1.00 0.00 C ATOM 825 O LYS A 408 -7.620 11.446 3.288 1.00 0.00 O ATOM 826 CB LYS A 408 -10.267 12.590 1.621 1.00 0.00 C ATOM 827 CG LYS A 408 -10.929 12.728 0.259 1.00 0.00 C ATOM 828 CD LYS A 408 -11.664 14.052 0.129 1.00 0.00 C ATOM 829 CE LYS A 408 -12.324 14.190 -1.233 1.00 0.00 C ATOM 830 NZ LYS A 408 -13.319 13.111 -1.481 1.00 0.00 N ATOM 0 H LYS A 408 -11.346 10.370 1.491 1.00 0.00 H new ATOM 0 HA LYS A 408 -8.703 11.240 1.034 1.00 0.00 H new ATOM 0 HB2 LYS A 408 -11.032 12.649 2.395 1.00 0.00 H new ATOM 0 HB3 LYS A 408 -9.592 13.432 1.775 1.00 0.00 H new ATOM 0 HG2 LYS A 408 -10.174 12.651 -0.523 1.00 0.00 H new ATOM 0 HG3 LYS A 408 -11.629 11.906 0.108 1.00 0.00 H new ATOM 0 HD2 LYS A 408 -12.420 14.128 0.910 1.00 0.00 H new ATOM 0 HD3 LYS A 408 -10.965 14.874 0.281 1.00 0.00 H new ATOM 0 HE2 LYS A 408 -12.816 15.160 -1.301 1.00 0.00 H new ATOM 0 HE3 LYS A 408 -11.560 14.165 -2.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 -13.888 13.349 -2.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 -12.823 12.212 -1.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 -13.943 13.017 -0.654 1.00 0.00 H new ATOM 844 N GLU A 409 -9.630 11.014 4.201 1.00 0.00 N ATOM 845 CA GLU A 409 -9.122 10.960 5.569 1.00 0.00 C ATOM 846 C GLU A 409 -7.996 9.937 5.690 1.00 0.00 C ATOM 847 O GLU A 409 -6.930 10.233 6.232 1.00 0.00 O ATOM 848 CB GLU A 409 -10.250 10.611 6.542 1.00 0.00 C ATOM 849 CG GLU A 409 -11.390 11.617 6.539 1.00 0.00 C ATOM 850 CD GLU A 409 -12.498 11.245 7.506 1.00 0.00 C ATOM 851 OE1 GLU A 409 -12.218 11.148 8.719 1.00 0.00 O ATOM 852 OE2 GLU A 409 -13.644 11.051 7.050 1.00 0.00 O ATOM 0 H GLU A 409 -10.633 10.852 4.117 1.00 0.00 H new ATOM 0 HA GLU A 409 -8.726 11.943 5.822 1.00 0.00 H new ATOM 0 HB2 GLU A 409 -10.645 9.627 6.290 1.00 0.00 H new ATOM 0 HB3 GLU A 409 -9.841 10.542 7.550 1.00 0.00 H new ATOM 0 HG2 GLU A 409 -11.001 12.602 6.799 1.00 0.00 H new ATOM 0 HG3 GLU A 409 -11.801 11.692 5.532 1.00 0.00 H new ATOM 859 N GLU A 410 -8.239 8.737 5.174 1.00 0.00 N ATOM 860 CA GLU A 410 -7.243 7.674 5.214 1.00 0.00 C ATOM 861 C GLU A 410 -6.010 8.070 4.415 1.00 0.00 C ATOM 862 O GLU A 410 -4.881 7.889 4.867 1.00 0.00 O ATOM 863 CB GLU A 410 -7.829 6.371 4.665 1.00 0.00 C ATOM 864 CG GLU A 410 -9.034 5.866 5.442 1.00 0.00 C ATOM 865 CD GLU A 410 -8.701 5.486 6.874 1.00 0.00 C ATOM 866 OE1 GLU A 410 -7.514 5.570 7.253 1.00 0.00 O ATOM 867 OE2 GLU A 410 -9.628 5.098 7.615 1.00 0.00 O ATOM 0 H GLU A 410 -9.116 8.477 4.724 1.00 0.00 H new ATOM 0 HA GLU A 410 -6.951 7.516 6.252 1.00 0.00 H new ATOM 0 HB2 GLU A 410 -8.117 6.523 3.625 1.00 0.00 H new ATOM 0 HB3 GLU A 410 -7.055 5.603 4.673 1.00 0.00 H new ATOM 0 HG2 GLU A 410 -9.805 6.636 5.446 1.00 0.00 H new ATOM 0 HG3 GLU A 410 -9.452 4.999 4.930 1.00 0.00 H new ATOM 874 N ALA A 411 -6.239 8.618 3.225 1.00 0.00 N ATOM 875 CA ALA A 411 -5.149 9.053 2.358 1.00 0.00 C ATOM 876 C ALA A 411 -4.260 10.068 3.066 1.00 0.00 C ATOM 877 O ALA A 411 -3.041 10.060 2.908 1.00 0.00 O ATOM 878 CB ALA A 411 -5.708 9.642 1.071 1.00 0.00 C ATOM 0 H ALA A 411 -7.171 8.771 2.839 1.00 0.00 H new ATOM 0 HA ALA A 411 -4.538 8.184 2.113 1.00 0.00 H new ATOM 0 HB1 ALA A 411 -4.886 9.964 0.431 1.00 0.00 H new ATOM 0 HB2 ALA A 411 -6.298 8.887 0.552 1.00 0.00 H new ATOM 0 HB3 ALA A 411 -6.340 10.498 1.307 1.00 0.00 H new ATOM 884 N LYS A 412 -4.877 10.939 3.854 1.00 0.00 N ATOM 885 CA LYS A 412 -4.137 11.951 4.594 1.00 0.00 C ATOM 886 C LYS A 412 -3.182 11.290 5.581 1.00 0.00 C ATOM 887 O LYS A 412 -2.021 11.680 5.695 1.00 0.00 O ATOM 888 CB LYS A 412 -5.105 12.876 5.333 1.00 0.00 C ATOM 889 CG LYS A 412 -6.001 13.683 4.408 1.00 0.00 C ATOM 890 CD LYS A 412 -7.050 14.467 5.182 1.00 0.00 C ATOM 891 CE LYS A 412 -6.416 15.508 6.094 1.00 0.00 C ATOM 892 NZ LYS A 412 -7.439 16.288 6.844 1.00 0.00 N ATOM 0 H LYS A 412 -5.887 10.965 3.997 1.00 0.00 H new ATOM 0 HA LYS A 412 -3.554 12.544 3.889 1.00 0.00 H new ATOM 0 HB2 LYS A 412 -5.728 12.279 5.999 1.00 0.00 H new ATOM 0 HB3 LYS A 412 -4.533 13.560 5.960 1.00 0.00 H new ATOM 0 HG2 LYS A 412 -5.392 14.371 3.821 1.00 0.00 H new ATOM 0 HG3 LYS A 412 -6.494 13.013 3.704 1.00 0.00 H new ATOM 0 HD2 LYS A 412 -7.726 14.959 4.483 1.00 0.00 H new ATOM 0 HD3 LYS A 412 -7.652 13.780 5.777 1.00 0.00 H new ATOM 0 HE2 LYS A 412 -5.748 15.014 6.799 1.00 0.00 H new ATOM 0 HE3 LYS A 412 -5.806 16.188 5.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 412 -6.966 16.986 7.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 412 -8.061 16.781 6.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 412 -8.005 15.643 7.431 1.00 0.00 H new ATOM 906 N LYS A 413 -3.687 10.287 6.295 1.00 0.00 N ATOM 907 CA LYS A 413 -2.900 9.564 7.275 1.00 0.00 C ATOM 908 C LYS A 413 -1.782 8.758 6.614 1.00 0.00 C ATOM 909 O LYS A 413 -0.648 8.746 7.094 1.00 0.00 O ATOM 910 CB LYS A 413 -3.809 8.628 8.066 1.00 0.00 C ATOM 911 CG LYS A 413 -3.179 8.124 9.343 1.00 0.00 C ATOM 912 CD LYS A 413 -4.112 7.195 10.101 1.00 0.00 C ATOM 913 CE LYS A 413 -3.481 6.701 11.392 1.00 0.00 C ATOM 914 NZ LYS A 413 -2.226 5.939 11.144 1.00 0.00 N ATOM 0 H LYS A 413 -4.649 9.958 6.207 1.00 0.00 H new ATOM 0 HA LYS A 413 -2.439 10.291 7.943 1.00 0.00 H new ATOM 0 HB2 LYS A 413 -4.735 9.150 8.307 1.00 0.00 H new ATOM 0 HB3 LYS A 413 -4.076 7.777 7.440 1.00 0.00 H new ATOM 0 HG2 LYS A 413 -2.253 7.599 9.109 1.00 0.00 H new ATOM 0 HG3 LYS A 413 -2.914 8.970 9.977 1.00 0.00 H new ATOM 0 HD2 LYS A 413 -5.042 7.717 10.326 1.00 0.00 H new ATOM 0 HD3 LYS A 413 -4.369 6.343 9.471 1.00 0.00 H new ATOM 0 HE2 LYS A 413 -3.267 7.551 12.039 1.00 0.00 H new ATOM 0 HE3 LYS A 413 -4.191 6.067 11.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 413 -1.947 5.437 12.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 413 -2.383 5.250 10.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 413 -1.470 6.597 10.867 1.00 0.00 H new ATOM 928 N VAL A 414 -2.112 8.078 5.517 1.00 0.00 N ATOM 929 CA VAL A 414 -1.139 7.259 4.800 1.00 0.00 C ATOM 930 C VAL A 414 0.045 8.098 4.334 1.00 0.00 C ATOM 931 O VAL A 414 1.187 7.643 4.345 1.00 0.00 O ATOM 932 CB VAL A 414 -1.778 6.537 3.596 1.00 0.00 C ATOM 933 CG1 VAL A 414 -1.859 7.455 2.403 1.00 0.00 C ATOM 934 CG2 VAL A 414 -1.005 5.271 3.258 1.00 0.00 C ATOM 0 H VAL A 414 -3.046 8.079 5.106 1.00 0.00 H new ATOM 0 HA VAL A 414 -0.782 6.503 5.499 1.00 0.00 H new ATOM 0 HB VAL A 414 -2.794 6.251 3.868 1.00 0.00 H new ATOM 0 HG11 VAL A 414 -2.313 6.925 1.566 1.00 0.00 H new ATOM 0 HG12 VAL A 414 -2.466 8.325 2.654 1.00 0.00 H new ATOM 0 HG13 VAL A 414 -0.856 7.780 2.126 1.00 0.00 H new ATOM 0 HG21 VAL A 414 -1.472 4.776 2.406 1.00 0.00 H new ATOM 0 HG22 VAL A 414 0.024 5.529 3.009 1.00 0.00 H new ATOM 0 HG23 VAL A 414 -1.013 4.600 4.117 1.00 0.00 H new ATOM 944 N ALA A 415 -0.238 9.328 3.926 1.00 0.00 N ATOM 945 CA ALA A 415 0.799 10.237 3.462 1.00 0.00 C ATOM 946 C ALA A 415 1.535 10.868 4.637 1.00 0.00 C ATOM 947 O ALA A 415 2.754 11.040 4.602 1.00 0.00 O ATOM 948 CB ALA A 415 0.201 11.319 2.578 1.00 0.00 C ATOM 0 H ALA A 415 -1.180 9.719 3.907 1.00 0.00 H new ATOM 0 HA ALA A 415 1.516 9.660 2.877 1.00 0.00 H new ATOM 0 HB1 ALA A 415 0.991 11.990 2.240 1.00 0.00 H new ATOM 0 HB2 ALA A 415 -0.279 10.859 1.714 1.00 0.00 H new ATOM 0 HB3 ALA A 415 -0.538 11.885 3.145 1.00 0.00 H new ATOM 954 N ASP A 416 0.779 11.226 5.670 1.00 0.00 N ATOM 955 CA ASP A 416 1.350 11.856 6.855 1.00 0.00 C ATOM 956 C ASP A 416 1.900 10.816 7.832 1.00 0.00 C ATOM 957 O ASP A 416 1.834 11.000 9.049 1.00 0.00 O ATOM 958 CB ASP A 416 0.291 12.715 7.548 1.00 0.00 C ATOM 959 CG ASP A 416 0.869 13.595 8.642 1.00 0.00 C ATOM 960 OD1 ASP A 416 2.104 13.583 8.828 1.00 0.00 O ATOM 961 OD2 ASP A 416 0.084 14.300 9.312 1.00 0.00 O ATOM 0 H ASP A 416 -0.231 11.090 5.710 1.00 0.00 H new ATOM 0 HA ASP A 416 2.180 12.486 6.535 1.00 0.00 H new ATOM 0 HB2 ASP A 416 -0.203 13.343 6.806 1.00 0.00 H new ATOM 0 HB3 ASP A 416 -0.473 12.066 7.976 1.00 0.00 H new ATOM 966 N GLU A 417 2.452 9.732 7.301 1.00 0.00 N ATOM 967 CA GLU A 417 3.019 8.683 8.142 1.00 0.00 C ATOM 968 C GLU A 417 4.393 9.091 8.662 1.00 0.00 C ATOM 969 O GLU A 417 5.083 8.301 9.306 1.00 0.00 O ATOM 970 CB GLU A 417 3.119 7.365 7.372 1.00 0.00 C ATOM 971 CG GLU A 417 1.772 6.730 7.075 1.00 0.00 C ATOM 972 CD GLU A 417 1.898 5.420 6.321 1.00 0.00 C ATOM 973 OE1 GLU A 417 2.448 5.430 5.200 1.00 0.00 O ATOM 974 OE2 GLU A 417 1.445 4.384 6.853 1.00 0.00 O ATOM 0 H GLU A 417 2.519 9.556 6.299 1.00 0.00 H new ATOM 0 HA GLU A 417 2.353 8.539 8.993 1.00 0.00 H new ATOM 0 HB2 GLU A 417 3.643 7.542 6.433 1.00 0.00 H new ATOM 0 HB3 GLU A 417 3.723 6.663 7.947 1.00 0.00 H new ATOM 0 HG2 GLU A 417 1.242 6.556 8.012 1.00 0.00 H new ATOM 0 HG3 GLU A 417 1.168 7.424 6.491 1.00 0.00 H new ATOM 981 N THR A 418 4.778 10.336 8.376 1.00 0.00 N ATOM 982 CA THR A 418 6.067 10.868 8.810 1.00 0.00 C ATOM 983 C THR A 418 7.202 9.907 8.474 1.00 0.00 C ATOM 984 O THR A 418 8.020 9.570 9.332 1.00 0.00 O ATOM 985 CB THR A 418 6.078 11.166 10.323 1.00 0.00 C ATOM 986 OG1 THR A 418 5.877 9.961 11.069 1.00 0.00 O ATOM 987 CG2 THR A 418 4.994 12.174 10.676 1.00 0.00 C ATOM 0 H THR A 418 4.211 10.996 7.843 1.00 0.00 H new ATOM 0 HA THR A 418 6.220 11.802 8.270 1.00 0.00 H new ATOM 0 HB THR A 418 7.050 11.587 10.581 1.00 0.00 H new ATOM 0 HG1 THR A 418 5.928 9.190 10.466 1.00 0.00 H new ATOM 0 HG21 THR A 418 5.017 12.372 11.748 1.00 0.00 H new ATOM 0 HG22 THR A 418 5.169 13.102 10.132 1.00 0.00 H new ATOM 0 HG23 THR A 418 4.019 11.771 10.402 1.00 0.00 H new ATOM 995 N ALA A 419 7.242 9.465 7.222 1.00 0.00 N ATOM 996 CA ALA A 419 8.272 8.537 6.771 1.00 0.00 C ATOM 997 C ALA A 419 8.288 8.428 5.249 1.00 0.00 C ATOM 998 O ALA A 419 9.352 8.435 4.629 1.00 0.00 O ATOM 999 CB ALA A 419 8.049 7.168 7.394 1.00 0.00 C ATOM 0 H ALA A 419 6.573 9.735 6.501 1.00 0.00 H new ATOM 0 HA ALA A 419 9.240 8.922 7.091 1.00 0.00 H new ATOM 0 HB1 ALA A 419 8.823 6.482 7.051 1.00 0.00 H new ATOM 0 HB2 ALA A 419 8.093 7.251 8.480 1.00 0.00 H new ATOM 0 HB3 ALA A 419 7.071 6.789 7.098 1.00 0.00 H new ATOM 1005 N LYS A 420 7.103 8.325 4.656 1.00 0.00 N ATOM 1006 CA LYS A 420 6.979 8.209 3.207 1.00 0.00 C ATOM 1007 C LYS A 420 7.537 9.445 2.510 1.00 0.00 C ATOM 1008 O LYS A 420 8.355 9.339 1.595 1.00 0.00 O ATOM 1009 CB LYS A 420 5.513 8.010 2.815 1.00 0.00 C ATOM 1010 CG LYS A 420 4.869 6.787 3.453 1.00 0.00 C ATOM 1011 CD LYS A 420 5.574 5.492 3.063 1.00 0.00 C ATOM 1012 CE LYS A 420 5.398 5.163 1.585 1.00 0.00 C ATOM 1013 NZ LYS A 420 6.112 6.126 0.702 1.00 0.00 N ATOM 0 H LYS A 420 6.214 8.319 5.157 1.00 0.00 H new ATOM 0 HA LYS A 420 7.557 7.342 2.888 1.00 0.00 H new ATOM 0 HB2 LYS A 420 4.947 8.897 3.098 1.00 0.00 H new ATOM 0 HB3 LYS A 420 5.445 7.921 1.731 1.00 0.00 H new ATOM 0 HG2 LYS A 420 4.885 6.895 4.538 1.00 0.00 H new ATOM 0 HG3 LYS A 420 3.822 6.733 3.154 1.00 0.00 H new ATOM 0 HD2 LYS A 420 6.637 5.576 3.291 1.00 0.00 H new ATOM 0 HD3 LYS A 420 5.183 4.672 3.665 1.00 0.00 H new ATOM 0 HE2 LYS A 420 5.767 4.155 1.393 1.00 0.00 H new ATOM 0 HE3 LYS A 420 4.336 5.166 1.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 420 6.551 5.612 -0.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 420 5.436 6.822 0.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 420 6.849 6.617 1.248 1.00 0.00 H new ATOM 1027 N ASP A 421 7.088 10.614 2.949 1.00 0.00 N ATOM 1028 CA ASP A 421 7.537 11.876 2.372 1.00 0.00 C ATOM 1029 C ASP A 421 9.000 12.143 2.710 1.00 0.00 C ATOM 1030 O ASP A 421 9.784 12.537 1.846 1.00 0.00 O ATOM 1031 CB ASP A 421 6.667 13.028 2.872 1.00 0.00 C ATOM 1032 CG ASP A 421 5.217 12.882 2.454 1.00 0.00 C ATOM 1033 OD1 ASP A 421 4.592 11.866 2.823 1.00 0.00 O ATOM 1034 OD2 ASP A 421 4.707 13.784 1.757 1.00 0.00 O ATOM 0 H ASP A 421 6.411 10.715 3.705 1.00 0.00 H new ATOM 0 HA ASP A 421 7.443 11.803 1.289 1.00 0.00 H new ATOM 0 HB2 ASP A 421 6.725 13.078 3.959 1.00 0.00 H new ATOM 0 HB3 ASP A 421 7.060 13.969 2.488 1.00 0.00 H new ATOM 1039 N GLY A 422 9.359 11.931 3.972 1.00 0.00 N ATOM 1040 CA GLY A 422 10.725 12.159 4.404 1.00 0.00 C ATOM 1041 C GLY A 422 10.937 11.815 5.866 1.00 0.00 C ATOM 1042 O GLY A 422 10.048 12.025 6.692 1.00 0.00 O ATOM 0 H GLY A 422 8.727 11.605 4.704 1.00 0.00 H new ATOM 0 HA2 GLY A 422 11.401 11.562 3.792 1.00 0.00 H new ATOM 0 HA3 GLY A 422 10.985 13.204 4.239 1.00 0.00 H new ATOM 1046 N LYS A 423 12.116 11.286 6.182 1.00 0.00 N ATOM 1047 CA LYS A 423 12.449 10.908 7.553 1.00 0.00 C ATOM 1048 C LYS A 423 12.189 12.067 8.509 1.00 0.00 C ATOM 1049 O LYS A 423 12.476 13.222 8.192 1.00 0.00 O ATOM 1050 CB LYS A 423 13.915 10.478 7.641 1.00 0.00 C ATOM 1051 CG LYS A 423 14.327 9.991 9.020 1.00 0.00 C ATOM 1052 CD LYS A 423 15.791 9.583 9.050 1.00 0.00 C ATOM 1053 CE LYS A 423 16.193 9.041 10.411 1.00 0.00 C ATOM 1054 NZ LYS A 423 15.995 10.046 11.491 1.00 0.00 N ATOM 0 H LYS A 423 12.859 11.109 5.506 1.00 0.00 H new ATOM 0 HA LYS A 423 11.814 10.070 7.841 1.00 0.00 H new ATOM 0 HB2 LYS A 423 14.096 9.684 6.916 1.00 0.00 H new ATOM 0 HB3 LYS A 423 14.549 11.319 7.358 1.00 0.00 H new ATOM 0 HG2 LYS A 423 14.152 10.779 9.753 1.00 0.00 H new ATOM 0 HG3 LYS A 423 13.706 9.143 9.309 1.00 0.00 H new ATOM 0 HD2 LYS A 423 15.974 8.826 8.288 1.00 0.00 H new ATOM 0 HD3 LYS A 423 16.414 10.442 8.802 1.00 0.00 H new ATOM 0 HE2 LYS A 423 15.607 8.149 10.634 1.00 0.00 H new ATOM 0 HE3 LYS A 423 17.239 8.737 10.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 16.464 9.719 12.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 16.405 10.956 11.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 14.978 10.166 11.671 1.00 0.00 H new ATOM 1068 N THR A 424 11.637 11.754 9.678 1.00 0.00 N ATOM 1069 CA THR A 424 11.330 12.771 10.677 1.00 0.00 C ATOM 1070 C THR A 424 11.208 12.158 12.068 1.00 0.00 C ATOM 1071 O THR A 424 10.677 11.059 12.230 1.00 0.00 O ATOM 1072 CB THR A 424 10.020 13.513 10.337 1.00 0.00 C ATOM 1073 OG1 THR A 424 10.122 14.126 9.046 1.00 0.00 O ATOM 1074 CG2 THR A 424 9.706 14.575 11.380 1.00 0.00 C ATOM 0 H THR A 424 11.393 10.803 9.956 1.00 0.00 H new ATOM 0 HA THR A 424 12.156 13.482 10.669 1.00 0.00 H new ATOM 0 HB THR A 424 9.212 12.782 10.332 1.00 0.00 H new ATOM 0 HG1 THR A 424 11.063 14.166 8.776 1.00 0.00 H new ATOM 0 HG21 THR A 424 8.778 15.082 11.115 1.00 0.00 H new ATOM 0 HG22 THR A 424 9.596 14.104 12.357 1.00 0.00 H new ATOM 0 HG23 THR A 424 10.518 15.301 11.416 1.00 0.00 H new ATOM 1082 N GLY A 425 11.705 12.878 13.071 1.00 0.00 N ATOM 1083 CA GLY A 425 11.645 12.395 14.438 1.00 0.00 C ATOM 1084 C GLY A 425 12.006 13.470 15.446 1.00 0.00 C ATOM 1085 O GLY A 425 11.512 14.595 15.365 1.00 0.00 O ATOM 0 H GLY A 425 12.149 13.789 12.959 1.00 0.00 H new ATOM 0 HA2 GLY A 425 10.641 12.027 14.647 1.00 0.00 H new ATOM 0 HA3 GLY A 425 12.324 11.550 14.552 1.00 0.00 H new ATOM 1089 N ASN A 426 12.868 13.124 16.398 1.00 0.00 N ATOM 1090 CA ASN A 426 13.292 14.072 17.422 1.00 0.00 C ATOM 1091 C ASN A 426 13.969 15.287 16.794 1.00 0.00 C ATOM 1092 O ASN A 426 14.757 15.154 15.858 1.00 0.00 O ATOM 1093 CB ASN A 426 14.239 13.395 18.419 1.00 0.00 C ATOM 1094 CG ASN A 426 15.460 12.793 17.749 1.00 0.00 C ATOM 1095 OD1 ASN A 426 16.266 13.499 17.143 1.00 0.00 O ATOM 1096 ND2 ASN A 426 15.604 11.477 17.857 1.00 0.00 N ATOM 0 H ASN A 426 13.285 12.197 16.481 1.00 0.00 H new ATOM 0 HA ASN A 426 12.404 14.412 17.955 1.00 0.00 H new ATOM 0 HB2 ASN A 426 14.560 14.125 19.162 1.00 0.00 H new ATOM 0 HB3 ASN A 426 13.699 12.613 18.953 1.00 0.00 H new ATOM 0 HD21 ASN A 426 16.406 11.015 17.429 1.00 0.00 H new ATOM 0 HD22 ASN A 426 14.913 10.929 18.368 1.00 0.00 H new ATOM 1103 N THR A 427 13.649 16.469 17.318 1.00 0.00 N ATOM 1104 CA THR A 427 14.216 17.720 16.817 1.00 0.00 C ATOM 1105 C THR A 427 13.770 18.003 15.384 1.00 0.00 C ATOM 1106 O THR A 427 13.823 17.128 14.520 1.00 0.00 O ATOM 1107 CB THR A 427 15.757 17.707 16.872 1.00 0.00 C ATOM 1108 OG1 THR A 427 16.199 17.475 18.215 1.00 0.00 O ATOM 1109 CG2 THR A 427 16.329 19.024 16.367 1.00 0.00 C ATOM 0 H THR A 427 12.997 16.587 18.093 1.00 0.00 H new ATOM 0 HA THR A 427 13.844 18.510 17.469 1.00 0.00 H new ATOM 0 HB THR A 427 16.113 16.903 16.228 1.00 0.00 H new ATOM 0 HG1 THR A 427 17.179 17.467 18.240 1.00 0.00 H new ATOM 0 HG21 THR A 427 17.417 18.990 16.416 1.00 0.00 H new ATOM 0 HG22 THR A 427 16.017 19.185 15.335 1.00 0.00 H new ATOM 0 HG23 THR A 427 15.963 19.842 16.988 1.00 0.00 H new ATOM 1117 N ASN A 428 13.338 19.239 15.143 1.00 0.00 N ATOM 1118 CA ASN A 428 12.886 19.656 13.822 1.00 0.00 C ATOM 1119 C ASN A 428 12.514 21.135 13.827 1.00 0.00 C ATOM 1120 O ASN A 428 12.827 21.869 12.890 1.00 0.00 O ATOM 1121 CB ASN A 428 11.686 18.817 13.371 1.00 0.00 C ATOM 1122 CG ASN A 428 11.231 19.159 11.965 1.00 0.00 C ATOM 1123 OD1 ASN A 428 10.840 20.291 11.682 1.00 0.00 O ATOM 1124 ND2 ASN A 428 11.281 18.177 11.071 1.00 0.00 N ATOM 0 H ASN A 428 13.292 19.971 15.851 1.00 0.00 H new ATOM 0 HA ASN A 428 13.705 19.501 13.119 1.00 0.00 H new ATOM 0 HB2 ASN A 428 11.948 17.760 13.417 1.00 0.00 H new ATOM 0 HB3 ASN A 428 10.859 18.971 14.064 1.00 0.00 H new ATOM 0 HD21 ASN A 428 10.989 18.348 10.109 1.00 0.00 H new ATOM 0 HD22 ASN A 428 11.612 17.252 11.347 1.00 0.00 H new ATOM 1131 N THR A 429 11.849 21.564 14.897 1.00 0.00 N ATOM 1132 CA THR A 429 11.433 22.954 15.040 1.00 0.00 C ATOM 1133 C THR A 429 11.507 23.393 16.497 1.00 0.00 C ATOM 1134 O THR A 429 11.066 22.670 17.392 1.00 0.00 O ATOM 1135 CB THR A 429 9.995 23.174 14.526 1.00 0.00 C ATOM 1136 OG1 THR A 429 9.089 22.306 15.216 1.00 0.00 O ATOM 1137 CG2 THR A 429 9.906 22.922 13.028 1.00 0.00 C ATOM 0 H THR A 429 11.587 20.965 15.680 1.00 0.00 H new ATOM 0 HA THR A 429 12.118 23.552 14.439 1.00 0.00 H new ATOM 0 HB THR A 429 9.722 24.212 14.718 1.00 0.00 H new ATOM 0 HG1 THR A 429 8.179 22.453 14.885 1.00 0.00 H new ATOM 0 HG21 THR A 429 8.882 23.084 12.692 1.00 0.00 H new ATOM 0 HG22 THR A 429 10.573 23.607 12.504 1.00 0.00 H new ATOM 0 HG23 THR A 429 10.200 21.894 12.814 1.00 0.00 H new ATOM 1145 N THR A 430 12.072 24.582 16.721 1.00 0.00 N ATOM 1146 CA THR A 430 12.222 25.141 18.066 1.00 0.00 C ATOM 1147 C THR A 430 13.335 24.438 18.845 1.00 0.00 C ATOM 1148 O THR A 430 14.089 25.081 19.577 1.00 0.00 O ATOM 1149 CB THR A 430 10.909 25.064 18.874 1.00 0.00 C ATOM 1150 OG1 THR A 430 9.863 25.749 18.175 1.00 0.00 O ATOM 1151 CG2 THR A 430 11.084 25.677 20.256 1.00 0.00 C ATOM 0 H THR A 430 12.436 25.181 15.980 1.00 0.00 H new ATOM 0 HA THR A 430 12.487 26.190 17.932 1.00 0.00 H new ATOM 0 HB THR A 430 10.643 24.013 18.991 1.00 0.00 H new ATOM 0 HG1 THR A 430 9.033 25.694 18.693 1.00 0.00 H new ATOM 0 HG21 THR A 430 10.145 25.610 20.805 1.00 0.00 H new ATOM 0 HG22 THR A 430 11.860 25.137 20.798 1.00 0.00 H new ATOM 0 HG23 THR A 430 11.372 26.723 20.156 1.00 0.00 H new ATOM 1159 N GLY A 431 13.433 23.120 18.685 1.00 0.00 N ATOM 1160 CA GLY A 431 14.456 22.360 19.381 1.00 0.00 C ATOM 1161 C GLY A 431 15.858 22.845 19.070 1.00 0.00 C ATOM 1162 O GLY A 431 16.684 22.988 19.971 1.00 0.00 O ATOM 0 H GLY A 431 12.822 22.566 18.086 1.00 0.00 H new ATOM 0 HA2 GLY A 431 14.283 22.425 20.455 1.00 0.00 H new ATOM 0 HA3 GLY A 431 14.371 21.308 19.108 1.00 0.00 H new ATOM 1166 N SER A 432 16.126 23.097 17.792 1.00 0.00 N ATOM 1167 CA SER A 432 17.439 23.568 17.360 1.00 0.00 C ATOM 1168 C SER A 432 17.617 25.054 17.667 1.00 0.00 C ATOM 1169 O SER A 432 17.747 25.873 16.757 1.00 0.00 O ATOM 1170 CB SER A 432 17.627 23.316 15.863 1.00 0.00 C ATOM 1171 OG SER A 432 17.519 21.937 15.561 1.00 0.00 O ATOM 0 H SER A 432 15.451 22.983 17.036 1.00 0.00 H new ATOM 0 HA SER A 432 18.196 23.011 17.913 1.00 0.00 H new ATOM 0 HB2 SER A 432 16.879 23.874 15.300 1.00 0.00 H new ATOM 0 HB3 SER A 432 18.603 23.685 15.549 1.00 0.00 H new ATOM 0 HG SER A 432 17.641 21.802 14.598 1.00 0.00 H new ATOM 1177 N SER A 433 17.626 25.392 18.955 1.00 0.00 N ATOM 1178 CA SER A 433 17.791 26.778 19.384 1.00 0.00 C ATOM 1179 C SER A 433 18.191 26.843 20.855 1.00 0.00 C ATOM 1180 O SER A 433 19.129 27.602 21.178 1.00 0.00 O ATOM 1181 CB SER A 433 16.496 27.564 19.167 1.00 0.00 C ATOM 1182 OG SER A 433 16.134 27.593 17.797 1.00 0.00 O ATOM 1183 OXT SER A 433 17.563 26.136 21.670 1.00 0.00 O ATOM 0 H SER A 433 17.521 24.725 19.719 1.00 0.00 H new ATOM 0 HA SER A 433 18.583 27.225 18.783 1.00 0.00 H new ATOM 0 HB2 SER A 433 15.692 27.112 19.748 1.00 0.00 H new ATOM 0 HB3 SER A 433 16.621 28.583 19.534 1.00 0.00 H new ATOM 0 HG SER A 433 16.891 27.293 17.252 1.00 0.00 H new TER 1189 SER A 433