USER MOD reduce.3.24.130724 H: found=0, std=0, add=971, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 973 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 425 HIS : no HD1:sc= -6.68! C(o=-17!,f=-18!) USER MOD Set 1.2: A 434 ASN : amide:sc= -10.8! C(o=-17!,f=-18!) USER MOD Set 2.1: A 421 TYR OH : rot 50:sc= 1.16 USER MOD Set 2.2: A 473 CYS SG : rot -87:sc= -0.939! USER MOD Set 3.1: A 398 ASN :FLIP amide:sc= -1.19! C(o=-4.7!,f=-0.17!) USER MOD Set 3.2: A 454 GLN : amide:sc= 1.02 K(o=-0.17,f=-6.7) USER MOD Set 4.1: A 389 SER OG : rot -89:sc= 0.529 USER MOD Set 4.2: A 402 THR OG1 : rot 22:sc= -1.43! USER MOD Single : A 392 TYR OH : rot 30:sc= -0.0081 USER MOD Single : A 394 GLN :FLIP amide:sc= -6.33! C(o=-7.6!,f=-6.3!) USER MOD Single : A 396 ASN :FLIP amide:sc= 0 F(o=-0.5,f=0) USER MOD Single : A 397 SER OG : rot -139:sc= 0.905 USER MOD Single : A 400 GLN :FLIP amide:sc= -0.281 F(o=-1.6,f=-0.28) USER MOD Single : A 401 CYS SG : rot -128:sc= -4.96! USER MOD Single : A 407 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 410 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 412 MET CE :methyl 157:sc= -0.688 (180deg=-1.91) USER MOD Single : A 414 SER OG : rot 180:sc= 0 USER MOD Single : A 415 ASN : amide:sc= -4.67! C(o=-4.7!,f=-4.3!) USER MOD Single : A 423 LYS NZ :NH3+ -122:sc= -1.54 (180deg=-4.1!) USER MOD Single : A 431 SER OG : rot 180:sc= 0 USER MOD Single : A 432 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.147) USER MOD Single : A 433 SER OG : rot -32:sc= 0.149! USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 438 THR OG1 : rot 43:sc= -2.64! USER MOD Single : A 439 LYS NZ :NH3+ -133:sc= -2.4! (180deg=-5.14!) USER MOD Single : A 440 THR OG1 : rot 180:sc= -0.744 USER MOD Single : A 443 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 444 THR OG1 : rot 84:sc= -0.662! USER MOD Single : A 446 ASN :FLIP amide:sc= 0.298 F(o=-4!,f=0.3) USER MOD Single : A 450 ASN : amide:sc= -1.05 X(o=-1,f=-1.3!) USER MOD Single : A 452 THR OG1 : rot 180:sc= -1.49 USER MOD Single : A 455 TYR OH : rot -130:sc= -3.82! USER MOD Single : A 456 HIS : no HE2:sc= 1.12 K(o=1.1,f=-6.4!) USER MOD Single : A 459 THR OG1 : rot -76:sc= 0.469 USER MOD Single : A 463 MET CE :methyl -136:sc= -0.99 (180deg=-4!) USER MOD Single : A 464 GLN : amide:sc= 0 X(o=0,f=-0.098) USER MOD Single : A 466 LYS NZ :NH3+ -171:sc= -2.74 (180deg=-3.07!) USER MOD Single : A 467 THR OG1 : rot 180:sc= 0 USER MOD Single : A 471 SER OG : rot 180:sc= 0 USER MOD Single : A 481 ASN :FLIP amide:sc= -0.0883! C(o=-1.4!,f=-0.088!) USER MOD Single : A 487 THR OG1 : rot 147:sc= -1.16 USER MOD Single : A 490 SER OG : rot 150:sc= -0.518 USER MOD Single : A 492 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 493 LYS NZ :NH3+ -132:sc= -0.243 (180deg=-1.14) USER MOD Single : A 495 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 497 ASN : amide:sc= -3.43! C(o=-3.4!,f=-3.5!) USER MOD Single : A 498 GLN :FLIP amide:sc= -0.0535 F(o=-1,f=-0.054) USER MOD Single : A 500 LYS NZ :NH3+ -159:sc= -0.0529 (180deg=-0.417) USER MOD Single : A 501 ASN :FLIP amide:sc= -1.43 F(o=-6.6!,f=-1.4) USER MOD Single : A 503 ASN : amide:sc= -1.53 K(o=-1.5,f=-4!) USER MOD Single : A 505 CYS SG : rot -60:sc= 0.164 USER MOD ----------------------------------------------------------------- ATOM 8 N ALA A 385 -11.852 16.271 1.370 1.00 10.04 N ATOM 9 CA ALA A 385 -12.910 16.510 0.389 1.00 43.31 C ATOM 10 C ALA A 385 -12.321 16.493 -1.014 1.00 54.14 C ATOM 11 O ALA A 385 -11.132 16.760 -1.193 1.00 71.03 O ATOM 12 CB ALA A 385 -13.584 17.862 0.658 1.00 52.31 C ATOM 0 HA ALA A 385 -13.659 15.722 0.474 1.00 43.31 H new ATOM 0 HB1 ALA A 385 -14.370 18.030 -0.078 1.00 52.31 H new ATOM 0 HB2 ALA A 385 -14.018 17.860 1.658 1.00 52.31 H new ATOM 0 HB3 ALA A 385 -12.843 18.659 0.586 1.00 52.31 H new ATOM 18 N LEU A 386 -13.146 16.173 -2.009 1.00 35.42 N ATOM 19 CA LEU A 386 -12.661 16.126 -3.384 1.00 41.23 C ATOM 20 C LEU A 386 -13.657 16.755 -4.340 1.00 71.33 C ATOM 21 O LEU A 386 -14.867 16.510 -4.274 1.00 52.31 O ATOM 22 CB LEU A 386 -12.415 14.683 -3.812 1.00 12.25 C ATOM 23 CG LEU A 386 -11.425 14.630 -4.990 1.00 75.44 C ATOM 24 CD1 LEU A 386 -9.983 14.670 -4.470 1.00 75.23 C ATOM 25 CD2 LEU A 386 -11.636 13.329 -5.773 1.00 73.01 C ATOM 0 H LEU A 386 -14.134 15.947 -1.892 1.00 35.42 H new ATOM 0 HA LEU A 386 -11.728 16.689 -3.420 1.00 41.23 H new ATOM 0 HB2 LEU A 386 -12.021 14.111 -2.972 1.00 12.25 H new ATOM 0 HB3 LEU A 386 -13.357 14.218 -4.100 1.00 12.25 H new ATOM 0 HG LEU A 386 -11.599 15.490 -5.637 1.00 75.44 H new ATOM 0 HD11 LEU A 386 -9.292 14.632 -5.312 1.00 75.23 H new ATOM 0 HD12 LEU A 386 -9.823 15.592 -3.911 1.00 75.23 H new ATOM 0 HD13 LEU A 386 -9.808 13.815 -3.817 1.00 75.23 H new ATOM 0 HD21 LEU A 386 -10.936 13.289 -6.608 1.00 73.01 H new ATOM 0 HD22 LEU A 386 -11.465 12.477 -5.115 1.00 73.01 H new ATOM 0 HD23 LEU A 386 -12.657 13.295 -6.154 1.00 73.01 H new ATOM 37 N GLU A 387 -13.112 17.572 -5.217 1.00 62.45 N ATOM 38 CA GLU A 387 -13.887 18.283 -6.220 1.00 10.24 C ATOM 39 C GLU A 387 -13.428 17.878 -7.617 1.00 73.04 C ATOM 40 O GLU A 387 -12.260 18.065 -7.975 1.00 35.14 O ATOM 41 CB GLU A 387 -13.696 19.792 -6.023 1.00 32.24 C ATOM 42 CG GLU A 387 -14.760 20.336 -5.064 1.00 61.24 C ATOM 43 CD GLU A 387 -14.561 21.834 -4.861 1.00 43.35 C ATOM 44 OE1 GLU A 387 -14.507 22.545 -5.852 1.00 73.33 O ATOM 45 OE2 GLU A 387 -14.465 22.250 -3.718 1.00 33.43 O ATOM 0 H GLU A 387 -12.111 17.765 -5.257 1.00 62.45 H new ATOM 0 HA GLU A 387 -14.942 18.031 -6.113 1.00 10.24 H new ATOM 0 HB2 GLU A 387 -12.701 19.992 -5.626 1.00 32.24 H new ATOM 0 HB3 GLU A 387 -13.765 20.304 -6.983 1.00 32.24 H new ATOM 0 HG2 GLU A 387 -15.755 20.144 -5.465 1.00 61.24 H new ATOM 0 HG3 GLU A 387 -14.697 19.819 -4.106 1.00 61.24 H new ATOM 52 N PHE A 388 -14.356 17.330 -8.403 1.00 42.44 N ATOM 53 CA PHE A 388 -14.050 16.903 -9.767 1.00 14.25 C ATOM 54 C PHE A 388 -15.204 17.238 -10.706 1.00 42.21 C ATOM 55 O PHE A 388 -16.366 17.260 -10.299 1.00 24.20 O ATOM 56 CB PHE A 388 -13.777 15.393 -9.813 1.00 50.54 C ATOM 57 CG PHE A 388 -14.744 14.653 -8.916 1.00 11.41 C ATOM 58 CD1 PHE A 388 -14.628 14.756 -7.524 1.00 65.04 C ATOM 59 CD2 PHE A 388 -15.746 13.850 -9.476 1.00 41.42 C ATOM 60 CE1 PHE A 388 -15.514 14.059 -6.694 1.00 70.34 C ATOM 61 CE2 PHE A 388 -16.630 13.151 -8.646 1.00 20.25 C ATOM 62 CZ PHE A 388 -16.515 13.257 -7.255 1.00 34.21 C ATOM 0 H PHE A 388 -15.323 17.172 -8.119 1.00 42.44 H new ATOM 0 HA PHE A 388 -13.157 17.437 -10.093 1.00 14.25 H new ATOM 0 HB2 PHE A 388 -13.872 15.031 -10.837 1.00 50.54 H new ATOM 0 HB3 PHE A 388 -12.753 15.193 -9.498 1.00 50.54 H new ATOM 0 HD1 PHE A 388 -13.855 15.373 -7.091 1.00 65.04 H new ATOM 0 HD2 PHE A 388 -15.836 13.770 -10.549 1.00 41.42 H new ATOM 0 HE1 PHE A 388 -15.425 14.140 -5.621 1.00 70.34 H new ATOM 0 HE2 PHE A 388 -17.401 12.530 -9.079 1.00 20.25 H new ATOM 0 HZ PHE A 388 -17.199 12.720 -6.614 1.00 34.21 H new ATOM 72 N SER A 389 -14.872 17.484 -11.971 1.00 71.41 N ATOM 73 CA SER A 389 -15.874 17.805 -12.985 1.00 3.23 C ATOM 74 C SER A 389 -15.893 16.711 -14.045 1.00 55.42 C ATOM 75 O SER A 389 -14.843 16.280 -14.514 1.00 64.24 O ATOM 76 CB SER A 389 -15.548 19.149 -13.638 1.00 73.12 C ATOM 77 OG SER A 389 -16.182 19.219 -14.908 1.00 55.20 O ATOM 0 H SER A 389 -13.914 17.467 -12.319 1.00 71.41 H new ATOM 0 HA SER A 389 -16.853 17.870 -12.511 1.00 3.23 H new ATOM 0 HB2 SER A 389 -15.888 19.967 -13.003 1.00 73.12 H new ATOM 0 HB3 SER A 389 -14.469 19.260 -13.750 1.00 73.12 H new ATOM 0 HG SER A 389 -15.587 18.846 -15.592 1.00 55.20 H new ATOM 83 N LEU A 390 -17.088 16.259 -14.413 1.00 40.22 N ATOM 84 CA LEU A 390 -17.224 15.200 -15.414 1.00 4.01 C ATOM 85 C LEU A 390 -18.060 15.671 -16.598 1.00 5.22 C ATOM 86 O LEU A 390 -19.056 16.374 -16.429 1.00 64.45 O ATOM 87 CB LEU A 390 -17.882 13.974 -14.782 1.00 32.02 C ATOM 88 CG LEU A 390 -17.127 13.582 -13.507 1.00 32.12 C ATOM 89 CD1 LEU A 390 -17.853 12.425 -12.814 1.00 33.02 C ATOM 90 CD2 LEU A 390 -15.697 13.149 -13.861 1.00 31.33 C ATOM 0 H LEU A 390 -17.971 16.605 -14.038 1.00 40.22 H new ATOM 0 HA LEU A 390 -16.228 14.941 -15.774 1.00 4.01 H new ATOM 0 HB2 LEU A 390 -18.924 14.189 -14.547 1.00 32.02 H new ATOM 0 HB3 LEU A 390 -17.879 13.143 -15.488 1.00 32.02 H new ATOM 0 HG LEU A 390 -17.088 14.441 -12.837 1.00 32.12 H new ATOM 0 HD11 LEU A 390 -17.314 12.148 -11.908 1.00 33.02 H new ATOM 0 HD12 LEU A 390 -18.865 12.734 -12.554 1.00 33.02 H new ATOM 0 HD13 LEU A 390 -17.897 11.568 -13.486 1.00 33.02 H new ATOM 0 HD21 LEU A 390 -15.165 12.872 -12.951 1.00 31.33 H new ATOM 0 HD22 LEU A 390 -15.732 12.294 -14.536 1.00 31.33 H new ATOM 0 HD23 LEU A 390 -15.177 13.974 -14.348 1.00 31.33 H new ATOM 102 N LEU A 391 -17.647 15.268 -17.798 1.00 41.03 N ATOM 103 CA LEU A 391 -18.353 15.635 -19.024 1.00 2.11 C ATOM 104 C LEU A 391 -18.522 14.411 -19.910 1.00 52.42 C ATOM 105 O LEU A 391 -17.537 13.808 -20.339 1.00 53.02 O ATOM 106 CB LEU A 391 -17.556 16.702 -19.788 1.00 70.32 C ATOM 107 CG LEU A 391 -18.142 16.916 -21.190 1.00 4.41 C ATOM 108 CD1 LEU A 391 -19.616 17.315 -21.086 1.00 10.02 C ATOM 109 CD2 LEU A 391 -17.354 18.024 -21.888 1.00 61.35 C ATOM 0 H LEU A 391 -16.824 14.685 -17.948 1.00 41.03 H new ATOM 0 HA LEU A 391 -19.333 16.032 -18.758 1.00 2.11 H new ATOM 0 HB2 LEU A 391 -17.572 17.641 -19.234 1.00 70.32 H new ATOM 0 HB3 LEU A 391 -16.513 16.397 -19.867 1.00 70.32 H new ATOM 0 HG LEU A 391 -18.070 15.992 -21.763 1.00 4.41 H new ATOM 0 HD11 LEU A 391 -20.024 17.465 -22.086 1.00 10.02 H new ATOM 0 HD12 LEU A 391 -20.172 16.525 -20.582 1.00 10.02 H new ATOM 0 HD13 LEU A 391 -19.703 18.240 -20.516 1.00 10.02 H new ATOM 0 HD21 LEU A 391 -17.761 18.186 -22.886 1.00 61.35 H new ATOM 0 HD22 LEU A 391 -17.432 18.945 -21.310 1.00 61.35 H new ATOM 0 HD23 LEU A 391 -16.307 17.732 -21.966 1.00 61.35 H new ATOM 121 N TYR A 392 -19.768 14.055 -20.202 1.00 53.11 N ATOM 122 CA TYR A 392 -20.034 12.905 -21.065 1.00 40.03 C ATOM 123 C TYR A 392 -20.473 13.396 -22.440 1.00 10.43 C ATOM 124 O TYR A 392 -21.554 13.966 -22.589 1.00 42.52 O ATOM 125 CB TYR A 392 -21.114 12.013 -20.438 1.00 31.53 C ATOM 126 CG TYR A 392 -21.664 11.023 -21.451 1.00 32.33 C ATOM 127 CD1 TYR A 392 -20.868 10.540 -22.506 1.00 54.42 C ATOM 128 CD2 TYR A 392 -22.988 10.586 -21.326 1.00 44.21 C ATOM 129 CE1 TYR A 392 -21.402 9.628 -23.424 1.00 31.23 C ATOM 130 CE2 TYR A 392 -23.518 9.673 -22.245 1.00 52.33 C ATOM 131 CZ TYR A 392 -22.726 9.195 -23.294 1.00 42.52 C ATOM 132 OH TYR A 392 -23.250 8.296 -24.199 1.00 13.11 O ATOM 0 H TYR A 392 -20.600 14.536 -19.861 1.00 53.11 H new ATOM 0 HA TYR A 392 -19.125 12.313 -21.174 1.00 40.03 H new ATOM 0 HB2 TYR A 392 -20.696 11.474 -19.588 1.00 31.53 H new ATOM 0 HB3 TYR A 392 -21.924 12.633 -20.054 1.00 31.53 H new ATOM 0 HD1 TYR A 392 -19.846 10.873 -22.607 1.00 54.42 H new ATOM 0 HD2 TYR A 392 -23.602 10.955 -20.518 1.00 44.21 H new ATOM 0 HE1 TYR A 392 -20.791 9.258 -24.234 1.00 31.23 H new ATOM 0 HE2 TYR A 392 -24.540 9.337 -22.144 1.00 52.33 H new ATOM 0 HH TYR A 392 -22.535 7.718 -24.537 1.00 13.11 H new ATOM 142 N ASP A 393 -19.621 13.184 -23.443 1.00 72.15 N ATOM 143 CA ASP A 393 -19.920 13.620 -24.804 1.00 71.44 C ATOM 144 C ASP A 393 -20.325 12.416 -25.660 1.00 75.43 C ATOM 145 O ASP A 393 -19.632 11.400 -25.688 1.00 10.03 O ATOM 146 CB ASP A 393 -18.679 14.341 -25.376 1.00 61.04 C ATOM 147 CG ASP A 393 -18.393 13.911 -26.815 1.00 53.24 C ATOM 148 OD1 ASP A 393 -18.077 12.749 -27.013 1.00 54.44 O ATOM 149 OD2 ASP A 393 -18.496 14.749 -27.694 1.00 63.20 O ATOM 0 H ASP A 393 -18.722 12.715 -23.338 1.00 72.15 H new ATOM 0 HA ASP A 393 -20.758 14.317 -24.807 1.00 71.44 H new ATOM 0 HB2 ASP A 393 -18.836 15.419 -25.342 1.00 61.04 H new ATOM 0 HB3 ASP A 393 -17.812 14.125 -24.752 1.00 61.04 H new ATOM 154 N GLN A 394 -21.472 12.534 -26.328 1.00 33.31 N ATOM 155 CA GLN A 394 -22.000 11.458 -27.155 1.00 72.32 C ATOM 156 C GLN A 394 -21.521 11.547 -28.601 1.00 62.55 C ATOM 157 O GLN A 394 -21.173 10.538 -29.213 1.00 61.15 O ATOM 158 CB GLN A 394 -23.521 11.538 -27.138 1.00 70.34 C ATOM 159 CG GLN A 394 -23.980 12.893 -27.692 1.00 24.03 C ATOM 160 CD GLN A 394 -24.178 12.812 -29.204 1.00 42.25 C ATOM 161 OE1 GLN A 394 -23.815 13.817 -29.954 1.00 33.22 O flip ATOM 162 NE2 GLN A 394 -24.677 11.809 -29.714 1.00 1.25 N flip ATOM 0 H GLN A 394 -22.054 13.371 -26.310 1.00 33.31 H new ATOM 0 HA GLN A 394 -21.642 10.513 -26.745 1.00 72.32 H new ATOM 0 HB2 GLN A 394 -23.943 10.730 -27.735 1.00 70.34 H new ATOM 0 HB3 GLN A 394 -23.889 11.408 -26.120 1.00 70.34 H new ATOM 0 HG2 GLN A 394 -24.912 13.192 -27.213 1.00 24.03 H new ATOM 0 HG3 GLN A 394 -23.241 13.658 -27.456 1.00 24.03 H new ATOM 0 HE21 GLN A 394 -24.960 11.025 -29.126 1.00 1.25 H new ATOM 0 HE22 GLN A 394 -24.808 11.762 -30.725 1.00 1.25 H new ATOM 171 N ASP A 395 -21.535 12.753 -29.145 1.00 1.25 N ATOM 172 CA ASP A 395 -21.130 12.964 -30.533 1.00 44.52 C ATOM 173 C ASP A 395 -19.842 12.212 -30.847 1.00 73.50 C ATOM 174 O ASP A 395 -19.709 11.607 -31.910 1.00 53.24 O ATOM 175 CB ASP A 395 -20.928 14.457 -30.795 1.00 44.41 C ATOM 176 CG ASP A 395 -20.841 14.714 -32.297 1.00 32.40 C ATOM 177 OD1 ASP A 395 -21.607 14.108 -33.027 1.00 12.34 O ATOM 178 OD2 ASP A 395 -20.010 15.515 -32.693 1.00 64.35 O ATOM 0 H ASP A 395 -21.820 13.600 -28.653 1.00 1.25 H new ATOM 0 HA ASP A 395 -21.920 12.582 -31.179 1.00 44.52 H new ATOM 0 HB2 ASP A 395 -21.754 15.025 -30.367 1.00 44.41 H new ATOM 0 HB3 ASP A 395 -20.017 14.801 -30.305 1.00 44.41 H new ATOM 183 N ASN A 396 -18.900 12.254 -29.915 1.00 5.21 N ATOM 184 CA ASN A 396 -17.624 11.578 -30.086 1.00 74.33 C ATOM 185 C ASN A 396 -17.515 10.416 -29.103 1.00 20.14 C ATOM 186 O ASN A 396 -16.511 9.706 -29.073 1.00 45.14 O ATOM 187 CB ASN A 396 -16.493 12.582 -29.843 1.00 13.23 C ATOM 188 CG ASN A 396 -16.181 13.352 -31.124 1.00 31.43 C ATOM 189 OD1 ASN A 396 -17.142 13.973 -31.751 1.00 4.45 O flip ATOM 190 ND2 ASN A 396 -15.032 13.387 -31.563 1.00 2.24 N flip ATOM 0 H ASN A 396 -18.997 12.751 -29.030 1.00 5.21 H new ATOM 0 HA ASN A 396 -17.549 11.183 -31.099 1.00 74.33 H new ATOM 0 HB2 ASN A 396 -16.779 13.277 -29.054 1.00 13.23 H new ATOM 0 HB3 ASN A 396 -15.601 12.058 -29.499 1.00 13.23 H new ATOM 0 HD21 ASN A 396 -14.283 12.901 -31.071 1.00 2.24 H new ATOM 0 HD22 ASN A 396 -14.829 13.903 -32.419 1.00 2.24 H new ATOM 197 N SER A 397 -18.561 10.225 -28.305 1.00 75.22 N ATOM 198 CA SER A 397 -18.569 9.146 -27.324 1.00 33.22 C ATOM 199 C SER A 397 -17.279 9.195 -26.522 1.00 31.22 C ATOM 200 O SER A 397 -16.566 8.199 -26.396 1.00 73.34 O ATOM 201 CB SER A 397 -18.697 7.794 -28.028 1.00 74.54 C ATOM 202 OG SER A 397 -19.163 6.824 -27.100 1.00 33.23 O ATOM 0 H SER A 397 -19.406 10.797 -28.318 1.00 75.22 H new ATOM 0 HA SER A 397 -19.421 9.269 -26.655 1.00 33.22 H new ATOM 0 HB2 SER A 397 -19.388 7.872 -28.868 1.00 74.54 H new ATOM 0 HB3 SER A 397 -17.733 7.490 -28.436 1.00 74.54 H new ATOM 0 HG SER A 397 -18.685 5.980 -27.241 1.00 33.23 H new ATOM 208 N ASN A 398 -16.976 10.383 -26.010 1.00 51.41 N ATOM 209 CA ASN A 398 -15.756 10.603 -25.246 1.00 31.45 C ATOM 210 C ASN A 398 -16.075 10.870 -23.780 1.00 53.11 C ATOM 211 O ASN A 398 -16.763 11.837 -23.451 1.00 44.02 O ATOM 212 CB ASN A 398 -15.021 11.810 -25.837 1.00 41.22 C ATOM 213 CG ASN A 398 -14.159 11.381 -27.019 1.00 61.43 C ATOM 214 OD1 ASN A 398 -14.663 10.585 -27.918 1.00 74.33 O flip ATOM 215 ND2 ASN A 398 -12.999 11.780 -27.123 1.00 13.33 N flip ATOM 0 H ASN A 398 -17.562 11.211 -26.112 1.00 51.41 H new ATOM 0 HA ASN A 398 -15.133 9.711 -25.303 1.00 31.45 H new ATOM 0 HB2 ASN A 398 -15.742 12.561 -26.159 1.00 41.22 H new ATOM 0 HB3 ASN A 398 -14.397 12.274 -25.073 1.00 41.22 H new ATOM 0 HD21 ASN A 398 -12.609 12.403 -26.416 1.00 13.33 H new ATOM 0 HD22 ASN A 398 -12.428 11.487 -27.916 1.00 13.33 H new ATOM 222 N LEU A 399 -15.553 10.021 -22.901 1.00 1.32 N ATOM 223 CA LEU A 399 -15.763 10.181 -21.481 1.00 75.40 C ATOM 224 C LEU A 399 -14.647 11.053 -20.917 1.00 51.01 C ATOM 225 O LEU A 399 -13.502 10.614 -20.809 1.00 3.20 O ATOM 226 CB LEU A 399 -15.739 8.796 -20.851 1.00 64.31 C ATOM 227 CG LEU A 399 -15.679 8.897 -19.335 1.00 14.33 C ATOM 228 CD1 LEU A 399 -16.845 9.747 -18.827 1.00 70.40 C ATOM 229 CD2 LEU A 399 -15.779 7.486 -18.772 1.00 12.13 C ATOM 0 H LEU A 399 -14.981 9.216 -23.156 1.00 1.32 H new ATOM 0 HA LEU A 399 -16.718 10.661 -21.268 1.00 75.40 H new ATOM 0 HB2 LEU A 399 -16.628 8.240 -21.149 1.00 64.31 H new ATOM 0 HB3 LEU A 399 -14.877 8.239 -21.218 1.00 64.31 H new ATOM 0 HG LEU A 399 -14.748 9.367 -19.018 1.00 14.33 H new ATOM 0 HD11 LEU A 399 -16.798 9.817 -17.740 1.00 70.40 H new ATOM 0 HD12 LEU A 399 -16.782 10.746 -19.258 1.00 70.40 H new ATOM 0 HD13 LEU A 399 -17.787 9.285 -19.121 1.00 70.40 H new ATOM 0 HD21 LEU A 399 -15.739 7.525 -17.683 1.00 12.13 H new ATOM 0 HD22 LEU A 399 -16.721 7.036 -19.084 1.00 12.13 H new ATOM 0 HD23 LEU A 399 -14.949 6.886 -19.145 1.00 12.13 H new ATOM 241 N GLN A 400 -14.976 12.297 -20.581 1.00 4.11 N ATOM 242 CA GLN A 400 -13.982 13.231 -20.055 1.00 35.50 C ATOM 243 C GLN A 400 -14.193 13.495 -18.570 1.00 32.43 C ATOM 244 O GLN A 400 -15.309 13.761 -18.124 1.00 75.22 O ATOM 245 CB GLN A 400 -14.070 14.551 -20.826 1.00 60.54 C ATOM 246 CG GLN A 400 -13.594 14.353 -22.284 1.00 25.22 C ATOM 247 CD GLN A 400 -12.759 15.545 -22.740 1.00 54.53 C ATOM 248 OE1 GLN A 400 -11.916 16.091 -21.909 1.00 72.54 O flip ATOM 249 NE2 GLN A 400 -12.879 15.989 -23.882 1.00 43.24 N flip ATOM 0 H GLN A 400 -15.917 12.681 -20.662 1.00 4.11 H new ATOM 0 HA GLN A 400 -12.996 12.785 -20.181 1.00 35.50 H new ATOM 0 HB2 GLN A 400 -15.097 14.917 -20.818 1.00 60.54 H new ATOM 0 HB3 GLN A 400 -13.458 15.308 -20.336 1.00 60.54 H new ATOM 0 HG2 GLN A 400 -13.005 13.439 -22.360 1.00 25.22 H new ATOM 0 HG3 GLN A 400 -14.455 14.232 -22.941 1.00 25.22 H new ATOM 0 HE21 GLN A 400 -13.540 15.559 -24.529 1.00 43.24 H new ATOM 0 HE22 GLN A 400 -12.318 16.787 -24.181 1.00 43.24 H new ATOM 258 N CYS A 401 -13.099 13.429 -17.813 1.00 32.10 N ATOM 259 CA CYS A 401 -13.141 13.673 -16.372 1.00 53.22 C ATOM 260 C CYS A 401 -12.161 14.779 -16.007 1.00 62.12 C ATOM 261 O CYS A 401 -10.994 14.733 -16.398 1.00 52.34 O ATOM 262 CB CYS A 401 -12.768 12.401 -15.612 1.00 70.44 C ATOM 263 SG CYS A 401 -12.698 12.762 -13.840 1.00 65.13 S ATOM 0 H CYS A 401 -12.171 13.208 -18.174 1.00 32.10 H new ATOM 0 HA CYS A 401 -14.152 13.974 -16.098 1.00 53.22 H new ATOM 0 HB2 CYS A 401 -13.502 11.619 -15.807 1.00 70.44 H new ATOM 0 HB3 CYS A 401 -11.804 12.027 -15.957 1.00 70.44 H new ATOM 0 HG CYS A 401 -11.562 12.353 -13.358 1.00 65.13 H new ATOM 269 N THR A 402 -12.634 15.773 -15.259 1.00 23.35 N ATOM 270 CA THR A 402 -11.783 16.890 -14.852 1.00 3.24 C ATOM 271 C THR A 402 -11.670 16.960 -13.330 1.00 53.12 C ATOM 272 O THR A 402 -12.571 17.455 -12.657 1.00 24.15 O ATOM 273 CB THR A 402 -12.374 18.208 -15.390 1.00 5.31 C ATOM 274 OG1 THR A 402 -13.759 18.031 -15.646 1.00 54.30 O ATOM 275 CG2 THR A 402 -11.670 18.613 -16.691 1.00 21.42 C ATOM 0 H THR A 402 -13.596 15.829 -14.924 1.00 23.35 H new ATOM 0 HA THR A 402 -10.786 16.737 -15.265 1.00 3.24 H new ATOM 0 HB THR A 402 -12.228 18.991 -14.646 1.00 5.31 H new ATOM 0 HG1 THR A 402 -14.095 17.275 -15.121 1.00 54.30 H new ATOM 0 HG21 THR A 402 -12.097 19.545 -17.061 1.00 21.42 H new ATOM 0 HG22 THR A 402 -10.606 18.751 -16.501 1.00 21.42 H new ATOM 0 HG23 THR A 402 -11.807 17.831 -17.437 1.00 21.42 H new ATOM 283 N ILE A 403 -10.545 16.489 -12.796 1.00 72.44 N ATOM 284 CA ILE A 403 -10.322 16.538 -11.367 1.00 71.13 C ATOM 285 C ILE A 403 -9.853 17.941 -10.998 1.00 13.41 C ATOM 286 O ILE A 403 -8.805 18.398 -11.457 1.00 32.24 O ATOM 287 CB ILE A 403 -9.293 15.472 -10.985 1.00 34.11 C ATOM 288 CG1 ILE A 403 -8.961 15.554 -9.503 1.00 22.11 C ATOM 289 CG2 ILE A 403 -8.009 15.660 -11.782 1.00 55.41 C ATOM 290 CD1 ILE A 403 -10.176 15.157 -8.673 1.00 2.34 C ATOM 0 H ILE A 403 -9.784 16.074 -13.333 1.00 72.44 H new ATOM 0 HA ILE A 403 -11.239 16.327 -10.817 1.00 71.13 H new ATOM 0 HB ILE A 403 -9.727 14.497 -11.210 1.00 34.11 H new ATOM 0 HG12 ILE A 403 -8.123 14.896 -9.273 1.00 22.11 H new ATOM 0 HG13 ILE A 403 -8.651 16.567 -9.247 1.00 22.11 H new ATOM 0 HG21 ILE A 403 -7.289 14.893 -11.497 1.00 55.41 H new ATOM 0 HG22 ILE A 403 -8.226 15.576 -12.847 1.00 55.41 H new ATOM 0 HG23 ILE A 403 -7.592 16.645 -11.573 1.00 55.41 H new ATOM 0 HD11 ILE A 403 -9.929 15.219 -7.613 1.00 2.34 H new ATOM 0 HD12 ILE A 403 -11.003 15.832 -8.893 1.00 2.34 H new ATOM 0 HD13 ILE A 403 -10.467 14.136 -8.919 1.00 2.34 H new ATOM 302 N ILE A 404 -10.665 18.644 -10.216 1.00 32.24 N ATOM 303 CA ILE A 404 -10.354 20.021 -9.847 1.00 33.01 C ATOM 304 C ILE A 404 -9.317 20.128 -8.734 1.00 45.42 C ATOM 305 O ILE A 404 -8.189 20.558 -8.976 1.00 4.41 O ATOM 306 CB ILE A 404 -11.629 20.745 -9.415 1.00 64.55 C ATOM 307 CG1 ILE A 404 -12.674 20.643 -10.529 1.00 60.41 C ATOM 308 CG2 ILE A 404 -11.313 22.219 -9.152 1.00 44.30 C ATOM 309 CD1 ILE A 404 -14.018 21.161 -10.017 1.00 63.21 C ATOM 0 H ILE A 404 -11.538 18.287 -9.827 1.00 32.24 H new ATOM 0 HA ILE A 404 -9.925 20.488 -10.734 1.00 33.01 H new ATOM 0 HB ILE A 404 -12.017 20.286 -8.506 1.00 64.55 H new ATOM 0 HG12 ILE A 404 -12.355 21.223 -11.395 1.00 60.41 H new ATOM 0 HG13 ILE A 404 -12.772 19.608 -10.856 1.00 60.41 H new ATOM 0 HG21 ILE A 404 -12.221 22.737 -8.844 1.00 44.30 H new ATOM 0 HG22 ILE A 404 -10.566 22.296 -8.362 1.00 44.30 H new ATOM 0 HG23 ILE A 404 -10.926 22.676 -10.063 1.00 44.30 H new ATOM 0 HD11 ILE A 404 -14.762 21.088 -10.810 1.00 63.21 H new ATOM 0 HD12 ILE A 404 -14.338 20.562 -9.164 1.00 63.21 H new ATOM 0 HD13 ILE A 404 -13.914 22.202 -9.711 1.00 63.21 H new ATOM 321 N ARG A 405 -9.697 19.779 -7.507 1.00 71.02 N ATOM 322 CA ARG A 405 -8.753 19.915 -6.395 1.00 44.21 C ATOM 323 C ARG A 405 -9.137 19.086 -5.173 1.00 34.22 C ATOM 324 O ARG A 405 -10.280 18.649 -5.028 1.00 45.45 O ATOM 325 CB ARG A 405 -8.692 21.386 -5.992 1.00 34.15 C ATOM 326 CG ARG A 405 -9.995 21.788 -5.294 1.00 15.23 C ATOM 327 CD ARG A 405 -10.091 23.313 -5.229 1.00 52.33 C ATOM 328 NE ARG A 405 -11.347 23.714 -4.607 1.00 63.30 N ATOM 329 CZ ARG A 405 -11.533 24.955 -4.169 1.00 75.40 C ATOM 330 NH1 ARG A 405 -10.582 25.840 -4.295 1.00 0.12 N ATOM 331 NH2 ARG A 405 -12.666 25.289 -3.616 1.00 2.42 N ATOM 0 H ARG A 405 -10.616 19.413 -7.260 1.00 71.02 H new ATOM 0 HA ARG A 405 -7.787 19.546 -6.740 1.00 44.21 H new ATOM 0 HB2 ARG A 405 -7.845 21.555 -5.327 1.00 34.15 H new ATOM 0 HB3 ARG A 405 -8.534 22.008 -6.873 1.00 34.15 H new ATOM 0 HG2 ARG A 405 -10.850 21.382 -5.835 1.00 15.23 H new ATOM 0 HG3 ARG A 405 -10.026 21.368 -4.289 1.00 15.23 H new ATOM 0 HD2 ARG A 405 -9.252 23.713 -4.660 1.00 52.33 H new ATOM 0 HD3 ARG A 405 -10.024 23.732 -6.233 1.00 52.33 H new ATOM 0 HE ARG A 405 -12.097 23.030 -4.506 1.00 63.30 H new ATOM 0 HH11 ARG A 405 -9.697 25.579 -4.729 1.00 0.12 H new ATOM 0 HH12 ARG A 405 -10.724 26.793 -3.959 1.00 0.12 H new ATOM 0 HH21 ARG A 405 -13.410 24.598 -3.519 1.00 2.42 H new ATOM 0 HH22 ARG A 405 -12.808 26.241 -3.280 1.00 2.42 H new ATOM 345 N ALA A 406 -8.160 18.907 -4.282 1.00 52.15 N ATOM 346 CA ALA A 406 -8.367 18.164 -3.038 1.00 0.20 C ATOM 347 C ALA A 406 -8.310 19.135 -1.859 1.00 52.33 C ATOM 348 O ALA A 406 -7.649 20.171 -1.939 1.00 12.24 O ATOM 349 CB ALA A 406 -7.282 17.086 -2.881 1.00 62.10 C ATOM 0 H ALA A 406 -7.213 19.268 -4.400 1.00 52.15 H new ATOM 0 HA ALA A 406 -9.342 17.677 -3.064 1.00 0.20 H new ATOM 0 HB1 ALA A 406 -7.445 16.539 -1.953 1.00 62.10 H new ATOM 0 HB2 ALA A 406 -7.331 16.395 -3.723 1.00 62.10 H new ATOM 0 HB3 ALA A 406 -6.300 17.559 -2.856 1.00 62.10 H new ATOM 355 N LYS A 407 -9.011 18.806 -0.776 1.00 1.23 N ATOM 356 CA LYS A 407 -9.035 19.678 0.401 1.00 71.23 C ATOM 357 C LYS A 407 -8.629 18.929 1.669 1.00 41.02 C ATOM 358 O LYS A 407 -9.269 17.951 2.059 1.00 53.23 O ATOM 359 CB LYS A 407 -10.440 20.258 0.587 1.00 41.31 C ATOM 360 CG LYS A 407 -10.376 21.486 1.498 1.00 64.14 C ATOM 361 CD LYS A 407 -11.795 21.955 1.824 1.00 64.04 C ATOM 362 CE LYS A 407 -11.730 23.188 2.727 1.00 22.43 C ATOM 363 NZ LYS A 407 -13.112 23.657 3.027 1.00 3.24 N ATOM 0 H LYS A 407 -9.564 17.954 -0.687 1.00 1.23 H new ATOM 0 HA LYS A 407 -8.315 20.479 0.233 1.00 71.23 H new ATOM 0 HB2 LYS A 407 -10.861 20.533 -0.380 1.00 41.31 H new ATOM 0 HB3 LYS A 407 -11.100 19.506 1.020 1.00 41.31 H new ATOM 0 HG2 LYS A 407 -9.842 21.243 2.417 1.00 64.14 H new ATOM 0 HG3 LYS A 407 -9.821 22.286 1.009 1.00 64.14 H new ATOM 0 HD2 LYS A 407 -12.331 22.192 0.905 1.00 64.04 H new ATOM 0 HD3 LYS A 407 -12.348 21.157 2.319 1.00 64.04 H new ATOM 0 HE2 LYS A 407 -11.207 22.947 3.653 1.00 22.43 H new ATOM 0 HE3 LYS A 407 -11.164 23.981 2.238 1.00 22.43 H new ATOM 0 HZ1 LYS A 407 -13.068 24.495 3.641 1.00 3.24 H new ATOM 0 HZ2 LYS A 407 -13.596 23.902 2.140 1.00 3.24 H new ATOM 0 HZ3 LYS A 407 -13.638 22.901 3.510 1.00 3.24 H new ATOM 377 N GLY A 408 -7.577 19.422 2.319 1.00 23.32 N ATOM 378 CA GLY A 408 -7.094 18.830 3.561 1.00 14.51 C ATOM 379 C GLY A 408 -6.524 17.432 3.355 1.00 4.31 C ATOM 380 O GLY A 408 -7.267 16.453 3.283 1.00 2.11 O ATOM 0 H GLY A 408 -7.043 20.232 2.004 1.00 23.32 H new ATOM 0 HA2 GLY A 408 -6.326 19.473 3.992 1.00 14.51 H new ATOM 0 HA3 GLY A 408 -7.912 18.784 4.280 1.00 14.51 H new ATOM 384 N LEU A 409 -5.194 17.341 3.293 1.00 5.11 N ATOM 385 CA LEU A 409 -4.524 16.047 3.130 1.00 22.04 C ATOM 386 C LEU A 409 -3.783 15.671 4.415 1.00 4.14 C ATOM 387 O LEU A 409 -2.927 16.416 4.894 1.00 65.42 O ATOM 388 CB LEU A 409 -3.535 16.097 1.962 1.00 0.22 C ATOM 389 CG LEU A 409 -4.263 16.483 0.666 1.00 25.44 C ATOM 390 CD1 LEU A 409 -3.275 16.409 -0.502 1.00 31.33 C ATOM 391 CD2 LEU A 409 -5.429 15.518 0.404 1.00 43.11 C ATOM 0 H LEU A 409 -4.563 18.140 3.353 1.00 5.11 H new ATOM 0 HA LEU A 409 -5.282 15.293 2.918 1.00 22.04 H new ATOM 0 HB2 LEU A 409 -2.747 16.820 2.174 1.00 0.22 H new ATOM 0 HB3 LEU A 409 -3.054 15.126 1.842 1.00 0.22 H new ATOM 0 HG LEU A 409 -4.656 17.495 0.763 1.00 25.44 H new ATOM 0 HD11 LEU A 409 -3.784 16.682 -1.427 1.00 31.33 H new ATOM 0 HD12 LEU A 409 -2.450 17.099 -0.325 1.00 31.33 H new ATOM 0 HD13 LEU A 409 -2.887 15.394 -0.587 1.00 31.33 H new ATOM 0 HD21 LEU A 409 -5.937 15.803 -0.518 1.00 43.11 H new ATOM 0 HD22 LEU A 409 -5.046 14.502 0.308 1.00 43.11 H new ATOM 0 HD23 LEU A 409 -6.133 15.564 1.235 1.00 43.11 H new ATOM 403 N LYS A 410 -4.132 14.512 4.971 1.00 23.24 N ATOM 404 CA LYS A 410 -3.517 14.029 6.209 1.00 42.30 C ATOM 405 C LYS A 410 -2.041 13.673 5.997 1.00 34.31 C ATOM 406 O LYS A 410 -1.657 13.230 4.915 1.00 32.23 O ATOM 407 CB LYS A 410 -4.273 12.792 6.706 1.00 51.34 C ATOM 408 CG LYS A 410 -4.270 11.717 5.617 1.00 53.24 C ATOM 409 CD LYS A 410 -5.306 10.643 5.954 1.00 12.32 C ATOM 410 CE LYS A 410 -4.912 9.935 7.251 1.00 35.25 C ATOM 411 NZ LYS A 410 -5.664 8.652 7.366 1.00 12.45 N ATOM 0 H LYS A 410 -4.839 13.888 4.583 1.00 23.24 H new ATOM 0 HA LYS A 410 -3.573 14.826 6.950 1.00 42.30 H new ATOM 0 HB2 LYS A 410 -3.805 12.407 7.612 1.00 51.34 H new ATOM 0 HB3 LYS A 410 -5.298 13.059 6.965 1.00 51.34 H new ATOM 0 HG2 LYS A 410 -4.497 12.165 4.649 1.00 53.24 H new ATOM 0 HG3 LYS A 410 -3.280 11.269 5.537 1.00 53.24 H new ATOM 0 HD2 LYS A 410 -6.292 11.096 6.061 1.00 12.32 H new ATOM 0 HD3 LYS A 410 -5.373 9.921 5.140 1.00 12.32 H new ATOM 0 HE2 LYS A 410 -3.839 9.742 7.261 1.00 35.25 H new ATOM 0 HE3 LYS A 410 -5.129 10.574 8.107 1.00 35.25 H new ATOM 0 HZ1 LYS A 410 -5.396 8.170 8.248 1.00 12.45 H new ATOM 0 HZ2 LYS A 410 -6.685 8.848 7.375 1.00 12.45 H new ATOM 0 HZ3 LYS A 410 -5.436 8.042 6.555 1.00 12.45 H new ATOM 425 N PRO A 411 -1.211 13.854 7.005 1.00 41.52 N ATOM 426 CA PRO A 411 0.245 13.543 6.925 1.00 14.11 C ATOM 427 C PRO A 411 0.535 12.360 6.005 1.00 42.30 C ATOM 428 O PRO A 411 -0.299 11.471 5.844 1.00 51.20 O ATOM 429 CB PRO A 411 0.597 13.228 8.376 1.00 24.13 C ATOM 430 CG PRO A 411 -0.302 14.111 9.190 1.00 75.41 C ATOM 431 CD PRO A 411 -1.561 14.372 8.341 1.00 1.21 C ATOM 0 HA PRO A 411 0.831 14.358 6.501 1.00 14.11 H new ATOM 0 HB2 PRO A 411 0.429 12.175 8.604 1.00 24.13 H new ATOM 0 HB3 PRO A 411 1.647 13.435 8.582 1.00 24.13 H new ATOM 0 HG2 PRO A 411 -0.565 13.631 10.133 1.00 75.41 H new ATOM 0 HG3 PRO A 411 0.198 15.047 9.438 1.00 75.41 H new ATOM 0 HD2 PRO A 411 -2.431 13.860 8.751 1.00 1.21 H new ATOM 0 HD3 PRO A 411 -1.804 15.434 8.305 1.00 1.21 H new ATOM 439 N MET A 412 1.710 12.376 5.377 1.00 4.51 N ATOM 440 CA MET A 412 2.090 11.319 4.436 1.00 42.41 C ATOM 441 C MET A 412 3.452 10.709 4.722 1.00 5.44 C ATOM 442 O MET A 412 3.559 9.536 5.082 1.00 54.44 O ATOM 443 CB MET A 412 2.118 11.899 3.025 1.00 34.44 C ATOM 444 CG MET A 412 0.698 11.961 2.453 1.00 42.13 C ATOM 445 SD MET A 412 0.104 10.280 2.123 1.00 52.32 S ATOM 446 CE MET A 412 -1.480 10.397 2.993 1.00 14.24 C ATOM 0 H MET A 412 2.413 13.104 5.501 1.00 4.51 H new ATOM 0 HA MET A 412 1.349 10.527 4.543 1.00 42.41 H new ATOM 0 HB2 MET A 412 2.555 12.897 3.042 1.00 34.44 H new ATOM 0 HB3 MET A 412 2.750 11.285 2.384 1.00 34.44 H new ATOM 0 HG2 MET A 412 0.033 12.461 3.157 1.00 42.13 H new ATOM 0 HG3 MET A 412 0.690 12.548 1.534 1.00 42.13 H new ATOM 0 HE1 MET A 412 -2.171 9.655 2.593 1.00 14.24 H new ATOM 0 HE2 MET A 412 -1.326 10.213 4.056 1.00 14.24 H new ATOM 0 HE3 MET A 412 -1.898 11.394 2.854 1.00 14.24 H new ATOM 456 N ASP A 413 4.489 11.502 4.525 1.00 25.23 N ATOM 457 CA ASP A 413 5.849 11.023 4.727 1.00 32.14 C ATOM 458 C ASP A 413 6.272 11.200 6.174 1.00 41.24 C ATOM 459 O ASP A 413 5.864 12.152 6.836 1.00 13.02 O ATOM 460 CB ASP A 413 6.806 11.789 3.812 1.00 12.53 C ATOM 461 CG ASP A 413 6.323 11.700 2.366 1.00 4.40 C ATOM 462 OD1 ASP A 413 5.876 10.634 1.976 1.00 20.14 O ATOM 463 OD2 ASP A 413 6.406 12.699 1.670 1.00 3.22 O ATOM 0 H ASP A 413 4.420 12.475 4.227 1.00 25.23 H new ATOM 0 HA ASP A 413 5.882 9.961 4.484 1.00 32.14 H new ATOM 0 HB2 ASP A 413 6.863 12.832 4.122 1.00 12.53 H new ATOM 0 HB3 ASP A 413 7.811 11.376 3.895 1.00 12.53 H new ATOM 468 N SER A 414 7.103 10.284 6.661 1.00 1.11 N ATOM 469 CA SER A 414 7.576 10.376 8.030 1.00 5.01 C ATOM 470 C SER A 414 8.087 11.786 8.276 1.00 42.20 C ATOM 471 O SER A 414 8.087 12.279 9.404 1.00 42.51 O ATOM 472 CB SER A 414 8.700 9.367 8.273 1.00 60.24 C ATOM 473 OG SER A 414 8.184 8.049 8.137 1.00 51.54 O ATOM 0 H SER A 414 7.456 9.484 6.136 1.00 1.11 H new ATOM 0 HA SER A 414 6.758 10.151 8.714 1.00 5.01 H new ATOM 0 HB2 SER A 414 9.510 9.528 7.561 1.00 60.24 H new ATOM 0 HB3 SER A 414 9.119 9.505 9.270 1.00 60.24 H new ATOM 0 HG SER A 414 8.902 7.399 8.290 1.00 51.54 H new ATOM 479 N ASN A 415 8.520 12.430 7.194 1.00 11.43 N ATOM 480 CA ASN A 415 9.029 13.787 7.281 1.00 52.52 C ATOM 481 C ASN A 415 7.885 14.773 7.488 1.00 15.04 C ATOM 482 O ASN A 415 8.098 15.869 8.007 1.00 5.42 O ATOM 483 CB ASN A 415 9.788 14.143 6.001 1.00 53.51 C ATOM 484 CG ASN A 415 10.341 15.560 6.101 1.00 25.14 C ATOM 485 OD1 ASN A 415 10.313 16.165 7.172 1.00 31.03 O ATOM 486 ND2 ASN A 415 10.846 16.129 5.040 1.00 22.31 N ATOM 0 H ASN A 415 8.527 12.033 6.255 1.00 11.43 H new ATOM 0 HA ASN A 415 9.706 13.849 8.133 1.00 52.52 H new ATOM 0 HB2 ASN A 415 10.602 13.436 5.843 1.00 53.51 H new ATOM 0 HB3 ASN A 415 9.124 14.063 5.140 1.00 53.51 H new ATOM 0 HD21 ASN A 415 11.218 17.077 5.098 1.00 22.31 H new ATOM 0 HD22 ASN A 415 10.868 15.626 4.153 1.00 22.31 H new ATOM 493 N GLY A 416 6.665 14.390 7.093 1.00 71.23 N ATOM 494 CA GLY A 416 5.520 15.276 7.270 1.00 23.35 C ATOM 495 C GLY A 416 5.186 15.989 5.973 1.00 22.13 C ATOM 496 O GLY A 416 4.241 16.777 5.913 1.00 42.43 O ATOM 0 H GLY A 416 6.452 13.492 6.659 1.00 71.23 H new ATOM 0 HA2 GLY A 416 4.658 14.701 7.607 1.00 23.35 H new ATOM 0 HA3 GLY A 416 5.738 16.008 8.047 1.00 23.35 H new ATOM 500 N LEU A 417 5.943 15.690 4.923 1.00 21.52 N ATOM 501 CA LEU A 417 5.689 16.289 3.624 1.00 14.03 C ATOM 502 C LEU A 417 4.653 15.450 2.904 1.00 42.22 C ATOM 503 O LEU A 417 4.107 14.509 3.484 1.00 70.03 O ATOM 504 CB LEU A 417 6.976 16.342 2.797 1.00 40.10 C ATOM 505 CG LEU A 417 8.120 16.897 3.647 1.00 24.45 C ATOM 506 CD1 LEU A 417 9.339 17.136 2.755 1.00 71.12 C ATOM 507 CD2 LEU A 417 7.692 18.223 4.289 1.00 52.43 C ATOM 0 H LEU A 417 6.730 15.042 4.948 1.00 21.52 H new ATOM 0 HA LEU A 417 5.326 17.308 3.757 1.00 14.03 H new ATOM 0 HB2 LEU A 417 7.229 15.344 2.438 1.00 40.10 H new ATOM 0 HB3 LEU A 417 6.828 16.969 1.918 1.00 40.10 H new ATOM 0 HG LEU A 417 8.370 16.182 4.431 1.00 24.45 H new ATOM 0 HD11 LEU A 417 10.158 17.532 3.356 1.00 71.12 H new ATOM 0 HD12 LEU A 417 9.646 16.195 2.299 1.00 71.12 H new ATOM 0 HD13 LEU A 417 9.083 17.852 1.974 1.00 71.12 H new ATOM 0 HD21 LEU A 417 8.510 18.615 4.894 1.00 52.43 H new ATOM 0 HD22 LEU A 417 7.441 18.941 3.508 1.00 52.43 H new ATOM 0 HD23 LEU A 417 6.820 18.056 4.922 1.00 52.43 H new ATOM 519 N ALA A 418 4.381 15.768 1.648 1.00 60.41 N ATOM 520 CA ALA A 418 3.399 14.999 0.904 1.00 75.42 C ATOM 521 C ALA A 418 3.424 15.337 -0.577 1.00 24.41 C ATOM 522 O ALA A 418 3.569 16.499 -0.967 1.00 73.51 O ATOM 523 CB ALA A 418 2.000 15.272 1.449 1.00 24.42 C ATOM 0 H ALA A 418 4.815 16.534 1.133 1.00 60.41 H new ATOM 0 HA ALA A 418 3.653 13.946 1.023 1.00 75.42 H new ATOM 0 HB1 ALA A 418 1.270 14.691 0.885 1.00 24.42 H new ATOM 0 HB2 ALA A 418 1.957 14.987 2.500 1.00 24.42 H new ATOM 0 HB3 ALA A 418 1.772 16.333 1.352 1.00 24.42 H new ATOM 529 N ASP A 419 3.243 14.303 -1.387 1.00 53.41 N ATOM 530 CA ASP A 419 3.200 14.449 -2.836 1.00 72.43 C ATOM 531 C ASP A 419 2.039 13.608 -3.360 1.00 40.25 C ATOM 532 O ASP A 419 2.206 12.425 -3.659 1.00 40.31 O ATOM 533 CB ASP A 419 4.518 13.963 -3.449 1.00 14.10 C ATOM 534 CG ASP A 419 5.690 14.397 -2.574 1.00 72.42 C ATOM 535 OD1 ASP A 419 6.001 13.681 -1.637 1.00 42.45 O ATOM 536 OD2 ASP A 419 6.260 15.440 -2.853 1.00 54.50 O ATOM 0 H ASP A 419 3.122 13.344 -1.061 1.00 53.41 H new ATOM 0 HA ASP A 419 3.061 15.495 -3.108 1.00 72.43 H new ATOM 0 HB2 ASP A 419 4.506 12.877 -3.544 1.00 14.10 H new ATOM 0 HB3 ASP A 419 4.633 14.369 -4.454 1.00 14.10 H new ATOM 541 N PRO A 420 0.866 14.180 -3.438 1.00 71.22 N ATOM 542 CA PRO A 420 -0.348 13.459 -3.887 1.00 5.41 C ATOM 543 C PRO A 420 -0.560 13.488 -5.399 1.00 42.12 C ATOM 544 O PRO A 420 -0.234 14.462 -6.078 1.00 53.22 O ATOM 545 CB PRO A 420 -1.457 14.210 -3.155 1.00 14.21 C ATOM 546 CG PRO A 420 -0.982 15.629 -3.106 1.00 24.21 C ATOM 547 CD PRO A 420 0.556 15.579 -3.097 1.00 71.42 C ATOM 0 HA PRO A 420 -0.299 12.393 -3.665 1.00 5.41 H new ATOM 0 HB2 PRO A 420 -2.407 14.128 -3.683 1.00 14.21 H new ATOM 0 HB3 PRO A 420 -1.613 13.809 -2.153 1.00 14.21 H new ATOM 0 HG2 PRO A 420 -1.346 16.189 -3.967 1.00 24.21 H new ATOM 0 HG3 PRO A 420 -1.358 16.133 -2.216 1.00 24.21 H new ATOM 0 HD2 PRO A 420 0.983 16.271 -3.823 1.00 71.42 H new ATOM 0 HD3 PRO A 420 0.959 15.851 -2.122 1.00 71.42 H new ATOM 555 N TYR A 421 -1.136 12.399 -5.895 1.00 21.15 N ATOM 556 CA TYR A 421 -1.438 12.257 -7.313 1.00 4.42 C ATOM 557 C TYR A 421 -2.748 11.498 -7.472 1.00 70.13 C ATOM 558 O TYR A 421 -3.128 10.714 -6.603 1.00 15.32 O ATOM 559 CB TYR A 421 -0.295 11.541 -8.041 1.00 65.32 C ATOM 560 CG TYR A 421 -0.227 10.085 -7.635 1.00 1.22 C ATOM 561 CD1 TYR A 421 0.081 9.737 -6.314 1.00 21.12 C ATOM 562 CD2 TYR A 421 -0.455 9.082 -8.587 1.00 54.20 C ATOM 563 CE1 TYR A 421 0.159 8.388 -5.945 1.00 33.12 C ATOM 564 CE2 TYR A 421 -0.378 7.735 -8.216 1.00 14.15 C ATOM 565 CZ TYR A 421 -0.070 7.389 -6.897 1.00 54.20 C ATOM 566 OH TYR A 421 0.007 6.059 -6.533 1.00 35.24 O ATOM 0 H TYR A 421 -1.405 11.594 -5.329 1.00 21.15 H new ATOM 0 HA TYR A 421 -1.543 13.245 -7.761 1.00 4.42 H new ATOM 0 HB2 TYR A 421 -0.441 11.616 -9.119 1.00 65.32 H new ATOM 0 HB3 TYR A 421 0.651 12.031 -7.812 1.00 65.32 H new ATOM 0 HD1 TYR A 421 0.258 10.509 -5.580 1.00 21.12 H new ATOM 0 HD2 TYR A 421 -0.690 9.349 -9.607 1.00 54.20 H new ATOM 0 HE1 TYR A 421 0.396 8.119 -4.926 1.00 33.12 H new ATOM 0 HE2 TYR A 421 -0.557 6.962 -8.949 1.00 14.15 H new ATOM 0 HH TYR A 421 -0.537 5.907 -5.732 1.00 35.24 H new ATOM 576 N VAL A 422 -3.456 11.759 -8.566 1.00 42.30 N ATOM 577 CA VAL A 422 -4.747 11.120 -8.806 1.00 13.44 C ATOM 578 C VAL A 422 -4.653 10.035 -9.876 1.00 50.32 C ATOM 579 O VAL A 422 -3.838 10.117 -10.795 1.00 22.42 O ATOM 580 CB VAL A 422 -5.759 12.185 -9.239 1.00 13.21 C ATOM 581 CG1 VAL A 422 -7.070 11.511 -9.640 1.00 3.23 C ATOM 582 CG2 VAL A 422 -6.008 13.170 -8.083 1.00 31.33 C ATOM 0 H VAL A 422 -3.160 12.405 -9.298 1.00 42.30 H new ATOM 0 HA VAL A 422 -5.069 10.643 -7.880 1.00 13.44 H new ATOM 0 HB VAL A 422 -5.362 12.734 -10.092 1.00 13.21 H new ATOM 0 HG11 VAL A 422 -7.790 12.269 -9.948 1.00 3.23 H new ATOM 0 HG12 VAL A 422 -6.888 10.826 -10.468 1.00 3.23 H new ATOM 0 HG13 VAL A 422 -7.469 10.956 -8.791 1.00 3.23 H new ATOM 0 HG21 VAL A 422 -6.729 13.925 -8.397 1.00 31.33 H new ATOM 0 HG22 VAL A 422 -6.401 12.629 -7.222 1.00 31.33 H new ATOM 0 HG23 VAL A 422 -5.071 13.655 -7.810 1.00 31.33 H new ATOM 592 N LYS A 423 -5.507 9.021 -9.745 1.00 75.34 N ATOM 593 CA LYS A 423 -5.544 7.915 -10.699 1.00 4.15 C ATOM 594 C LYS A 423 -6.992 7.533 -10.997 1.00 75.11 C ATOM 595 O LYS A 423 -7.751 7.194 -10.088 1.00 73.23 O ATOM 596 CB LYS A 423 -4.808 6.683 -10.144 1.00 1.33 C ATOM 597 CG LYS A 423 -3.668 7.106 -9.216 1.00 1.45 C ATOM 598 CD LYS A 423 -3.089 5.862 -8.530 1.00 32.35 C ATOM 599 CE LYS A 423 -2.372 4.977 -9.558 1.00 10.22 C ATOM 600 NZ LYS A 423 -3.365 4.086 -10.223 1.00 22.14 N ATOM 0 H LYS A 423 -6.184 8.943 -8.986 1.00 75.34 H new ATOM 0 HA LYS A 423 -5.048 8.243 -11.612 1.00 4.15 H new ATOM 0 HB2 LYS A 423 -5.509 6.049 -9.601 1.00 1.33 H new ATOM 0 HB3 LYS A 423 -4.412 6.089 -10.967 1.00 1.33 H new ATOM 0 HG2 LYS A 423 -2.891 7.618 -9.784 1.00 1.45 H new ATOM 0 HG3 LYS A 423 -4.033 7.811 -8.469 1.00 1.45 H new ATOM 0 HD2 LYS A 423 -2.392 6.161 -7.747 1.00 32.35 H new ATOM 0 HD3 LYS A 423 -3.888 5.298 -8.048 1.00 32.35 H new ATOM 0 HE2 LYS A 423 -1.869 5.597 -10.300 1.00 10.22 H new ATOM 0 HE3 LYS A 423 -1.603 4.380 -9.067 1.00 10.22 H new ATOM 0 HZ1 LYS A 423 -3.091 3.093 -10.080 1.00 22.14 H new ATOM 0 HZ2 LYS A 423 -4.307 4.248 -9.812 1.00 22.14 H new ATOM 0 HZ3 LYS A 423 -3.391 4.295 -11.241 1.00 22.14 H new ATOM 614 N LEU A 424 -7.370 7.589 -12.268 1.00 15.11 N ATOM 615 CA LEU A 424 -8.725 7.247 -12.671 1.00 34.33 C ATOM 616 C LEU A 424 -8.796 5.785 -13.107 1.00 24.30 C ATOM 617 O LEU A 424 -7.970 5.320 -13.889 1.00 64.11 O ATOM 618 CB LEU A 424 -9.145 8.157 -13.835 1.00 73.54 C ATOM 619 CG LEU A 424 -10.268 9.104 -13.405 1.00 3.15 C ATOM 620 CD1 LEU A 424 -9.758 10.091 -12.346 1.00 43.52 C ATOM 621 CD2 LEU A 424 -10.742 9.882 -14.627 1.00 25.11 C ATOM 0 H LEU A 424 -6.758 7.868 -13.035 1.00 15.11 H new ATOM 0 HA LEU A 424 -9.399 7.390 -11.827 1.00 34.33 H new ATOM 0 HB2 LEU A 424 -8.287 8.735 -14.179 1.00 73.54 H new ATOM 0 HB3 LEU A 424 -9.478 7.549 -14.676 1.00 73.54 H new ATOM 0 HG LEU A 424 -11.087 8.524 -12.979 1.00 3.15 H new ATOM 0 HD11 LEU A 424 -10.568 10.758 -12.050 1.00 43.52 H new ATOM 0 HD12 LEU A 424 -9.405 9.539 -11.474 1.00 43.52 H new ATOM 0 HD13 LEU A 424 -8.938 10.678 -12.760 1.00 43.52 H new ATOM 0 HD21 LEU A 424 -11.543 10.562 -14.337 1.00 25.11 H new ATOM 0 HD22 LEU A 424 -9.911 10.455 -15.039 1.00 25.11 H new ATOM 0 HD23 LEU A 424 -11.111 9.186 -15.380 1.00 25.11 H new ATOM 633 N HIS A 425 -9.791 5.073 -12.591 1.00 4.33 N ATOM 634 CA HIS A 425 -9.976 3.663 -12.926 1.00 54.30 C ATOM 635 C HIS A 425 -11.454 3.366 -13.156 1.00 71.10 C ATOM 636 O HIS A 425 -12.304 3.726 -12.341 1.00 21.21 O ATOM 637 CB HIS A 425 -9.444 2.786 -11.788 1.00 43.30 C ATOM 638 CG HIS A 425 -9.243 1.377 -12.280 1.00 64.52 C ATOM 639 ND1 HIS A 425 -10.187 0.723 -13.053 1.00 15.41 N ATOM 640 CD2 HIS A 425 -8.213 0.486 -12.110 1.00 54.12 C ATOM 641 CE1 HIS A 425 -9.712 -0.508 -13.318 1.00 60.44 C ATOM 642 NE2 HIS A 425 -8.511 -0.704 -12.767 1.00 74.54 N ATOM 0 H HIS A 425 -10.482 5.446 -11.940 1.00 4.33 H new ATOM 0 HA HIS A 425 -9.425 3.443 -13.840 1.00 54.30 H new ATOM 0 HB2 HIS A 425 -8.502 3.189 -11.416 1.00 43.30 H new ATOM 0 HB3 HIS A 425 -10.145 2.793 -10.953 1.00 43.30 H new ATOM 0 HD2 HIS A 425 -7.309 0.679 -11.551 1.00 54.12 H new ATOM 0 HE1 HIS A 425 -10.238 -1.247 -13.904 1.00 60.44 H new ATOM 0 HE2 HIS A 425 -7.936 -1.545 -12.817 1.00 74.54 H new ATOM 651 N LEU A 426 -11.757 2.716 -14.277 1.00 14.52 N ATOM 652 CA LEU A 426 -13.141 2.378 -14.611 1.00 23.04 C ATOM 653 C LEU A 426 -13.396 0.901 -14.360 1.00 73.24 C ATOM 654 O LEU A 426 -12.713 0.037 -14.911 1.00 13.21 O ATOM 655 CB LEU A 426 -13.421 2.716 -16.083 1.00 14.44 C ATOM 656 CG LEU A 426 -13.785 4.201 -16.218 1.00 72.44 C ATOM 657 CD1 LEU A 426 -12.776 5.062 -15.450 1.00 40.20 C ATOM 658 CD2 LEU A 426 -13.770 4.598 -17.697 1.00 65.30 C ATOM 0 H LEU A 426 -11.069 2.414 -14.967 1.00 14.52 H new ATOM 0 HA LEU A 426 -13.809 2.962 -13.978 1.00 23.04 H new ATOM 0 HB2 LEU A 426 -12.544 2.491 -16.690 1.00 14.44 H new ATOM 0 HB3 LEU A 426 -14.236 2.097 -16.459 1.00 14.44 H new ATOM 0 HG LEU A 426 -14.780 4.362 -15.804 1.00 72.44 H new ATOM 0 HD11 LEU A 426 -13.043 6.114 -15.552 1.00 40.20 H new ATOM 0 HD12 LEU A 426 -12.789 4.785 -14.396 1.00 40.20 H new ATOM 0 HD13 LEU A 426 -11.777 4.900 -15.855 1.00 40.20 H new ATOM 0 HD21 LEU A 426 -14.028 5.653 -17.793 1.00 65.30 H new ATOM 0 HD22 LEU A 426 -12.775 4.429 -18.109 1.00 65.30 H new ATOM 0 HD23 LEU A 426 -14.496 3.995 -18.243 1.00 65.30 H new ATOM 670 N LEU A 427 -14.390 0.617 -13.525 1.00 41.31 N ATOM 671 CA LEU A 427 -14.738 -0.770 -13.204 1.00 62.43 C ATOM 672 C LEU A 427 -16.259 -0.972 -13.214 1.00 24.53 C ATOM 673 O LEU A 427 -17.002 -0.069 -12.831 1.00 11.44 O ATOM 674 CB LEU A 427 -14.190 -1.142 -11.820 1.00 21.01 C ATOM 675 CG LEU A 427 -12.676 -0.842 -11.753 1.00 2.35 C ATOM 676 CD1 LEU A 427 -12.439 0.514 -11.078 1.00 70.22 C ATOM 677 CD2 LEU A 427 -11.968 -1.935 -10.945 1.00 31.35 C ATOM 0 H LEU A 427 -14.966 1.319 -13.060 1.00 41.31 H new ATOM 0 HA LEU A 427 -14.293 -1.413 -13.964 1.00 62.43 H new ATOM 0 HB2 LEU A 427 -14.715 -0.579 -11.048 1.00 21.01 H new ATOM 0 HB3 LEU A 427 -14.369 -2.199 -11.621 1.00 21.01 H new ATOM 0 HG LEU A 427 -12.277 -0.817 -12.767 1.00 2.35 H new ATOM 0 HD11 LEU A 427 -11.369 0.717 -11.035 1.00 70.22 H new ATOM 0 HD12 LEU A 427 -12.934 1.297 -11.652 1.00 70.22 H new ATOM 0 HD13 LEU A 427 -12.845 0.493 -10.067 1.00 70.22 H new ATOM 0 HD21 LEU A 427 -10.900 -1.720 -10.900 1.00 31.35 H new ATOM 0 HD22 LEU A 427 -12.376 -1.962 -9.935 1.00 31.35 H new ATOM 0 HD23 LEU A 427 -12.124 -2.901 -11.425 1.00 31.35 H new ATOM 689 N PRO A 428 -16.744 -2.131 -13.617 1.00 13.12 N ATOM 690 CA PRO A 428 -15.910 -3.278 -14.098 1.00 20.35 C ATOM 691 C PRO A 428 -15.442 -3.064 -15.536 1.00 21.02 C ATOM 692 O PRO A 428 -16.196 -2.566 -16.372 1.00 1.12 O ATOM 693 CB PRO A 428 -16.866 -4.470 -14.003 1.00 62.42 C ATOM 694 CG PRO A 428 -18.223 -3.888 -14.221 1.00 0.24 C ATOM 695 CD PRO A 428 -18.180 -2.468 -13.645 1.00 22.51 C ATOM 0 HA PRO A 428 -14.998 -3.411 -13.516 1.00 20.35 H new ATOM 0 HB2 PRO A 428 -16.634 -5.224 -14.755 1.00 62.42 H new ATOM 0 HB3 PRO A 428 -16.796 -4.957 -13.030 1.00 62.42 H new ATOM 0 HG2 PRO A 428 -18.472 -3.870 -15.282 1.00 0.24 H new ATOM 0 HG3 PRO A 428 -18.987 -4.486 -13.724 1.00 0.24 H new ATOM 0 HD2 PRO A 428 -18.741 -1.769 -14.266 1.00 22.51 H new ATOM 0 HD3 PRO A 428 -18.617 -2.430 -12.647 1.00 22.51 H new ATOM 703 N GLY A 429 -14.199 -3.437 -15.823 1.00 22.12 N ATOM 704 CA GLY A 429 -13.664 -3.269 -17.170 1.00 42.31 C ATOM 705 C GLY A 429 -12.357 -4.033 -17.348 1.00 0.22 C ATOM 706 O GLY A 429 -11.824 -4.604 -16.397 1.00 24.15 O ATOM 0 H GLY A 429 -13.551 -3.851 -15.153 1.00 22.12 H new ATOM 0 HA2 GLY A 429 -14.394 -3.619 -17.900 1.00 42.31 H new ATOM 0 HA3 GLY A 429 -13.498 -2.210 -17.368 1.00 42.31 H new ATOM 710 N ALA A 430 -11.848 -4.037 -18.577 1.00 34.32 N ATOM 711 CA ALA A 430 -10.602 -4.731 -18.877 1.00 72.13 C ATOM 712 C ALA A 430 -9.405 -3.896 -18.436 1.00 3.32 C ATOM 713 O ALA A 430 -9.213 -2.773 -18.902 1.00 22.42 O ATOM 714 CB ALA A 430 -10.507 -5.008 -20.379 1.00 2.21 C ATOM 0 H ALA A 430 -12.277 -3.570 -19.376 1.00 34.32 H new ATOM 0 HA ALA A 430 -10.593 -5.675 -18.332 1.00 72.13 H new ATOM 0 HB1 ALA A 430 -9.573 -5.527 -20.595 1.00 2.21 H new ATOM 0 HB2 ALA A 430 -11.347 -5.630 -20.688 1.00 2.21 H new ATOM 0 HB3 ALA A 430 -10.533 -4.065 -20.925 1.00 2.21 H new ATOM 720 N SER A 431 -8.604 -4.453 -17.534 1.00 42.11 N ATOM 721 CA SER A 431 -7.429 -3.763 -17.028 1.00 20.21 C ATOM 722 C SER A 431 -6.487 -3.382 -18.168 1.00 52.23 C ATOM 723 O SER A 431 -5.424 -2.806 -17.938 1.00 3.22 O ATOM 724 CB SER A 431 -6.701 -4.665 -16.031 1.00 2.40 C ATOM 725 OG SER A 431 -7.367 -4.611 -14.777 1.00 23.21 O ATOM 0 H SER A 431 -8.750 -5.382 -17.139 1.00 42.11 H new ATOM 0 HA SER A 431 -7.749 -2.847 -16.531 1.00 20.21 H new ATOM 0 HB2 SER A 431 -6.678 -5.690 -16.400 1.00 2.40 H new ATOM 0 HB3 SER A 431 -5.666 -4.343 -15.920 1.00 2.40 H new ATOM 0 HG SER A 431 -6.904 -5.189 -14.136 1.00 23.21 H new ATOM 731 N LYS A 432 -6.881 -3.703 -19.397 1.00 43.31 N ATOM 732 CA LYS A 432 -6.061 -3.385 -20.562 1.00 73.14 C ATOM 733 C LYS A 432 -5.452 -1.995 -20.427 1.00 32.14 C ATOM 734 O LYS A 432 -4.234 -1.841 -20.355 1.00 64.12 O ATOM 735 CB LYS A 432 -6.911 -3.453 -21.835 1.00 23.23 C ATOM 736 CG LYS A 432 -6.004 -3.437 -23.075 1.00 14.12 C ATOM 737 CD LYS A 432 -5.552 -4.862 -23.416 1.00 51.13 C ATOM 738 CE LYS A 432 -4.740 -4.843 -24.713 1.00 21.31 C ATOM 739 NZ LYS A 432 -3.431 -4.176 -24.469 1.00 43.01 N ATOM 0 H LYS A 432 -7.757 -4.180 -19.611 1.00 43.31 H new ATOM 0 HA LYS A 432 -5.255 -4.116 -20.625 1.00 73.14 H new ATOM 0 HB2 LYS A 432 -7.517 -4.359 -21.829 1.00 23.23 H new ATOM 0 HB3 LYS A 432 -7.600 -2.609 -21.867 1.00 23.23 H new ATOM 0 HG2 LYS A 432 -6.539 -3.005 -23.921 1.00 14.12 H new ATOM 0 HG3 LYS A 432 -5.135 -2.806 -22.891 1.00 14.12 H new ATOM 0 HD2 LYS A 432 -4.950 -5.268 -22.603 1.00 51.13 H new ATOM 0 HD3 LYS A 432 -6.419 -5.513 -23.527 1.00 51.13 H new ATOM 0 HE2 LYS A 432 -4.581 -5.861 -25.070 1.00 21.31 H new ATOM 0 HE3 LYS A 432 -5.290 -4.314 -25.491 1.00 21.31 H new ATOM 0 HZ1 LYS A 432 -2.796 -4.354 -25.273 1.00 43.01 H new ATOM 0 HZ2 LYS A 432 -3.578 -3.152 -24.363 1.00 43.01 H new ATOM 0 HZ3 LYS A 432 -3.004 -4.556 -23.600 1.00 43.01 H new ATOM 753 N SER A 433 -6.314 -0.991 -20.398 1.00 34.32 N ATOM 754 CA SER A 433 -5.859 0.392 -20.275 1.00 1.33 C ATOM 755 C SER A 433 -6.966 1.285 -19.721 1.00 10.40 C ATOM 756 O SER A 433 -6.943 2.502 -19.905 1.00 62.45 O ATOM 757 CB SER A 433 -5.419 0.917 -21.641 1.00 10.03 C ATOM 758 OG SER A 433 -4.617 -0.066 -22.285 1.00 21.44 O ATOM 0 H SER A 433 -7.326 -1.102 -20.457 1.00 34.32 H new ATOM 0 HA SER A 433 -5.017 0.412 -19.583 1.00 1.33 H new ATOM 0 HB2 SER A 433 -6.291 1.149 -22.252 1.00 10.03 H new ATOM 0 HB3 SER A 433 -4.856 1.843 -21.524 1.00 10.03 H new ATOM 0 HG SER A 433 -4.113 -0.569 -21.612 1.00 21.44 H new ATOM 764 N ASN A 434 -7.934 0.678 -19.040 1.00 61.20 N ATOM 765 CA ASN A 434 -9.036 1.428 -18.466 1.00 52.53 C ATOM 766 C ASN A 434 -8.573 2.220 -17.245 1.00 20.13 C ATOM 767 O ASN A 434 -9.370 2.534 -16.356 1.00 43.13 O ATOM 768 CB ASN A 434 -10.149 0.456 -18.068 1.00 75.42 C ATOM 769 CG ASN A 434 -9.751 -0.339 -16.826 1.00 21.45 C ATOM 770 OD1 ASN A 434 -9.403 0.242 -15.800 1.00 22.25 O ATOM 771 ND2 ASN A 434 -9.787 -1.643 -16.857 1.00 42.13 N ATOM 0 H ASN A 434 -7.974 -0.328 -18.875 1.00 61.20 H new ATOM 0 HA ASN A 434 -9.410 2.135 -19.207 1.00 52.53 H new ATOM 0 HB2 ASN A 434 -11.069 1.008 -17.874 1.00 75.42 H new ATOM 0 HB3 ASN A 434 -10.355 -0.227 -18.893 1.00 75.42 H new ATOM 0 HD21 ASN A 434 -9.526 -2.180 -16.030 1.00 42.13 H new ATOM 0 HD22 ASN A 434 -10.076 -2.125 -17.708 1.00 42.13 H new ATOM 778 N LYS A 435 -7.277 2.529 -17.199 1.00 44.11 N ATOM 779 CA LYS A 435 -6.708 3.265 -16.085 1.00 34.11 C ATOM 780 C LYS A 435 -5.774 4.374 -16.581 1.00 32.25 C ATOM 781 O LYS A 435 -4.834 4.118 -17.333 1.00 44.31 O ATOM 782 CB LYS A 435 -5.923 2.292 -15.200 1.00 32.33 C ATOM 783 CG LYS A 435 -5.399 1.124 -16.042 1.00 45.44 C ATOM 784 CD LYS A 435 -4.463 0.256 -15.195 1.00 63.41 C ATOM 785 CE LYS A 435 -3.633 -0.650 -16.108 1.00 73.34 C ATOM 786 NZ LYS A 435 -3.044 -1.758 -15.305 1.00 41.12 N ATOM 0 H LYS A 435 -6.606 2.278 -17.925 1.00 44.11 H new ATOM 0 HA LYS A 435 -7.515 3.728 -15.517 1.00 34.11 H new ATOM 0 HB2 LYS A 435 -5.090 2.811 -14.725 1.00 32.33 H new ATOM 0 HB3 LYS A 435 -6.563 1.917 -14.401 1.00 32.33 H new ATOM 0 HG2 LYS A 435 -6.232 0.525 -16.410 1.00 45.44 H new ATOM 0 HG3 LYS A 435 -4.868 1.502 -16.916 1.00 45.44 H new ATOM 0 HD2 LYS A 435 -3.805 0.888 -14.599 1.00 63.41 H new ATOM 0 HD3 LYS A 435 -5.043 -0.348 -14.497 1.00 63.41 H new ATOM 0 HE2 LYS A 435 -4.259 -1.055 -16.903 1.00 73.34 H new ATOM 0 HE3 LYS A 435 -2.842 -0.074 -16.588 1.00 73.34 H new ATOM 0 HZ1 LYS A 435 -2.480 -2.374 -15.925 1.00 41.12 H new ATOM 0 HZ2 LYS A 435 -2.434 -1.362 -14.562 1.00 41.12 H new ATOM 0 HZ3 LYS A 435 -3.807 -2.313 -14.867 1.00 41.12 H new ATOM 800 N LEU A 436 -6.031 5.602 -16.129 1.00 44.04 N ATOM 801 CA LEU A 436 -5.203 6.751 -16.502 1.00 4.44 C ATOM 802 C LEU A 436 -4.658 7.419 -15.246 1.00 25.43 C ATOM 803 O LEU A 436 -5.384 7.611 -14.271 1.00 53.44 O ATOM 804 CB LEU A 436 -6.022 7.769 -17.308 1.00 74.23 C ATOM 805 CG LEU A 436 -6.109 7.332 -18.782 1.00 74.33 C ATOM 806 CD1 LEU A 436 -7.363 7.926 -19.431 1.00 51.21 C ATOM 807 CD2 LEU A 436 -4.876 7.830 -19.547 1.00 50.52 C ATOM 0 H LEU A 436 -6.805 5.827 -15.504 1.00 44.04 H new ATOM 0 HA LEU A 436 -4.377 6.398 -17.119 1.00 4.44 H new ATOM 0 HB2 LEU A 436 -7.024 7.856 -16.887 1.00 74.23 H new ATOM 0 HB3 LEU A 436 -5.561 8.754 -17.240 1.00 74.23 H new ATOM 0 HG LEU A 436 -6.154 6.244 -18.820 1.00 74.33 H new ATOM 0 HD11 LEU A 436 -7.417 7.612 -20.473 1.00 51.21 H new ATOM 0 HD12 LEU A 436 -8.248 7.575 -18.900 1.00 51.21 H new ATOM 0 HD13 LEU A 436 -7.318 9.014 -19.382 1.00 51.21 H new ATOM 0 HD21 LEU A 436 -4.944 7.518 -20.589 1.00 50.52 H new ATOM 0 HD22 LEU A 436 -4.831 8.918 -19.497 1.00 50.52 H new ATOM 0 HD23 LEU A 436 -3.976 7.409 -19.100 1.00 50.52 H new ATOM 819 N ARG A 437 -3.372 7.756 -15.266 1.00 62.41 N ATOM 820 CA ARG A 437 -2.736 8.384 -14.110 1.00 11.24 C ATOM 821 C ARG A 437 -2.629 9.894 -14.298 1.00 25.52 C ATOM 822 O ARG A 437 -2.281 10.380 -15.374 1.00 53.14 O ATOM 823 CB ARG A 437 -1.338 7.798 -13.907 1.00 62.41 C ATOM 824 CG ARG A 437 -0.477 8.089 -15.138 1.00 15.34 C ATOM 825 CD ARG A 437 0.829 7.300 -15.047 1.00 23.51 C ATOM 826 NE ARG A 437 0.549 5.874 -14.914 1.00 31.31 N ATOM 827 CZ ARG A 437 0.045 5.176 -15.927 1.00 53.30 C ATOM 828 NH1 ARG A 437 -0.207 5.764 -17.064 1.00 12.42 N ATOM 829 NH2 ARG A 437 -0.197 3.902 -15.783 1.00 33.11 N ATOM 0 H ARG A 437 -2.753 7.607 -16.063 1.00 62.41 H new ATOM 0 HA ARG A 437 -3.352 8.185 -13.233 1.00 11.24 H new ATOM 0 HB2 ARG A 437 -0.877 8.229 -13.018 1.00 62.41 H new ATOM 0 HB3 ARG A 437 -1.404 6.723 -13.742 1.00 62.41 H new ATOM 0 HG2 ARG A 437 -1.017 7.816 -16.045 1.00 15.34 H new ATOM 0 HG3 ARG A 437 -0.265 9.156 -15.202 1.00 15.34 H new ATOM 0 HD2 ARG A 437 1.432 7.478 -15.937 1.00 23.51 H new ATOM 0 HD3 ARG A 437 1.412 7.645 -14.193 1.00 23.51 H new ATOM 0 HE ARG A 437 0.743 5.405 -14.029 1.00 31.31 H new ATOM 0 HH11 ARG A 437 -0.017 6.760 -17.176 1.00 12.42 H new ATOM 0 HH12 ARG A 437 -0.594 5.228 -17.841 1.00 12.42 H new ATOM 0 HH21 ARG A 437 0.000 3.443 -14.894 1.00 33.11 H new ATOM 0 HH22 ARG A 437 -0.584 3.365 -16.559 1.00 33.11 H new ATOM 843 N THR A 438 -2.940 10.621 -13.233 1.00 31.11 N ATOM 844 CA THR A 438 -2.894 12.078 -13.248 1.00 54.11 C ATOM 845 C THR A 438 -1.494 12.578 -12.889 1.00 23.14 C ATOM 846 O THR A 438 -0.621 11.793 -12.521 1.00 33.23 O ATOM 847 CB THR A 438 -3.911 12.604 -12.227 1.00 24.24 C ATOM 848 OG1 THR A 438 -4.977 11.671 -12.117 1.00 5.12 O ATOM 849 CG2 THR A 438 -4.475 13.956 -12.664 1.00 10.23 C ATOM 0 H THR A 438 -3.229 10.222 -12.340 1.00 31.11 H new ATOM 0 HA THR A 438 -3.136 12.440 -14.247 1.00 54.11 H new ATOM 0 HB THR A 438 -3.410 12.730 -11.267 1.00 24.24 H new ATOM 0 HG1 THR A 438 -4.614 10.761 -12.090 1.00 5.12 H new ATOM 0 HG21 THR A 438 -5.193 14.307 -11.923 1.00 10.23 H new ATOM 0 HG22 THR A 438 -3.663 14.678 -12.752 1.00 10.23 H new ATOM 0 HG23 THR A 438 -4.971 13.849 -13.628 1.00 10.23 H new ATOM 857 N LYS A 439 -1.298 13.890 -12.982 1.00 0.13 N ATOM 858 CA LYS A 439 -0.013 14.487 -12.649 1.00 45.04 C ATOM 859 C LYS A 439 0.227 14.386 -11.145 1.00 71.11 C ATOM 860 O LYS A 439 -0.720 14.231 -10.372 1.00 73.03 O ATOM 861 CB LYS A 439 -0.001 15.955 -13.081 1.00 2.51 C ATOM 862 CG LYS A 439 0.238 16.047 -14.591 1.00 35.43 C ATOM 863 CD LYS A 439 -0.124 17.451 -15.085 1.00 41.21 C ATOM 864 CE LYS A 439 0.795 18.485 -14.427 1.00 15.11 C ATOM 865 NZ LYS A 439 0.306 18.781 -13.051 1.00 61.11 N ATOM 0 H LYS A 439 -2.010 14.555 -13.284 1.00 0.13 H new ATOM 0 HA LYS A 439 0.780 13.953 -13.173 1.00 45.04 H new ATOM 0 HB2 LYS A 439 -0.949 16.428 -12.824 1.00 2.51 H new ATOM 0 HB3 LYS A 439 0.780 16.495 -12.546 1.00 2.51 H new ATOM 0 HG2 LYS A 439 1.282 15.829 -14.818 1.00 35.43 H new ATOM 0 HG3 LYS A 439 -0.364 15.301 -15.111 1.00 35.43 H new ATOM 0 HD2 LYS A 439 -0.026 17.502 -16.169 1.00 41.21 H new ATOM 0 HD3 LYS A 439 -1.165 17.673 -14.848 1.00 41.21 H new ATOM 0 HE2 LYS A 439 1.816 18.106 -14.388 1.00 15.11 H new ATOM 0 HE3 LYS A 439 0.816 19.399 -15.021 1.00 15.11 H new ATOM 0 HZ1 LYS A 439 0.286 19.810 -12.904 1.00 61.11 H new ATOM 0 HZ2 LYS A 439 -0.653 18.396 -12.933 1.00 61.11 H new ATOM 0 HZ3 LYS A 439 0.943 18.344 -12.355 1.00 61.11 H new ATOM 879 N THR A 440 1.493 14.455 -10.731 1.00 23.10 N ATOM 880 CA THR A 440 1.835 14.349 -9.311 1.00 64.31 C ATOM 881 C THR A 440 2.447 15.643 -8.780 1.00 73.20 C ATOM 882 O THR A 440 3.522 16.058 -9.215 1.00 4.12 O ATOM 883 CB THR A 440 2.834 13.205 -9.112 1.00 51.51 C ATOM 884 OG1 THR A 440 2.231 11.978 -9.494 1.00 70.53 O ATOM 885 CG2 THR A 440 3.257 13.134 -7.641 1.00 51.03 C ATOM 0 H THR A 440 2.292 14.583 -11.352 1.00 23.10 H new ATOM 0 HA THR A 440 0.915 14.155 -8.759 1.00 64.31 H new ATOM 0 HB THR A 440 3.714 13.385 -9.729 1.00 51.51 H new ATOM 0 HG1 THR A 440 2.870 11.246 -9.368 1.00 70.53 H new ATOM 0 HG21 THR A 440 3.967 12.319 -7.506 1.00 51.03 H new ATOM 0 HG22 THR A 440 3.725 14.075 -7.351 1.00 51.03 H new ATOM 0 HG23 THR A 440 2.380 12.958 -7.018 1.00 51.03 H new ATOM 893 N LEU A 441 1.768 16.260 -7.812 1.00 72.31 N ATOM 894 CA LEU A 441 2.257 17.481 -7.196 1.00 4.04 C ATOM 895 C LEU A 441 3.104 17.115 -5.983 1.00 33.32 C ATOM 896 O LEU A 441 2.870 16.089 -5.345 1.00 0.20 O ATOM 897 CB LEU A 441 1.071 18.357 -6.771 1.00 73.30 C ATOM 898 CG LEU A 441 0.585 19.183 -7.966 1.00 63.15 C ATOM 899 CD1 LEU A 441 0.089 18.242 -9.069 1.00 53.42 C ATOM 900 CD2 LEU A 441 -0.558 20.114 -7.530 1.00 32.44 C ATOM 0 H LEU A 441 0.877 15.929 -7.441 1.00 72.31 H new ATOM 0 HA LEU A 441 2.864 18.040 -7.908 1.00 4.04 H new ATOM 0 HB2 LEU A 441 0.261 17.732 -6.395 1.00 73.30 H new ATOM 0 HB3 LEU A 441 1.368 19.018 -5.957 1.00 73.30 H new ATOM 0 HG LEU A 441 1.410 19.786 -8.345 1.00 63.15 H new ATOM 0 HD11 LEU A 441 -0.257 18.829 -9.920 1.00 53.42 H new ATOM 0 HD12 LEU A 441 0.904 17.591 -9.385 1.00 53.42 H new ATOM 0 HD13 LEU A 441 -0.733 17.636 -8.688 1.00 53.42 H new ATOM 0 HD21 LEU A 441 -0.898 20.698 -8.385 1.00 32.44 H new ATOM 0 HD22 LEU A 441 -1.386 19.518 -7.145 1.00 32.44 H new ATOM 0 HD23 LEU A 441 -0.202 20.787 -6.750 1.00 32.44 H new ATOM 912 N ARG A 442 4.103 17.938 -5.687 1.00 31.41 N ATOM 913 CA ARG A 442 5.004 17.669 -4.562 1.00 74.32 C ATOM 914 C ARG A 442 4.894 18.727 -3.465 1.00 21.34 C ATOM 915 O ARG A 442 4.339 19.807 -3.668 1.00 73.05 O ATOM 916 CB ARG A 442 6.447 17.617 -5.065 1.00 40.20 C ATOM 917 CG ARG A 442 6.785 18.925 -5.784 1.00 45.02 C ATOM 918 CD ARG A 442 8.177 18.820 -6.408 1.00 61.25 C ATOM 919 NE ARG A 442 8.251 17.656 -7.283 1.00 32.24 N ATOM 920 CZ ARG A 442 9.411 17.248 -7.788 1.00 71.14 C ATOM 921 NH1 ARG A 442 10.509 17.892 -7.502 1.00 34.52 N ATOM 922 NH2 ARG A 442 9.452 16.204 -8.569 1.00 64.22 N ATOM 0 H ARG A 442 4.313 18.792 -6.203 1.00 31.41 H new ATOM 0 HA ARG A 442 4.711 16.711 -4.132 1.00 74.32 H new ATOM 0 HB2 ARG A 442 7.129 17.462 -4.229 1.00 40.20 H new ATOM 0 HB3 ARG A 442 6.577 16.773 -5.743 1.00 40.20 H new ATOM 0 HG2 ARG A 442 6.043 19.130 -6.556 1.00 45.02 H new ATOM 0 HG3 ARG A 442 6.752 19.758 -5.081 1.00 45.02 H new ATOM 0 HD2 ARG A 442 8.398 19.724 -6.975 1.00 61.25 H new ATOM 0 HD3 ARG A 442 8.930 18.743 -5.624 1.00 61.25 H new ATOM 0 HE ARG A 442 7.398 17.146 -7.512 1.00 32.24 H new ATOM 0 HH11 ARG A 442 10.477 18.708 -6.891 1.00 34.52 H new ATOM 0 HH12 ARG A 442 11.399 17.579 -7.889 1.00 34.52 H new ATOM 0 HH21 ARG A 442 8.594 15.700 -8.793 1.00 64.22 H new ATOM 0 HH22 ARG A 442 10.342 15.891 -8.956 1.00 64.22 H new ATOM 936 N ASN A 443 5.454 18.393 -2.303 1.00 24.52 N ATOM 937 CA ASN A 443 5.459 19.289 -1.150 1.00 43.41 C ATOM 938 C ASN A 443 4.175 20.110 -1.059 1.00 2.01 C ATOM 939 O ASN A 443 4.148 21.277 -1.448 1.00 15.14 O ATOM 940 CB ASN A 443 6.658 20.236 -1.236 1.00 24.23 C ATOM 941 CG ASN A 443 7.938 19.436 -1.448 1.00 53.02 C ATOM 942 OD1 ASN A 443 8.325 18.643 -0.589 1.00 51.13 O ATOM 943 ND2 ASN A 443 8.622 19.597 -2.547 1.00 40.41 N ATOM 0 H ASN A 443 5.914 17.498 -2.136 1.00 24.52 H new ATOM 0 HA ASN A 443 5.528 18.671 -0.255 1.00 43.41 H new ATOM 0 HB2 ASN A 443 6.519 20.939 -2.057 1.00 24.23 H new ATOM 0 HB3 ASN A 443 6.734 20.824 -0.322 1.00 24.23 H new ATOM 0 HD21 ASN A 443 9.480 19.065 -2.696 1.00 40.41 H new ATOM 0 HD22 ASN A 443 8.299 20.254 -3.257 1.00 40.41 H new ATOM 950 N THR A 444 3.115 19.497 -0.538 1.00 24.04 N ATOM 951 CA THR A 444 1.841 20.202 -0.399 1.00 13.44 C ATOM 952 C THR A 444 0.948 19.531 0.640 1.00 65.43 C ATOM 953 O THR A 444 1.320 18.529 1.245 1.00 2.51 O ATOM 954 CB THR A 444 1.106 20.237 -1.741 1.00 52.24 C ATOM 955 OG1 THR A 444 -0.259 20.579 -1.520 1.00 75.00 O ATOM 956 CG2 THR A 444 1.192 18.863 -2.410 1.00 60.02 C ATOM 0 H THR A 444 3.110 18.531 -0.210 1.00 24.04 H new ATOM 0 HA THR A 444 2.061 21.218 -0.070 1.00 13.44 H new ATOM 0 HB THR A 444 1.567 20.981 -2.391 1.00 52.24 H new ATOM 0 HG1 THR A 444 -0.347 21.553 -1.464 1.00 75.00 H new ATOM 0 HG21 THR A 444 0.668 18.890 -3.365 1.00 60.02 H new ATOM 0 HG22 THR A 444 2.238 18.604 -2.577 1.00 60.02 H new ATOM 0 HG23 THR A 444 0.732 18.115 -1.765 1.00 60.02 H new ATOM 964 N ARG A 445 -0.238 20.099 0.830 1.00 23.24 N ATOM 965 CA ARG A 445 -1.207 19.567 1.784 1.00 50.23 C ATOM 966 C ARG A 445 -2.613 19.867 1.283 1.00 75.31 C ATOM 967 O ARG A 445 -3.602 19.324 1.788 1.00 20.31 O ATOM 968 CB ARG A 445 -0.998 20.203 3.159 1.00 44.14 C ATOM 969 CG ARG A 445 -1.162 21.720 3.051 1.00 31.31 C ATOM 970 CD ARG A 445 -0.667 22.381 4.338 1.00 60.23 C ATOM 971 NE ARG A 445 0.749 22.098 4.538 1.00 31.02 N ATOM 972 CZ ARG A 445 1.312 22.220 5.736 1.00 14.30 C ATOM 973 NH1 ARG A 445 0.595 22.599 6.758 1.00 50.24 N ATOM 974 NH2 ARG A 445 2.582 21.960 5.890 1.00 22.22 N ATOM 0 H ARG A 445 -0.553 20.932 0.333 1.00 23.24 H new ATOM 0 HA ARG A 445 -1.071 18.489 1.876 1.00 50.23 H new ATOM 0 HB2 ARG A 445 -1.717 19.799 3.871 1.00 44.14 H new ATOM 0 HB3 ARG A 445 -0.005 19.960 3.536 1.00 44.14 H new ATOM 0 HG2 ARG A 445 -0.600 22.097 2.197 1.00 31.31 H new ATOM 0 HG3 ARG A 445 -2.209 21.972 2.880 1.00 31.31 H new ATOM 0 HD2 ARG A 445 -0.826 23.458 4.286 1.00 60.23 H new ATOM 0 HD3 ARG A 445 -1.242 22.014 5.188 1.00 60.23 H new ATOM 0 HE ARG A 445 1.318 21.801 3.745 1.00 31.02 H new ATOM 0 HH11 ARG A 445 -0.397 22.802 6.638 1.00 50.24 H new ATOM 0 HH12 ARG A 445 1.027 22.693 7.677 1.00 50.24 H new ATOM 0 HH21 ARG A 445 3.142 21.663 5.091 1.00 22.22 H new ATOM 0 HH22 ARG A 445 3.014 22.054 6.809 1.00 22.22 H new ATOM 988 N ASN A 446 -2.679 20.746 0.286 1.00 72.21 N ATOM 989 CA ASN A 446 -3.941 21.152 -0.314 1.00 43.52 C ATOM 990 C ASN A 446 -3.687 21.592 -1.758 1.00 20.41 C ATOM 991 O ASN A 446 -3.725 22.782 -2.074 1.00 72.12 O ATOM 992 CB ASN A 446 -4.525 22.307 0.499 1.00 22.51 C ATOM 993 CG ASN A 446 -6.030 22.401 0.290 1.00 34.34 C ATOM 994 OD1 ASN A 446 -6.831 22.039 1.254 1.00 2.44 O flip ATOM 995 ND2 ASN A 446 -6.488 22.812 -0.777 1.00 13.10 N flip ATOM 0 H ASN A 446 -1.860 21.194 -0.126 1.00 72.21 H new ATOM 0 HA ASN A 446 -4.648 20.322 -0.315 1.00 43.52 H new ATOM 0 HB2 ASN A 446 -4.308 22.161 1.557 1.00 22.51 H new ATOM 0 HB3 ASN A 446 -4.052 23.243 0.203 1.00 22.51 H new ATOM 0 HD21 ASN A 446 -5.858 23.094 -1.528 1.00 13.10 H new ATOM 0 HD22 ASN A 446 -7.498 22.871 -0.910 1.00 13.10 H new ATOM 1002 N PRO A 447 -3.388 20.654 -2.620 1.00 12.41 N ATOM 1003 CA PRO A 447 -3.065 20.920 -4.045 1.00 10.03 C ATOM 1004 C PRO A 447 -4.272 20.885 -4.984 1.00 14.23 C ATOM 1005 O PRO A 447 -5.260 20.187 -4.744 1.00 31.12 O ATOM 1006 CB PRO A 447 -2.083 19.792 -4.378 1.00 72.20 C ATOM 1007 CG PRO A 447 -2.418 18.658 -3.444 1.00 64.41 C ATOM 1008 CD PRO A 447 -3.321 19.219 -2.332 1.00 12.45 C ATOM 0 HA PRO A 447 -2.672 21.927 -4.183 1.00 10.03 H new ATOM 0 HB2 PRO A 447 -2.183 19.483 -5.418 1.00 72.20 H new ATOM 0 HB3 PRO A 447 -1.052 20.119 -4.240 1.00 72.20 H new ATOM 0 HG2 PRO A 447 -2.926 17.857 -3.981 1.00 64.41 H new ATOM 0 HG3 PRO A 447 -1.509 18.231 -3.020 1.00 64.41 H new ATOM 0 HD2 PRO A 447 -4.310 18.761 -2.352 1.00 12.45 H new ATOM 0 HD3 PRO A 447 -2.902 19.029 -1.344 1.00 12.45 H new ATOM 1016 N VAL A 448 -4.147 21.644 -6.071 1.00 11.32 N ATOM 1017 CA VAL A 448 -5.179 21.726 -7.100 1.00 1.23 C ATOM 1018 C VAL A 448 -4.656 21.074 -8.377 1.00 35.52 C ATOM 1019 O VAL A 448 -3.610 21.467 -8.895 1.00 44.35 O ATOM 1020 CB VAL A 448 -5.522 23.199 -7.356 1.00 23.22 C ATOM 1021 CG1 VAL A 448 -6.363 23.327 -8.632 1.00 64.45 C ATOM 1022 CG2 VAL A 448 -6.305 23.763 -6.152 1.00 74.33 C ATOM 0 H VAL A 448 -3.327 22.219 -6.262 1.00 11.32 H new ATOM 0 HA VAL A 448 -6.080 21.206 -6.774 1.00 1.23 H new ATOM 0 HB VAL A 448 -4.600 23.766 -7.484 1.00 23.22 H new ATOM 0 HG11 VAL A 448 -6.602 24.376 -8.806 1.00 64.45 H new ATOM 0 HG12 VAL A 448 -5.799 22.937 -9.480 1.00 64.45 H new ATOM 0 HG13 VAL A 448 -7.286 22.759 -8.518 1.00 64.45 H new ATOM 0 HG21 VAL A 448 -6.548 24.810 -6.334 1.00 74.33 H new ATOM 0 HG22 VAL A 448 -7.225 23.194 -6.018 1.00 74.33 H new ATOM 0 HG23 VAL A 448 -5.695 23.684 -5.252 1.00 74.33 H new ATOM 1032 N TRP A 449 -5.367 20.064 -8.873 1.00 54.24 N ATOM 1033 CA TRP A 449 -4.927 19.364 -10.078 1.00 63.24 C ATOM 1034 C TRP A 449 -5.440 20.047 -11.339 1.00 12.04 C ATOM 1035 O TRP A 449 -4.674 20.294 -12.270 1.00 34.41 O ATOM 1036 CB TRP A 449 -5.425 17.914 -10.055 1.00 53.40 C ATOM 1037 CG TRP A 449 -4.552 17.091 -9.165 1.00 13.11 C ATOM 1038 CD1 TRP A 449 -3.252 16.802 -9.402 1.00 53.33 C ATOM 1039 CD2 TRP A 449 -4.893 16.443 -7.908 1.00 51.22 C ATOM 1040 NE1 TRP A 449 -2.773 16.017 -8.370 1.00 70.52 N ATOM 1041 CE2 TRP A 449 -3.748 15.768 -7.425 1.00 64.25 C ATOM 1042 CE3 TRP A 449 -6.074 16.376 -7.148 1.00 61.42 C ATOM 1043 CZ2 TRP A 449 -3.773 15.052 -6.231 1.00 2.32 C ATOM 1044 CZ3 TRP A 449 -6.102 15.655 -5.944 1.00 34.33 C ATOM 1045 CH2 TRP A 449 -4.954 14.993 -5.487 1.00 10.22 C ATOM 0 H TRP A 449 -6.236 19.716 -8.468 1.00 54.24 H new ATOM 0 HA TRP A 449 -3.837 19.385 -10.091 1.00 63.24 H new ATOM 0 HB2 TRP A 449 -6.455 17.880 -9.701 1.00 53.40 H new ATOM 0 HB3 TRP A 449 -5.421 17.503 -11.064 1.00 53.40 H new ATOM 0 HD1 TRP A 449 -2.681 17.131 -10.258 1.00 53.33 H new ATOM 0 HE1 TRP A 449 -1.817 15.665 -8.314 1.00 70.52 H new ATOM 0 HE3 TRP A 449 -6.964 16.882 -7.492 1.00 61.42 H new ATOM 0 HZ2 TRP A 449 -2.885 14.546 -5.882 1.00 2.32 H new ATOM 0 HZ3 TRP A 449 -7.013 15.610 -5.366 1.00 34.33 H new ATOM 0 HH2 TRP A 449 -4.982 14.438 -4.561 1.00 10.22 H new ATOM 1056 N ASN A 450 -6.737 20.337 -11.379 1.00 73.22 N ATOM 1057 CA ASN A 450 -7.315 20.972 -12.555 1.00 34.35 C ATOM 1058 C ASN A 450 -6.792 20.289 -13.808 1.00 34.52 C ATOM 1059 O ASN A 450 -6.332 20.937 -14.748 1.00 22.41 O ATOM 1060 CB ASN A 450 -6.949 22.446 -12.576 1.00 64.30 C ATOM 1061 CG ASN A 450 -7.670 23.152 -13.719 1.00 41.54 C ATOM 1062 OD1 ASN A 450 -7.129 23.264 -14.821 1.00 22.33 O ATOM 1063 ND2 ASN A 450 -8.865 23.638 -13.524 1.00 52.45 N ATOM 0 H ASN A 450 -7.396 20.146 -10.625 1.00 73.22 H new ATOM 0 HA ASN A 450 -8.400 20.878 -12.521 1.00 34.35 H new ATOM 0 HB2 ASN A 450 -7.218 22.908 -11.626 1.00 64.30 H new ATOM 0 HB3 ASN A 450 -5.871 22.559 -12.692 1.00 64.30 H new ATOM 0 HD21 ASN A 450 -9.353 24.112 -14.284 1.00 52.45 H new ATOM 0 HD22 ASN A 450 -9.311 23.544 -12.611 1.00 52.45 H new ATOM 1070 N GLU A 451 -6.867 18.966 -13.793 1.00 54.51 N ATOM 1071 CA GLU A 451 -6.403 18.151 -14.910 1.00 13.40 C ATOM 1072 C GLU A 451 -7.581 17.477 -15.604 1.00 62.10 C ATOM 1073 O GLU A 451 -8.543 17.055 -14.952 1.00 63.13 O ATOM 1074 CB GLU A 451 -5.430 17.085 -14.406 1.00 15.53 C ATOM 1075 CG GLU A 451 -5.018 16.182 -15.570 1.00 11.41 C ATOM 1076 CD GLU A 451 -3.718 15.453 -15.242 1.00 51.31 C ATOM 1077 OE1 GLU A 451 -2.861 16.061 -14.624 1.00 34.41 O ATOM 1078 OE2 GLU A 451 -3.601 14.298 -15.613 1.00 32.53 O ATOM 0 H GLU A 451 -7.248 18.429 -13.014 1.00 54.51 H new ATOM 0 HA GLU A 451 -5.896 18.799 -15.625 1.00 13.40 H new ATOM 0 HB2 GLU A 451 -4.550 17.557 -13.969 1.00 15.53 H new ATOM 0 HB3 GLU A 451 -5.898 16.493 -13.620 1.00 15.53 H new ATOM 0 HG2 GLU A 451 -5.807 15.458 -15.774 1.00 11.41 H new ATOM 0 HG3 GLU A 451 -4.890 16.778 -16.474 1.00 11.41 H new ATOM 1085 N THR A 452 -7.495 17.384 -16.931 1.00 74.20 N ATOM 1086 CA THR A 452 -8.553 16.769 -17.731 1.00 22.31 C ATOM 1087 C THR A 452 -8.115 15.417 -18.285 1.00 5.33 C ATOM 1088 O THR A 452 -7.335 15.348 -19.234 1.00 51.01 O ATOM 1089 CB THR A 452 -8.918 17.693 -18.896 1.00 50.30 C ATOM 1090 OG1 THR A 452 -9.430 18.917 -18.388 1.00 13.24 O ATOM 1091 CG2 THR A 452 -9.974 17.020 -19.776 1.00 71.53 C ATOM 0 H THR A 452 -6.703 17.727 -17.474 1.00 74.20 H new ATOM 0 HA THR A 452 -9.418 16.615 -17.085 1.00 22.31 H new ATOM 0 HB THR A 452 -8.027 17.892 -19.492 1.00 50.30 H new ATOM 0 HG1 THR A 452 -9.662 19.509 -19.134 1.00 13.24 H new ATOM 0 HG21 THR A 452 -10.232 17.680 -20.604 1.00 71.53 H new ATOM 0 HG22 THR A 452 -9.578 16.083 -20.168 1.00 71.53 H new ATOM 0 HG23 THR A 452 -10.866 16.817 -19.183 1.00 71.53 H new ATOM 1099 N LEU A 453 -8.648 14.343 -17.706 1.00 20.24 N ATOM 1100 CA LEU A 453 -8.338 12.998 -18.162 1.00 44.22 C ATOM 1101 C LEU A 453 -9.429 12.547 -19.129 1.00 5.33 C ATOM 1102 O LEU A 453 -10.615 12.607 -18.803 1.00 42.14 O ATOM 1103 CB LEU A 453 -8.271 12.056 -16.961 1.00 10.01 C ATOM 1104 CG LEU A 453 -6.946 12.249 -16.218 1.00 62.24 C ATOM 1105 CD1 LEU A 453 -6.987 11.480 -14.893 1.00 24.21 C ATOM 1106 CD2 LEU A 453 -5.767 11.743 -17.073 1.00 65.25 C ATOM 0 H LEU A 453 -9.297 14.383 -16.920 1.00 20.24 H new ATOM 0 HA LEU A 453 -7.374 12.984 -18.670 1.00 44.22 H new ATOM 0 HB2 LEU A 453 -9.106 12.251 -16.288 1.00 10.01 H new ATOM 0 HB3 LEU A 453 -8.364 11.022 -17.294 1.00 10.01 H new ATOM 0 HG LEU A 453 -6.804 13.312 -16.023 1.00 62.24 H new ATOM 0 HD11 LEU A 453 -6.044 11.617 -14.364 1.00 24.21 H new ATOM 0 HD12 LEU A 453 -7.806 11.856 -14.279 1.00 24.21 H new ATOM 0 HD13 LEU A 453 -7.140 10.419 -15.092 1.00 24.21 H new ATOM 0 HD21 LEU A 453 -4.834 11.888 -16.529 1.00 65.25 H new ATOM 0 HD22 LEU A 453 -5.901 10.683 -17.286 1.00 65.25 H new ATOM 0 HD23 LEU A 453 -5.731 12.300 -18.009 1.00 65.25 H new ATOM 1118 N GLN A 454 -9.033 12.132 -20.332 1.00 64.34 N ATOM 1119 CA GLN A 454 -10.004 11.718 -21.349 1.00 3.21 C ATOM 1120 C GLN A 454 -9.922 10.225 -21.658 1.00 3.35 C ATOM 1121 O GLN A 454 -8.837 9.651 -21.755 1.00 30.14 O ATOM 1122 CB GLN A 454 -9.761 12.513 -22.636 1.00 60.35 C ATOM 1123 CG GLN A 454 -10.677 11.995 -23.749 1.00 11.53 C ATOM 1124 CD GLN A 454 -10.764 13.020 -24.875 1.00 71.42 C ATOM 1125 OE1 GLN A 454 -11.860 13.390 -25.295 1.00 72.15 O ATOM 1126 NE2 GLN A 454 -9.667 13.505 -25.390 1.00 34.31 N ATOM 0 H GLN A 454 -8.058 12.073 -20.626 1.00 64.34 H new ATOM 0 HA GLN A 454 -10.999 11.919 -20.952 1.00 3.21 H new ATOM 0 HB2 GLN A 454 -9.950 13.572 -22.461 1.00 60.35 H new ATOM 0 HB3 GLN A 454 -8.718 12.421 -22.939 1.00 60.35 H new ATOM 0 HG2 GLN A 454 -10.294 11.050 -24.135 1.00 11.53 H new ATOM 0 HG3 GLN A 454 -11.672 11.797 -23.349 1.00 11.53 H new ATOM 0 HE21 GLN A 454 -8.760 13.197 -25.040 1.00 34.31 H new ATOM 0 HE22 GLN A 454 -9.717 14.192 -26.142 1.00 34.31 H new ATOM 1135 N TYR A 455 -11.095 9.619 -21.838 1.00 23.04 N ATOM 1136 CA TYR A 455 -11.197 8.200 -22.172 1.00 53.03 C ATOM 1137 C TYR A 455 -11.883 8.063 -23.532 1.00 74.30 C ATOM 1138 O TYR A 455 -13.106 8.187 -23.635 1.00 43.22 O ATOM 1139 CB TYR A 455 -12.018 7.462 -21.095 1.00 12.22 C ATOM 1140 CG TYR A 455 -11.100 6.770 -20.108 1.00 73.11 C ATOM 1141 CD1 TYR A 455 -10.217 5.777 -20.551 1.00 12.21 C ATOM 1142 CD2 TYR A 455 -11.140 7.112 -18.749 1.00 1.23 C ATOM 1143 CE1 TYR A 455 -9.375 5.129 -19.638 1.00 65.31 C ATOM 1144 CE2 TYR A 455 -10.298 6.464 -17.838 1.00 74.32 C ATOM 1145 CZ TYR A 455 -9.416 5.472 -18.281 1.00 71.23 C ATOM 1146 OH TYR A 455 -8.587 4.834 -17.382 1.00 3.14 O ATOM 0 H TYR A 455 -11.994 10.094 -21.757 1.00 23.04 H new ATOM 0 HA TYR A 455 -10.201 7.759 -22.213 1.00 53.03 H new ATOM 0 HB2 TYR A 455 -12.659 8.170 -20.570 1.00 12.22 H new ATOM 0 HB3 TYR A 455 -12.672 6.729 -21.567 1.00 12.22 H new ATOM 0 HD1 TYR A 455 -10.185 5.511 -21.597 1.00 12.21 H new ATOM 0 HD2 TYR A 455 -11.821 7.876 -18.405 1.00 1.23 H new ATOM 0 HE1 TYR A 455 -8.694 4.364 -19.981 1.00 65.31 H new ATOM 0 HE2 TYR A 455 -10.329 6.730 -16.792 1.00 74.32 H new ATOM 0 HH TYR A 455 -9.114 4.518 -16.618 1.00 3.14 H new ATOM 1156 N HIS A 456 -11.088 7.828 -24.574 1.00 74.41 N ATOM 1157 CA HIS A 456 -11.620 7.695 -25.926 1.00 15.45 C ATOM 1158 C HIS A 456 -11.749 6.226 -26.321 1.00 52.50 C ATOM 1159 O HIS A 456 -10.830 5.432 -26.118 1.00 33.43 O ATOM 1160 CB HIS A 456 -10.692 8.419 -26.906 1.00 33.23 C ATOM 1161 CG HIS A 456 -9.264 8.255 -26.464 1.00 12.24 C ATOM 1162 ND1 HIS A 456 -8.765 7.043 -26.013 1.00 65.35 N ATOM 1163 CD2 HIS A 456 -8.218 9.140 -26.398 1.00 43.54 C ATOM 1164 CE1 HIS A 456 -7.470 7.231 -25.698 1.00 2.12 C ATOM 1165 NE2 HIS A 456 -7.085 8.491 -25.914 1.00 51.34 N ATOM 0 H HIS A 456 -10.075 7.726 -24.507 1.00 74.41 H new ATOM 0 HA HIS A 456 -12.614 8.142 -25.957 1.00 15.45 H new ATOM 0 HB2 HIS A 456 -10.821 8.015 -27.910 1.00 33.23 H new ATOM 0 HB3 HIS A 456 -10.950 9.477 -26.952 1.00 33.23 H new ATOM 0 HD1 HIS A 456 -9.284 6.169 -25.934 1.00 65.35 H new ATOM 0 HD2 HIS A 456 -8.266 10.182 -26.679 1.00 43.54 H new ATOM 0 HE1 HIS A 456 -6.821 6.457 -25.317 1.00 2.12 H new ATOM 1174 N GLY A 457 -12.904 5.876 -26.882 1.00 61.32 N ATOM 1175 CA GLY A 457 -13.170 4.502 -27.304 1.00 3.15 C ATOM 1176 C GLY A 457 -14.306 3.908 -26.483 1.00 44.30 C ATOM 1177 O GLY A 457 -14.592 2.713 -26.563 1.00 44.44 O ATOM 0 H GLY A 457 -13.672 6.525 -27.055 1.00 61.32 H new ATOM 0 HA2 GLY A 457 -13.429 4.483 -28.363 1.00 3.15 H new ATOM 0 HA3 GLY A 457 -12.271 3.897 -27.185 1.00 3.15 H new ATOM 1181 N ILE A 458 -14.947 4.759 -25.688 1.00 22.13 N ATOM 1182 CA ILE A 458 -16.054 4.327 -24.842 1.00 11.42 C ATOM 1183 C ILE A 458 -17.367 4.340 -25.616 1.00 2.03 C ATOM 1184 O ILE A 458 -17.579 5.185 -26.486 1.00 42.21 O ATOM 1185 CB ILE A 458 -16.177 5.262 -23.636 1.00 60.40 C ATOM 1186 CG1 ILE A 458 -14.870 5.245 -22.817 1.00 62.43 C ATOM 1187 CG2 ILE A 458 -17.357 4.820 -22.769 1.00 62.13 C ATOM 1188 CD1 ILE A 458 -14.856 4.072 -21.826 1.00 11.25 C ATOM 0 H ILE A 458 -14.719 5.750 -25.612 1.00 22.13 H new ATOM 0 HA ILE A 458 -15.851 3.309 -24.508 1.00 11.42 H new ATOM 0 HB ILE A 458 -16.352 6.281 -23.983 1.00 60.40 H new ATOM 0 HG12 ILE A 458 -14.016 5.167 -23.490 1.00 62.43 H new ATOM 0 HG13 ILE A 458 -14.764 6.185 -22.275 1.00 62.43 H new ATOM 0 HG21 ILE A 458 -17.446 5.485 -21.910 1.00 62.13 H new ATOM 0 HG22 ILE A 458 -18.275 4.860 -23.356 1.00 62.13 H new ATOM 0 HG23 ILE A 458 -17.192 3.800 -22.423 1.00 62.13 H new ATOM 0 HD11 ILE A 458 -13.924 4.084 -21.262 1.00 11.25 H new ATOM 0 HD12 ILE A 458 -15.697 4.166 -21.139 1.00 11.25 H new ATOM 0 HD13 ILE A 458 -14.937 3.133 -22.373 1.00 11.25 H new ATOM 1200 N THR A 459 -18.251 3.401 -25.284 1.00 71.24 N ATOM 1201 CA THR A 459 -19.555 3.308 -25.938 1.00 15.22 C ATOM 1202 C THR A 459 -20.665 3.605 -24.934 1.00 42.42 C ATOM 1203 O THR A 459 -20.554 3.270 -23.756 1.00 44.31 O ATOM 1204 CB THR A 459 -19.750 1.903 -26.515 1.00 52.52 C ATOM 1205 OG1 THR A 459 -20.041 0.996 -25.461 1.00 44.24 O ATOM 1206 CG2 THR A 459 -18.473 1.461 -27.231 1.00 43.14 C ATOM 0 H THR A 459 -18.088 2.694 -24.567 1.00 71.24 H new ATOM 0 HA THR A 459 -19.596 4.039 -26.746 1.00 15.22 H new ATOM 0 HB THR A 459 -20.577 1.914 -27.225 1.00 52.52 H new ATOM 0 HG1 THR A 459 -19.219 0.793 -24.968 1.00 44.24 H new ATOM 0 HG21 THR A 459 -18.613 0.461 -27.641 1.00 43.14 H new ATOM 0 HG22 THR A 459 -18.250 2.157 -28.040 1.00 43.14 H new ATOM 0 HG23 THR A 459 -17.644 1.450 -26.523 1.00 43.14 H new ATOM 1214 N GLU A 460 -21.736 4.236 -25.403 1.00 40.24 N ATOM 1215 CA GLU A 460 -22.854 4.571 -24.526 1.00 23.41 C ATOM 1216 C GLU A 460 -23.208 3.386 -23.633 1.00 33.21 C ATOM 1217 O GLU A 460 -23.580 3.558 -22.470 1.00 71.14 O ATOM 1218 CB GLU A 460 -24.073 4.964 -25.363 1.00 72.43 C ATOM 1219 CG GLU A 460 -25.175 5.494 -24.443 1.00 23.32 C ATOM 1220 CD GLU A 460 -26.355 5.987 -25.272 1.00 43.31 C ATOM 1221 OE1 GLU A 460 -26.203 6.092 -26.478 1.00 12.30 O ATOM 1222 OE2 GLU A 460 -27.394 6.251 -24.689 1.00 21.20 O ATOM 0 H GLU A 460 -21.854 4.524 -26.374 1.00 40.24 H new ATOM 0 HA GLU A 460 -22.559 5.410 -23.896 1.00 23.41 H new ATOM 0 HB2 GLU A 460 -23.796 5.725 -26.092 1.00 72.43 H new ATOM 0 HB3 GLU A 460 -24.436 4.102 -25.923 1.00 72.43 H new ATOM 0 HG2 GLU A 460 -25.502 4.707 -23.763 1.00 23.32 H new ATOM 0 HG3 GLU A 460 -24.787 6.306 -23.828 1.00 23.32 H new ATOM 1229 N GLU A 461 -23.088 2.183 -24.184 1.00 54.21 N ATOM 1230 CA GLU A 461 -23.397 0.973 -23.429 1.00 2.12 C ATOM 1231 C GLU A 461 -22.463 0.833 -22.231 1.00 22.34 C ATOM 1232 O GLU A 461 -22.865 0.343 -21.175 1.00 11.43 O ATOM 1233 CB GLU A 461 -23.259 -0.255 -24.334 1.00 22.50 C ATOM 1234 CG GLU A 461 -23.835 -1.482 -23.627 1.00 40.01 C ATOM 1235 CD GLU A 461 -25.349 -1.351 -23.497 1.00 25.14 C ATOM 1236 OE1 GLU A 461 -25.941 -0.692 -24.335 1.00 64.43 O ATOM 1237 OE2 GLU A 461 -25.893 -1.911 -22.560 1.00 2.15 O ATOM 0 H GLU A 461 -22.782 2.019 -25.143 1.00 54.21 H new ATOM 0 HA GLU A 461 -24.423 1.045 -23.067 1.00 2.12 H new ATOM 0 HB2 GLU A 461 -23.783 -0.086 -25.275 1.00 22.50 H new ATOM 0 HB3 GLU A 461 -22.210 -0.423 -24.578 1.00 22.50 H new ATOM 0 HG2 GLU A 461 -23.587 -2.384 -24.187 1.00 40.01 H new ATOM 0 HG3 GLU A 461 -23.385 -1.587 -22.640 1.00 40.01 H new ATOM 1244 N ASP A 462 -21.218 1.268 -22.397 1.00 42.14 N ATOM 1245 CA ASP A 462 -20.242 1.186 -21.318 1.00 74.11 C ATOM 1246 C ASP A 462 -20.528 2.245 -20.258 1.00 60.53 C ATOM 1247 O ASP A 462 -20.414 1.988 -19.060 1.00 74.02 O ATOM 1248 CB ASP A 462 -18.824 1.375 -21.881 1.00 70.12 C ATOM 1249 CG ASP A 462 -18.259 0.038 -22.356 1.00 43.12 C ATOM 1250 OD1 ASP A 462 -17.997 -0.803 -21.513 1.00 12.23 O ATOM 1251 OD2 ASP A 462 -18.097 -0.123 -23.554 1.00 72.13 O ATOM 0 H ASP A 462 -20.864 1.678 -23.261 1.00 42.14 H new ATOM 0 HA ASP A 462 -20.315 0.202 -20.854 1.00 74.11 H new ATOM 0 HB2 ASP A 462 -18.846 2.083 -22.709 1.00 70.12 H new ATOM 0 HB3 ASP A 462 -18.175 1.800 -21.115 1.00 70.12 H new ATOM 1256 N MET A 463 -20.900 3.434 -20.711 1.00 21.33 N ATOM 1257 CA MET A 463 -21.202 4.529 -19.802 1.00 51.41 C ATOM 1258 C MET A 463 -22.376 4.167 -18.900 1.00 50.43 C ATOM 1259 O MET A 463 -22.451 4.611 -17.754 1.00 62.54 O ATOM 1260 CB MET A 463 -21.541 5.784 -20.610 1.00 4.40 C ATOM 1261 CG MET A 463 -20.254 6.444 -21.110 1.00 71.51 C ATOM 1262 SD MET A 463 -19.351 7.168 -19.717 1.00 51.34 S ATOM 1263 CE MET A 463 -20.556 8.447 -19.286 1.00 0.14 C ATOM 0 H MET A 463 -21.000 3.664 -21.700 1.00 21.33 H new ATOM 0 HA MET A 463 -20.329 4.719 -19.178 1.00 51.41 H new ATOM 0 HB2 MET A 463 -22.178 5.522 -21.455 1.00 4.40 H new ATOM 0 HB3 MET A 463 -22.103 6.484 -19.992 1.00 4.40 H new ATOM 0 HG2 MET A 463 -19.630 5.707 -21.616 1.00 71.51 H new ATOM 0 HG3 MET A 463 -20.492 7.216 -21.842 1.00 71.51 H new ATOM 0 HE1 MET A 463 -20.037 9.386 -19.095 1.00 0.14 H new ATOM 0 HE2 MET A 463 -21.256 8.580 -20.111 1.00 0.14 H new ATOM 0 HE3 MET A 463 -21.102 8.146 -18.392 1.00 0.14 H new ATOM 1273 N GLN A 464 -23.296 3.370 -19.427 1.00 72.45 N ATOM 1274 CA GLN A 464 -24.471 2.964 -18.665 1.00 65.32 C ATOM 1275 C GLN A 464 -24.195 1.702 -17.851 1.00 75.55 C ATOM 1276 O GLN A 464 -25.037 1.273 -17.062 1.00 3.41 O ATOM 1277 CB GLN A 464 -25.641 2.711 -19.622 1.00 41.22 C ATOM 1278 CG GLN A 464 -26.912 2.406 -18.822 1.00 42.41 C ATOM 1279 CD GLN A 464 -28.143 2.612 -19.700 1.00 34.12 C ATOM 1280 OE1 GLN A 464 -28.367 3.711 -20.208 1.00 4.43 O ATOM 1281 NE2 GLN A 464 -28.959 1.616 -19.908 1.00 11.51 N ATOM 0 H GLN A 464 -23.253 2.993 -20.374 1.00 72.45 H new ATOM 0 HA GLN A 464 -24.723 3.768 -17.973 1.00 65.32 H new ATOM 0 HB2 GLN A 464 -25.800 3.584 -20.255 1.00 41.22 H new ATOM 0 HB3 GLN A 464 -25.408 1.876 -20.283 1.00 41.22 H new ATOM 0 HG2 GLN A 464 -26.884 1.380 -18.456 1.00 42.41 H new ATOM 0 HG3 GLN A 464 -26.966 3.055 -17.948 1.00 42.41 H new ATOM 0 HE21 GLN A 464 -28.771 0.706 -19.486 1.00 11.51 H new ATOM 0 HE22 GLN A 464 -29.785 1.747 -20.493 1.00 11.51 H new ATOM 1290 N ARG A 465 -23.029 1.089 -18.065 1.00 63.42 N ATOM 1291 CA ARG A 465 -22.687 -0.150 -17.358 1.00 70.32 C ATOM 1292 C ARG A 465 -21.459 -0.010 -16.452 1.00 61.14 C ATOM 1293 O ARG A 465 -21.302 -0.786 -15.510 1.00 0.31 O ATOM 1294 CB ARG A 465 -22.423 -1.258 -18.379 1.00 43.32 C ATOM 1295 CG ARG A 465 -22.224 -2.589 -17.650 1.00 22.22 C ATOM 1296 CD ARG A 465 -22.145 -3.723 -18.673 1.00 31.21 C ATOM 1297 NE ARG A 465 -23.431 -3.893 -19.340 1.00 22.05 N ATOM 1298 CZ ARG A 465 -23.534 -4.594 -20.464 1.00 25.11 C ATOM 1299 NH1 ARG A 465 -22.475 -5.145 -20.989 1.00 53.05 N ATOM 1300 NH2 ARG A 465 -24.696 -4.731 -21.043 1.00 51.30 N ATOM 0 H ARG A 465 -22.314 1.423 -18.712 1.00 63.42 H new ATOM 0 HA ARG A 465 -23.536 -0.392 -16.718 1.00 70.32 H new ATOM 0 HB2 ARG A 465 -23.260 -1.333 -19.074 1.00 43.32 H new ATOM 0 HB3 ARG A 465 -21.539 -1.019 -18.970 1.00 43.32 H new ATOM 0 HG2 ARG A 465 -21.311 -2.557 -17.055 1.00 22.22 H new ATOM 0 HG3 ARG A 465 -23.049 -2.765 -16.959 1.00 22.22 H new ATOM 0 HD2 ARG A 465 -21.372 -3.504 -19.409 1.00 31.21 H new ATOM 0 HD3 ARG A 465 -21.860 -4.651 -18.177 1.00 31.21 H new ATOM 0 HE ARG A 465 -24.265 -3.467 -18.937 1.00 22.05 H new ATOM 0 HH11 ARG A 465 -21.567 -5.038 -20.537 1.00 53.05 H new ATOM 0 HH12 ARG A 465 -22.555 -5.683 -21.852 1.00 53.05 H new ATOM 0 HH21 ARG A 465 -25.524 -4.300 -20.633 1.00 51.30 H new ATOM 0 HH22 ARG A 465 -24.776 -5.269 -21.906 1.00 51.30 H new ATOM 1314 N LYS A 466 -20.568 0.941 -16.739 1.00 53.51 N ATOM 1315 CA LYS A 466 -19.359 1.090 -15.928 1.00 50.40 C ATOM 1316 C LYS A 466 -19.509 2.118 -14.803 1.00 0.54 C ATOM 1317 O LYS A 466 -20.510 2.835 -14.693 1.00 42.13 O ATOM 1318 CB LYS A 466 -18.184 1.476 -16.828 1.00 11.12 C ATOM 1319 CG LYS A 466 -17.517 0.211 -17.375 1.00 51.44 C ATOM 1320 CD LYS A 466 -16.621 0.586 -18.560 1.00 34.41 C ATOM 1321 CE LYS A 466 -15.432 -0.376 -18.651 1.00 10.34 C ATOM 1322 NZ LYS A 466 -14.353 0.077 -17.729 1.00 55.14 N ATOM 0 H LYS A 466 -20.656 1.605 -17.508 1.00 53.51 H new ATOM 0 HA LYS A 466 -19.176 0.127 -15.450 1.00 50.40 H new ATOM 0 HB2 LYS A 466 -18.533 2.100 -17.651 1.00 11.12 H new ATOM 0 HB3 LYS A 466 -17.461 2.066 -16.265 1.00 11.12 H new ATOM 0 HG2 LYS A 466 -16.926 -0.269 -16.595 1.00 51.44 H new ATOM 0 HG3 LYS A 466 -18.274 -0.507 -17.689 1.00 51.44 H new ATOM 0 HD2 LYS A 466 -17.197 0.553 -19.485 1.00 34.41 H new ATOM 0 HD3 LYS A 466 -16.262 1.609 -18.444 1.00 34.41 H new ATOM 0 HE2 LYS A 466 -15.747 -1.386 -18.390 1.00 10.34 H new ATOM 0 HE3 LYS A 466 -15.058 -0.413 -19.674 1.00 10.34 H new ATOM 0 HZ1 LYS A 466 -13.493 -0.482 -17.900 1.00 55.14 H new ATOM 0 HZ2 LYS A 466 -14.152 1.083 -17.898 1.00 55.14 H new ATOM 0 HZ3 LYS A 466 -14.660 -0.054 -16.744 1.00 55.14 H new ATOM 1336 N THR A 467 -18.474 2.161 -13.967 1.00 3.41 N ATOM 1337 CA THR A 467 -18.429 3.067 -12.821 1.00 74.24 C ATOM 1338 C THR A 467 -17.114 3.840 -12.803 1.00 41.11 C ATOM 1339 O THR A 467 -16.031 3.248 -12.830 1.00 1.31 O ATOM 1340 CB THR A 467 -18.562 2.256 -11.526 1.00 5.21 C ATOM 1341 OG1 THR A 467 -19.701 1.412 -11.617 1.00 73.13 O ATOM 1342 CG2 THR A 467 -18.718 3.193 -10.325 1.00 4.34 C ATOM 0 H THR A 467 -17.647 1.572 -14.064 1.00 3.41 H new ATOM 0 HA THR A 467 -19.252 3.777 -12.901 1.00 74.24 H new ATOM 0 HB THR A 467 -17.663 1.655 -11.390 1.00 5.21 H new ATOM 0 HG1 THR A 467 -19.789 0.891 -10.792 1.00 73.13 H new ATOM 0 HG21 THR A 467 -18.811 2.603 -9.413 1.00 4.34 H new ATOM 0 HG22 THR A 467 -17.843 3.839 -10.251 1.00 4.34 H new ATOM 0 HG23 THR A 467 -19.611 3.805 -10.454 1.00 4.34 H new ATOM 1350 N LEU A 468 -17.218 5.166 -12.753 1.00 1.22 N ATOM 1351 CA LEU A 468 -16.047 6.024 -12.725 1.00 41.15 C ATOM 1352 C LEU A 468 -15.525 6.168 -11.299 1.00 22.31 C ATOM 1353 O LEU A 468 -16.211 6.714 -10.433 1.00 2.11 O ATOM 1354 CB LEU A 468 -16.426 7.402 -13.264 1.00 42.32 C ATOM 1355 CG LEU A 468 -15.158 8.256 -13.484 1.00 2.20 C ATOM 1356 CD1 LEU A 468 -14.722 8.174 -14.951 1.00 32.23 C ATOM 1357 CD2 LEU A 468 -15.448 9.720 -13.123 1.00 54.44 C ATOM 0 H LEU A 468 -18.107 5.666 -12.731 1.00 1.22 H new ATOM 0 HA LEU A 468 -15.266 5.579 -13.342 1.00 41.15 H new ATOM 0 HB2 LEU A 468 -16.970 7.296 -14.203 1.00 42.32 H new ATOM 0 HB3 LEU A 468 -17.094 7.903 -12.564 1.00 42.32 H new ATOM 0 HG LEU A 468 -14.360 7.874 -12.847 1.00 2.20 H new ATOM 0 HD11 LEU A 468 -13.827 8.779 -15.099 1.00 32.23 H new ATOM 0 HD12 LEU A 468 -14.506 7.137 -15.209 1.00 32.23 H new ATOM 0 HD13 LEU A 468 -15.522 8.548 -15.590 1.00 32.23 H new ATOM 0 HD21 LEU A 468 -14.550 10.318 -13.280 1.00 54.44 H new ATOM 0 HD22 LEU A 468 -16.251 10.098 -13.755 1.00 54.44 H new ATOM 0 HD23 LEU A 468 -15.749 9.784 -12.077 1.00 54.44 H new ATOM 1369 N ARG A 469 -14.309 5.682 -11.059 1.00 10.01 N ATOM 1370 CA ARG A 469 -13.702 5.767 -9.731 1.00 13.32 C ATOM 1371 C ARG A 469 -12.479 6.683 -9.772 1.00 24.25 C ATOM 1372 O ARG A 469 -11.642 6.577 -10.667 1.00 52.23 O ATOM 1373 CB ARG A 469 -13.305 4.360 -9.257 1.00 21.43 C ATOM 1374 CG ARG A 469 -12.230 4.444 -8.165 1.00 41.11 C ATOM 1375 CD ARG A 469 -12.142 3.106 -7.429 1.00 0.21 C ATOM 1376 NE ARG A 469 -11.016 3.115 -6.500 1.00 4.30 N ATOM 1377 CZ ARG A 469 -10.707 2.039 -5.785 1.00 43.33 C ATOM 1378 NH1 ARG A 469 -11.414 0.949 -5.908 1.00 44.22 N ATOM 1379 NH2 ARG A 469 -9.696 2.071 -4.961 1.00 31.41 N ATOM 0 H ARG A 469 -13.727 5.227 -11.762 1.00 10.01 H new ATOM 0 HA ARG A 469 -14.423 6.186 -9.029 1.00 13.32 H new ATOM 0 HB2 ARG A 469 -14.182 3.838 -8.873 1.00 21.43 H new ATOM 0 HB3 ARG A 469 -12.931 3.778 -10.099 1.00 21.43 H new ATOM 0 HG2 ARG A 469 -11.265 4.691 -8.608 1.00 41.11 H new ATOM 0 HG3 ARG A 469 -12.472 5.242 -7.463 1.00 41.11 H new ATOM 0 HD2 ARG A 469 -13.069 2.919 -6.887 1.00 0.21 H new ATOM 0 HD3 ARG A 469 -12.024 2.295 -8.147 1.00 0.21 H new ATOM 0 HE ARG A 469 -10.457 3.962 -6.398 1.00 4.30 H new ATOM 0 HH11 ARG A 469 -12.204 0.923 -6.553 1.00 44.22 H new ATOM 0 HH12 ARG A 469 -11.177 0.123 -5.359 1.00 44.22 H new ATOM 0 HH21 ARG A 469 -9.143 2.922 -4.866 1.00 31.41 H new ATOM 0 HH22 ARG A 469 -9.459 1.245 -4.412 1.00 31.41 H new ATOM 1393 N ILE A 470 -12.382 7.573 -8.786 1.00 4.15 N ATOM 1394 CA ILE A 470 -11.253 8.503 -8.700 1.00 51.42 C ATOM 1395 C ILE A 470 -10.396 8.136 -7.496 1.00 51.24 C ATOM 1396 O ILE A 470 -10.768 8.410 -6.356 1.00 42.35 O ATOM 1397 CB ILE A 470 -11.776 9.940 -8.555 1.00 60.33 C ATOM 1398 CG1 ILE A 470 -12.974 10.129 -9.493 1.00 50.24 C ATOM 1399 CG2 ILE A 470 -10.672 10.952 -8.913 1.00 43.41 C ATOM 1400 CD1 ILE A 470 -13.453 11.578 -9.432 1.00 64.12 C ATOM 0 H ILE A 470 -13.068 7.671 -8.037 1.00 4.15 H new ATOM 0 HA ILE A 470 -10.652 8.437 -9.607 1.00 51.42 H new ATOM 0 HB ILE A 470 -12.080 10.111 -7.522 1.00 60.33 H new ATOM 0 HG12 ILE A 470 -12.693 9.872 -10.514 1.00 50.24 H new ATOM 0 HG13 ILE A 470 -13.782 9.456 -9.206 1.00 50.24 H new ATOM 0 HG21 ILE A 470 -11.059 11.965 -8.805 1.00 43.41 H new ATOM 0 HG22 ILE A 470 -9.822 10.815 -8.245 1.00 43.41 H new ATOM 0 HG23 ILE A 470 -10.353 10.793 -9.943 1.00 43.41 H new ATOM 0 HD11 ILE A 470 -14.304 11.708 -10.100 1.00 64.12 H new ATOM 0 HD12 ILE A 470 -13.752 11.820 -8.412 1.00 64.12 H new ATOM 0 HD13 ILE A 470 -12.645 12.242 -9.740 1.00 64.12 H new ATOM 1412 N SER A 471 -9.261 7.496 -7.754 1.00 42.53 N ATOM 1413 CA SER A 471 -8.368 7.070 -6.678 1.00 32.11 C ATOM 1414 C SER A 471 -7.261 8.087 -6.434 1.00 33.14 C ATOM 1415 O SER A 471 -6.422 8.328 -7.301 1.00 25.12 O ATOM 1416 CB SER A 471 -7.746 5.719 -7.030 1.00 14.02 C ATOM 1417 OG SER A 471 -7.184 5.141 -5.860 1.00 0.13 O ATOM 0 H SER A 471 -8.937 7.261 -8.692 1.00 42.53 H new ATOM 0 HA SER A 471 -8.959 6.985 -5.766 1.00 32.11 H new ATOM 0 HB2 SER A 471 -8.502 5.056 -7.450 1.00 14.02 H new ATOM 0 HB3 SER A 471 -6.977 5.847 -7.792 1.00 14.02 H new ATOM 0 HG SER A 471 -6.786 4.274 -6.082 1.00 0.13 H new ATOM 1423 N VAL A 472 -7.256 8.664 -5.235 1.00 2.15 N ATOM 1424 CA VAL A 472 -6.236 9.637 -4.859 1.00 24.42 C ATOM 1425 C VAL A 472 -5.201 8.965 -3.966 1.00 53.50 C ATOM 1426 O VAL A 472 -5.492 8.619 -2.821 1.00 51.34 O ATOM 1427 CB VAL A 472 -6.879 10.810 -4.115 1.00 3.13 C ATOM 1428 CG1 VAL A 472 -5.861 11.941 -3.967 1.00 63.21 C ATOM 1429 CG2 VAL A 472 -8.086 11.314 -4.908 1.00 34.42 C ATOM 0 H VAL A 472 -7.946 8.474 -4.508 1.00 2.15 H new ATOM 0 HA VAL A 472 -5.750 10.014 -5.759 1.00 24.42 H new ATOM 0 HB VAL A 472 -7.202 10.480 -3.127 1.00 3.13 H new ATOM 0 HG11 VAL A 472 -6.319 12.776 -3.437 1.00 63.21 H new ATOM 0 HG12 VAL A 472 -4.999 11.583 -3.404 1.00 63.21 H new ATOM 0 HG13 VAL A 472 -5.538 12.271 -4.954 1.00 63.21 H new ATOM 0 HG21 VAL A 472 -8.545 12.149 -4.380 1.00 34.42 H new ATOM 0 HG22 VAL A 472 -7.761 11.643 -5.895 1.00 34.42 H new ATOM 0 HG23 VAL A 472 -8.813 10.509 -5.015 1.00 34.42 H new ATOM 1439 N CYS A 473 -4.000 8.760 -4.502 1.00 53.52 N ATOM 1440 CA CYS A 473 -2.932 8.099 -3.745 1.00 53.41 C ATOM 1441 C CYS A 473 -1.738 9.028 -3.536 1.00 10.12 C ATOM 1442 O CYS A 473 -1.597 10.042 -4.219 1.00 1.13 O ATOM 1443 CB CYS A 473 -2.478 6.844 -4.495 1.00 45.34 C ATOM 1444 SG CYS A 473 -0.997 6.165 -3.704 1.00 61.22 S ATOM 0 H CYS A 473 -3.740 9.038 -5.448 1.00 53.52 H new ATOM 0 HA CYS A 473 -3.327 7.829 -2.765 1.00 53.41 H new ATOM 0 HB2 CYS A 473 -3.275 6.101 -4.496 1.00 45.34 H new ATOM 0 HB3 CYS A 473 -2.267 7.087 -5.536 1.00 45.34 H new ATOM 0 HG CYS A 473 0.061 6.733 -4.203 1.00 61.22 H new ATOM 1450 N ASP A 474 -0.875 8.662 -2.583 1.00 42.30 N ATOM 1451 CA ASP A 474 0.319 9.452 -2.276 1.00 30.11 C ATOM 1452 C ASP A 474 1.576 8.681 -2.662 1.00 71.34 C ATOM 1453 O ASP A 474 1.689 7.484 -2.393 1.00 24.20 O ATOM 1454 CB ASP A 474 0.361 9.787 -0.781 1.00 72.21 C ATOM 1455 CG ASP A 474 1.696 10.439 -0.422 1.00 41.33 C ATOM 1456 OD1 ASP A 474 1.964 11.519 -0.927 1.00 34.22 O ATOM 1457 OD2 ASP A 474 2.430 9.849 0.352 1.00 33.54 O ATOM 0 H ASP A 474 -0.982 7.824 -2.012 1.00 42.30 H new ATOM 0 HA ASP A 474 0.278 10.378 -2.850 1.00 30.11 H new ATOM 0 HB2 ASP A 474 -0.459 10.459 -0.529 1.00 72.21 H new ATOM 0 HB3 ASP A 474 0.222 8.879 -0.194 1.00 72.21 H new ATOM 1462 N GLU A 475 2.517 9.376 -3.295 1.00 22.51 N ATOM 1463 CA GLU A 475 3.771 8.756 -3.721 1.00 31.40 C ATOM 1464 C GLU A 475 4.958 9.378 -2.993 1.00 72.24 C ATOM 1465 O GLU A 475 5.063 10.601 -2.887 1.00 34.11 O ATOM 1466 CB GLU A 475 3.951 8.937 -5.230 1.00 53.24 C ATOM 1467 CG GLU A 475 5.093 8.044 -5.719 1.00 52.32 C ATOM 1468 CD GLU A 475 5.261 8.190 -7.227 1.00 62.42 C ATOM 1469 OE1 GLU A 475 4.621 9.062 -7.793 1.00 24.35 O ATOM 1470 OE2 GLU A 475 6.026 7.428 -7.795 1.00 41.31 O ATOM 0 H GLU A 475 2.437 10.367 -3.525 1.00 22.51 H new ATOM 0 HA GLU A 475 3.728 7.694 -3.478 1.00 31.40 H new ATOM 0 HB2 GLU A 475 3.028 8.682 -5.750 1.00 53.24 H new ATOM 0 HB3 GLU A 475 4.168 9.980 -5.458 1.00 53.24 H new ATOM 0 HG2 GLU A 475 6.020 8.316 -5.214 1.00 52.32 H new ATOM 0 HG3 GLU A 475 4.886 7.004 -5.467 1.00 52.32 H new ATOM 1477 N ASP A 476 5.855 8.526 -2.499 1.00 22.23 N ATOM 1478 CA ASP A 476 7.047 8.989 -1.789 1.00 50.44 C ATOM 1479 C ASP A 476 8.293 8.506 -2.526 1.00 31.04 C ATOM 1480 O ASP A 476 8.436 8.731 -3.729 1.00 5.41 O ATOM 1481 CB ASP A 476 7.049 8.445 -0.357 1.00 22.42 C ATOM 1482 CG ASP A 476 5.668 8.608 0.268 1.00 35.43 C ATOM 1483 OD1 ASP A 476 4.859 9.321 -0.303 1.00 52.14 O ATOM 1484 OD2 ASP A 476 5.439 8.018 1.312 1.00 42.42 O ATOM 0 H ASP A 476 5.779 7.512 -2.577 1.00 22.23 H new ATOM 0 HA ASP A 476 7.044 10.078 -1.752 1.00 50.44 H new ATOM 0 HB2 ASP A 476 7.333 7.393 -0.360 1.00 22.42 H new ATOM 0 HB3 ASP A 476 7.792 8.974 0.240 1.00 22.42 H new ATOM 1556 N ASN A 481 4.218 3.256 -0.728 1.00 54.21 N ATOM 1557 CA ASN A 481 3.257 4.335 -0.948 1.00 34.40 C ATOM 1558 C ASN A 481 2.089 4.218 0.028 1.00 23.44 C ATOM 1559 O ASN A 481 1.993 3.250 0.782 1.00 45.01 O ATOM 1560 CB ASN A 481 2.731 4.281 -2.384 1.00 43.12 C ATOM 1561 CG ASN A 481 2.395 2.843 -2.764 1.00 61.24 C ATOM 1562 OD1 ASN A 481 1.210 2.561 -3.232 1.00 4.23 O flip ATOM 1563 ND2 ASN A 481 3.234 1.952 -2.630 1.00 4.24 N flip ATOM 0 HA ASN A 481 3.762 5.286 -0.782 1.00 34.40 H new ATOM 0 HB2 ASN A 481 1.844 4.907 -2.479 1.00 43.12 H new ATOM 0 HB3 ASN A 481 3.478 4.681 -3.069 1.00 43.12 H new ATOM 0 HD21 ASN A 481 4.160 2.174 -2.264 1.00 4.24 H new ATOM 0 HD22 ASN A 481 3.003 0.992 -2.885 1.00 4.24 H new ATOM 1570 N GLU A 482 1.205 5.213 0.010 1.00 72.25 N ATOM 1571 CA GLU A 482 0.045 5.217 0.899 1.00 3.52 C ATOM 1572 C GLU A 482 -1.174 5.804 0.192 1.00 71.12 C ATOM 1573 O GLU A 482 -1.090 6.857 -0.439 1.00 3.13 O ATOM 1574 CB GLU A 482 0.353 6.040 2.151 1.00 13.32 C ATOM 1575 CG GLU A 482 1.751 5.689 2.663 1.00 65.21 C ATOM 1576 CD GLU A 482 2.032 6.437 3.962 1.00 31.41 C ATOM 1577 OE1 GLU A 482 1.655 5.932 5.007 1.00 23.34 O ATOM 1578 OE2 GLU A 482 2.622 7.503 3.894 1.00 74.04 O ATOM 0 H GLU A 482 1.269 6.023 -0.607 1.00 72.25 H new ATOM 0 HA GLU A 482 -0.175 4.188 1.182 1.00 3.52 H new ATOM 0 HB2 GLU A 482 0.295 7.104 1.923 1.00 13.32 H new ATOM 0 HB3 GLU A 482 -0.390 5.838 2.923 1.00 13.32 H new ATOM 0 HG2 GLU A 482 1.828 4.614 2.828 1.00 65.21 H new ATOM 0 HG3 GLU A 482 2.498 5.951 1.914 1.00 65.21 H new ATOM 1585 N PHE A 483 -2.306 5.114 0.303 1.00 51.30 N ATOM 1586 CA PHE A 483 -3.537 5.571 -0.323 1.00 5.44 C ATOM 1587 C PHE A 483 -4.212 6.632 0.540 1.00 55.43 C ATOM 1588 O PHE A 483 -4.357 6.461 1.751 1.00 13.42 O ATOM 1589 CB PHE A 483 -4.481 4.381 -0.513 1.00 42.03 C ATOM 1590 CG PHE A 483 -4.033 3.558 -1.699 1.00 43.41 C ATOM 1591 CD1 PHE A 483 -3.051 2.573 -1.535 1.00 72.25 C ATOM 1592 CD2 PHE A 483 -4.598 3.779 -2.959 1.00 14.21 C ATOM 1593 CE1 PHE A 483 -2.634 1.810 -2.633 1.00 30.40 C ATOM 1594 CE2 PHE A 483 -4.183 3.017 -4.057 1.00 52.35 C ATOM 1595 CZ PHE A 483 -3.201 2.032 -3.894 1.00 4.53 C ATOM 0 H PHE A 483 -2.393 4.239 0.820 1.00 51.30 H new ATOM 0 HA PHE A 483 -3.300 6.011 -1.292 1.00 5.44 H new ATOM 0 HB2 PHE A 483 -4.490 3.765 0.386 1.00 42.03 H new ATOM 0 HB3 PHE A 483 -5.500 4.735 -0.668 1.00 42.03 H new ATOM 0 HD1 PHE A 483 -2.615 2.402 -0.562 1.00 72.25 H new ATOM 0 HD2 PHE A 483 -5.355 4.539 -3.085 1.00 14.21 H new ATOM 0 HE1 PHE A 483 -1.876 1.051 -2.507 1.00 30.40 H new ATOM 0 HE2 PHE A 483 -4.620 3.189 -5.030 1.00 52.35 H new ATOM 0 HZ PHE A 483 -2.881 1.443 -4.741 1.00 4.53 H new ATOM 1605 N ILE A 484 -4.622 7.732 -0.089 1.00 54.02 N ATOM 1606 CA ILE A 484 -5.279 8.817 0.635 1.00 63.30 C ATOM 1607 C ILE A 484 -6.786 8.586 0.705 1.00 22.14 C ATOM 1608 O ILE A 484 -7.329 8.302 1.772 1.00 44.11 O ATOM 1609 CB ILE A 484 -4.999 10.153 -0.056 1.00 34.43 C ATOM 1610 CG1 ILE A 484 -3.485 10.386 -0.120 1.00 71.01 C ATOM 1611 CG2 ILE A 484 -5.654 11.285 0.735 1.00 52.55 C ATOM 1612 CD1 ILE A 484 -3.174 11.512 -1.112 1.00 45.21 C ATOM 0 H ILE A 484 -4.512 7.894 -1.090 1.00 54.02 H new ATOM 0 HA ILE A 484 -4.880 8.841 1.649 1.00 63.30 H new ATOM 0 HB ILE A 484 -5.408 10.132 -1.066 1.00 34.43 H new ATOM 0 HG12 ILE A 484 -3.106 10.645 0.869 1.00 71.01 H new ATOM 0 HG13 ILE A 484 -2.980 9.470 -0.426 1.00 71.01 H new ATOM 0 HG21 ILE A 484 -5.454 12.236 0.242 1.00 52.55 H new ATOM 0 HG22 ILE A 484 -6.730 11.120 0.783 1.00 52.55 H new ATOM 0 HG23 ILE A 484 -5.245 11.307 1.745 1.00 52.55 H new ATOM 0 HD11 ILE A 484 -2.097 11.673 -1.153 1.00 45.21 H new ATOM 0 HD12 ILE A 484 -3.538 11.236 -2.102 1.00 45.21 H new ATOM 0 HD13 ILE A 484 -3.666 12.429 -0.787 1.00 45.21 H new ATOM 1624 N GLY A 485 -7.456 8.713 -0.437 1.00 72.34 N ATOM 1625 CA GLY A 485 -8.901 8.517 -0.484 1.00 52.22 C ATOM 1626 C GLY A 485 -9.377 8.277 -1.914 1.00 64.10 C ATOM 1627 O GLY A 485 -8.710 8.665 -2.874 1.00 3.34 O ATOM 0 H GLY A 485 -7.027 8.948 -1.332 1.00 72.34 H new ATOM 0 HA2 GLY A 485 -9.176 7.668 0.141 1.00 52.22 H new ATOM 0 HA3 GLY A 485 -9.403 9.392 -0.072 1.00 52.22 H new ATOM 1631 N GLU A 486 -10.528 7.618 -2.047 1.00 23.12 N ATOM 1632 CA GLU A 486 -11.080 7.314 -3.369 1.00 45.41 C ATOM 1633 C GLU A 486 -12.573 7.630 -3.450 1.00 23.22 C ATOM 1634 O GLU A 486 -13.262 7.716 -2.433 1.00 51.32 O ATOM 1635 CB GLU A 486 -10.861 5.834 -3.689 1.00 31.10 C ATOM 1636 CG GLU A 486 -11.704 4.976 -2.744 1.00 15.22 C ATOM 1637 CD GLU A 486 -11.269 3.517 -2.837 1.00 1.24 C ATOM 1638 OE1 GLU A 486 -10.163 3.222 -2.416 1.00 2.40 O ATOM 1639 OE2 GLU A 486 -12.050 2.717 -3.327 1.00 4.54 O ATOM 0 H GLU A 486 -11.092 7.287 -1.265 1.00 23.12 H new ATOM 0 HA GLU A 486 -10.562 7.941 -4.095 1.00 45.41 H new ATOM 0 HB2 GLU A 486 -11.136 5.631 -4.724 1.00 31.10 H new ATOM 0 HB3 GLU A 486 -9.806 5.581 -3.583 1.00 31.10 H new ATOM 0 HG2 GLU A 486 -11.594 5.332 -1.720 1.00 15.22 H new ATOM 0 HG3 GLU A 486 -12.759 5.067 -3.001 1.00 15.22 H new ATOM 1646 N THR A 487 -13.060 7.790 -4.683 1.00 44.33 N ATOM 1647 CA THR A 487 -14.474 8.083 -4.930 1.00 31.24 C ATOM 1648 C THR A 487 -15.051 7.059 -5.902 1.00 33.05 C ATOM 1649 O THR A 487 -14.313 6.436 -6.665 1.00 51.24 O ATOM 1650 CB THR A 487 -14.642 9.486 -5.526 1.00 43.02 C ATOM 1651 OG1 THR A 487 -14.207 9.478 -6.877 1.00 22.31 O ATOM 1652 CG2 THR A 487 -13.823 10.502 -4.727 1.00 42.22 C ATOM 0 H THR A 487 -12.494 7.721 -5.529 1.00 44.33 H new ATOM 0 HA THR A 487 -15.004 8.035 -3.979 1.00 31.24 H new ATOM 0 HB THR A 487 -15.693 9.770 -5.481 1.00 43.02 H new ATOM 0 HG1 THR A 487 -14.747 10.108 -7.398 1.00 22.31 H new ATOM 0 HG21 THR A 487 -13.951 11.494 -5.160 1.00 42.22 H new ATOM 0 HG22 THR A 487 -14.165 10.511 -3.692 1.00 42.22 H new ATOM 0 HG23 THR A 487 -12.769 10.225 -4.759 1.00 42.22 H new ATOM 1660 N ARG A 488 -16.374 6.897 -5.883 1.00 35.54 N ATOM 1661 CA ARG A 488 -17.036 5.948 -6.777 1.00 34.22 C ATOM 1662 C ARG A 488 -18.351 6.529 -7.291 1.00 62.42 C ATOM 1663 O ARG A 488 -19.158 7.041 -6.517 1.00 44.11 O ATOM 1664 CB ARG A 488 -17.313 4.637 -6.035 1.00 52.23 C ATOM 1665 CG ARG A 488 -16.005 3.863 -5.855 1.00 32.15 C ATOM 1666 CD ARG A 488 -16.240 2.661 -4.938 1.00 74.44 C ATOM 1667 NE ARG A 488 -17.032 1.645 -5.625 1.00 71.42 N ATOM 1668 CZ ARG A 488 -18.362 1.663 -5.591 1.00 5.13 C ATOM 1669 NH1 ARG A 488 -18.988 2.604 -4.938 1.00 23.43 N ATOM 1670 NH2 ARG A 488 -19.043 0.740 -6.215 1.00 3.04 N ATOM 0 H ARG A 488 -17.004 7.406 -5.263 1.00 35.54 H new ATOM 0 HA ARG A 488 -16.378 5.754 -7.624 1.00 34.22 H new ATOM 0 HB2 ARG A 488 -17.761 4.845 -5.063 1.00 52.23 H new ATOM 0 HB3 ARG A 488 -18.029 4.035 -6.594 1.00 52.23 H new ATOM 0 HG2 ARG A 488 -15.634 3.527 -6.823 1.00 32.15 H new ATOM 0 HG3 ARG A 488 -15.241 4.514 -5.429 1.00 32.15 H new ATOM 0 HD2 ARG A 488 -15.284 2.239 -4.629 1.00 74.44 H new ATOM 0 HD3 ARG A 488 -16.755 2.981 -4.032 1.00 74.44 H new ATOM 0 HE ARG A 488 -16.556 0.906 -6.142 1.00 71.42 H new ATOM 0 HH11 ARG A 488 -18.458 3.327 -4.453 1.00 23.43 H new ATOM 0 HH12 ARG A 488 -20.008 2.616 -4.913 1.00 23.43 H new ATOM 0 HH21 ARG A 488 -18.555 0.006 -6.728 1.00 3.04 H new ATOM 0 HH22 ARG A 488 -20.063 0.753 -6.189 1.00 3.04 H new ATOM 1684 N PHE A 489 -18.561 6.445 -8.603 1.00 30.42 N ATOM 1685 CA PHE A 489 -19.786 6.967 -9.210 1.00 41.24 C ATOM 1686 C PHE A 489 -20.189 6.126 -10.419 1.00 33.13 C ATOM 1687 O PHE A 489 -19.348 5.761 -11.241 1.00 71.23 O ATOM 1688 CB PHE A 489 -19.577 8.424 -9.641 1.00 71.42 C ATOM 1689 CG PHE A 489 -19.696 9.333 -8.440 1.00 2.31 C ATOM 1690 CD1 PHE A 489 -18.584 9.563 -7.621 1.00 70.30 C ATOM 1691 CD2 PHE A 489 -20.919 9.947 -8.147 1.00 24.04 C ATOM 1692 CE1 PHE A 489 -18.696 10.406 -6.509 1.00 54.02 C ATOM 1693 CE2 PHE A 489 -21.031 10.790 -7.034 1.00 4.14 C ATOM 1694 CZ PHE A 489 -19.920 11.020 -6.215 1.00 12.24 C ATOM 0 H PHE A 489 -17.906 6.025 -9.262 1.00 30.42 H new ATOM 0 HA PHE A 489 -20.584 6.919 -8.469 1.00 41.24 H new ATOM 0 HB2 PHE A 489 -18.596 8.540 -10.101 1.00 71.42 H new ATOM 0 HB3 PHE A 489 -20.316 8.700 -10.393 1.00 71.42 H new ATOM 0 HD1 PHE A 489 -17.640 9.090 -7.847 1.00 70.30 H new ATOM 0 HD2 PHE A 489 -21.777 9.771 -8.779 1.00 24.04 H new ATOM 0 HE1 PHE A 489 -17.838 10.583 -5.877 1.00 54.02 H new ATOM 0 HE2 PHE A 489 -21.975 11.263 -6.808 1.00 4.14 H new ATOM 0 HZ PHE A 489 -20.006 11.670 -5.357 1.00 12.24 H new ATOM 1704 N SER A 490 -21.482 5.834 -10.526 1.00 24.55 N ATOM 1705 CA SER A 490 -21.988 5.048 -11.645 1.00 72.54 C ATOM 1706 C SER A 490 -22.121 5.931 -12.881 1.00 14.02 C ATOM 1707 O SER A 490 -22.928 6.861 -12.904 1.00 62.42 O ATOM 1708 CB SER A 490 -23.346 4.436 -11.280 1.00 53.20 C ATOM 1709 OG SER A 490 -23.456 3.150 -11.873 1.00 63.40 O ATOM 0 H SER A 490 -22.193 6.128 -9.856 1.00 24.55 H new ATOM 0 HA SER A 490 -21.287 4.242 -11.863 1.00 72.54 H new ATOM 0 HB2 SER A 490 -23.444 4.359 -10.197 1.00 53.20 H new ATOM 0 HB3 SER A 490 -24.153 5.080 -11.628 1.00 53.20 H new ATOM 0 HG SER A 490 -24.022 2.579 -11.313 1.00 63.40 H new ATOM 1715 N LEU A 491 -21.312 5.652 -13.898 1.00 72.01 N ATOM 1716 CA LEU A 491 -21.350 6.458 -15.113 1.00 12.22 C ATOM 1717 C LEU A 491 -22.792 6.652 -15.579 1.00 0.10 C ATOM 1718 O LEU A 491 -23.121 7.662 -16.198 1.00 72.11 O ATOM 1719 CB LEU A 491 -20.518 5.794 -16.216 1.00 5.44 C ATOM 1720 CG LEU A 491 -19.024 6.073 -15.978 1.00 35.23 C ATOM 1721 CD1 LEU A 491 -18.192 5.180 -16.900 1.00 3.24 C ATOM 1722 CD2 LEU A 491 -18.699 7.552 -16.261 1.00 52.05 C ATOM 0 H LEU A 491 -20.635 4.889 -13.907 1.00 72.01 H new ATOM 0 HA LEU A 491 -20.923 7.437 -14.895 1.00 12.22 H new ATOM 0 HB2 LEU A 491 -20.700 4.719 -16.225 1.00 5.44 H new ATOM 0 HB3 LEU A 491 -20.818 6.176 -17.191 1.00 5.44 H new ATOM 0 HG LEU A 491 -18.785 5.857 -14.937 1.00 35.23 H new ATOM 0 HD11 LEU A 491 -17.132 5.374 -16.735 1.00 3.24 H new ATOM 0 HD12 LEU A 491 -18.407 4.133 -16.684 1.00 3.24 H new ATOM 0 HD13 LEU A 491 -18.443 5.395 -17.939 1.00 3.24 H new ATOM 0 HD21 LEU A 491 -17.638 7.731 -16.087 1.00 52.05 H new ATOM 0 HD22 LEU A 491 -18.942 7.786 -17.298 1.00 52.05 H new ATOM 0 HD23 LEU A 491 -19.287 8.187 -15.598 1.00 52.05 H new ATOM 1734 N LYS A 492 -23.646 5.683 -15.279 1.00 72.13 N ATOM 1735 CA LYS A 492 -25.048 5.763 -15.676 1.00 31.05 C ATOM 1736 C LYS A 492 -25.667 7.100 -15.264 1.00 0.33 C ATOM 1737 O LYS A 492 -26.662 7.534 -15.844 1.00 42.51 O ATOM 1738 CB LYS A 492 -25.839 4.612 -15.036 1.00 23.25 C ATOM 1739 CG LYS A 492 -24.930 3.392 -14.864 1.00 54.24 C ATOM 1740 CD LYS A 492 -25.782 2.148 -14.598 1.00 4.33 C ATOM 1741 CE LYS A 492 -26.508 2.299 -13.259 1.00 2.22 C ATOM 1742 NZ LYS A 492 -27.022 0.972 -12.821 1.00 2.21 N ATOM 0 H LYS A 492 -23.397 4.837 -14.766 1.00 72.13 H new ATOM 0 HA LYS A 492 -25.095 5.684 -16.762 1.00 31.05 H new ATOM 0 HB2 LYS A 492 -26.233 4.923 -14.068 1.00 23.25 H new ATOM 0 HB3 LYS A 492 -26.694 4.355 -15.661 1.00 23.25 H new ATOM 0 HG2 LYS A 492 -24.327 3.247 -15.760 1.00 54.24 H new ATOM 0 HG3 LYS A 492 -24.239 3.555 -14.037 1.00 54.24 H new ATOM 0 HD2 LYS A 492 -26.505 2.012 -15.402 1.00 4.33 H new ATOM 0 HD3 LYS A 492 -25.151 1.259 -14.583 1.00 4.33 H new ATOM 0 HE2 LYS A 492 -25.829 2.704 -12.509 1.00 2.22 H new ATOM 0 HE3 LYS A 492 -27.332 3.006 -13.358 1.00 2.22 H new ATOM 0 HZ1 LYS A 492 -27.515 1.074 -11.911 1.00 2.21 H new ATOM 0 HZ2 LYS A 492 -27.683 0.603 -13.534 1.00 2.21 H new ATOM 0 HZ3 LYS A 492 -26.227 0.311 -12.711 1.00 2.21 H new ATOM 1756 N LYS A 493 -25.090 7.739 -14.249 1.00 52.43 N ATOM 1757 CA LYS A 493 -25.615 9.009 -13.762 1.00 23.14 C ATOM 1758 C LYS A 493 -25.246 10.167 -14.689 1.00 30.34 C ATOM 1759 O LYS A 493 -25.741 11.282 -14.521 1.00 14.03 O ATOM 1760 CB LYS A 493 -25.061 9.276 -12.362 1.00 32.43 C ATOM 1761 CG LYS A 493 -25.777 8.382 -11.345 1.00 12.04 C ATOM 1762 CD LYS A 493 -24.983 8.354 -10.037 1.00 23.13 C ATOM 1763 CE LYS A 493 -25.858 7.785 -8.919 1.00 12.13 C ATOM 1764 NZ LYS A 493 -27.036 8.673 -8.710 1.00 60.53 N ATOM 0 H LYS A 493 -24.266 7.401 -13.752 1.00 52.43 H new ATOM 0 HA LYS A 493 -26.702 8.940 -13.734 1.00 23.14 H new ATOM 0 HB2 LYS A 493 -23.989 9.081 -12.341 1.00 32.43 H new ATOM 0 HB3 LYS A 493 -25.199 10.325 -12.100 1.00 32.43 H new ATOM 0 HG2 LYS A 493 -26.784 8.756 -11.163 1.00 12.04 H new ATOM 0 HG3 LYS A 493 -25.879 7.372 -11.742 1.00 12.04 H new ATOM 0 HD2 LYS A 493 -24.087 7.745 -10.157 1.00 23.13 H new ATOM 0 HD3 LYS A 493 -24.653 9.360 -9.778 1.00 23.13 H new ATOM 0 HE2 LYS A 493 -26.189 6.779 -9.178 1.00 12.13 H new ATOM 0 HE3 LYS A 493 -25.282 7.704 -7.997 1.00 12.13 H new ATOM 0 HZ1 LYS A 493 -27.148 8.868 -7.695 1.00 60.53 H new ATOM 0 HZ2 LYS A 493 -26.891 9.568 -9.220 1.00 60.53 H new ATOM 0 HZ3 LYS A 493 -27.892 8.204 -9.069 1.00 60.53 H new ATOM 1778 N LEU A 494 -24.377 9.909 -15.663 1.00 32.25 N ATOM 1779 CA LEU A 494 -23.959 10.944 -16.594 1.00 2.33 C ATOM 1780 C LEU A 494 -24.925 11.030 -17.770 1.00 53.33 C ATOM 1781 O LEU A 494 -25.417 10.017 -18.266 1.00 32.35 O ATOM 1782 CB LEU A 494 -22.551 10.636 -17.108 1.00 54.25 C ATOM 1783 CG LEU A 494 -21.500 11.043 -16.064 1.00 31.50 C ATOM 1784 CD1 LEU A 494 -21.417 12.575 -15.953 1.00 22.52 C ATOM 1785 CD2 LEU A 494 -21.877 10.446 -14.702 1.00 22.12 C ATOM 0 H LEU A 494 -23.952 8.996 -15.825 1.00 32.25 H new ATOM 0 HA LEU A 494 -23.958 11.901 -16.073 1.00 2.33 H new ATOM 0 HB2 LEU A 494 -22.462 9.572 -17.328 1.00 54.25 H new ATOM 0 HB3 LEU A 494 -22.372 11.170 -18.041 1.00 54.25 H new ATOM 0 HG LEU A 494 -20.527 10.663 -16.375 1.00 31.50 H new ATOM 0 HD11 LEU A 494 -20.668 12.846 -15.209 1.00 22.52 H new ATOM 0 HD12 LEU A 494 -21.138 12.995 -16.919 1.00 22.52 H new ATOM 0 HD13 LEU A 494 -22.387 12.971 -15.652 1.00 22.52 H new ATOM 0 HD21 LEU A 494 -21.132 10.734 -13.960 1.00 22.12 H new ATOM 0 HD22 LEU A 494 -22.855 10.820 -14.399 1.00 22.12 H new ATOM 0 HD23 LEU A 494 -21.912 9.359 -14.778 1.00 22.12 H new ATOM 1797 N LYS A 495 -25.182 12.255 -18.208 1.00 24.31 N ATOM 1798 CA LYS A 495 -26.079 12.508 -19.329 1.00 24.24 C ATOM 1799 C LYS A 495 -25.271 12.940 -20.553 1.00 2.43 C ATOM 1800 O LYS A 495 -24.304 13.691 -20.433 1.00 72.21 O ATOM 1801 CB LYS A 495 -27.075 13.613 -18.944 1.00 3.23 C ATOM 1802 CG LYS A 495 -28.301 13.004 -18.242 1.00 61.14 C ATOM 1803 CD LYS A 495 -29.332 12.555 -19.284 1.00 31.01 C ATOM 1804 CE LYS A 495 -30.574 12.016 -18.572 1.00 43.54 C ATOM 1805 NZ LYS A 495 -31.609 11.657 -19.583 1.00 70.44 N ATOM 0 H LYS A 495 -24.777 13.098 -17.799 1.00 24.31 H new ATOM 0 HA LYS A 495 -26.625 11.596 -19.570 1.00 24.24 H new ATOM 0 HB2 LYS A 495 -26.592 14.335 -18.286 1.00 3.23 H new ATOM 0 HB3 LYS A 495 -27.390 14.155 -19.836 1.00 3.23 H new ATOM 0 HG2 LYS A 495 -27.996 12.155 -17.631 1.00 61.14 H new ATOM 0 HG3 LYS A 495 -28.747 13.737 -17.570 1.00 61.14 H new ATOM 0 HD2 LYS A 495 -29.603 13.392 -19.927 1.00 31.01 H new ATOM 0 HD3 LYS A 495 -28.905 11.785 -19.926 1.00 31.01 H new ATOM 0 HE2 LYS A 495 -30.314 11.141 -17.976 1.00 43.54 H new ATOM 0 HE3 LYS A 495 -30.966 12.765 -17.884 1.00 43.54 H new ATOM 0 HZ1 LYS A 495 -32.454 11.290 -19.100 1.00 70.44 H new ATOM 0 HZ2 LYS A 495 -31.864 12.502 -20.134 1.00 70.44 H new ATOM 0 HZ3 LYS A 495 -31.232 10.928 -20.222 1.00 70.44 H new ATOM 1819 N ALA A 496 -25.664 12.457 -21.726 1.00 4.44 N ATOM 1820 CA ALA A 496 -24.960 12.803 -22.956 1.00 22.40 C ATOM 1821 C ALA A 496 -24.916 14.318 -23.149 1.00 31.44 C ATOM 1822 O ALA A 496 -25.935 14.999 -23.031 1.00 22.02 O ATOM 1823 CB ALA A 496 -25.660 12.146 -24.152 1.00 74.02 C ATOM 0 H ALA A 496 -26.459 11.830 -21.852 1.00 4.44 H new ATOM 0 HA ALA A 496 -23.936 12.436 -22.885 1.00 22.40 H new ATOM 0 HB1 ALA A 496 -25.133 12.406 -25.070 1.00 74.02 H new ATOM 0 HB2 ALA A 496 -25.657 11.063 -24.026 1.00 74.02 H new ATOM 0 HB3 ALA A 496 -26.689 12.501 -24.212 1.00 74.02 H new ATOM 1829 N ASN A 497 -23.725 14.834 -23.448 1.00 52.52 N ATOM 1830 CA ASN A 497 -23.540 16.268 -23.662 1.00 23.32 C ATOM 1831 C ASN A 497 -23.906 17.059 -22.411 1.00 44.02 C ATOM 1832 O ASN A 497 -24.422 18.173 -22.500 1.00 21.44 O ATOM 1833 CB ASN A 497 -24.395 16.746 -24.839 1.00 74.50 C ATOM 1834 CG ASN A 497 -24.055 15.943 -26.088 1.00 43.33 C ATOM 1835 OD1 ASN A 497 -22.884 15.680 -26.358 1.00 65.03 O ATOM 1836 ND2 ASN A 497 -25.016 15.538 -26.872 1.00 54.45 N ATOM 0 H ASN A 497 -22.874 14.281 -23.548 1.00 52.52 H new ATOM 0 HA ASN A 497 -22.487 16.439 -23.888 1.00 23.32 H new ATOM 0 HB2 ASN A 497 -25.453 16.633 -24.601 1.00 74.50 H new ATOM 0 HB3 ASN A 497 -24.220 17.807 -25.019 1.00 74.50 H new ATOM 0 HD21 ASN A 497 -24.797 15.002 -27.712 1.00 54.45 H new ATOM 0 HD22 ASN A 497 -25.986 15.758 -26.645 1.00 54.45 H new ATOM 1843 N GLN A 498 -23.628 16.480 -21.245 1.00 13.13 N ATOM 1844 CA GLN A 498 -23.922 17.141 -19.974 1.00 62.43 C ATOM 1845 C GLN A 498 -22.664 17.188 -19.105 1.00 14.32 C ATOM 1846 O GLN A 498 -21.813 16.293 -19.177 1.00 21.42 O ATOM 1847 CB GLN A 498 -25.053 16.385 -19.241 1.00 51.34 C ATOM 1848 CG GLN A 498 -26.185 17.350 -18.867 1.00 54.42 C ATOM 1849 CD GLN A 498 -26.976 17.726 -20.115 1.00 60.14 C ATOM 1850 OE1 GLN A 498 -27.236 16.813 -21.011 1.00 10.05 O flip ATOM 1851 NE2 GLN A 498 -27.368 18.883 -20.278 1.00 42.23 N flip ATOM 0 H GLN A 498 -23.201 15.558 -21.153 1.00 13.13 H new ATOM 0 HA GLN A 498 -24.249 18.162 -20.168 1.00 62.43 H new ATOM 0 HB2 GLN A 498 -25.440 15.590 -19.878 1.00 51.34 H new ATOM 0 HB3 GLN A 498 -24.659 15.910 -18.342 1.00 51.34 H new ATOM 0 HG2 GLN A 498 -26.844 16.885 -18.134 1.00 54.42 H new ATOM 0 HG3 GLN A 498 -25.773 18.246 -18.403 1.00 54.42 H new ATOM 0 HE21 GLN A 498 -27.163 19.594 -19.576 1.00 42.23 H new ATOM 0 HE22 GLN A 498 -27.897 19.129 -21.115 1.00 42.23 H new ATOM 1860 N ARG A 499 -22.562 18.230 -18.278 1.00 54.44 N ATOM 1861 CA ARG A 499 -21.421 18.395 -17.380 1.00 21.23 C ATOM 1862 C ARG A 499 -21.915 18.553 -15.945 1.00 65.30 C ATOM 1863 O ARG A 499 -22.724 19.434 -15.659 1.00 72.32 O ATOM 1864 CB ARG A 499 -20.614 19.635 -17.781 1.00 33.00 C ATOM 1865 CG ARG A 499 -19.223 19.572 -17.147 1.00 63.35 C ATOM 1866 CD ARG A 499 -18.407 20.791 -17.580 1.00 40.42 C ATOM 1867 NE ARG A 499 -19.141 22.018 -17.289 1.00 53.21 N ATOM 1868 CZ ARG A 499 -18.670 23.204 -17.659 1.00 30.34 C ATOM 1869 NH1 ARG A 499 -17.533 23.285 -18.294 1.00 44.44 N ATOM 1870 NH2 ARG A 499 -19.344 24.288 -17.388 1.00 10.11 N ATOM 0 H ARG A 499 -23.258 18.973 -18.213 1.00 54.44 H new ATOM 0 HA ARG A 499 -20.784 17.514 -17.451 1.00 21.23 H new ATOM 0 HB2 ARG A 499 -20.527 19.689 -18.866 1.00 33.00 H new ATOM 0 HB3 ARG A 499 -21.131 20.538 -17.457 1.00 33.00 H new ATOM 0 HG2 ARG A 499 -19.308 19.546 -16.061 1.00 63.35 H new ATOM 0 HG3 ARG A 499 -18.716 18.656 -17.449 1.00 63.35 H new ATOM 0 HD2 ARG A 499 -17.449 20.800 -17.060 1.00 40.42 H new ATOM 0 HD3 ARG A 499 -18.190 20.732 -18.647 1.00 40.42 H new ATOM 0 HE ARG A 499 -20.031 21.964 -16.793 1.00 53.21 H new ATOM 0 HH11 ARG A 499 -17.006 22.438 -18.506 1.00 44.44 H new ATOM 0 HH12 ARG A 499 -17.171 24.195 -18.578 1.00 44.44 H new ATOM 0 HH21 ARG A 499 -20.233 24.225 -16.892 1.00 10.11 H new ATOM 0 HH22 ARG A 499 -18.982 25.198 -17.672 1.00 10.11 H new ATOM 1884 N LYS A 500 -21.432 17.698 -15.045 1.00 20.55 N ATOM 1885 CA LYS A 500 -21.846 17.762 -13.641 1.00 33.31 C ATOM 1886 C LYS A 500 -20.633 17.813 -12.715 1.00 61.32 C ATOM 1887 O LYS A 500 -19.717 16.998 -12.831 1.00 54.45 O ATOM 1888 CB LYS A 500 -22.701 16.538 -13.298 1.00 3.04 C ATOM 1889 CG LYS A 500 -23.459 16.776 -11.980 1.00 25.52 C ATOM 1890 CD LYS A 500 -24.782 17.499 -12.257 1.00 75.11 C ATOM 1891 CE LYS A 500 -25.573 17.629 -10.954 1.00 75.40 C ATOM 1892 NZ LYS A 500 -26.044 16.283 -10.521 1.00 13.13 N ATOM 0 H LYS A 500 -20.761 16.960 -15.258 1.00 20.55 H new ATOM 0 HA LYS A 500 -22.429 18.672 -13.497 1.00 33.31 H new ATOM 0 HB2 LYS A 500 -23.409 16.342 -14.103 1.00 3.04 H new ATOM 0 HB3 LYS A 500 -22.067 15.656 -13.208 1.00 3.04 H new ATOM 0 HG2 LYS A 500 -23.652 15.824 -11.486 1.00 25.52 H new ATOM 0 HG3 LYS A 500 -22.846 17.369 -11.301 1.00 25.52 H new ATOM 0 HD2 LYS A 500 -24.589 18.486 -12.678 1.00 75.11 H new ATOM 0 HD3 LYS A 500 -25.364 16.946 -12.995 1.00 75.11 H new ATOM 0 HE2 LYS A 500 -24.948 18.074 -10.180 1.00 75.40 H new ATOM 0 HE3 LYS A 500 -26.424 18.295 -11.098 1.00 75.40 H new ATOM 0 HZ1 LYS A 500 -26.849 16.389 -9.871 1.00 13.13 H new ATOM 0 HZ2 LYS A 500 -26.341 15.735 -11.353 1.00 13.13 H new ATOM 0 HZ3 LYS A 500 -25.271 15.784 -10.035 1.00 13.13 H new ATOM 1906 N ASN A 501 -20.642 18.771 -11.789 1.00 72.23 N ATOM 1907 CA ASN A 501 -19.547 18.922 -10.833 1.00 2.34 C ATOM 1908 C ASN A 501 -19.935 18.308 -9.492 1.00 20.12 C ATOM 1909 O ASN A 501 -21.048 18.515 -9.008 1.00 1.42 O ATOM 1910 CB ASN A 501 -19.222 20.404 -10.643 1.00 34.45 C ATOM 1911 CG ASN A 501 -17.882 20.557 -9.929 1.00 14.33 C ATOM 1912 OD1 ASN A 501 -17.225 19.491 -9.561 1.00 15.04 O flip ATOM 1913 ND2 ASN A 501 -17.423 21.676 -9.703 1.00 64.14 N flip ATOM 0 H ASN A 501 -21.393 19.452 -11.681 1.00 72.23 H new ATOM 0 HA ASN A 501 -18.668 18.407 -11.221 1.00 2.34 H new ATOM 0 HB2 ASN A 501 -19.187 20.904 -11.611 1.00 34.45 H new ATOM 0 HB3 ASN A 501 -20.009 20.886 -10.064 1.00 34.45 H new ATOM 0 HD21 ASN A 501 -17.939 22.507 -9.992 1.00 64.14 H new ATOM 0 HD22 ASN A 501 -16.526 21.773 -9.227 1.00 64.14 H new ATOM 1920 N PHE A 502 -19.020 17.541 -8.901 1.00 23.14 N ATOM 1921 CA PHE A 502 -19.286 16.888 -7.618 1.00 44.41 C ATOM 1922 C PHE A 502 -18.275 17.309 -6.558 1.00 13.10 C ATOM 1923 O PHE A 502 -17.088 17.476 -6.838 1.00 43.01 O ATOM 1924 CB PHE A 502 -19.222 15.371 -7.784 1.00 61.01 C ATOM 1925 CG PHE A 502 -20.111 14.937 -8.925 1.00 25.42 C ATOM 1926 CD1 PHE A 502 -19.654 15.032 -10.244 1.00 35.42 C ATOM 1927 CD2 PHE A 502 -21.390 14.432 -8.661 1.00 40.31 C ATOM 1928 CE1 PHE A 502 -20.475 14.619 -11.300 1.00 11.23 C ATOM 1929 CE2 PHE A 502 -22.212 14.021 -9.717 1.00 23.42 C ATOM 1930 CZ PHE A 502 -21.754 14.115 -11.036 1.00 14.34 C ATOM 0 H PHE A 502 -18.094 17.357 -9.286 1.00 23.14 H new ATOM 0 HA PHE A 502 -20.281 17.192 -7.293 1.00 44.41 H new ATOM 0 HB2 PHE A 502 -18.195 15.061 -7.975 1.00 61.01 H new ATOM 0 HB3 PHE A 502 -19.536 14.883 -6.862 1.00 61.01 H new ATOM 0 HD1 PHE A 502 -18.668 15.424 -10.447 1.00 35.42 H new ATOM 0 HD2 PHE A 502 -21.742 14.360 -7.643 1.00 40.31 H new ATOM 0 HE1 PHE A 502 -20.122 14.689 -12.318 1.00 11.23 H new ATOM 0 HE2 PHE A 502 -23.199 13.632 -9.514 1.00 23.42 H new ATOM 0 HZ PHE A 502 -22.388 13.798 -11.851 1.00 14.34 H new ATOM 1940 N ASN A 503 -18.768 17.448 -5.332 1.00 33.34 N ATOM 1941 CA ASN A 503 -17.938 17.818 -4.192 1.00 73.32 C ATOM 1942 C ASN A 503 -18.332 16.942 -3.011 1.00 63.20 C ATOM 1943 O ASN A 503 -19.373 17.164 -2.392 1.00 13.23 O ATOM 1944 CB ASN A 503 -18.155 19.289 -3.837 1.00 45.11 C ATOM 1945 CG ASN A 503 -17.049 19.770 -2.904 1.00 2.12 C ATOM 1946 OD1 ASN A 503 -16.383 18.960 -2.258 1.00 21.43 O ATOM 1947 ND2 ASN A 503 -16.811 21.049 -2.793 1.00 53.43 N ATOM 0 H ASN A 503 -19.752 17.308 -5.101 1.00 33.34 H new ATOM 0 HA ASN A 503 -16.886 17.674 -4.437 1.00 73.32 H new ATOM 0 HB2 ASN A 503 -18.165 19.893 -4.744 1.00 45.11 H new ATOM 0 HB3 ASN A 503 -19.126 19.417 -3.359 1.00 45.11 H new ATOM 0 HD21 ASN A 503 -16.073 21.378 -2.171 1.00 53.43 H new ATOM 0 HD22 ASN A 503 -17.363 21.719 -3.329 1.00 53.43 H new ATOM 1954 N ILE A 504 -17.527 15.922 -2.725 1.00 54.42 N ATOM 1955 CA ILE A 504 -17.858 14.999 -1.636 1.00 41.33 C ATOM 1956 C ILE A 504 -16.638 14.624 -0.798 1.00 64.21 C ATOM 1957 O ILE A 504 -15.499 14.938 -1.143 1.00 65.21 O ATOM 1958 CB ILE A 504 -18.512 13.735 -2.212 1.00 55.32 C ATOM 1959 CG1 ILE A 504 -17.819 13.333 -3.517 1.00 1.50 C ATOM 1960 CG2 ILE A 504 -19.989 14.013 -2.502 1.00 23.35 C ATOM 1961 CD1 ILE A 504 -16.330 13.080 -3.268 1.00 71.40 C ATOM 0 H ILE A 504 -16.659 15.714 -3.218 1.00 54.42 H new ATOM 0 HA ILE A 504 -18.556 15.510 -0.973 1.00 41.33 H new ATOM 0 HB ILE A 504 -18.418 12.927 -1.487 1.00 55.32 H new ATOM 0 HG12 ILE A 504 -18.285 12.435 -3.923 1.00 1.50 H new ATOM 0 HG13 ILE A 504 -17.942 14.121 -4.260 1.00 1.50 H new ATOM 0 HG21 ILE A 504 -20.455 13.116 -2.911 1.00 23.35 H new ATOM 0 HG22 ILE A 504 -20.494 14.295 -1.578 1.00 23.35 H new ATOM 0 HG23 ILE A 504 -20.071 14.826 -3.223 1.00 23.35 H new ATOM 0 HD11 ILE A 504 -15.848 12.795 -4.203 1.00 71.40 H new ATOM 0 HD12 ILE A 504 -15.866 13.988 -2.883 1.00 71.40 H new ATOM 0 HD13 ILE A 504 -16.214 12.277 -2.540 1.00 71.40 H new ATOM 1973 N CYS A 505 -16.908 13.943 0.317 1.00 61.03 N ATOM 1974 CA CYS A 505 -15.858 13.507 1.232 1.00 61.12 C ATOM 1975 C CYS A 505 -15.399 12.095 0.889 1.00 12.12 C ATOM 1976 O CYS A 505 -16.214 11.223 0.590 1.00 64.43 O ATOM 1977 CB CYS A 505 -16.378 13.538 2.671 1.00 41.02 C ATOM 1978 SG CYS A 505 -15.019 13.180 3.811 1.00 1.42 S ATOM 0 H CYS A 505 -17.850 13.682 0.607 1.00 61.03 H new ATOM 0 HA CYS A 505 -15.011 14.186 1.133 1.00 61.12 H new ATOM 0 HB2 CYS A 505 -16.806 14.516 2.894 1.00 41.02 H new ATOM 0 HB3 CYS A 505 -17.175 12.805 2.797 1.00 41.02 H new ATOM 0 HG CYS A 505 -14.528 12.006 3.546 1.00 1.42 H new ATOM 1984 N LEU A 506 -14.089 11.873 0.946 1.00 63.45 N ATOM 1985 CA LEU A 506 -13.540 10.554 0.649 1.00 24.03 C ATOM 1986 C LEU A 506 -13.764 9.608 1.824 1.00 3.31 C ATOM 1987 O LEU A 506 -13.818 10.036 2.978 1.00 20.11 O ATOM 1988 CB LEU A 506 -12.041 10.660 0.359 1.00 24.13 C ATOM 1989 CG LEU A 506 -11.794 11.729 -0.710 1.00 11.32 C ATOM 1990 CD1 LEU A 506 -10.303 11.775 -1.056 1.00 12.12 C ATOM 1991 CD2 LEU A 506 -12.605 11.393 -1.968 1.00 53.33 C ATOM 0 H LEU A 506 -13.396 12.579 1.192 1.00 63.45 H new ATOM 0 HA LEU A 506 -14.051 10.159 -0.229 1.00 24.03 H new ATOM 0 HB2 LEU A 506 -11.502 10.914 1.272 1.00 24.13 H new ATOM 0 HB3 LEU A 506 -11.658 9.698 0.019 1.00 24.13 H new ATOM 0 HG LEU A 506 -12.105 12.701 -0.328 1.00 11.32 H new ATOM 0 HD11 LEU A 506 -10.129 12.536 -1.817 1.00 12.12 H new ATOM 0 HD12 LEU A 506 -9.729 12.018 -0.162 1.00 12.12 H new ATOM 0 HD13 LEU A 506 -9.988 10.803 -1.436 1.00 12.12 H new ATOM 0 HD21 LEU A 506 -12.429 12.154 -2.728 1.00 53.33 H new ATOM 0 HD22 LEU A 506 -12.297 10.420 -2.350 1.00 53.33 H new ATOM 0 HD23 LEU A 506 -13.666 11.366 -1.720 1.00 53.33 H new