USER MOD reduce.3.24.130724 H: found=0, std=0, add=971, rem=0, adj=36 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= -6.35! C(o=-18!,f=-18!) USER MOD Set 1.2: A 434 ASN : amide:sc= -11.2! C(o=-18!,f=-18!) USER MOD Set 2.1: A 421 TYR OH : rot 89:sc= 0.0868! USER MOD Set 2.2: A 473 CYS SG : rot -106:sc= -0.0033! USER MOD Set 3.1: A 394 GLN :FLIP amide:sc= -1.22! C(o=-8.8!,f=-7.2!) USER MOD Set 3.2: A 497 ASN : amide:sc= -5.96! C(o=-7.2!,f=-8.8!) USER MOD Set 4.1: A 389 SER OG : rot -88:sc= 0.0149 USER MOD Set 4.2: A 402 THR OG1 : rot 38:sc= -0.955! USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 396 ASN :FLIP amide:sc= -0.0113 F(o=-2.4!,f=-0.011) USER MOD Single : A 397 SER OG : rot -120:sc= 0.929 USER MOD Single : A 398 ASN : amide:sc= -1.5 K(o=-1.5,f=-2.7!) USER MOD Single : A 400 GLN :FLIP amide:sc= -1.52 F(o=-4.8!,f=-1.5) USER MOD Single : A 401 CYS SG : rot 153:sc= -5.09! 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 162:sc= -0.322 (180deg=-1.01) USER MOD Single : A 414 SER OG : rot 180:sc= 0 USER MOD Single : A 415 ASN : amide:sc= -4.64! C(o=-4.6!,f=-5.5!) USER MOD Single : A 423 LYS NZ :NH3+ -117:sc= -1.08 (180deg=-2.98!) USER MOD Single : A 431 SER OG : rot 180:sc= 0.075 USER MOD Single : A 432 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 438 THR OG1 : rot -130:sc= -2.79! USER MOD Single : A 439 LYS NZ :NH3+ -162:sc= -0.175 (180deg=-0.946) USER MOD Single : A 440 THR OG1 : rot 180:sc= -0.658 USER MOD Single : A 443 ASN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : A 444 THR OG1 : rot 83:sc= -0.718! USER MOD Single : A 446 ASN : amide:sc= -6.9! C(o=-6.9!,f=-7.4!) USER MOD Single : A 450 ASN : amide:sc= -1.13 K(o=-1.1,f=-4.7!) USER MOD Single : A 452 THR OG1 : rot 180:sc= -1.12 USER MOD Single : A 454 GLN : amide:sc= -0.0736 K(o=-0.074,f=-1) USER MOD Single : A 455 TYR OH : rot -92:sc= -0.846 USER MOD Single : A 456 HIS :FLIP no HD1:sc= 0.363 F(o=-3!,f=0.36) USER MOD Single : A 459 THR OG1 : rot 180:sc= 0 USER MOD Single : A 463 MET CE :methyl -131:sc= -0.948 (180deg=-5.61!) USER MOD Single : A 464 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 466 LYS NZ :NH3+ -131:sc= -2.25! (180deg=-6.23!) USER MOD Single : A 467 THR OG1 : rot 180:sc= 0 USER MOD Single : A 471 SER OG : rot 180:sc= 0.116 USER MOD Single : A 481 ASN :FLIP amide:sc= -0.138! C(o=-1.5!,f=-0.14!) USER MOD Single : A 487 THR OG1 : rot 140:sc= -1.2 USER MOD Single : A 490 SER OG : rot 180:sc= 0 USER MOD Single : A 492 LYS NZ :NH3+ 169:sc= -0.326 (180deg=-0.893) USER MOD Single : A 493 LYS NZ :NH3+ -133:sc= -0.136 (180deg=-1.26) USER MOD Single : A 495 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 GLN :FLIP amide:sc= -0.0675 F(o=-0.96,f=-0.068) USER MOD Single : A 500 LYS NZ :NH3+ -165:sc=-0.00715 (180deg=-0.174) USER MOD Single : A 501 ASN : amide:sc= -0.493 K(o=-0.49,f=-4.2!) USER MOD Single : A 503 ASN : amide:sc= -1.39 K(o=-1.4,f=-4!) USER MOD Single : A 505 CYS SG : rot 39:sc= 0.233 USER MOD ----------------------------------------------------------------- ATOM 8 N ALA A 385 -11.718 16.269 1.460 1.00 10.04 N ATOM 9 CA ALA A 385 -12.787 16.475 0.485 1.00 43.31 C ATOM 10 C ALA A 385 -12.203 16.486 -0.919 1.00 54.14 C ATOM 11 O ALA A 385 -11.026 16.797 -1.102 1.00 71.03 O ATOM 12 CB ALA A 385 -13.505 17.799 0.761 1.00 52.31 C ATOM 0 HA ALA A 385 -13.507 15.661 0.570 1.00 43.31 H new ATOM 0 HB1 ALA A 385 -14.299 17.942 0.028 1.00 52.31 H new ATOM 0 HB2 ALA A 385 -13.935 17.778 1.763 1.00 52.31 H new ATOM 0 HB3 ALA A 385 -12.793 18.621 0.689 1.00 52.31 H new ATOM 18 N LEU A 386 -13.020 16.145 -1.914 1.00 35.42 N ATOM 19 CA LEU A 386 -12.540 16.125 -3.292 1.00 41.23 C ATOM 20 C LEU A 386 -13.565 16.721 -4.239 1.00 71.33 C ATOM 21 O LEU A 386 -14.766 16.448 -4.155 1.00 52.31 O ATOM 22 CB LEU A 386 -12.233 14.696 -3.731 1.00 12.25 C ATOM 23 CG LEU A 386 -11.262 14.696 -4.924 1.00 75.44 C ATOM 24 CD1 LEU A 386 -9.867 15.178 -4.487 1.00 75.23 C ATOM 25 CD2 LEU A 386 -11.166 13.273 -5.486 1.00 73.01 C ATOM 0 H LEU A 386 -13.999 15.884 -1.795 1.00 35.42 H new ATOM 0 HA LEU A 386 -11.631 16.725 -3.329 1.00 41.23 H new ATOM 0 HB2 LEU A 386 -11.798 14.140 -2.901 1.00 12.25 H new ATOM 0 HB3 LEU A 386 -13.157 14.187 -4.006 1.00 12.25 H new ATOM 0 HG LEU A 386 -11.635 15.376 -5.690 1.00 75.44 H new ATOM 0 HD11 LEU A 386 -9.194 15.171 -5.345 1.00 75.23 H new ATOM 0 HD12 LEU A 386 -9.940 16.191 -4.091 1.00 75.23 H new ATOM 0 HD13 LEU A 386 -9.478 14.514 -3.715 1.00 75.23 H new ATOM 0 HD21 LEU A 386 -10.480 13.262 -6.333 1.00 73.01 H new ATOM 0 HD22 LEU A 386 -10.798 12.600 -4.712 1.00 73.01 H new ATOM 0 HD23 LEU A 386 -12.152 12.944 -5.814 1.00 73.01 H new ATOM 37 N GLU A 387 -13.050 17.541 -5.134 1.00 62.45 N ATOM 38 CA GLU A 387 -13.853 18.220 -6.135 1.00 10.24 C ATOM 39 C GLU A 387 -13.403 17.796 -7.529 1.00 73.04 C ATOM 40 O GLU A 387 -12.234 17.959 -7.890 1.00 35.14 O ATOM 41 CB GLU A 387 -13.690 19.736 -5.967 1.00 32.24 C ATOM 42 CG GLU A 387 -14.752 20.274 -5.001 1.00 61.24 C ATOM 43 CD GLU A 387 -14.497 21.750 -4.716 1.00 43.35 C ATOM 44 OE1 GLU A 387 -14.556 22.532 -5.649 1.00 73.33 O ATOM 45 OE2 GLU A 387 -14.246 22.076 -3.567 1.00 33.43 O ATOM 0 H GLU A 387 -12.055 17.757 -5.188 1.00 62.45 H new ATOM 0 HA GLU A 387 -14.902 17.953 -6.008 1.00 10.24 H new ATOM 0 HB2 GLU A 387 -12.694 19.963 -5.588 1.00 32.24 H new ATOM 0 HB3 GLU A 387 -13.783 20.229 -6.934 1.00 32.24 H new ATOM 0 HG2 GLU A 387 -15.745 20.144 -5.431 1.00 61.24 H new ATOM 0 HG3 GLU A 387 -14.730 19.706 -4.071 1.00 61.24 H new ATOM 52 N PHE A 388 -14.337 17.250 -8.303 1.00 42.44 N ATOM 53 CA PHE A 388 -14.039 16.797 -9.659 1.00 14.25 C ATOM 54 C PHE A 388 -15.246 17.026 -10.568 1.00 42.21 C ATOM 55 O PHE A 388 -16.384 17.062 -10.102 1.00 24.20 O ATOM 56 CB PHE A 388 -13.669 15.310 -9.638 1.00 50.54 C ATOM 57 CG PHE A 388 -14.884 14.466 -9.335 1.00 11.41 C ATOM 58 CD1 PHE A 388 -15.806 14.182 -10.345 1.00 41.42 C ATOM 59 CD2 PHE A 388 -15.080 13.957 -8.044 1.00 65.04 C ATOM 60 CE1 PHE A 388 -16.926 13.388 -10.069 1.00 20.25 C ATOM 61 CE2 PHE A 388 -16.201 13.166 -7.767 1.00 70.34 C ATOM 62 CZ PHE A 388 -17.123 12.880 -8.780 1.00 34.21 C ATOM 0 H PHE A 388 -15.306 17.111 -8.015 1.00 42.44 H new ATOM 0 HA PHE A 388 -13.196 17.369 -10.048 1.00 14.25 H new ATOM 0 HB2 PHE A 388 -13.249 15.020 -10.601 1.00 50.54 H new ATOM 0 HB3 PHE A 388 -12.899 15.132 -8.888 1.00 50.54 H new ATOM 0 HD1 PHE A 388 -15.655 14.575 -11.340 1.00 41.42 H new ATOM 0 HD2 PHE A 388 -14.366 14.175 -7.263 1.00 65.04 H new ATOM 0 HE1 PHE A 388 -17.638 13.168 -10.851 1.00 20.25 H new ATOM 0 HE2 PHE A 388 -16.354 12.776 -6.771 1.00 70.34 H new ATOM 0 HZ PHE A 388 -17.987 12.267 -8.567 1.00 34.21 H new ATOM 72 N SER A 389 -14.989 17.184 -11.867 1.00 71.41 N ATOM 73 CA SER A 389 -16.062 17.414 -12.837 1.00 3.23 C ATOM 74 C SER A 389 -15.981 16.401 -13.971 1.00 55.42 C ATOM 75 O SER A 389 -14.894 16.077 -14.444 1.00 64.24 O ATOM 76 CB SER A 389 -15.954 18.828 -13.407 1.00 73.12 C ATOM 77 OG SER A 389 -16.716 18.911 -14.604 1.00 55.20 O ATOM 0 H SER A 389 -14.053 17.157 -12.271 1.00 71.41 H new ATOM 0 HA SER A 389 -17.019 17.299 -12.328 1.00 3.23 H new ATOM 0 HB2 SER A 389 -16.317 19.554 -12.680 1.00 73.12 H new ATOM 0 HB3 SER A 389 -14.911 19.073 -13.608 1.00 73.12 H new ATOM 0 HG SER A 389 -16.158 18.649 -15.366 1.00 55.20 H new ATOM 83 N LEU A 390 -17.140 15.903 -14.404 1.00 40.22 N ATOM 84 CA LEU A 390 -17.193 14.920 -15.487 1.00 4.01 C ATOM 85 C LEU A 390 -18.032 15.432 -16.652 1.00 5.22 C ATOM 86 O LEU A 390 -19.073 16.056 -16.455 1.00 64.45 O ATOM 87 CB LEU A 390 -17.788 13.607 -14.971 1.00 32.02 C ATOM 88 CG LEU A 390 -17.046 13.170 -13.704 1.00 32.12 C ATOM 89 CD1 LEU A 390 -17.694 11.908 -13.131 1.00 33.02 C ATOM 90 CD2 LEU A 390 -15.576 12.884 -14.036 1.00 31.33 C ATOM 0 H LEU A 390 -18.050 16.162 -14.024 1.00 40.22 H new ATOM 0 HA LEU A 390 -16.175 14.751 -15.839 1.00 4.01 H new ATOM 0 HB2 LEU A 390 -18.849 13.736 -14.757 1.00 32.02 H new ATOM 0 HB3 LEU A 390 -17.709 12.835 -15.736 1.00 32.02 H new ATOM 0 HG LEU A 390 -17.102 13.971 -12.966 1.00 32.12 H new ATOM 0 HD11 LEU A 390 -17.162 11.603 -12.230 1.00 33.02 H new ATOM 0 HD12 LEU A 390 -18.736 12.114 -12.885 1.00 33.02 H new ATOM 0 HD13 LEU A 390 -17.647 11.108 -13.869 1.00 33.02 H new ATOM 0 HD21 LEU A 390 -15.052 12.574 -13.132 1.00 31.33 H new ATOM 0 HD22 LEU A 390 -15.519 12.089 -14.779 1.00 31.33 H new ATOM 0 HD23 LEU A 390 -15.111 13.786 -14.433 1.00 31.33 H new ATOM 102 N LEU A 391 -17.567 15.149 -17.867 1.00 41.03 N ATOM 103 CA LEU A 391 -18.269 15.566 -19.081 1.00 2.11 C ATOM 104 C LEU A 391 -18.446 14.374 -20.007 1.00 52.42 C ATOM 105 O LEU A 391 -17.467 13.805 -20.489 1.00 53.02 O ATOM 106 CB LEU A 391 -17.468 16.656 -19.812 1.00 70.32 C ATOM 107 CG LEU A 391 -18.022 16.875 -21.228 1.00 4.41 C ATOM 108 CD1 LEU A 391 -19.518 17.194 -21.160 1.00 10.02 C ATOM 109 CD2 LEU A 391 -17.277 18.039 -21.883 1.00 61.35 C ATOM 0 H LEU A 391 -16.705 14.631 -18.038 1.00 41.03 H new ATOM 0 HA LEU A 391 -19.244 15.963 -18.800 1.00 2.11 H new ATOM 0 HB2 LEU A 391 -17.514 17.588 -19.249 1.00 70.32 H new ATOM 0 HB3 LEU A 391 -16.418 16.369 -19.867 1.00 70.32 H new ATOM 0 HG LEU A 391 -17.880 15.969 -21.817 1.00 4.41 H new ATOM 0 HD11 LEU A 391 -19.903 17.348 -22.168 1.00 10.02 H new ATOM 0 HD12 LEU A 391 -20.046 16.363 -20.692 1.00 10.02 H new ATOM 0 HD13 LEU A 391 -19.671 18.098 -20.571 1.00 10.02 H new ATOM 0 HD21 LEU A 391 -17.665 18.200 -22.889 1.00 61.35 H new ATOM 0 HD22 LEU A 391 -17.420 18.942 -21.290 1.00 61.35 H new ATOM 0 HD23 LEU A 391 -16.214 17.806 -21.938 1.00 61.35 H new ATOM 121 N TYR A 392 -19.694 14.010 -20.276 1.00 53.11 N ATOM 122 CA TYR A 392 -19.967 12.892 -21.174 1.00 40.03 C ATOM 123 C TYR A 392 -20.378 13.433 -22.537 1.00 10.43 C ATOM 124 O TYR A 392 -21.459 14.002 -22.688 1.00 42.52 O ATOM 125 CB TYR A 392 -21.071 12.003 -20.591 1.00 31.53 C ATOM 126 CG TYR A 392 -21.602 11.030 -21.633 1.00 32.33 C ATOM 127 CD1 TYR A 392 -20.793 10.578 -22.694 1.00 54.42 C ATOM 128 CD2 TYR A 392 -22.922 10.575 -21.528 1.00 44.21 C ATOM 129 CE1 TYR A 392 -21.312 9.682 -23.636 1.00 31.23 C ATOM 130 CE2 TYR A 392 -23.436 9.678 -22.471 1.00 52.33 C ATOM 131 CZ TYR A 392 -22.632 9.233 -23.526 1.00 42.52 C ATOM 132 OH TYR A 392 -23.141 8.349 -24.455 1.00 13.11 O ATOM 0 H TYR A 392 -20.523 14.464 -19.892 1.00 53.11 H new ATOM 0 HA TYR A 392 -19.068 12.286 -21.287 1.00 40.03 H new ATOM 0 HB2 TYR A 392 -20.682 11.449 -19.737 1.00 31.53 H new ATOM 0 HB3 TYR A 392 -21.886 12.626 -20.222 1.00 31.53 H new ATOM 0 HD1 TYR A 392 -19.773 10.923 -22.781 1.00 54.42 H new ATOM 0 HD2 TYR A 392 -23.546 10.918 -20.716 1.00 44.21 H new ATOM 0 HE1 TYR A 392 -20.692 9.337 -24.450 1.00 31.23 H new ATOM 0 HE2 TYR A 392 -24.454 9.329 -22.384 1.00 52.33 H new ATOM 0 HH TYR A 392 -24.071 8.138 -24.231 1.00 13.11 H new ATOM 142 N ASP A 393 -19.507 13.260 -23.528 1.00 72.15 N ATOM 143 CA ASP A 393 -19.783 13.738 -24.878 1.00 71.44 C ATOM 144 C ASP A 393 -20.238 12.564 -25.747 1.00 75.43 C ATOM 145 O ASP A 393 -19.588 11.519 -25.785 1.00 10.03 O ATOM 146 CB ASP A 393 -18.513 14.419 -25.436 1.00 61.04 C ATOM 147 CG ASP A 393 -18.224 13.978 -26.872 1.00 53.24 C ATOM 148 OD1 ASP A 393 -17.993 12.796 -27.073 1.00 54.44 O ATOM 149 OD2 ASP A 393 -18.239 14.828 -27.746 1.00 63.20 O ATOM 0 H ASP A 393 -18.606 12.793 -23.421 1.00 72.15 H new ATOM 0 HA ASP A 393 -20.586 14.475 -24.874 1.00 71.44 H new ATOM 0 HB2 ASP A 393 -18.636 15.502 -25.405 1.00 61.04 H new ATOM 0 HB3 ASP A 393 -17.660 14.177 -24.801 1.00 61.04 H new ATOM 154 N GLN A 394 -21.378 12.735 -26.410 1.00 33.31 N ATOM 155 CA GLN A 394 -21.947 11.679 -27.242 1.00 72.32 C ATOM 156 C GLN A 394 -21.494 11.782 -28.698 1.00 62.55 C ATOM 157 O GLN A 394 -21.229 10.768 -29.345 1.00 61.15 O ATOM 158 CB GLN A 394 -23.469 11.770 -27.165 1.00 70.34 C ATOM 159 CG GLN A 394 -23.883 13.237 -27.219 1.00 24.03 C ATOM 160 CD GLN A 394 -25.330 13.365 -27.686 1.00 42.25 C ATOM 161 OE1 GLN A 394 -26.148 12.359 -27.531 1.00 33.22 O flip ATOM 162 NE2 GLN A 394 -25.726 14.409 -28.206 1.00 1.25 N flip ATOM 0 H GLN A 394 -21.926 13.595 -26.387 1.00 33.31 H new ATOM 0 HA GLN A 394 -21.596 10.718 -26.866 1.00 72.32 H new ATOM 0 HB2 GLN A 394 -23.921 11.221 -27.991 1.00 70.34 H new ATOM 0 HB3 GLN A 394 -23.827 11.312 -26.243 1.00 70.34 H new ATOM 0 HG2 GLN A 394 -23.771 13.689 -26.234 1.00 24.03 H new ATOM 0 HG3 GLN A 394 -23.226 13.782 -27.897 1.00 24.03 H new ATOM 0 HE21 GLN A 394 -25.086 15.194 -28.326 1.00 1.25 H new ATOM 0 HE22 GLN A 394 -26.694 14.489 -28.516 1.00 1.25 H new ATOM 171 N ASP A 395 -21.431 13.000 -29.216 1.00 1.25 N ATOM 172 CA ASP A 395 -21.037 13.205 -30.608 1.00 44.52 C ATOM 173 C ASP A 395 -19.795 12.393 -30.953 1.00 73.50 C ATOM 174 O ASP A 395 -19.717 11.781 -32.018 1.00 53.24 O ATOM 175 CB ASP A 395 -20.764 14.689 -30.858 1.00 44.41 C ATOM 176 CG ASP A 395 -20.632 14.949 -32.355 1.00 32.40 C ATOM 177 OD1 ASP A 395 -21.623 14.807 -33.051 1.00 12.34 O ATOM 178 OD2 ASP A 395 -19.540 15.287 -32.783 1.00 64.35 O ATOM 0 H ASP A 395 -21.645 13.855 -28.702 1.00 1.25 H new ATOM 0 HA ASP A 395 -21.856 12.869 -31.244 1.00 44.52 H new ATOM 0 HB2 ASP A 395 -21.574 15.291 -30.446 1.00 44.41 H new ATOM 0 HB3 ASP A 395 -19.850 14.991 -30.346 1.00 44.41 H new ATOM 183 N ASN A 396 -18.824 12.396 -30.049 1.00 5.21 N ATOM 184 CA ASN A 396 -17.585 11.667 -30.255 1.00 74.33 C ATOM 185 C ASN A 396 -17.469 10.520 -29.253 1.00 20.14 C ATOM 186 O ASN A 396 -16.450 9.832 -29.198 1.00 45.14 O ATOM 187 CB ASN A 396 -16.409 12.628 -30.084 1.00 13.23 C ATOM 188 CG ASN A 396 -16.158 13.394 -31.379 1.00 31.43 C ATOM 189 OD1 ASN A 396 -17.099 13.461 -32.281 1.00 4.45 O flip ATOM 190 ND2 ASN A 396 -15.075 13.948 -31.574 1.00 2.24 N flip ATOM 0 H ASN A 396 -18.874 12.899 -29.163 1.00 5.21 H new ATOM 0 HA ASN A 396 -17.576 11.247 -31.261 1.00 74.33 H new ATOM 0 HB2 ASN A 396 -16.617 13.327 -29.274 1.00 13.23 H new ATOM 0 HB3 ASN A 396 -15.514 12.072 -29.803 1.00 13.23 H new ATOM 0 HD21 ASN A 396 -14.341 13.895 -30.868 1.00 2.24 H new ATOM 0 HD22 ASN A 396 -14.913 14.460 -32.441 1.00 2.24 H new ATOM 197 N SER A 397 -18.518 10.322 -28.459 1.00 75.22 N ATOM 198 CA SER A 397 -18.513 9.258 -27.462 1.00 33.22 C ATOM 199 C SER A 397 -17.212 9.321 -26.683 1.00 31.22 C ATOM 200 O SER A 397 -16.479 8.337 -26.575 1.00 73.34 O ATOM 201 CB SER A 397 -18.648 7.894 -28.143 1.00 74.54 C ATOM 202 OG SER A 397 -19.033 6.924 -27.179 1.00 33.23 O ATOM 0 H SER A 397 -19.373 10.878 -28.486 1.00 75.22 H new ATOM 0 HA SER A 397 -19.356 9.390 -26.784 1.00 33.22 H new ATOM 0 HB2 SER A 397 -19.389 7.945 -28.941 1.00 74.54 H new ATOM 0 HB3 SER A 397 -17.702 7.610 -28.604 1.00 74.54 H new ATOM 0 HG SER A 397 -18.348 6.225 -27.127 1.00 33.23 H new ATOM 208 N ASN A 398 -16.924 10.509 -26.172 1.00 51.41 N ATOM 209 CA ASN A 398 -15.699 10.755 -25.430 1.00 31.45 C ATOM 210 C ASN A 398 -16.005 11.010 -23.960 1.00 53.11 C ATOM 211 O ASN A 398 -16.672 11.986 -23.619 1.00 44.02 O ATOM 212 CB ASN A 398 -15.016 11.983 -26.030 1.00 41.22 C ATOM 213 CG ASN A 398 -14.246 11.604 -27.290 1.00 61.43 C ATOM 214 OD1 ASN A 398 -13.912 10.436 -27.491 1.00 74.33 O ATOM 215 ND2 ASN A 398 -13.943 12.532 -28.155 1.00 13.33 N ATOM 0 H ASN A 398 -17.530 11.325 -26.260 1.00 51.41 H new ATOM 0 HA ASN A 398 -15.049 9.882 -25.497 1.00 31.45 H new ATOM 0 HB2 ASN A 398 -15.762 12.742 -26.267 1.00 41.22 H new ATOM 0 HB3 ASN A 398 -14.336 12.422 -25.299 1.00 41.22 H new ATOM 0 HD21 ASN A 398 -13.428 12.291 -29.002 1.00 13.33 H new ATOM 0 HD22 ASN A 398 -14.222 13.498 -27.985 1.00 13.33 H new ATOM 222 N LEU A 399 -15.501 10.140 -23.091 1.00 1.32 N ATOM 223 CA LEU A 399 -15.712 10.293 -21.671 1.00 75.40 C ATOM 224 C LEU A 399 -14.586 11.138 -21.088 1.00 51.01 C ATOM 225 O LEU A 399 -13.439 10.696 -21.020 1.00 3.20 O ATOM 226 CB LEU A 399 -15.727 8.905 -21.053 1.00 64.31 C ATOM 227 CG LEU A 399 -15.647 8.988 -19.538 1.00 14.33 C ATOM 228 CD1 LEU A 399 -16.761 9.894 -19.012 1.00 70.40 C ATOM 229 CD2 LEU A 399 -15.817 7.580 -18.990 1.00 12.13 C ATOM 0 H LEU A 399 -14.946 9.326 -23.353 1.00 1.32 H new ATOM 0 HA LEU A 399 -16.657 10.795 -21.461 1.00 75.40 H new ATOM 0 HB2 LEU A 399 -16.637 8.382 -21.345 1.00 64.31 H new ATOM 0 HB3 LEU A 399 -14.888 8.323 -21.435 1.00 64.31 H new ATOM 0 HG LEU A 399 -14.690 9.404 -19.224 1.00 14.33 H new ATOM 0 HD11 LEU A 399 -16.701 9.951 -17.925 1.00 70.40 H new ATOM 0 HD12 LEU A 399 -16.648 10.892 -19.435 1.00 70.40 H new ATOM 0 HD13 LEU A 399 -17.729 9.485 -19.301 1.00 70.40 H new ATOM 0 HD21 LEU A 399 -15.764 7.604 -17.902 1.00 12.13 H new ATOM 0 HD22 LEU A 399 -16.785 7.184 -19.298 1.00 12.13 H new ATOM 0 HD23 LEU A 399 -15.024 6.941 -19.377 1.00 12.13 H new ATOM 241 N GLN A 400 -14.912 12.366 -20.694 1.00 4.11 N ATOM 242 CA GLN A 400 -13.913 13.280 -20.144 1.00 35.50 C ATOM 243 C GLN A 400 -14.137 13.522 -18.658 1.00 32.43 C ATOM 244 O GLN A 400 -15.254 13.800 -18.220 1.00 75.22 O ATOM 245 CB GLN A 400 -13.981 14.612 -20.897 1.00 60.54 C ATOM 246 CG GLN A 400 -13.438 14.442 -22.335 1.00 25.22 C ATOM 247 CD GLN A 400 -12.599 15.652 -22.732 1.00 54.53 C ATOM 248 OE1 GLN A 400 -11.798 16.188 -21.856 1.00 72.54 O flip ATOM 249 NE2 GLN A 400 -12.676 16.118 -23.870 1.00 43.24 N flip ATOM 0 H GLN A 400 -15.855 12.751 -20.745 1.00 4.11 H new ATOM 0 HA GLN A 400 -12.929 12.827 -20.266 1.00 35.50 H new ATOM 0 HB2 GLN A 400 -15.011 14.968 -20.929 1.00 60.54 H new ATOM 0 HB3 GLN A 400 -13.400 15.367 -20.368 1.00 60.54 H new ATOM 0 HG2 GLN A 400 -12.835 13.536 -22.398 1.00 25.22 H new ATOM 0 HG3 GLN A 400 -14.267 14.322 -23.032 1.00 25.22 H new ATOM 0 HE21 GLN A 400 -13.305 15.695 -24.553 1.00 43.24 H new ATOM 0 HE22 GLN A 400 -12.111 16.927 -24.129 1.00 43.24 H new ATOM 258 N CYS A 401 -13.053 13.425 -17.889 1.00 32.10 N ATOM 259 CA CYS A 401 -13.109 13.646 -16.446 1.00 53.22 C ATOM 260 C CYS A 401 -12.170 14.779 -16.059 1.00 62.12 C ATOM 261 O CYS A 401 -11.005 14.790 -16.459 1.00 52.34 O ATOM 262 CB CYS A 401 -12.705 12.375 -15.700 1.00 70.44 C ATOM 263 SG CYS A 401 -12.555 12.743 -13.933 1.00 65.13 S ATOM 0 H CYS A 401 -12.124 13.194 -18.243 1.00 32.10 H new ATOM 0 HA CYS A 401 -14.131 13.911 -16.174 1.00 53.22 H new ATOM 0 HB2 CYS A 401 -13.448 11.594 -15.859 1.00 70.44 H new ATOM 0 HB3 CYS A 401 -11.758 11.998 -16.087 1.00 70.44 H new ATOM 0 HG CYS A 401 -12.783 11.664 -13.244 1.00 65.13 H new ATOM 269 N THR A 402 -12.679 15.737 -15.287 1.00 23.35 N ATOM 270 CA THR A 402 -11.877 16.877 -14.862 1.00 3.24 C ATOM 271 C THR A 402 -11.751 16.920 -13.340 1.00 53.12 C ATOM 272 O THR A 402 -12.669 17.359 -12.647 1.00 24.15 O ATOM 273 CB THR A 402 -12.539 18.174 -15.362 1.00 5.31 C ATOM 274 OG1 THR A 402 -13.934 17.956 -15.514 1.00 54.30 O ATOM 275 CG2 THR A 402 -11.942 18.588 -16.710 1.00 21.42 C ATOM 0 H THR A 402 -13.640 15.745 -14.945 1.00 23.35 H new ATOM 0 HA THR A 402 -10.877 16.779 -15.285 1.00 3.24 H new ATOM 0 HB THR A 402 -12.361 18.968 -14.637 1.00 5.31 H new ATOM 0 HG1 THR A 402 -14.256 17.382 -14.788 1.00 54.30 H new ATOM 0 HG21 THR A 402 -12.419 19.506 -17.052 1.00 21.42 H new ATOM 0 HG22 THR A 402 -10.871 18.755 -16.598 1.00 21.42 H new ATOM 0 HG23 THR A 402 -12.111 17.797 -17.441 1.00 21.42 H new ATOM 283 N ILE A 403 -10.602 16.487 -12.826 1.00 72.44 N ATOM 284 CA ILE A 403 -10.367 16.513 -11.397 1.00 71.13 C ATOM 285 C ILE A 403 -9.899 17.913 -11.006 1.00 13.41 C ATOM 286 O ILE A 403 -8.890 18.403 -11.512 1.00 32.24 O ATOM 287 CB ILE A 403 -9.326 15.449 -11.047 1.00 34.11 C ATOM 288 CG1 ILE A 403 -8.994 15.500 -9.566 1.00 22.11 C ATOM 289 CG2 ILE A 403 -8.045 15.670 -11.841 1.00 55.41 C ATOM 290 CD1 ILE A 403 -10.228 15.143 -8.742 1.00 2.34 C ATOM 0 H ILE A 403 -9.828 16.118 -13.379 1.00 72.44 H new ATOM 0 HA ILE A 403 -11.278 16.289 -10.843 1.00 71.13 H new ATOM 0 HB ILE A 403 -9.748 14.476 -11.298 1.00 34.11 H new ATOM 0 HG12 ILE A 403 -8.184 14.806 -9.342 1.00 22.11 H new ATOM 0 HG13 ILE A 403 -8.643 16.496 -9.298 1.00 22.11 H new ATOM 0 HG21 ILE A 403 -7.317 14.903 -11.578 1.00 55.41 H new ATOM 0 HG22 ILE A 403 -8.263 15.612 -12.907 1.00 55.41 H new ATOM 0 HG23 ILE A 403 -7.637 16.653 -11.607 1.00 55.41 H new ATOM 0 HD11 ILE A 403 -9.981 15.182 -7.681 1.00 2.34 H new ATOM 0 HD12 ILE A 403 -11.026 15.854 -8.955 1.00 2.34 H new ATOM 0 HD13 ILE A 403 -10.560 14.137 -9.000 1.00 2.34 H new ATOM 302 N ILE A 404 -10.672 18.578 -10.149 1.00 32.24 N ATOM 303 CA ILE A 404 -10.353 19.949 -9.757 1.00 33.01 C ATOM 304 C ILE A 404 -9.318 20.034 -8.637 1.00 45.42 C ATOM 305 O ILE A 404 -8.181 20.450 -8.872 1.00 4.41 O ATOM 306 CB ILE A 404 -11.627 20.669 -9.316 1.00 64.55 C ATOM 307 CG1 ILE A 404 -12.671 20.585 -10.433 1.00 60.41 C ATOM 308 CG2 ILE A 404 -11.307 22.139 -9.029 1.00 44.30 C ATOM 309 CD1 ILE A 404 -14.014 21.103 -9.919 1.00 63.21 C ATOM 0 H ILE A 404 -11.513 18.195 -9.718 1.00 32.24 H new ATOM 0 HA ILE A 404 -9.917 20.428 -10.634 1.00 33.01 H new ATOM 0 HB ILE A 404 -12.019 20.198 -8.414 1.00 64.55 H new ATOM 0 HG12 ILE A 404 -12.348 21.173 -11.292 1.00 60.41 H new ATOM 0 HG13 ILE A 404 -12.773 19.554 -10.773 1.00 60.41 H new ATOM 0 HG21 ILE A 404 -12.215 22.654 -8.714 1.00 44.30 H new ATOM 0 HG22 ILE A 404 -10.561 22.201 -8.237 1.00 44.30 H new ATOM 0 HG23 ILE A 404 -10.917 22.609 -9.932 1.00 44.30 H new ATOM 0 HD11 ILE A 404 -14.756 21.043 -10.715 1.00 63.21 H new ATOM 0 HD12 ILE A 404 -14.339 20.496 -9.074 1.00 63.21 H new ATOM 0 HD13 ILE A 404 -13.906 22.140 -9.601 1.00 63.21 H new ATOM 321 N ARG A 405 -9.707 19.684 -7.412 1.00 71.02 N ATOM 322 CA ARG A 405 -8.764 19.800 -6.300 1.00 44.21 C ATOM 323 C ARG A 405 -9.177 18.994 -5.069 1.00 34.22 C ATOM 324 O ARG A 405 -10.328 18.583 -4.926 1.00 45.45 O ATOM 325 CB ARG A 405 -8.656 21.274 -5.906 1.00 34.15 C ATOM 326 CG ARG A 405 -9.935 21.716 -5.186 1.00 15.23 C ATOM 327 CD ARG A 405 -9.990 23.244 -5.127 1.00 52.33 C ATOM 328 NE ARG A 405 -8.914 23.756 -4.284 1.00 63.30 N ATOM 329 CZ ARG A 405 -8.934 23.585 -2.966 1.00 75.40 C ATOM 330 NH1 ARG A 405 -9.926 22.950 -2.405 1.00 0.12 N ATOM 331 NH2 ARG A 405 -7.960 24.052 -2.235 1.00 2.42 N ATOM 0 H ARG A 405 -10.632 19.331 -7.168 1.00 71.02 H new ATOM 0 HA ARG A 405 -7.811 19.397 -6.642 1.00 44.21 H new ATOM 0 HB2 ARG A 405 -7.793 21.424 -5.258 1.00 34.15 H new ATOM 0 HB3 ARG A 405 -8.498 21.886 -6.794 1.00 34.15 H new ATOM 0 HG2 ARG A 405 -10.810 21.331 -5.709 1.00 15.23 H new ATOM 0 HG3 ARG A 405 -9.958 21.302 -4.178 1.00 15.23 H new ATOM 0 HD2 ARG A 405 -9.902 23.657 -6.132 1.00 52.33 H new ATOM 0 HD3 ARG A 405 -10.954 23.565 -4.733 1.00 52.33 H new ATOM 0 HE ARG A 405 -8.134 24.253 -4.713 1.00 63.30 H new ATOM 0 HH11 ARG A 405 -10.687 22.584 -2.978 1.00 0.12 H new ATOM 0 HH12 ARG A 405 -9.941 22.819 -1.394 1.00 0.12 H new ATOM 0 HH21 ARG A 405 -7.185 24.548 -2.675 1.00 2.42 H new ATOM 0 HH22 ARG A 405 -7.974 23.922 -1.223 1.00 2.42 H new ATOM 345 N ALA A 406 -8.208 18.815 -4.167 1.00 52.15 N ATOM 346 CA ALA A 406 -8.427 18.102 -2.909 1.00 0.20 C ATOM 347 C ALA A 406 -8.287 19.086 -1.752 1.00 52.33 C ATOM 348 O ALA A 406 -7.556 20.071 -1.860 1.00 12.24 O ATOM 349 CB ALA A 406 -7.401 16.975 -2.755 1.00 62.10 C ATOM 0 H ALA A 406 -7.255 19.159 -4.289 1.00 52.15 H new ATOM 0 HA ALA A 406 -9.426 17.667 -2.908 1.00 0.20 H new ATOM 0 HB1 ALA A 406 -7.574 16.451 -1.815 1.00 62.10 H new ATOM 0 HB2 ALA A 406 -7.502 16.275 -3.584 1.00 62.10 H new ATOM 0 HB3 ALA A 406 -6.395 17.396 -2.756 1.00 62.10 H new ATOM 355 N LYS A 407 -9.002 18.836 -0.656 1.00 1.23 N ATOM 356 CA LYS A 407 -8.954 19.738 0.497 1.00 71.23 C ATOM 357 C LYS A 407 -8.565 19.009 1.780 1.00 41.02 C ATOM 358 O LYS A 407 -9.212 18.041 2.180 1.00 53.23 O ATOM 359 CB LYS A 407 -10.323 20.392 0.692 1.00 41.31 C ATOM 360 CG LYS A 407 -10.197 21.565 1.667 1.00 64.14 C ATOM 361 CD LYS A 407 -11.539 22.300 1.763 1.00 64.04 C ATOM 362 CE LYS A 407 -12.601 21.375 2.369 1.00 22.43 C ATOM 363 NZ LYS A 407 -13.692 22.199 2.962 1.00 3.24 N ATOM 0 H LYS A 407 -9.614 18.028 -0.541 1.00 1.23 H new ATOM 0 HA LYS A 407 -8.193 20.491 0.292 1.00 71.23 H new ATOM 0 HB2 LYS A 407 -10.710 20.741 -0.265 1.00 41.31 H new ATOM 0 HB3 LYS A 407 -11.035 19.661 1.076 1.00 41.31 H new ATOM 0 HG2 LYS A 407 -9.898 21.203 2.651 1.00 64.14 H new ATOM 0 HG3 LYS A 407 -9.419 22.250 1.329 1.00 64.14 H new ATOM 0 HD2 LYS A 407 -11.430 23.194 2.377 1.00 64.04 H new ATOM 0 HD3 LYS A 407 -11.854 22.630 0.773 1.00 64.04 H new ATOM 0 HE2 LYS A 407 -13.005 20.714 1.602 1.00 22.43 H new ATOM 0 HE3 LYS A 407 -12.153 20.740 3.133 1.00 22.43 H new ATOM 0 HZ1 LYS A 407 -14.414 21.574 3.374 1.00 3.24 H new ATOM 0 HZ2 LYS A 407 -13.300 22.812 3.705 1.00 3.24 H new ATOM 0 HZ3 LYS A 407 -14.125 22.787 2.221 1.00 3.24 H new ATOM 377 N GLY A 408 -7.519 19.511 2.434 1.00 23.32 N ATOM 378 CA GLY A 408 -7.053 18.941 3.691 1.00 14.51 C ATOM 379 C GLY A 408 -6.579 17.504 3.538 1.00 4.31 C ATOM 380 O GLY A 408 -7.382 16.571 3.541 1.00 2.11 O ATOM 0 H GLY A 408 -6.979 20.314 2.111 1.00 23.32 H new ATOM 0 HA2 GLY A 408 -6.238 19.550 4.082 1.00 14.51 H new ATOM 0 HA3 GLY A 408 -7.859 18.978 4.424 1.00 14.51 H new ATOM 384 N LEU A 409 -5.262 17.328 3.439 1.00 5.11 N ATOM 385 CA LEU A 409 -4.678 15.988 3.326 1.00 22.04 C ATOM 386 C LEU A 409 -3.955 15.622 4.625 1.00 4.14 C ATOM 387 O LEU A 409 -3.081 16.352 5.090 1.00 65.42 O ATOM 388 CB LEU A 409 -3.699 15.924 2.149 1.00 0.22 C ATOM 389 CG LEU A 409 -4.409 16.307 0.842 1.00 25.44 C ATOM 390 CD1 LEU A 409 -3.453 16.087 -0.333 1.00 31.33 C ATOM 391 CD2 LEU A 409 -5.662 15.438 0.642 1.00 43.11 C ATOM 0 H LEU A 409 -4.582 18.088 3.435 1.00 5.11 H new ATOM 0 HA LEU A 409 -5.482 15.274 3.148 1.00 22.04 H new ATOM 0 HB2 LEU A 409 -2.862 16.599 2.327 1.00 0.22 H new ATOM 0 HB3 LEU A 409 -3.286 14.919 2.065 1.00 0.22 H new ATOM 0 HG LEU A 409 -4.706 17.354 0.893 1.00 25.44 H new ATOM 0 HD11 LEU A 409 -3.952 16.357 -1.264 1.00 31.33 H new ATOM 0 HD12 LEU A 409 -2.567 16.708 -0.202 1.00 31.33 H new ATOM 0 HD13 LEU A 409 -3.158 15.038 -0.371 1.00 31.33 H new ATOM 0 HD21 LEU A 409 -6.156 15.720 -0.288 1.00 43.11 H new ATOM 0 HD22 LEU A 409 -5.373 14.388 0.596 1.00 43.11 H new ATOM 0 HD23 LEU A 409 -6.347 15.589 1.477 1.00 43.11 H new ATOM 403 N LYS A 410 -4.345 14.489 5.206 1.00 23.24 N ATOM 404 CA LYS A 410 -3.756 14.017 6.461 1.00 42.30 C ATOM 405 C LYS A 410 -2.276 13.660 6.286 1.00 34.31 C ATOM 406 O LYS A 410 -1.862 13.233 5.207 1.00 32.23 O ATOM 407 CB LYS A 410 -4.524 12.790 6.961 1.00 51.34 C ATOM 408 CG LYS A 410 -4.798 11.849 5.786 1.00 53.24 C ATOM 409 CD LYS A 410 -5.242 10.484 6.319 1.00 12.32 C ATOM 410 CE LYS A 410 -5.460 9.525 5.146 1.00 35.25 C ATOM 411 NZ LYS A 410 -5.820 8.176 5.668 1.00 12.45 N ATOM 0 H LYS A 410 -5.069 13.878 4.827 1.00 23.24 H new ATOM 0 HA LYS A 410 -3.826 14.823 7.191 1.00 42.30 H new ATOM 0 HB2 LYS A 410 -3.947 12.274 7.728 1.00 51.34 H new ATOM 0 HB3 LYS A 410 -5.463 13.098 7.422 1.00 51.34 H new ATOM 0 HG2 LYS A 410 -5.571 12.269 5.142 1.00 53.24 H new ATOM 0 HG3 LYS A 410 -3.901 11.739 5.177 1.00 53.24 H new ATOM 0 HD2 LYS A 410 -4.487 10.083 6.995 1.00 12.32 H new ATOM 0 HD3 LYS A 410 -6.162 10.588 6.894 1.00 12.32 H new ATOM 0 HE2 LYS A 410 -6.253 9.900 4.498 1.00 35.25 H new ATOM 0 HE3 LYS A 410 -4.556 9.463 4.540 1.00 35.25 H new ATOM 0 HZ1 LYS A 410 -5.968 7.524 4.872 1.00 12.45 H new ATOM 0 HZ2 LYS A 410 -5.050 7.819 6.269 1.00 12.45 H new ATOM 0 HZ3 LYS A 410 -6.694 8.242 6.228 1.00 12.45 H new ATOM 425 N PRO A 411 -1.477 13.827 7.321 1.00 41.52 N ATOM 426 CA PRO A 411 -0.021 13.520 7.285 1.00 14.11 C ATOM 427 C PRO A 411 0.306 12.377 6.328 1.00 42.30 C ATOM 428 O PRO A 411 -0.499 11.465 6.141 1.00 51.20 O ATOM 429 CB PRO A 411 0.273 13.147 8.735 1.00 24.13 C ATOM 430 CG PRO A 411 -0.657 14.003 9.546 1.00 75.41 C ATOM 431 CD PRO A 411 -1.873 14.319 8.651 1.00 1.21 C ATOM 0 HA PRO A 411 0.582 14.351 6.918 1.00 14.11 H new ATOM 0 HB2 PRO A 411 0.094 12.087 8.915 1.00 24.13 H new ATOM 0 HB3 PRO A 411 1.315 13.342 8.991 1.00 24.13 H new ATOM 0 HG2 PRO A 411 -0.969 13.483 10.452 1.00 75.41 H new ATOM 0 HG3 PRO A 411 -0.161 14.921 9.861 1.00 75.41 H new ATOM 0 HD2 PRO A 411 -2.773 13.819 9.010 1.00 1.21 H new ATOM 0 HD3 PRO A 411 -2.088 15.387 8.633 1.00 1.21 H new ATOM 439 N MET A 412 1.475 12.455 5.695 1.00 4.51 N ATOM 440 CA MET A 412 1.884 11.444 4.719 1.00 42.41 C ATOM 441 C MET A 412 3.267 10.869 4.980 1.00 5.44 C ATOM 442 O MET A 412 3.409 9.700 5.339 1.00 54.44 O ATOM 443 CB MET A 412 1.874 12.076 3.331 1.00 34.44 C ATOM 444 CG MET A 412 0.439 12.125 2.796 1.00 42.13 C ATOM 445 SD MET A 412 -0.109 10.447 2.387 1.00 52.32 S ATOM 446 CE MET A 412 -1.790 10.577 3.047 1.00 14.24 C ATOM 0 H MET A 412 2.153 13.203 5.839 1.00 4.51 H new ATOM 0 HA MET A 412 1.176 10.619 4.800 1.00 42.41 H new ATOM 0 HB2 MET A 412 2.290 13.082 3.376 1.00 34.44 H new ATOM 0 HB3 MET A 412 2.505 11.500 2.654 1.00 34.44 H new ATOM 0 HG2 MET A 412 -0.224 12.564 3.541 1.00 42.13 H new ATOM 0 HG3 MET A 412 0.390 12.761 1.912 1.00 42.13 H new ATOM 0 HE1 MET A 412 -2.408 9.783 2.627 1.00 14.24 H new ATOM 0 HE2 MET A 412 -1.763 10.481 4.132 1.00 14.24 H new ATOM 0 HE3 MET A 412 -2.212 11.546 2.779 1.00 14.24 H new ATOM 456 N ASP A 413 4.281 11.689 4.770 1.00 25.23 N ATOM 457 CA ASP A 413 5.656 11.245 4.956 1.00 32.14 C ATOM 458 C ASP A 413 6.103 11.466 6.390 1.00 41.24 C ATOM 459 O ASP A 413 5.725 12.452 7.021 1.00 13.02 O ATOM 460 CB ASP A 413 6.577 12.010 4.004 1.00 12.53 C ATOM 461 CG ASP A 413 6.014 11.960 2.586 1.00 4.40 C ATOM 462 OD1 ASP A 413 4.970 11.356 2.405 1.00 20.14 O ATOM 463 OD2 ASP A 413 6.634 12.527 1.700 1.00 3.22 O ATOM 0 H ASP A 413 4.183 12.660 4.473 1.00 25.23 H new ATOM 0 HA ASP A 413 5.709 10.178 4.738 1.00 32.14 H new ATOM 0 HB2 ASP A 413 6.673 13.046 4.330 1.00 12.53 H new ATOM 0 HB3 ASP A 413 7.577 11.576 4.023 1.00 12.53 H new ATOM 468 N SER A 414 6.919 10.551 6.900 1.00 1.11 N ATOM 469 CA SER A 414 7.414 10.681 8.262 1.00 5.01 C ATOM 470 C SER A 414 7.962 12.085 8.455 1.00 42.20 C ATOM 471 O SER A 414 8.007 12.605 9.569 1.00 42.51 O ATOM 472 CB SER A 414 8.514 9.652 8.525 1.00 60.24 C ATOM 473 OG SER A 414 9.682 10.019 7.805 1.00 51.54 O ATOM 0 H SER A 414 7.247 9.725 6.400 1.00 1.11 H new ATOM 0 HA SER A 414 6.599 10.503 8.964 1.00 5.01 H new ATOM 0 HB2 SER A 414 8.732 9.600 9.592 1.00 60.24 H new ATOM 0 HB3 SER A 414 8.181 8.660 8.219 1.00 60.24 H new ATOM 0 HG SER A 414 10.390 9.362 7.973 1.00 51.54 H new ATOM 479 N ASN A 415 8.376 12.693 7.346 1.00 11.43 N ATOM 480 CA ASN A 415 8.918 14.040 7.383 1.00 52.52 C ATOM 481 C ASN A 415 7.796 15.065 7.512 1.00 15.04 C ATOM 482 O ASN A 415 8.025 16.183 7.971 1.00 5.42 O ATOM 483 CB ASN A 415 9.721 14.315 6.110 1.00 53.51 C ATOM 484 CG ASN A 415 10.325 15.715 6.168 1.00 25.14 C ATOM 485 OD1 ASN A 415 10.662 16.290 5.133 1.00 31.03 O ATOM 486 ND2 ASN A 415 10.482 16.301 7.323 1.00 22.31 N ATOM 0 H ASN A 415 8.345 12.273 6.417 1.00 11.43 H new ATOM 0 HA ASN A 415 9.573 14.125 8.250 1.00 52.52 H new ATOM 0 HB2 ASN A 415 10.512 13.573 6.001 1.00 53.51 H new ATOM 0 HB3 ASN A 415 9.076 14.224 5.236 1.00 53.51 H new ATOM 0 HD21 ASN A 415 10.885 17.237 7.369 1.00 22.31 H new ATOM 0 HD22 ASN A 415 10.202 15.823 8.180 1.00 22.31 H new ATOM 493 N GLY A 416 6.576 14.687 7.114 1.00 71.23 N ATOM 494 CA GLY A 416 5.446 15.604 7.211 1.00 23.35 C ATOM 495 C GLY A 416 5.177 16.271 5.873 1.00 22.13 C ATOM 496 O GLY A 416 4.348 17.175 5.775 1.00 42.43 O ATOM 0 H GLY A 416 6.353 13.769 6.729 1.00 71.23 H new ATOM 0 HA2 GLY A 416 4.559 15.062 7.537 1.00 23.35 H new ATOM 0 HA3 GLY A 416 5.651 16.363 7.966 1.00 23.35 H new ATOM 500 N LEU A 417 5.862 15.801 4.833 1.00 21.52 N ATOM 501 CA LEU A 417 5.666 16.340 3.495 1.00 14.03 C ATOM 502 C LEU A 417 4.696 15.443 2.748 1.00 42.22 C ATOM 503 O LEU A 417 4.124 14.521 3.336 1.00 70.03 O ATOM 504 CB LEU A 417 6.997 16.397 2.744 1.00 40.10 C ATOM 505 CG LEU A 417 8.077 16.998 3.645 1.00 24.45 C ATOM 506 CD1 LEU A 417 9.352 17.218 2.829 1.00 71.12 C ATOM 507 CD2 LEU A 417 7.594 18.340 4.207 1.00 52.43 C ATOM 0 H LEU A 417 6.553 15.053 4.893 1.00 21.52 H new ATOM 0 HA LEU A 417 5.266 17.351 3.565 1.00 14.03 H new ATOM 0 HB2 LEU A 417 7.290 15.396 2.429 1.00 40.10 H new ATOM 0 HB3 LEU A 417 6.889 16.997 1.840 1.00 40.10 H new ATOM 0 HG LEU A 417 8.282 16.315 4.469 1.00 24.45 H new ATOM 0 HD11 LEU A 417 10.124 17.646 3.468 1.00 71.12 H new ATOM 0 HD12 LEU A 417 9.698 16.264 2.431 1.00 71.12 H new ATOM 0 HD13 LEU A 417 9.143 17.900 2.005 1.00 71.12 H new ATOM 0 HD21 LEU A 417 8.366 18.765 4.848 1.00 52.43 H new ATOM 0 HD22 LEU A 417 7.387 19.025 3.385 1.00 52.43 H new ATOM 0 HD23 LEU A 417 6.685 18.185 4.788 1.00 52.43 H new ATOM 519 N ALA A 418 4.507 15.695 1.460 1.00 60.41 N ATOM 520 CA ALA A 418 3.592 14.872 0.689 1.00 75.42 C ATOM 521 C ALA A 418 3.650 15.187 -0.797 1.00 24.41 C ATOM 522 O ALA A 418 3.739 16.348 -1.202 1.00 73.51 O ATOM 523 CB ALA A 418 2.161 15.093 1.170 1.00 24.42 C ATOM 0 H ALA A 418 4.963 16.444 0.939 1.00 60.41 H new ATOM 0 HA ALA A 418 3.896 13.836 0.837 1.00 75.42 H new ATOM 0 HB1 ALA A 418 1.481 14.472 0.587 1.00 24.42 H new ATOM 0 HB2 ALA A 418 2.085 14.823 2.223 1.00 24.42 H new ATOM 0 HB3 ALA A 418 1.893 16.142 1.044 1.00 24.42 H new ATOM 529 N ASP A 419 3.544 14.132 -1.595 1.00 53.41 N ATOM 530 CA ASP A 419 3.523 14.253 -3.045 1.00 72.43 C ATOM 531 C ASP A 419 2.311 13.479 -3.553 1.00 40.25 C ATOM 532 O ASP A 419 2.400 12.284 -3.836 1.00 40.31 O ATOM 533 CB ASP A 419 4.807 13.669 -3.641 1.00 14.10 C ATOM 534 CG ASP A 419 6.006 14.089 -2.798 1.00 72.42 C ATOM 535 OD1 ASP A 419 6.383 15.247 -2.874 1.00 54.50 O ATOM 536 OD2 ASP A 419 6.532 13.246 -2.089 1.00 42.45 O ATOM 0 H ASP A 419 3.471 13.173 -1.256 1.00 53.41 H new ATOM 0 HA ASP A 419 3.460 15.300 -3.340 1.00 72.43 H new ATOM 0 HB2 ASP A 419 4.740 12.582 -3.678 1.00 14.10 H new ATOM 0 HB3 ASP A 419 4.933 14.015 -4.667 1.00 14.10 H new ATOM 541 N PRO A 420 1.176 14.124 -3.627 1.00 71.22 N ATOM 542 CA PRO A 420 -0.092 13.480 -4.053 1.00 5.41 C ATOM 543 C PRO A 420 -0.316 13.483 -5.564 1.00 42.12 C ATOM 544 O PRO A 420 0.108 14.390 -6.279 1.00 53.22 O ATOM 545 CB PRO A 420 -1.142 14.323 -3.330 1.00 14.21 C ATOM 546 CG PRO A 420 -0.561 15.702 -3.277 1.00 24.21 C ATOM 547 CD PRO A 420 0.967 15.543 -3.299 1.00 71.42 C ATOM 0 HA PRO A 420 -0.114 12.418 -3.807 1.00 5.41 H new ATOM 0 HB2 PRO A 420 -2.092 14.315 -3.865 1.00 14.21 H new ATOM 0 HB3 PRO A 420 -1.337 13.938 -2.329 1.00 14.21 H new ATOM 0 HG2 PRO A 420 -0.900 16.297 -4.125 1.00 24.21 H new ATOM 0 HG3 PRO A 420 -0.882 16.222 -2.375 1.00 24.21 H new ATOM 0 HD2 PRO A 420 1.425 16.195 -4.042 1.00 71.42 H new ATOM 0 HD3 PRO A 420 1.408 15.799 -2.336 1.00 71.42 H new ATOM 555 N TYR A 421 -1.014 12.447 -6.019 1.00 21.15 N ATOM 556 CA TYR A 421 -1.344 12.291 -7.429 1.00 4.42 C ATOM 557 C TYR A 421 -2.675 11.562 -7.563 1.00 70.13 C ATOM 558 O TYR A 421 -3.115 10.888 -6.631 1.00 15.32 O ATOM 559 CB TYR A 421 -0.240 11.518 -8.157 1.00 65.32 C ATOM 560 CG TYR A 421 -0.178 10.097 -7.654 1.00 1.22 C ATOM 561 CD1 TYR A 421 0.493 9.807 -6.461 1.00 21.12 C ATOM 562 CD2 TYR A 421 -0.778 9.068 -8.387 1.00 54.20 C ATOM 563 CE1 TYR A 421 0.564 8.486 -6.002 1.00 33.12 C ATOM 564 CE2 TYR A 421 -0.707 7.749 -7.927 1.00 14.15 C ATOM 565 CZ TYR A 421 -0.037 7.458 -6.735 1.00 54.20 C ATOM 566 OH TYR A 421 0.034 6.156 -6.284 1.00 35.24 O ATOM 0 H TYR A 421 -1.364 11.697 -5.424 1.00 21.15 H new ATOM 0 HA TYR A 421 -1.427 13.278 -7.885 1.00 4.42 H new ATOM 0 HB2 TYR A 421 -0.430 11.523 -9.230 1.00 65.32 H new ATOM 0 HB3 TYR A 421 0.721 12.009 -8.001 1.00 65.32 H new ATOM 0 HD1 TYR A 421 0.956 10.601 -5.895 1.00 21.12 H new ATOM 0 HD2 TYR A 421 -1.296 9.292 -9.308 1.00 54.20 H new ATOM 0 HE1 TYR A 421 1.083 8.261 -5.082 1.00 33.12 H new ATOM 0 HE2 TYR A 421 -1.170 6.955 -8.493 1.00 14.15 H new ATOM 0 HH TYR A 421 -0.721 5.976 -5.685 1.00 35.24 H new ATOM 576 N VAL A 422 -3.327 11.718 -8.712 1.00 42.30 N ATOM 577 CA VAL A 422 -4.626 11.088 -8.941 1.00 13.44 C ATOM 578 C VAL A 422 -4.541 10.000 -10.009 1.00 50.32 C ATOM 579 O VAL A 422 -3.749 10.087 -10.946 1.00 22.42 O ATOM 580 CB VAL A 422 -5.638 12.153 -9.375 1.00 13.21 C ATOM 581 CG1 VAL A 422 -6.955 11.481 -9.758 1.00 3.23 C ATOM 582 CG2 VAL A 422 -5.876 13.145 -8.229 1.00 31.33 C ATOM 0 H VAL A 422 -2.981 12.272 -9.495 1.00 42.30 H new ATOM 0 HA VAL A 422 -4.946 10.621 -8.009 1.00 13.44 H new ATOM 0 HB VAL A 422 -5.244 12.693 -10.236 1.00 13.21 H new ATOM 0 HG11 VAL A 422 -7.674 12.240 -10.067 1.00 3.23 H new ATOM 0 HG12 VAL A 422 -6.784 10.787 -10.581 1.00 3.23 H new ATOM 0 HG13 VAL A 422 -7.348 10.936 -8.900 1.00 3.23 H new ATOM 0 HG21 VAL A 422 -6.597 13.899 -8.545 1.00 31.33 H new ATOM 0 HG22 VAL A 422 -6.265 12.612 -7.361 1.00 31.33 H new ATOM 0 HG23 VAL A 422 -4.936 13.629 -7.966 1.00 31.33 H new ATOM 592 N LYS A 423 -5.387 8.981 -9.859 1.00 75.34 N ATOM 593 CA LYS A 423 -5.442 7.870 -10.808 1.00 4.15 C ATOM 594 C LYS A 423 -6.898 7.500 -11.078 1.00 75.11 C ATOM 595 O LYS A 423 -7.640 7.159 -10.157 1.00 73.23 O ATOM 596 CB LYS A 423 -4.707 6.643 -10.246 1.00 1.33 C ATOM 597 CG LYS A 423 -3.215 6.712 -10.584 1.00 1.45 C ATOM 598 CD LYS A 423 -2.517 5.428 -10.117 1.00 32.35 C ATOM 599 CE LYS A 423 -3.054 4.214 -10.891 1.00 10.22 C ATOM 600 NZ LYS A 423 -4.195 3.614 -10.143 1.00 22.14 N ATOM 0 H LYS A 423 -6.047 8.902 -9.085 1.00 75.34 H new ATOM 0 HA LYS A 423 -4.958 8.181 -11.734 1.00 4.15 H new ATOM 0 HB2 LYS A 423 -4.839 6.596 -9.165 1.00 1.33 H new ATOM 0 HB3 LYS A 423 -5.138 5.732 -10.660 1.00 1.33 H new ATOM 0 HG2 LYS A 423 -3.082 6.839 -11.658 1.00 1.45 H new ATOM 0 HG3 LYS A 423 -2.763 7.579 -10.102 1.00 1.45 H new ATOM 0 HD2 LYS A 423 -1.441 5.516 -10.267 1.00 32.35 H new ATOM 0 HD3 LYS A 423 -2.679 5.287 -9.048 1.00 32.35 H new ATOM 0 HE2 LYS A 423 -3.377 4.518 -11.887 1.00 10.22 H new ATOM 0 HE3 LYS A 423 -2.264 3.475 -11.024 1.00 10.22 H new ATOM 0 HZ1 LYS A 423 -3.950 2.645 -9.855 1.00 22.14 H new ATOM 0 HZ2 LYS A 423 -4.395 4.186 -9.298 1.00 22.14 H new ATOM 0 HZ3 LYS A 423 -5.037 3.592 -10.753 1.00 22.14 H new ATOM 614 N LEU A 424 -7.302 7.571 -12.340 1.00 15.11 N ATOM 615 CA LEU A 424 -8.667 7.245 -12.721 1.00 34.33 C ATOM 616 C LEU A 424 -8.757 5.783 -13.155 1.00 24.30 C ATOM 617 O LEU A 424 -7.935 5.305 -13.936 1.00 64.11 O ATOM 618 CB LEU A 424 -9.086 8.156 -13.883 1.00 73.54 C ATOM 619 CG LEU A 424 -10.235 9.082 -13.471 1.00 3.15 C ATOM 620 CD1 LEU A 424 -9.763 10.083 -12.407 1.00 43.52 C ATOM 621 CD2 LEU A 424 -10.702 9.846 -14.707 1.00 25.11 C ATOM 0 H LEU A 424 -6.702 7.852 -13.116 1.00 15.11 H new ATOM 0 HA LEU A 424 -9.330 7.397 -11.869 1.00 34.33 H new ATOM 0 HB2 LEU A 424 -8.233 8.752 -14.208 1.00 73.54 H new ATOM 0 HB3 LEU A 424 -9.392 7.548 -14.734 1.00 73.54 H new ATOM 0 HG LEU A 424 -11.048 8.489 -13.054 1.00 3.15 H new ATOM 0 HD11 LEU A 424 -10.592 10.733 -12.126 1.00 43.52 H new ATOM 0 HD12 LEU A 424 -9.412 9.542 -11.528 1.00 43.52 H new ATOM 0 HD13 LEU A 424 -8.950 10.686 -12.810 1.00 43.52 H new ATOM 0 HD21 LEU A 424 -11.521 10.512 -14.435 1.00 25.11 H new ATOM 0 HD22 LEU A 424 -9.875 10.433 -15.106 1.00 25.11 H new ATOM 0 HD23 LEU A 424 -11.044 9.140 -15.463 1.00 25.11 H new ATOM 633 N HIS A 425 -9.761 5.083 -12.640 1.00 4.33 N ATOM 634 CA HIS A 425 -9.956 3.675 -12.974 1.00 54.30 C ATOM 635 C HIS A 425 -11.442 3.367 -13.131 1.00 71.10 C ATOM 636 O HIS A 425 -12.247 3.661 -12.246 1.00 21.21 O ATOM 637 CB HIS A 425 -9.360 2.793 -11.872 1.00 43.30 C ATOM 638 CG HIS A 425 -9.173 1.392 -12.386 1.00 64.52 C ATOM 639 ND1 HIS A 425 -10.104 0.774 -13.207 1.00 15.41 N ATOM 640 CD2 HIS A 425 -8.169 0.474 -12.201 1.00 54.12 C ATOM 641 CE1 HIS A 425 -9.645 -0.461 -13.481 1.00 60.44 C ATOM 642 NE2 HIS A 425 -8.470 -0.695 -12.893 1.00 74.54 N ATOM 0 H HIS A 425 -10.451 5.464 -11.992 1.00 4.33 H new ATOM 0 HA HIS A 425 -9.452 3.466 -13.918 1.00 54.30 H new ATOM 0 HB2 HIS A 425 -8.404 3.201 -11.545 1.00 43.30 H new ATOM 0 HB3 HIS A 425 -10.018 2.787 -11.003 1.00 43.30 H new ATOM 0 HD2 HIS A 425 -7.281 0.635 -11.608 1.00 54.12 H new ATOM 0 HE1 HIS A 425 -10.165 -1.176 -14.102 1.00 60.44 H new ATOM 0 HE2 HIS A 425 -7.912 -1.548 -12.941 1.00 74.54 H new ATOM 651 N LEU A 426 -11.800 2.775 -14.268 1.00 14.52 N ATOM 652 CA LEU A 426 -13.194 2.424 -14.543 1.00 23.04 C ATOM 653 C LEU A 426 -13.405 0.927 -14.360 1.00 73.24 C ATOM 654 O LEU A 426 -12.700 0.111 -14.953 1.00 13.21 O ATOM 655 CB LEU A 426 -13.568 2.845 -15.973 1.00 14.44 C ATOM 656 CG LEU A 426 -14.000 4.318 -15.983 1.00 72.44 C ATOM 657 CD1 LEU A 426 -12.966 5.168 -15.236 1.00 40.20 C ATOM 658 CD2 LEU A 426 -14.113 4.808 -17.429 1.00 65.30 C ATOM 0 H LEU A 426 -11.148 2.528 -15.012 1.00 14.52 H new ATOM 0 HA LEU A 426 -13.838 2.954 -13.841 1.00 23.04 H new ATOM 0 HB2 LEU A 426 -12.717 2.701 -16.639 1.00 14.44 H new ATOM 0 HB3 LEU A 426 -14.376 2.217 -16.348 1.00 14.44 H new ATOM 0 HG LEU A 426 -14.967 4.411 -15.489 1.00 72.44 H new ATOM 0 HD11 LEU A 426 -13.278 6.212 -15.246 1.00 40.20 H new ATOM 0 HD12 LEU A 426 -12.888 4.823 -14.205 1.00 40.20 H new ATOM 0 HD13 LEU A 426 -11.996 5.074 -15.725 1.00 40.20 H new ATOM 0 HD21 LEU A 426 -14.420 5.854 -17.436 1.00 65.30 H new ATOM 0 HD22 LEU A 426 -13.146 4.710 -17.923 1.00 65.30 H new ATOM 0 HD23 LEU A 426 -14.854 4.209 -17.959 1.00 65.30 H new ATOM 670 N LEU A 427 -14.380 0.579 -13.526 1.00 41.31 N ATOM 671 CA LEU A 427 -14.687 -0.829 -13.256 1.00 62.43 C ATOM 672 C LEU A 427 -16.198 -1.073 -13.313 1.00 24.53 C ATOM 673 O LEU A 427 -16.979 -0.186 -12.967 1.00 11.44 O ATOM 674 CB LEU A 427 -14.165 -1.214 -11.864 1.00 21.01 C ATOM 675 CG LEU A 427 -12.634 -1.029 -11.801 1.00 2.35 C ATOM 676 CD1 LEU A 427 -12.296 0.344 -11.210 1.00 70.22 C ATOM 677 CD2 LEU A 427 -12.018 -2.118 -10.916 1.00 31.35 C ATOM 0 H LEU A 427 -14.970 1.245 -13.026 1.00 41.31 H new ATOM 0 HA LEU A 427 -14.201 -1.440 -14.017 1.00 62.43 H new ATOM 0 HB2 LEU A 427 -14.645 -0.598 -11.104 1.00 21.01 H new ATOM 0 HB3 LEU A 427 -14.423 -2.250 -11.644 1.00 21.01 H new ATOM 0 HG LEU A 427 -12.230 -1.101 -12.811 1.00 2.35 H new ATOM 0 HD11 LEU A 427 -11.214 0.466 -11.169 1.00 70.22 H new ATOM 0 HD12 LEU A 427 -12.726 1.126 -11.836 1.00 70.22 H new ATOM 0 HD13 LEU A 427 -12.708 0.418 -10.203 1.00 70.22 H new ATOM 0 HD21 LEU A 427 -10.937 -1.984 -10.874 1.00 31.35 H new ATOM 0 HD22 LEU A 427 -12.432 -2.047 -9.910 1.00 31.35 H new ATOM 0 HD23 LEU A 427 -12.246 -3.099 -11.334 1.00 31.35 H new ATOM 689 N PRO A 428 -16.638 -2.246 -13.727 1.00 13.12 N ATOM 690 CA PRO A 428 -15.755 -3.374 -14.164 1.00 20.35 C ATOM 691 C PRO A 428 -15.237 -3.173 -15.588 1.00 21.02 C ATOM 692 O PRO A 428 -15.933 -2.616 -16.436 1.00 1.12 O ATOM 693 CB PRO A 428 -16.680 -4.591 -14.084 1.00 62.42 C ATOM 694 CG PRO A 428 -18.044 -4.051 -14.361 1.00 0.24 C ATOM 695 CD PRO A 428 -18.061 -2.617 -13.816 1.00 22.51 C ATOM 0 HA PRO A 428 -14.860 -3.468 -13.549 1.00 20.35 H new ATOM 0 HB2 PRO A 428 -16.399 -5.350 -14.814 1.00 62.42 H new ATOM 0 HB3 PRO A 428 -16.632 -5.060 -13.101 1.00 62.42 H new ATOM 0 HG2 PRO A 428 -18.257 -4.063 -15.430 1.00 0.24 H new ATOM 0 HG3 PRO A 428 -18.808 -4.659 -13.877 1.00 0.24 H new ATOM 0 HD2 PRO A 428 -18.607 -1.946 -14.479 1.00 22.51 H new ATOM 0 HD3 PRO A 428 -18.547 -2.567 -12.842 1.00 22.51 H new ATOM 703 N GLY A 429 -14.015 -3.629 -15.843 1.00 22.12 N ATOM 704 CA GLY A 429 -13.426 -3.488 -17.170 1.00 42.31 C ATOM 705 C GLY A 429 -12.026 -4.090 -17.219 1.00 0.22 C ATOM 706 O GLY A 429 -11.466 -4.472 -16.191 1.00 24.15 O ATOM 0 H GLY A 429 -13.419 -4.094 -15.158 1.00 22.12 H new ATOM 0 HA2 GLY A 429 -14.062 -3.979 -17.907 1.00 42.31 H new ATOM 0 HA3 GLY A 429 -13.381 -2.433 -17.440 1.00 42.31 H new ATOM 710 N ALA A 430 -11.466 -4.170 -18.422 1.00 34.32 N ATOM 711 CA ALA A 430 -10.129 -4.725 -18.601 1.00 72.13 C ATOM 712 C ALA A 430 -9.069 -3.674 -18.289 1.00 3.32 C ATOM 713 O ALA A 430 -9.013 -2.625 -18.930 1.00 22.42 O ATOM 714 CB ALA A 430 -9.955 -5.216 -20.038 1.00 2.21 C ATOM 0 H ALA A 430 -11.915 -3.859 -19.284 1.00 34.32 H new ATOM 0 HA ALA A 430 -10.008 -5.563 -17.915 1.00 72.13 H new ATOM 0 HB1 ALA A 430 -8.954 -5.629 -20.163 1.00 2.21 H new ATOM 0 HB2 ALA A 430 -10.695 -5.988 -20.251 1.00 2.21 H new ATOM 0 HB3 ALA A 430 -10.092 -4.382 -20.727 1.00 2.21 H new ATOM 720 N SER A 431 -8.229 -3.966 -17.301 1.00 42.11 N ATOM 721 CA SER A 431 -7.171 -3.046 -16.905 1.00 20.21 C ATOM 722 C SER A 431 -6.303 -2.661 -18.101 1.00 52.23 C ATOM 723 O SER A 431 -5.370 -1.870 -17.970 1.00 3.22 O ATOM 724 CB SER A 431 -6.305 -3.698 -15.826 1.00 2.40 C ATOM 725 OG SER A 431 -7.134 -4.458 -14.956 1.00 23.21 O ATOM 0 H SER A 431 -8.261 -4.831 -16.761 1.00 42.11 H new ATOM 0 HA SER A 431 -7.631 -2.139 -16.512 1.00 20.21 H new ATOM 0 HB2 SER A 431 -5.554 -4.341 -16.285 1.00 2.40 H new ATOM 0 HB3 SER A 431 -5.769 -2.934 -15.262 1.00 2.40 H new ATOM 0 HG SER A 431 -6.583 -4.879 -14.264 1.00 23.21 H new ATOM 731 N LYS A 432 -6.615 -3.229 -19.264 1.00 43.31 N ATOM 732 CA LYS A 432 -5.857 -2.942 -20.478 1.00 73.14 C ATOM 733 C LYS A 432 -5.455 -1.474 -20.539 1.00 32.14 C ATOM 734 O LYS A 432 -4.268 -1.143 -20.533 1.00 64.12 O ATOM 735 CB LYS A 432 -6.694 -3.292 -21.710 1.00 23.23 C ATOM 736 CG LYS A 432 -5.896 -2.978 -22.978 1.00 14.12 C ATOM 737 CD LYS A 432 -6.539 -3.681 -24.177 1.00 51.13 C ATOM 738 CE LYS A 432 -7.941 -3.113 -24.411 1.00 21.31 C ATOM 739 NZ LYS A 432 -8.417 -3.512 -25.767 1.00 43.01 N ATOM 0 H LYS A 432 -7.384 -3.887 -19.390 1.00 43.31 H new ATOM 0 HA LYS A 432 -4.952 -3.549 -20.463 1.00 73.14 H new ATOM 0 HB2 LYS A 432 -6.965 -4.348 -21.690 1.00 23.23 H new ATOM 0 HB3 LYS A 432 -7.624 -2.724 -21.704 1.00 23.23 H new ATOM 0 HG2 LYS A 432 -5.870 -1.901 -23.146 1.00 14.12 H new ATOM 0 HG3 LYS A 432 -4.864 -3.308 -22.861 1.00 14.12 H new ATOM 0 HD2 LYS A 432 -5.925 -3.540 -25.067 1.00 51.13 H new ATOM 0 HD3 LYS A 432 -6.596 -4.754 -23.995 1.00 51.13 H new ATOM 0 HE2 LYS A 432 -8.627 -3.483 -23.649 1.00 21.31 H new ATOM 0 HE3 LYS A 432 -7.924 -2.027 -24.324 1.00 21.31 H new ATOM 0 HZ1 LYS A 432 -9.370 -3.127 -25.928 1.00 43.01 H new ATOM 0 HZ2 LYS A 432 -7.766 -3.138 -26.487 1.00 43.01 H new ATOM 0 HZ3 LYS A 432 -8.447 -4.549 -25.833 1.00 43.01 H new ATOM 753 N SER A 433 -6.449 -0.601 -20.607 1.00 34.32 N ATOM 754 CA SER A 433 -6.191 0.836 -20.680 1.00 1.33 C ATOM 755 C SER A 433 -7.295 1.637 -19.994 1.00 10.40 C ATOM 756 O SER A 433 -7.314 2.865 -20.073 1.00 62.45 O ATOM 757 CB SER A 433 -6.085 1.268 -22.142 1.00 10.03 C ATOM 758 OG SER A 433 -7.272 0.894 -22.829 1.00 21.44 O ATOM 0 H SER A 433 -7.436 -0.856 -20.613 1.00 34.32 H new ATOM 0 HA SER A 433 -5.252 1.035 -20.163 1.00 1.33 H new ATOM 0 HB2 SER A 433 -5.939 2.346 -22.205 1.00 10.03 H new ATOM 0 HB3 SER A 433 -5.218 0.801 -22.609 1.00 10.03 H new ATOM 0 HG SER A 433 -7.208 1.171 -23.767 1.00 21.44 H new ATOM 764 N ASN A 434 -8.211 0.947 -19.322 1.00 61.20 N ATOM 765 CA ASN A 434 -9.301 1.619 -18.634 1.00 52.53 C ATOM 766 C ASN A 434 -8.783 2.364 -17.403 1.00 20.13 C ATOM 767 O ASN A 434 -9.555 2.724 -16.510 1.00 43.13 O ATOM 768 CB ASN A 434 -10.360 0.588 -18.229 1.00 75.42 C ATOM 769 CG ASN A 434 -9.936 -0.170 -16.971 1.00 21.45 C ATOM 770 OD1 ASN A 434 -9.666 0.439 -15.936 1.00 22.25 O ATOM 771 ND2 ASN A 434 -9.870 -1.472 -16.998 1.00 42.13 N ATOM 0 H ASN A 434 -8.219 -0.070 -19.241 1.00 61.20 H new ATOM 0 HA ASN A 434 -9.750 2.350 -19.307 1.00 52.53 H new ATOM 0 HB2 ASN A 434 -11.311 1.089 -18.052 1.00 75.42 H new ATOM 0 HB3 ASN A 434 -10.518 -0.116 -19.046 1.00 75.42 H new ATOM 0 HD21 ASN A 434 -9.595 -1.986 -16.161 1.00 42.13 H new ATOM 0 HD22 ASN A 434 -10.094 -1.976 -17.856 1.00 42.13 H new ATOM 778 N LYS A 435 -7.468 2.582 -17.360 1.00 44.11 N ATOM 779 CA LYS A 435 -6.839 3.267 -16.244 1.00 34.11 C ATOM 780 C LYS A 435 -5.897 4.364 -16.745 1.00 32.25 C ATOM 781 O LYS A 435 -4.963 4.094 -17.500 1.00 44.31 O ATOM 782 CB LYS A 435 -6.053 2.250 -15.407 1.00 32.33 C ATOM 783 CG LYS A 435 -5.632 1.063 -16.284 1.00 45.44 C ATOM 784 CD LYS A 435 -4.735 0.115 -15.477 1.00 63.41 C ATOM 785 CE LYS A 435 -3.409 0.805 -15.124 1.00 73.34 C ATOM 786 NZ LYS A 435 -2.339 -0.223 -14.992 1.00 41.12 N ATOM 0 H LYS A 435 -6.820 2.290 -18.092 1.00 44.11 H new ATOM 0 HA LYS A 435 -7.612 3.732 -15.632 1.00 34.11 H new ATOM 0 HB2 LYS A 435 -5.172 2.725 -14.976 1.00 32.33 H new ATOM 0 HB3 LYS A 435 -6.665 1.900 -14.576 1.00 32.33 H new ATOM 0 HG2 LYS A 435 -6.514 0.530 -16.639 1.00 45.44 H new ATOM 0 HG3 LYS A 435 -5.099 1.421 -17.165 1.00 45.44 H new ATOM 0 HD2 LYS A 435 -5.247 -0.192 -14.565 1.00 63.41 H new ATOM 0 HD3 LYS A 435 -4.540 -0.790 -16.053 1.00 63.41 H new ATOM 0 HE2 LYS A 435 -3.144 1.526 -15.898 1.00 73.34 H new ATOM 0 HE3 LYS A 435 -3.512 1.361 -14.192 1.00 73.34 H new ATOM 0 HZ1 LYS A 435 -1.439 0.241 -14.753 1.00 41.12 H new ATOM 0 HZ2 LYS A 435 -2.593 -0.894 -14.239 1.00 41.12 H new ATOM 0 HZ3 LYS A 435 -2.236 -0.735 -15.892 1.00 41.12 H new ATOM 800 N LEU A 436 -6.141 5.597 -16.305 1.00 44.04 N ATOM 801 CA LEU A 436 -5.304 6.735 -16.694 1.00 4.44 C ATOM 802 C LEU A 436 -4.748 7.416 -15.450 1.00 25.43 C ATOM 803 O LEU A 436 -5.465 7.619 -14.470 1.00 53.44 O ATOM 804 CB LEU A 436 -6.121 7.746 -17.512 1.00 74.23 C ATOM 805 CG LEU A 436 -6.223 7.280 -18.975 1.00 74.33 C ATOM 806 CD1 LEU A 436 -7.481 7.870 -19.619 1.00 51.21 C ATOM 807 CD2 LEU A 436 -4.994 7.752 -19.762 1.00 50.52 C ATOM 0 H LEU A 436 -6.910 5.835 -15.679 1.00 44.04 H new ATOM 0 HA LEU A 436 -4.481 6.368 -17.307 1.00 4.44 H new ATOM 0 HB2 LEU A 436 -7.118 7.851 -17.085 1.00 74.23 H new ATOM 0 HB3 LEU A 436 -5.650 8.728 -17.467 1.00 74.23 H new ATOM 0 HG LEU A 436 -6.273 6.191 -18.994 1.00 74.33 H new ATOM 0 HD11 LEU A 436 -7.550 7.538 -20.655 1.00 51.21 H new ATOM 0 HD12 LEU A 436 -8.362 7.535 -19.071 1.00 51.21 H new ATOM 0 HD13 LEU A 436 -7.428 8.958 -19.590 1.00 51.21 H new ATOM 0 HD21 LEU A 436 -5.074 7.418 -20.796 1.00 50.52 H new ATOM 0 HD22 LEU A 436 -4.941 8.840 -19.735 1.00 50.52 H new ATOM 0 HD23 LEU A 436 -4.093 7.334 -19.314 1.00 50.52 H new ATOM 819 N ARG A 437 -3.461 7.749 -15.485 1.00 62.41 N ATOM 820 CA ARG A 437 -2.812 8.386 -14.342 1.00 11.24 C ATOM 821 C ARG A 437 -2.693 9.893 -14.540 1.00 25.52 C ATOM 822 O ARG A 437 -2.383 10.373 -15.629 1.00 53.14 O ATOM 823 CB ARG A 437 -1.418 7.789 -14.140 1.00 62.41 C ATOM 824 CG ARG A 437 -0.556 8.077 -15.370 1.00 15.34 C ATOM 825 CD ARG A 437 0.746 7.281 -15.279 1.00 23.51 C ATOM 826 NE ARG A 437 1.445 7.598 -14.038 1.00 31.31 N ATOM 827 CZ ARG A 437 2.053 8.768 -13.871 1.00 53.30 C ATOM 828 NH1 ARG A 437 2.030 9.657 -14.826 1.00 12.42 N ATOM 829 NH2 ARG A 437 2.672 9.028 -12.752 1.00 33.11 N ATOM 0 H ARG A 437 -2.850 7.590 -16.286 1.00 62.41 H new ATOM 0 HA ARG A 437 -3.427 8.203 -13.461 1.00 11.24 H new ATOM 0 HB2 ARG A 437 -0.954 8.214 -13.250 1.00 62.41 H new ATOM 0 HB3 ARG A 437 -1.491 6.714 -13.978 1.00 62.41 H new ATOM 0 HG2 ARG A 437 -1.097 7.807 -16.277 1.00 15.34 H new ATOM 0 HG3 ARG A 437 -0.339 9.143 -15.433 1.00 15.34 H new ATOM 0 HD2 ARG A 437 0.532 6.213 -15.322 1.00 23.51 H new ATOM 0 HD3 ARG A 437 1.383 7.513 -16.133 1.00 23.51 H new ATOM 0 HE ARG A 437 1.467 6.910 -13.286 1.00 31.31 H new ATOM 0 HH11 ARG A 437 1.545 9.454 -15.700 1.00 12.42 H new ATOM 0 HH12 ARG A 437 2.496 10.555 -14.698 1.00 12.42 H new ATOM 0 HH21 ARG A 437 2.689 8.333 -12.005 1.00 33.11 H new ATOM 0 HH22 ARG A 437 3.139 9.926 -12.624 1.00 33.11 H new ATOM 843 N THR A 438 -2.952 10.623 -13.462 1.00 31.11 N ATOM 844 CA THR A 438 -2.889 12.080 -13.475 1.00 54.11 C ATOM 845 C THR A 438 -1.482 12.559 -13.115 1.00 23.14 C ATOM 846 O THR A 438 -0.614 11.759 -12.766 1.00 33.23 O ATOM 847 CB THR A 438 -3.899 12.615 -12.450 1.00 24.24 C ATOM 848 OG1 THR A 438 -4.923 11.648 -12.267 1.00 5.12 O ATOM 849 CG2 THR A 438 -4.526 13.923 -12.935 1.00 10.23 C ATOM 0 H THR A 438 -3.210 10.225 -12.559 1.00 31.11 H new ATOM 0 HA THR A 438 -3.128 12.449 -14.472 1.00 54.11 H new ATOM 0 HB THR A 438 -3.380 12.806 -11.511 1.00 24.24 H new ATOM 0 HG1 THR A 438 -5.799 12.079 -12.353 1.00 5.12 H new ATOM 0 HG21 THR A 438 -5.238 14.283 -12.192 1.00 10.23 H new ATOM 0 HG22 THR A 438 -3.745 14.669 -13.080 1.00 10.23 H new ATOM 0 HG23 THR A 438 -5.043 13.751 -13.879 1.00 10.23 H new ATOM 857 N LYS A 439 -1.273 13.868 -13.190 1.00 0.13 N ATOM 858 CA LYS A 439 0.020 14.448 -12.854 1.00 45.04 C ATOM 859 C LYS A 439 0.262 14.338 -11.351 1.00 71.11 C ATOM 860 O LYS A 439 -0.684 14.179 -10.578 1.00 73.03 O ATOM 861 CB LYS A 439 0.047 15.916 -13.282 1.00 2.51 C ATOM 862 CG LYS A 439 0.272 16.010 -14.794 1.00 35.43 C ATOM 863 CD LYS A 439 0.129 17.465 -15.242 1.00 41.21 C ATOM 864 CE LYS A 439 0.298 17.551 -16.759 1.00 15.11 C ATOM 865 NZ LYS A 439 1.506 16.781 -17.170 1.00 61.11 N ATOM 0 H LYS A 439 -1.979 14.545 -13.479 1.00 0.13 H new ATOM 0 HA LYS A 439 0.807 13.906 -13.379 1.00 45.04 H new ATOM 0 HB2 LYS A 439 -0.892 16.400 -13.014 1.00 2.51 H new ATOM 0 HB3 LYS A 439 0.840 16.444 -12.753 1.00 2.51 H new ATOM 0 HG2 LYS A 439 1.264 15.636 -15.049 1.00 35.43 H new ATOM 0 HG3 LYS A 439 -0.449 15.384 -15.319 1.00 35.43 H new ATOM 0 HD2 LYS A 439 -0.848 17.851 -14.952 1.00 41.21 H new ATOM 0 HD3 LYS A 439 0.877 18.084 -14.747 1.00 41.21 H new ATOM 0 HE2 LYS A 439 -0.586 17.153 -17.257 1.00 15.11 H new ATOM 0 HE3 LYS A 439 0.396 18.592 -17.066 1.00 15.11 H new ATOM 0 HZ1 LYS A 439 1.799 17.077 -18.123 1.00 61.11 H new ATOM 0 HZ2 LYS A 439 2.279 16.963 -16.498 1.00 61.11 H new ATOM 0 HZ3 LYS A 439 1.285 15.765 -17.176 1.00 61.11 H new ATOM 879 N THR A 440 1.528 14.410 -10.937 1.00 23.10 N ATOM 880 CA THR A 440 1.872 14.301 -9.516 1.00 64.31 C ATOM 881 C THR A 440 2.474 15.599 -8.986 1.00 73.20 C ATOM 882 O THR A 440 3.462 16.104 -9.519 1.00 4.12 O ATOM 883 CB THR A 440 2.878 13.162 -9.317 1.00 51.51 C ATOM 884 OG1 THR A 440 2.279 11.932 -9.701 1.00 70.53 O ATOM 885 CG2 THR A 440 3.300 13.090 -7.844 1.00 51.03 C ATOM 0 H THR A 440 2.326 14.542 -11.558 1.00 23.10 H new ATOM 0 HA THR A 440 0.955 14.097 -8.963 1.00 64.31 H new ATOM 0 HB THR A 440 3.759 13.348 -9.932 1.00 51.51 H new ATOM 0 HG1 THR A 440 2.921 11.202 -9.576 1.00 70.53 H new ATOM 0 HG21 THR A 440 4.015 12.278 -7.710 1.00 51.03 H new ATOM 0 HG22 THR A 440 3.762 14.033 -7.551 1.00 51.03 H new ATOM 0 HG23 THR A 440 2.423 12.908 -7.223 1.00 51.03 H new ATOM 893 N LEU A 441 1.877 16.121 -7.915 1.00 72.31 N ATOM 894 CA LEU A 441 2.354 17.343 -7.289 1.00 4.04 C ATOM 895 C LEU A 441 3.281 16.987 -6.131 1.00 33.32 C ATOM 896 O LEU A 441 3.183 15.902 -5.561 1.00 0.20 O ATOM 897 CB LEU A 441 1.155 18.152 -6.779 1.00 73.30 C ATOM 898 CG LEU A 441 0.551 18.961 -7.930 1.00 63.15 C ATOM 899 CD1 LEU A 441 0.001 18.006 -8.992 1.00 53.42 C ATOM 900 CD2 LEU A 441 -0.584 19.840 -7.398 1.00 32.44 C ATOM 0 H LEU A 441 1.059 15.711 -7.465 1.00 72.31 H new ATOM 0 HA LEU A 441 2.905 17.942 -8.014 1.00 4.04 H new ATOM 0 HB2 LEU A 441 0.404 17.482 -6.359 1.00 73.30 H new ATOM 0 HB3 LEU A 441 1.470 18.821 -5.978 1.00 73.30 H new ATOM 0 HG LEU A 441 1.322 19.592 -8.372 1.00 63.15 H new ATOM 0 HD11 LEU A 441 -0.429 18.582 -9.811 1.00 53.42 H new ATOM 0 HD12 LEU A 441 0.809 17.381 -9.373 1.00 53.42 H new ATOM 0 HD13 LEU A 441 -0.769 17.374 -8.549 1.00 53.42 H new ATOM 0 HD21 LEU A 441 -1.013 20.416 -8.218 1.00 32.44 H new ATOM 0 HD22 LEU A 441 -1.355 19.210 -6.954 1.00 32.44 H new ATOM 0 HD23 LEU A 441 -0.193 20.521 -6.642 1.00 32.44 H new ATOM 912 N ARG A 442 4.200 17.894 -5.812 1.00 31.41 N ATOM 913 CA ARG A 442 5.170 17.651 -4.738 1.00 74.32 C ATOM 914 C ARG A 442 5.032 18.653 -3.590 1.00 21.34 C ATOM 915 O ARG A 442 4.557 19.774 -3.772 1.00 73.05 O ATOM 916 CB ARG A 442 6.588 17.736 -5.305 1.00 40.20 C ATOM 917 CG ARG A 442 6.807 19.114 -5.931 1.00 45.02 C ATOM 918 CD ARG A 442 8.140 19.128 -6.681 1.00 61.25 C ATOM 919 NE ARG A 442 9.188 18.530 -5.862 1.00 32.24 N ATOM 920 CZ ARG A 442 10.355 18.175 -6.390 1.00 71.14 C ATOM 921 NH1 ARG A 442 10.578 18.360 -7.662 1.00 34.52 N ATOM 922 NH2 ARG A 442 11.276 17.642 -5.635 1.00 64.22 N ATOM 0 H ARG A 442 4.297 18.798 -6.275 1.00 31.41 H new ATOM 0 HA ARG A 442 4.970 16.657 -4.338 1.00 74.32 H new ATOM 0 HB2 ARG A 442 7.318 17.564 -4.514 1.00 40.20 H new ATOM 0 HB3 ARG A 442 6.739 16.957 -6.053 1.00 40.20 H new ATOM 0 HG2 ARG A 442 5.991 19.349 -6.614 1.00 45.02 H new ATOM 0 HG3 ARG A 442 6.805 19.881 -5.157 1.00 45.02 H new ATOM 0 HD2 ARG A 442 8.044 18.579 -7.618 1.00 61.25 H new ATOM 0 HD3 ARG A 442 8.410 20.152 -6.938 1.00 61.25 H new ATOM 0 HE ARG A 442 9.023 18.382 -4.867 1.00 32.24 H new ATOM 0 HH11 ARG A 442 9.857 18.777 -8.251 1.00 34.52 H new ATOM 0 HH12 ARG A 442 11.473 18.088 -8.068 1.00 34.52 H new ATOM 0 HH21 ARG A 442 11.100 17.498 -4.641 1.00 64.22 H new ATOM 0 HH22 ARG A 442 12.172 17.369 -6.039 1.00 64.22 H new ATOM 936 N ASN A 443 5.487 18.227 -2.411 1.00 24.52 N ATOM 937 CA ASN A 443 5.460 19.064 -1.212 1.00 43.41 C ATOM 938 C ASN A 443 4.175 19.882 -1.104 1.00 2.01 C ATOM 939 O ASN A 443 4.155 21.063 -1.450 1.00 15.14 O ATOM 940 CB ASN A 443 6.661 20.010 -1.219 1.00 24.23 C ATOM 941 CG ASN A 443 7.957 19.208 -1.274 1.00 53.02 C ATOM 942 OD1 ASN A 443 7.990 18.005 -0.767 1.00 51.13 O flip ATOM 943 ND2 ASN A 443 8.964 19.689 -1.791 1.00 40.41 N flip ATOM 0 H ASN A 443 5.882 17.299 -2.261 1.00 24.52 H new ATOM 0 HA ASN A 443 5.503 18.398 -0.350 1.00 43.41 H new ATOM 0 HB2 ASN A 443 6.602 20.680 -2.077 1.00 24.23 H new ATOM 0 HB3 ASN A 443 6.648 20.634 -0.326 1.00 24.23 H new ATOM 0 HD21 ASN A 443 8.935 20.629 -2.186 1.00 40.41 H new ATOM 0 HD22 ASN A 443 9.828 19.148 -1.825 1.00 40.41 H new ATOM 950 N THR A 444 3.108 19.258 -0.609 1.00 24.04 N ATOM 951 CA THR A 444 1.837 19.965 -0.453 1.00 13.44 C ATOM 952 C THR A 444 0.950 19.296 0.597 1.00 65.43 C ATOM 953 O THR A 444 1.316 18.281 1.185 1.00 2.51 O ATOM 954 CB THR A 444 1.087 20.014 -1.786 1.00 52.24 C ATOM 955 OG1 THR A 444 -0.268 20.377 -1.548 1.00 75.00 O ATOM 956 CG2 THR A 444 1.142 18.640 -2.457 1.00 60.02 C ATOM 0 H THR A 444 3.095 18.282 -0.313 1.00 24.04 H new ATOM 0 HA THR A 444 2.066 20.978 -0.122 1.00 13.44 H new ATOM 0 HB THR A 444 1.552 20.751 -2.441 1.00 52.24 H new ATOM 0 HG1 THR A 444 -0.337 21.352 -1.473 1.00 75.00 H new ATOM 0 HG21 THR A 444 0.607 18.677 -3.406 1.00 60.02 H new ATOM 0 HG22 THR A 444 2.181 18.364 -2.636 1.00 60.02 H new ATOM 0 HG23 THR A 444 0.677 17.899 -1.807 1.00 60.02 H new ATOM 964 N ARG A 445 -0.222 19.884 0.815 1.00 23.24 N ATOM 965 CA ARG A 445 -1.187 19.363 1.782 1.00 50.23 C ATOM 966 C ARG A 445 -2.596 19.699 1.308 1.00 75.31 C ATOM 967 O ARG A 445 -3.591 19.183 1.827 1.00 20.31 O ATOM 968 CB ARG A 445 -0.942 19.981 3.160 1.00 44.14 C ATOM 969 CG ARG A 445 0.465 19.619 3.640 1.00 31.31 C ATOM 970 CD ARG A 445 0.601 19.959 5.124 1.00 60.23 C ATOM 971 NE ARG A 445 0.367 21.383 5.339 1.00 31.02 N ATOM 972 CZ ARG A 445 0.302 21.891 6.566 1.00 14.30 C ATOM 973 NH1 ARG A 445 0.449 21.113 7.603 1.00 50.24 N ATOM 974 NH2 ARG A 445 0.091 23.169 6.733 1.00 22.22 N ATOM 0 H ARG A 445 -0.530 20.728 0.332 1.00 23.24 H new ATOM 0 HA ARG A 445 -1.072 18.282 1.861 1.00 50.23 H new ATOM 0 HB2 ARG A 445 -1.053 21.064 3.109 1.00 44.14 H new ATOM 0 HB3 ARG A 445 -1.685 19.618 3.870 1.00 44.14 H new ATOM 0 HG2 ARG A 445 0.653 18.557 3.481 1.00 31.31 H new ATOM 0 HG3 ARG A 445 1.210 20.165 3.061 1.00 31.31 H new ATOM 0 HD2 ARG A 445 -0.112 19.374 5.705 1.00 60.23 H new ATOM 0 HD3 ARG A 445 1.597 19.690 5.476 1.00 60.23 H new ATOM 0 HE ARG A 445 0.251 21.999 4.534 1.00 31.02 H new ATOM 0 HH11 ARG A 445 0.614 20.115 7.472 1.00 50.24 H new ATOM 0 HH12 ARG A 445 0.399 21.503 8.544 1.00 50.24 H new ATOM 0 HH21 ARG A 445 -0.024 23.777 5.922 1.00 22.22 H new ATOM 0 HH22 ARG A 445 0.041 23.559 7.674 1.00 22.22 H new ATOM 988 N ASN A 446 -2.651 20.575 0.306 1.00 72.21 N ATOM 989 CA ASN A 446 -3.904 21.019 -0.289 1.00 43.52 C ATOM 990 C ASN A 446 -3.653 21.289 -1.774 1.00 20.41 C ATOM 991 O ASN A 446 -3.504 22.437 -2.195 1.00 72.12 O ATOM 992 CB ASN A 446 -4.375 22.295 0.417 1.00 22.51 C ATOM 993 CG ASN A 446 -5.885 22.451 0.275 1.00 34.34 C ATOM 994 OD1 ASN A 446 -6.369 22.942 -0.745 1.00 2.44 O ATOM 995 ND2 ASN A 446 -6.661 22.061 1.250 1.00 13.10 N ATOM 0 H ASN A 446 -1.823 20.996 -0.115 1.00 72.21 H new ATOM 0 HA ASN A 446 -4.678 20.259 -0.180 1.00 43.52 H new ATOM 0 HB2 ASN A 446 -4.104 22.256 1.472 1.00 22.51 H new ATOM 0 HB3 ASN A 446 -3.871 23.162 -0.010 1.00 22.51 H new ATOM 0 HD21 ASN A 446 -7.673 22.163 1.168 1.00 13.10 H new ATOM 0 HD22 ASN A 446 -6.256 21.655 2.093 1.00 13.10 H new ATOM 1002 N PRO A 447 -3.541 20.245 -2.553 1.00 12.41 N ATOM 1003 CA PRO A 447 -3.226 20.337 -4.009 1.00 10.03 C ATOM 1004 C PRO A 447 -4.433 20.553 -4.917 1.00 14.23 C ATOM 1005 O PRO A 447 -5.545 20.113 -4.628 1.00 31.12 O ATOM 1006 CB PRO A 447 -2.601 18.971 -4.282 1.00 72.20 C ATOM 1007 CG PRO A 447 -3.365 18.042 -3.398 1.00 64.41 C ATOM 1008 CD PRO A 447 -3.705 18.843 -2.135 1.00 12.45 C ATOM 0 HA PRO A 447 -2.597 21.201 -4.223 1.00 10.03 H new ATOM 0 HB2 PRO A 447 -2.695 18.691 -5.331 1.00 72.20 H new ATOM 0 HB3 PRO A 447 -1.537 18.964 -4.044 1.00 72.20 H new ATOM 0 HG2 PRO A 447 -4.271 17.690 -3.892 1.00 64.41 H new ATOM 0 HG3 PRO A 447 -2.772 17.161 -3.153 1.00 64.41 H new ATOM 0 HD2 PRO A 447 -4.721 18.643 -1.796 1.00 12.45 H new ATOM 0 HD3 PRO A 447 -3.039 18.591 -1.310 1.00 12.45 H new ATOM 1016 N VAL A 448 -4.166 21.210 -6.043 1.00 11.32 N ATOM 1017 CA VAL A 448 -5.179 21.475 -7.057 1.00 1.23 C ATOM 1018 C VAL A 448 -4.686 20.917 -8.386 1.00 35.52 C ATOM 1019 O VAL A 448 -3.670 21.366 -8.917 1.00 44.35 O ATOM 1020 CB VAL A 448 -5.428 22.980 -7.177 1.00 23.22 C ATOM 1021 CG1 VAL A 448 -6.329 23.253 -8.391 1.00 64.45 C ATOM 1022 CG2 VAL A 448 -6.106 23.495 -5.893 1.00 74.33 C ATOM 0 H VAL A 448 -3.242 21.573 -6.277 1.00 11.32 H new ATOM 0 HA VAL A 448 -6.118 20.997 -6.777 1.00 1.23 H new ATOM 0 HB VAL A 448 -4.478 23.498 -7.311 1.00 23.22 H new ATOM 0 HG11 VAL A 448 -6.507 24.325 -8.478 1.00 64.45 H new ATOM 0 HG12 VAL A 448 -5.840 22.892 -9.296 1.00 64.45 H new ATOM 0 HG13 VAL A 448 -7.280 22.736 -8.262 1.00 64.45 H new ATOM 0 HG21 VAL A 448 -6.283 24.567 -5.980 1.00 74.33 H new ATOM 0 HG22 VAL A 448 -7.057 22.981 -5.752 1.00 74.33 H new ATOM 0 HG23 VAL A 448 -5.459 23.302 -5.037 1.00 74.33 H new ATOM 1032 N TRP A 449 -5.385 19.914 -8.908 1.00 54.24 N ATOM 1033 CA TRP A 449 -4.968 19.286 -10.159 1.00 63.24 C ATOM 1034 C TRP A 449 -5.544 20.002 -11.371 1.00 12.04 C ATOM 1035 O TRP A 449 -4.815 20.315 -12.313 1.00 34.41 O ATOM 1036 CB TRP A 449 -5.405 17.818 -10.170 1.00 53.40 C ATOM 1037 CG TRP A 449 -4.483 17.017 -9.307 1.00 13.11 C ATOM 1038 CD1 TRP A 449 -3.183 16.764 -9.586 1.00 53.33 C ATOM 1039 CD2 TRP A 449 -4.763 16.367 -8.035 1.00 51.22 C ATOM 1040 NE1 TRP A 449 -2.649 15.998 -8.565 1.00 70.52 N ATOM 1041 CE2 TRP A 449 -3.584 15.728 -7.587 1.00 64.25 C ATOM 1042 CE3 TRP A 449 -5.915 16.270 -7.234 1.00 61.42 C ATOM 1043 CZ2 TRP A 449 -3.548 15.017 -6.391 1.00 2.32 C ATOM 1044 CZ3 TRP A 449 -5.881 15.555 -6.026 1.00 34.33 C ATOM 1045 CH2 TRP A 449 -4.700 14.930 -5.606 1.00 10.22 C ATOM 0 H TRP A 449 -6.230 19.523 -8.493 1.00 54.24 H new ATOM 0 HA TRP A 449 -3.882 19.352 -10.219 1.00 63.24 H new ATOM 0 HB2 TRP A 449 -6.429 17.730 -9.807 1.00 53.40 H new ATOM 0 HB3 TRP A 449 -5.394 17.432 -11.189 1.00 53.40 H new ATOM 0 HD1 TRP A 449 -2.650 17.104 -10.462 1.00 53.33 H new ATOM 0 HE1 TRP A 449 -1.683 15.673 -8.539 1.00 70.52 H new ATOM 0 HE3 TRP A 449 -6.831 16.748 -7.550 1.00 61.42 H new ATOM 0 HZ2 TRP A 449 -2.635 14.536 -6.072 1.00 2.32 H new ATOM 0 HZ3 TRP A 449 -6.770 15.487 -5.417 1.00 34.33 H new ATOM 0 HH2 TRP A 449 -4.680 14.381 -4.676 1.00 10.22 H new ATOM 1056 N ASN A 450 -6.850 20.251 -11.364 1.00 73.22 N ATOM 1057 CA ASN A 450 -7.479 20.918 -12.497 1.00 34.35 C ATOM 1058 C ASN A 450 -6.966 20.310 -13.791 1.00 34.52 C ATOM 1059 O ASN A 450 -6.569 21.016 -14.719 1.00 22.41 O ATOM 1060 CB ASN A 450 -7.162 22.403 -12.460 1.00 64.30 C ATOM 1061 CG ASN A 450 -7.938 23.136 -13.550 1.00 41.54 C ATOM 1062 OD1 ASN A 450 -8.611 22.503 -14.364 1.00 22.33 O ATOM 1063 ND2 ASN A 450 -7.885 24.437 -13.613 1.00 52.45 N ATOM 0 H ASN A 450 -7.482 20.006 -10.602 1.00 73.22 H new ATOM 0 HA ASN A 450 -8.560 20.786 -12.442 1.00 34.35 H new ATOM 0 HB2 ASN A 450 -7.419 22.813 -11.483 1.00 64.30 H new ATOM 0 HB3 ASN A 450 -6.092 22.557 -12.599 1.00 64.30 H new ATOM 0 HD21 ASN A 450 -8.402 24.934 -14.338 1.00 52.45 H new ATOM 0 HD22 ASN A 450 -7.326 24.958 -12.937 1.00 52.45 H new ATOM 1070 N GLU A 451 -6.979 18.987 -13.829 1.00 54.51 N ATOM 1071 CA GLU A 451 -6.517 18.239 -14.993 1.00 13.40 C ATOM 1072 C GLU A 451 -7.689 17.546 -15.675 1.00 62.10 C ATOM 1073 O GLU A 451 -8.634 17.105 -15.014 1.00 63.13 O ATOM 1074 CB GLU A 451 -5.486 17.195 -14.562 1.00 15.53 C ATOM 1075 CG GLU A 451 -5.076 16.353 -15.772 1.00 11.41 C ATOM 1076 CD GLU A 451 -3.729 15.684 -15.518 1.00 51.31 C ATOM 1077 OE1 GLU A 451 -2.828 16.365 -15.062 1.00 32.53 O ATOM 1078 OE2 GLU A 451 -3.620 14.497 -15.785 1.00 34.41 O ATOM 0 H GLU A 451 -7.307 18.402 -13.060 1.00 54.51 H new ATOM 0 HA GLU A 451 -6.058 18.934 -15.696 1.00 13.40 H new ATOM 0 HB2 GLU A 451 -4.612 17.686 -14.135 1.00 15.53 H new ATOM 0 HB3 GLU A 451 -5.904 16.555 -13.785 1.00 15.53 H new ATOM 0 HG2 GLU A 451 -5.834 15.596 -15.971 1.00 11.41 H new ATOM 0 HG3 GLU A 451 -5.015 16.984 -16.659 1.00 11.41 H new ATOM 1085 N THR A 452 -7.620 17.458 -17.003 1.00 74.20 N ATOM 1086 CA THR A 452 -8.680 16.826 -17.787 1.00 22.31 C ATOM 1087 C THR A 452 -8.227 15.484 -18.354 1.00 5.33 C ATOM 1088 O THR A 452 -7.457 15.434 -19.313 1.00 51.01 O ATOM 1089 CB THR A 452 -9.083 17.746 -18.942 1.00 50.30 C ATOM 1090 OG1 THR A 452 -9.602 18.961 -18.420 1.00 13.24 O ATOM 1091 CG2 THR A 452 -10.147 17.060 -19.801 1.00 71.53 C ATOM 0 H THR A 452 -6.842 17.816 -17.558 1.00 74.20 H new ATOM 0 HA THR A 452 -9.530 16.654 -17.126 1.00 22.31 H new ATOM 0 HB THR A 452 -8.208 17.959 -19.557 1.00 50.30 H new ATOM 0 HG1 THR A 452 -9.859 19.551 -19.159 1.00 13.24 H new ATOM 0 HG21 THR A 452 -10.431 17.718 -20.622 1.00 71.53 H new ATOM 0 HG22 THR A 452 -9.746 16.130 -20.204 1.00 71.53 H new ATOM 0 HG23 THR A 452 -11.023 16.843 -19.190 1.00 71.53 H new ATOM 1099 N LEU A 453 -8.734 14.399 -17.773 1.00 20.24 N ATOM 1100 CA LEU A 453 -8.405 13.062 -18.245 1.00 44.22 C ATOM 1101 C LEU A 453 -9.481 12.608 -19.231 1.00 5.33 C ATOM 1102 O LEU A 453 -10.673 12.705 -18.939 1.00 42.14 O ATOM 1103 CB LEU A 453 -8.337 12.102 -17.055 1.00 10.01 C ATOM 1104 CG LEU A 453 -7.001 12.268 -16.321 1.00 62.24 C ATOM 1105 CD1 LEU A 453 -7.035 11.473 -15.011 1.00 24.21 C ATOM 1106 CD2 LEU A 453 -5.836 11.765 -17.196 1.00 65.25 C ATOM 0 H LEU A 453 -9.372 14.422 -16.977 1.00 20.24 H new ATOM 0 HA LEU A 453 -7.436 13.068 -18.745 1.00 44.22 H new ATOM 0 HB2 LEU A 453 -9.163 12.298 -16.372 1.00 10.01 H new ATOM 0 HB3 LEU A 453 -8.446 11.074 -17.400 1.00 10.01 H new ATOM 0 HG LEU A 453 -6.848 13.326 -16.108 1.00 62.24 H new ATOM 0 HD11 LEU A 453 -6.085 11.591 -14.489 1.00 24.21 H new ATOM 0 HD12 LEU A 453 -7.844 11.844 -14.381 1.00 24.21 H new ATOM 0 HD13 LEU A 453 -7.200 10.418 -15.230 1.00 24.21 H new ATOM 0 HD21 LEU A 453 -4.896 11.891 -16.658 1.00 65.25 H new ATOM 0 HD22 LEU A 453 -5.983 10.710 -17.427 1.00 65.25 H new ATOM 0 HD23 LEU A 453 -5.803 12.338 -18.123 1.00 65.25 H new ATOM 1118 N GLN A 454 -9.061 12.151 -20.411 1.00 64.34 N ATOM 1119 CA GLN A 454 -10.012 11.728 -21.443 1.00 3.21 C ATOM 1120 C GLN A 454 -9.959 10.224 -21.700 1.00 3.35 C ATOM 1121 O GLN A 454 -8.885 9.640 -21.841 1.00 30.14 O ATOM 1122 CB GLN A 454 -9.711 12.473 -22.746 1.00 60.35 C ATOM 1123 CG GLN A 454 -10.635 11.966 -23.858 1.00 11.53 C ATOM 1124 CD GLN A 454 -10.646 12.955 -25.019 1.00 71.42 C ATOM 1125 OE1 GLN A 454 -11.702 13.239 -25.584 1.00 72.15 O ATOM 1126 NE2 GLN A 454 -9.526 13.498 -25.412 1.00 34.31 N ATOM 0 H GLN A 454 -8.080 12.064 -20.676 1.00 64.34 H new ATOM 0 HA GLN A 454 -11.013 11.967 -21.084 1.00 3.21 H new ATOM 0 HB2 GLN A 454 -9.852 13.545 -22.604 1.00 60.35 H new ATOM 0 HB3 GLN A 454 -8.669 12.323 -23.029 1.00 60.35 H new ATOM 0 HG2 GLN A 454 -10.298 10.989 -24.205 1.00 11.53 H new ATOM 0 HG3 GLN A 454 -11.646 11.836 -23.471 1.00 11.53 H new ATOM 0 HE21 GLN A 454 -8.652 13.261 -24.942 1.00 34.31 H new ATOM 0 HE22 GLN A 454 -9.525 14.159 -26.189 1.00 34.31 H new ATOM 1135 N TYR A 455 -11.144 9.618 -21.789 1.00 23.04 N ATOM 1136 CA TYR A 455 -11.263 8.188 -22.065 1.00 53.03 C ATOM 1137 C TYR A 455 -11.890 8.000 -23.446 1.00 74.30 C ATOM 1138 O TYR A 455 -13.105 8.148 -23.615 1.00 43.22 O ATOM 1139 CB TYR A 455 -12.146 7.509 -21.000 1.00 12.22 C ATOM 1140 CG TYR A 455 -11.291 6.884 -19.916 1.00 73.11 C ATOM 1141 CD1 TYR A 455 -10.378 5.871 -20.242 1.00 12.21 C ATOM 1142 CD2 TYR A 455 -11.418 7.309 -18.587 1.00 1.23 C ATOM 1143 CE1 TYR A 455 -9.595 5.287 -19.239 1.00 65.31 C ATOM 1144 CE2 TYR A 455 -10.634 6.725 -17.587 1.00 74.32 C ATOM 1145 CZ TYR A 455 -9.723 5.713 -17.911 1.00 71.23 C ATOM 1146 OH TYR A 455 -8.951 5.138 -16.924 1.00 3.14 O ATOM 0 H TYR A 455 -12.037 10.098 -21.673 1.00 23.04 H new ATOM 0 HA TYR A 455 -10.273 7.732 -22.039 1.00 53.03 H new ATOM 0 HB2 TYR A 455 -12.822 8.242 -20.560 1.00 12.22 H new ATOM 0 HB3 TYR A 455 -12.766 6.744 -21.468 1.00 12.22 H new ATOM 0 HD1 TYR A 455 -10.279 5.542 -21.266 1.00 12.21 H new ATOM 0 HD2 TYR A 455 -12.122 8.088 -18.335 1.00 1.23 H new ATOM 0 HE1 TYR A 455 -8.891 4.507 -19.490 1.00 65.31 H new ATOM 0 HE2 TYR A 455 -10.732 7.055 -16.563 1.00 74.32 H new ATOM 0 HH TYR A 455 -9.433 4.381 -16.531 1.00 3.14 H new ATOM 1156 N HIS A 456 -11.051 7.686 -24.432 1.00 74.41 N ATOM 1157 CA HIS A 456 -11.519 7.487 -25.797 1.00 15.45 C ATOM 1158 C HIS A 456 -11.699 6.001 -26.086 1.00 52.50 C ATOM 1159 O HIS A 456 -10.769 5.209 -25.935 1.00 33.43 O ATOM 1160 CB HIS A 456 -10.510 8.091 -26.776 1.00 33.23 C ATOM 1161 CG HIS A 456 -9.114 7.896 -26.250 1.00 12.24 C ATOM 1162 ND1 HIS A 456 -8.453 8.439 -25.177 1.00 65.35 N flip ATOM 1163 CD2 HIS A 456 -8.210 7.037 -26.856 1.00 43.54 C flip ATOM 1164 CE1 HIS A 456 -7.160 7.928 -25.116 1.00 2.12 C flip ATOM 1165 NE2 HIS A 456 -7.066 7.089 -26.150 1.00 51.34 N flip ATOM 0 H HIS A 456 -10.046 7.565 -24.308 1.00 74.41 H new ATOM 0 HA HIS A 456 -12.483 7.982 -25.917 1.00 15.45 H new ATOM 0 HB2 HIS A 456 -10.610 7.619 -27.753 1.00 33.23 H new ATOM 0 HB3 HIS A 456 -10.712 9.153 -26.913 1.00 33.23 H new ATOM 0 HD2 HIS A 456 -8.391 6.436 -27.735 1.00 43.54 H new ATOM 0 HE1 HIS A 456 -6.397 8.160 -24.388 1.00 2.12 H new ATOM 0 HE2 HIS A 456 -6.229 6.553 -26.377 1.00 51.34 H new ATOM 1174 N GLY A 457 -12.909 5.634 -26.494 1.00 61.32 N ATOM 1175 CA GLY A 457 -13.226 4.241 -26.798 1.00 3.15 C ATOM 1176 C GLY A 457 -14.436 3.797 -25.990 1.00 44.30 C ATOM 1177 O GLY A 457 -14.844 2.637 -26.042 1.00 44.44 O ATOM 0 H GLY A 457 -13.687 6.281 -26.622 1.00 61.32 H new ATOM 0 HA2 GLY A 457 -13.428 4.129 -27.863 1.00 3.15 H new ATOM 0 HA3 GLY A 457 -12.371 3.606 -26.567 1.00 3.15 H new ATOM 1181 N ILE A 458 -15.010 4.739 -25.247 1.00 22.13 N ATOM 1182 CA ILE A 458 -16.178 4.455 -24.429 1.00 11.42 C ATOM 1183 C ILE A 458 -17.447 4.572 -25.266 1.00 2.03 C ATOM 1184 O ILE A 458 -17.529 5.401 -26.172 1.00 42.21 O ATOM 1185 CB ILE A 458 -16.241 5.447 -23.267 1.00 60.40 C ATOM 1186 CG1 ILE A 458 -14.906 5.460 -22.512 1.00 62.43 C ATOM 1187 CG2 ILE A 458 -17.366 5.051 -22.308 1.00 62.13 C ATOM 1188 CD1 ILE A 458 -14.509 4.039 -22.102 1.00 11.25 C ATOM 0 H ILE A 458 -14.683 5.704 -25.197 1.00 22.13 H new ATOM 0 HA ILE A 458 -16.101 3.439 -24.041 1.00 11.42 H new ATOM 0 HB ILE A 458 -16.437 6.443 -23.665 1.00 60.40 H new ATOM 0 HG12 ILE A 458 -14.129 5.894 -23.142 1.00 62.43 H new ATOM 0 HG13 ILE A 458 -14.988 6.091 -21.627 1.00 62.43 H new ATOM 0 HG21 ILE A 458 -17.407 5.761 -21.482 1.00 62.13 H new ATOM 0 HG22 ILE A 458 -18.317 5.059 -22.840 1.00 62.13 H new ATOM 0 HG23 ILE A 458 -17.176 4.051 -21.918 1.00 62.13 H new ATOM 0 HD11 ILE A 458 -13.559 4.066 -21.567 1.00 11.25 H new ATOM 0 HD12 ILE A 458 -15.278 3.619 -21.454 1.00 11.25 H new ATOM 0 HD13 ILE A 458 -14.406 3.419 -22.992 1.00 11.25 H new ATOM 1200 N THR A 459 -18.436 3.737 -24.955 1.00 71.24 N ATOM 1201 CA THR A 459 -19.705 3.753 -25.681 1.00 15.22 C ATOM 1202 C THR A 459 -20.870 3.830 -24.702 1.00 42.42 C ATOM 1203 O THR A 459 -20.717 3.537 -23.517 1.00 44.31 O ATOM 1204 CB THR A 459 -19.834 2.485 -26.530 1.00 52.52 C ATOM 1205 OG1 THR A 459 -19.977 1.358 -25.677 1.00 44.24 O ATOM 1206 CG2 THR A 459 -18.585 2.319 -27.396 1.00 43.14 C ATOM 0 H THR A 459 -18.384 3.044 -24.209 1.00 71.24 H new ATOM 0 HA THR A 459 -19.726 4.628 -26.330 1.00 15.22 H new ATOM 0 HB THR A 459 -20.710 2.566 -27.174 1.00 52.52 H new ATOM 0 HG1 THR A 459 -20.061 0.546 -26.219 1.00 44.24 H new ATOM 0 HG21 THR A 459 -18.678 1.416 -28.000 1.00 43.14 H new ATOM 0 HG22 THR A 459 -18.479 3.184 -28.051 1.00 43.14 H new ATOM 0 HG23 THR A 459 -17.706 2.238 -26.756 1.00 43.14 H new ATOM 1214 N GLU A 460 -22.037 4.226 -25.203 1.00 40.24 N ATOM 1215 CA GLU A 460 -23.219 4.335 -24.356 1.00 23.41 C ATOM 1216 C GLU A 460 -23.339 3.111 -23.455 1.00 33.21 C ATOM 1217 O GLU A 460 -23.733 3.217 -22.294 1.00 71.14 O ATOM 1218 CB GLU A 460 -24.474 4.460 -25.222 1.00 72.43 C ATOM 1219 CG GLU A 460 -25.653 4.898 -24.353 1.00 23.32 C ATOM 1220 CD GLU A 460 -26.883 5.133 -25.223 1.00 43.31 C ATOM 1221 OE1 GLU A 460 -26.858 6.064 -26.012 1.00 21.20 O ATOM 1222 OE2 GLU A 460 -27.833 4.378 -25.089 1.00 12.30 O ATOM 0 H GLU A 460 -22.188 4.474 -26.181 1.00 40.24 H new ATOM 0 HA GLU A 460 -23.120 5.225 -23.734 1.00 23.41 H new ATOM 0 HB2 GLU A 460 -24.308 5.184 -26.019 1.00 72.43 H new ATOM 0 HB3 GLU A 460 -24.696 3.506 -25.700 1.00 72.43 H new ATOM 0 HG2 GLU A 460 -25.867 4.135 -23.605 1.00 23.32 H new ATOM 0 HG3 GLU A 460 -25.399 5.811 -23.814 1.00 23.32 H new ATOM 1229 N GLU A 461 -22.995 1.949 -24.002 1.00 54.21 N ATOM 1230 CA GLU A 461 -23.065 0.707 -23.243 1.00 2.12 C ATOM 1231 C GLU A 461 -22.210 0.797 -21.983 1.00 22.34 C ATOM 1232 O GLU A 461 -22.656 0.437 -20.893 1.00 11.43 O ATOM 1233 CB GLU A 461 -22.583 -0.460 -24.108 1.00 22.50 C ATOM 1234 CG GLU A 461 -22.901 -1.785 -23.412 1.00 40.01 C ATOM 1235 CD GLU A 461 -24.408 -2.012 -23.377 1.00 25.14 C ATOM 1236 OE1 GLU A 461 -25.043 -1.798 -24.397 1.00 64.43 O ATOM 1237 OE2 GLU A 461 -24.906 -2.396 -22.332 1.00 2.15 O ATOM 0 H GLU A 461 -22.667 1.842 -24.962 1.00 54.21 H new ATOM 0 HA GLU A 461 -24.102 0.540 -22.951 1.00 2.12 H new ATOM 0 HB2 GLU A 461 -23.067 -0.426 -25.084 1.00 22.50 H new ATOM 0 HB3 GLU A 461 -21.510 -0.378 -24.281 1.00 22.50 H new ATOM 0 HG2 GLU A 461 -22.414 -2.606 -23.938 1.00 40.01 H new ATOM 0 HG3 GLU A 461 -22.503 -1.776 -22.397 1.00 40.01 H new ATOM 1244 N ASP A 462 -20.979 1.277 -22.135 1.00 42.14 N ATOM 1245 CA ASP A 462 -20.075 1.405 -21.000 1.00 74.11 C ATOM 1246 C ASP A 462 -20.567 2.483 -20.041 1.00 60.53 C ATOM 1247 O ASP A 462 -20.472 2.337 -18.824 1.00 74.02 O ATOM 1248 CB ASP A 462 -18.667 1.757 -21.499 1.00 70.12 C ATOM 1249 CG ASP A 462 -17.939 0.496 -21.960 1.00 43.12 C ATOM 1250 OD1 ASP A 462 -18.578 -0.337 -22.582 1.00 72.13 O ATOM 1251 OD2 ASP A 462 -16.757 0.384 -21.685 1.00 12.23 O ATOM 0 H ASP A 462 -20.588 1.581 -23.027 1.00 42.14 H new ATOM 0 HA ASP A 462 -20.046 0.454 -20.468 1.00 74.11 H new ATOM 0 HB2 ASP A 462 -18.733 2.469 -22.322 1.00 70.12 H new ATOM 0 HB3 ASP A 462 -18.102 2.241 -20.703 1.00 70.12 H new ATOM 1256 N MET A 463 -21.085 3.564 -20.602 1.00 21.33 N ATOM 1257 CA MET A 463 -21.579 4.668 -19.800 1.00 51.41 C ATOM 1258 C MET A 463 -22.747 4.230 -18.921 1.00 50.43 C ATOM 1259 O MET A 463 -22.846 4.622 -17.759 1.00 62.54 O ATOM 1260 CB MET A 463 -22.037 5.794 -20.722 1.00 4.40 C ATOM 1261 CG MET A 463 -20.856 6.303 -21.552 1.00 71.51 C ATOM 1262 SD MET A 463 -19.600 7.022 -20.463 1.00 51.34 S ATOM 1263 CE MET A 463 -20.599 8.387 -19.819 1.00 0.14 C ATOM 0 H MET A 463 -21.174 3.699 -21.609 1.00 21.33 H new ATOM 0 HA MET A 463 -20.772 5.013 -19.153 1.00 51.41 H new ATOM 0 HB2 MET A 463 -22.828 5.437 -21.381 1.00 4.40 H new ATOM 0 HB3 MET A 463 -22.457 6.610 -20.133 1.00 4.40 H new ATOM 0 HG2 MET A 463 -20.425 5.484 -22.127 1.00 71.51 H new ATOM 0 HG3 MET A 463 -21.199 7.050 -22.268 1.00 71.51 H new ATOM 0 HE1 MET A 463 -20.035 9.317 -19.893 1.00 0.14 H new ATOM 0 HE2 MET A 463 -21.517 8.472 -20.401 1.00 0.14 H new ATOM 0 HE3 MET A 463 -20.847 8.195 -18.775 1.00 0.14 H new ATOM 1273 N GLN A 464 -23.641 3.436 -19.494 1.00 72.45 N ATOM 1274 CA GLN A 464 -24.822 2.964 -18.776 1.00 65.32 C ATOM 1275 C GLN A 464 -24.595 1.584 -18.179 1.00 75.55 C ATOM 1276 O GLN A 464 -25.537 0.813 -18.001 1.00 3.41 O ATOM 1277 CB GLN A 464 -25.985 2.893 -19.752 1.00 41.22 C ATOM 1278 CG GLN A 464 -27.316 3.007 -19.001 1.00 42.41 C ATOM 1279 CD GLN A 464 -28.462 2.550 -19.899 1.00 34.12 C ATOM 1280 OE1 GLN A 464 -28.698 1.350 -20.042 1.00 4.43 O ATOM 1281 NE2 GLN A 464 -29.191 3.440 -20.515 1.00 11.51 N ATOM 0 H GLN A 464 -23.573 3.103 -20.456 1.00 72.45 H new ATOM 0 HA GLN A 464 -25.034 3.657 -17.962 1.00 65.32 H new ATOM 0 HB2 GLN A 464 -25.903 3.696 -20.485 1.00 41.22 H new ATOM 0 HB3 GLN A 464 -25.950 1.953 -20.303 1.00 41.22 H new ATOM 0 HG2 GLN A 464 -27.286 2.399 -18.097 1.00 42.41 H new ATOM 0 HG3 GLN A 464 -27.478 4.038 -18.686 1.00 42.41 H new ATOM 0 HE21 GLN A 464 -28.993 4.433 -20.395 1.00 11.51 H new ATOM 0 HE22 GLN A 464 -29.959 3.142 -21.117 1.00 11.51 H new ATOM 1290 N ARG A 465 -23.348 1.271 -17.884 1.00 63.42 N ATOM 1291 CA ARG A 465 -23.023 -0.040 -17.317 1.00 70.32 C ATOM 1292 C ARG A 465 -21.827 0.004 -16.362 1.00 61.14 C ATOM 1293 O ARG A 465 -21.757 -0.790 -15.424 1.00 0.31 O ATOM 1294 CB ARG A 465 -22.723 -1.025 -18.449 1.00 43.32 C ATOM 1295 CG ARG A 465 -22.572 -2.434 -17.873 1.00 22.22 C ATOM 1296 CD ARG A 465 -22.407 -3.438 -19.015 1.00 31.21 C ATOM 1297 NE ARG A 465 -23.676 -3.627 -19.708 1.00 22.05 N ATOM 1298 CZ ARG A 465 -24.619 -4.421 -19.212 1.00 25.11 C ATOM 1299 NH1 ARG A 465 -24.416 -5.048 -18.085 1.00 53.05 N ATOM 1300 NH2 ARG A 465 -25.746 -4.575 -19.850 1.00 51.30 N ATOM 0 H ARG A 465 -22.549 1.890 -18.022 1.00 63.42 H new ATOM 0 HA ARG A 465 -23.890 -0.361 -16.740 1.00 70.32 H new ATOM 0 HB2 ARG A 465 -23.527 -1.006 -19.185 1.00 43.32 H new ATOM 0 HB3 ARG A 465 -21.810 -0.733 -18.967 1.00 43.32 H new ATOM 0 HG2 ARG A 465 -21.708 -2.476 -17.210 1.00 22.22 H new ATOM 0 HG3 ARG A 465 -23.446 -2.689 -17.274 1.00 22.22 H new ATOM 0 HD2 ARG A 465 -21.652 -3.082 -19.715 1.00 31.21 H new ATOM 0 HD3 ARG A 465 -22.053 -4.391 -18.622 1.00 31.21 H new ATOM 0 HE ARG A 465 -23.843 -3.141 -20.589 1.00 22.05 H new ATOM 0 HH11 ARG A 465 -23.534 -4.928 -17.586 1.00 53.05 H new ATOM 0 HH12 ARG A 465 -25.139 -5.658 -17.703 1.00 53.05 H new ATOM 0 HH21 ARG A 465 -25.904 -4.086 -20.731 1.00 51.30 H new ATOM 0 HH22 ARG A 465 -26.469 -5.185 -19.468 1.00 51.30 H new ATOM 1314 N LYS A 466 -20.866 0.895 -16.611 1.00 53.51 N ATOM 1315 CA LYS A 466 -19.672 0.960 -15.760 1.00 50.40 C ATOM 1316 C LYS A 466 -19.785 2.000 -14.644 1.00 0.54 C ATOM 1317 O LYS A 466 -20.760 2.751 -14.541 1.00 42.13 O ATOM 1318 CB LYS A 466 -18.440 1.265 -16.617 1.00 11.12 C ATOM 1319 CG LYS A 466 -17.960 -0.017 -17.307 1.00 51.44 C ATOM 1320 CD LYS A 466 -16.990 0.341 -18.442 1.00 34.41 C ATOM 1321 CE LYS A 466 -15.923 -0.749 -18.583 1.00 10.34 C ATOM 1322 NZ LYS A 466 -14.957 -0.644 -17.453 1.00 55.14 N ATOM 0 H LYS A 466 -20.886 1.569 -17.377 1.00 53.51 H new ATOM 0 HA LYS A 466 -19.575 -0.015 -15.282 1.00 50.40 H new ATOM 0 HB2 LYS A 466 -18.682 2.022 -17.363 1.00 11.12 H new ATOM 0 HB3 LYS A 466 -17.644 1.674 -15.994 1.00 11.12 H new ATOM 0 HG2 LYS A 466 -17.467 -0.668 -16.585 1.00 51.44 H new ATOM 0 HG3 LYS A 466 -18.812 -0.569 -17.704 1.00 51.44 H new ATOM 0 HD2 LYS A 466 -17.537 0.449 -19.379 1.00 34.41 H new ATOM 0 HD3 LYS A 466 -16.516 1.301 -18.237 1.00 34.41 H new ATOM 0 HE2 LYS A 466 -16.391 -1.733 -18.586 1.00 10.34 H new ATOM 0 HE3 LYS A 466 -15.401 -0.642 -19.534 1.00 10.34 H new ATOM 0 HZ1 LYS A 466 -13.986 -0.659 -17.824 1.00 55.14 H new ATOM 0 HZ2 LYS A 466 -15.118 0.247 -16.941 1.00 55.14 H new ATOM 0 HZ3 LYS A 466 -15.093 -1.446 -16.805 1.00 55.14 H new ATOM 1336 N THR A 467 -18.745 2.020 -13.810 1.00 3.41 N ATOM 1337 CA THR A 467 -18.662 2.940 -12.678 1.00 74.24 C ATOM 1338 C THR A 467 -17.294 3.615 -12.652 1.00 41.11 C ATOM 1339 O THR A 467 -16.263 2.949 -12.538 1.00 1.31 O ATOM 1340 CB THR A 467 -18.876 2.163 -11.371 1.00 5.21 C ATOM 1341 OG1 THR A 467 -20.097 1.439 -11.451 1.00 73.13 O ATOM 1342 CG2 THR A 467 -18.933 3.125 -10.178 1.00 4.34 C ATOM 0 H THR A 467 -17.940 1.401 -13.900 1.00 3.41 H new ATOM 0 HA THR A 467 -19.433 3.703 -12.781 1.00 74.24 H new ATOM 0 HB THR A 467 -18.042 1.475 -11.228 1.00 5.21 H new ATOM 0 HG1 THR A 467 -20.237 0.940 -10.619 1.00 73.13 H new ATOM 0 HG21 THR A 467 -19.085 2.557 -9.260 1.00 4.34 H new ATOM 0 HG22 THR A 467 -17.996 3.678 -10.112 1.00 4.34 H new ATOM 0 HG23 THR A 467 -19.758 3.824 -10.313 1.00 4.34 H new ATOM 1350 N LEU A 468 -17.292 4.941 -12.763 1.00 1.22 N ATOM 1351 CA LEU A 468 -16.052 5.700 -12.753 1.00 41.15 C ATOM 1352 C LEU A 468 -15.569 5.920 -11.323 1.00 22.31 C ATOM 1353 O LEU A 468 -16.321 6.381 -10.466 1.00 2.11 O ATOM 1354 CB LEU A 468 -16.288 7.045 -13.439 1.00 42.32 C ATOM 1355 CG LEU A 468 -14.949 7.795 -13.638 1.00 2.20 C ATOM 1356 CD1 LEU A 468 -14.933 8.477 -15.010 1.00 32.23 C ATOM 1357 CD2 LEU A 468 -14.779 8.859 -12.548 1.00 54.44 C ATOM 0 H LEU A 468 -18.135 5.508 -12.860 1.00 1.22 H new ATOM 0 HA LEU A 468 -15.284 5.142 -13.289 1.00 41.15 H new ATOM 0 HB2 LEU A 468 -16.770 6.888 -14.404 1.00 42.32 H new ATOM 0 HB3 LEU A 468 -16.966 7.652 -12.839 1.00 42.32 H new ATOM 0 HG LEU A 468 -14.132 7.076 -13.577 1.00 2.20 H new ATOM 0 HD11 LEU A 468 -13.988 9.003 -15.144 1.00 32.23 H new ATOM 0 HD12 LEU A 468 -15.044 7.725 -15.791 1.00 32.23 H new ATOM 0 HD13 LEU A 468 -15.756 9.189 -15.072 1.00 32.23 H new ATOM 0 HD21 LEU A 468 -13.834 9.383 -12.695 1.00 54.44 H new ATOM 0 HD22 LEU A 468 -15.602 9.572 -12.604 1.00 54.44 H new ATOM 0 HD23 LEU A 468 -14.780 8.380 -11.569 1.00 54.44 H new ATOM 1369 N ARG A 469 -14.305 5.580 -11.077 1.00 10.01 N ATOM 1370 CA ARG A 469 -13.713 5.733 -9.747 1.00 13.32 C ATOM 1371 C ARG A 469 -12.493 6.652 -9.809 1.00 24.25 C ATOM 1372 O ARG A 469 -11.650 6.523 -10.697 1.00 52.23 O ATOM 1373 CB ARG A 469 -13.320 4.350 -9.201 1.00 21.43 C ATOM 1374 CG ARG A 469 -12.231 4.484 -8.128 1.00 41.11 C ATOM 1375 CD ARG A 469 -12.145 3.188 -7.320 1.00 0.21 C ATOM 1376 NE ARG A 469 -10.994 3.227 -6.425 1.00 4.30 N ATOM 1377 CZ ARG A 469 -10.489 2.112 -5.906 1.00 43.33 C ATOM 1378 NH1 ARG A 469 -11.023 0.957 -6.197 1.00 44.22 N ATOM 1379 NH2 ARG A 469 -9.459 2.172 -5.108 1.00 31.41 N ATOM 0 H ARG A 469 -13.671 5.197 -11.779 1.00 10.01 H new ATOM 0 HA ARG A 469 -14.444 6.186 -9.078 1.00 13.32 H new ATOM 0 HB2 ARG A 469 -14.196 3.857 -8.779 1.00 21.43 H new ATOM 0 HB3 ARG A 469 -12.961 3.720 -10.015 1.00 21.43 H new ATOM 0 HG2 ARG A 469 -11.270 4.697 -8.596 1.00 41.11 H new ATOM 0 HG3 ARG A 469 -12.457 5.322 -7.468 1.00 41.11 H new ATOM 0 HD2 ARG A 469 -13.059 3.050 -6.743 1.00 0.21 H new ATOM 0 HD3 ARG A 469 -12.062 2.336 -7.994 1.00 0.21 H new ATOM 0 HE ARG A 469 -10.569 4.125 -6.193 1.00 4.30 H new ATOM 0 HH11 ARG A 469 -11.827 0.910 -6.822 1.00 44.22 H new ATOM 0 HH12 ARG A 469 -10.636 0.101 -5.799 1.00 44.22 H new ATOM 0 HH21 ARG A 469 -9.041 3.074 -4.882 1.00 31.41 H new ATOM 0 HH22 ARG A 469 -9.072 1.316 -4.710 1.00 31.41 H new ATOM 1393 N ILE A 470 -12.403 7.572 -8.850 1.00 4.15 N ATOM 1394 CA ILE A 470 -11.277 8.507 -8.784 1.00 51.42 C ATOM 1395 C ILE A 470 -10.391 8.144 -7.599 1.00 51.24 C ATOM 1396 O ILE A 470 -10.741 8.405 -6.450 1.00 42.35 O ATOM 1397 CB ILE A 470 -11.803 9.940 -8.623 1.00 60.33 C ATOM 1398 CG1 ILE A 470 -13.019 10.124 -9.536 1.00 50.24 C ATOM 1399 CG2 ILE A 470 -10.711 10.958 -8.996 1.00 43.41 C ATOM 1400 CD1 ILE A 470 -13.483 11.580 -9.488 1.00 64.12 C ATOM 0 H ILE A 470 -13.094 7.691 -8.109 1.00 4.15 H new ATOM 0 HA ILE A 470 -10.695 8.444 -9.704 1.00 51.42 H new ATOM 0 HB ILE A 470 -12.088 10.107 -7.584 1.00 60.33 H new ATOM 0 HG12 ILE A 470 -12.763 9.847 -10.559 1.00 50.24 H new ATOM 0 HG13 ILE A 470 -13.827 9.464 -9.220 1.00 50.24 H new ATOM 0 HG21 ILE A 470 -11.100 11.969 -8.876 1.00 43.41 H new ATOM 0 HG22 ILE A 470 -9.848 10.822 -8.344 1.00 43.41 H new ATOM 0 HG23 ILE A 470 -10.410 10.805 -10.032 1.00 43.41 H new ATOM 0 HD11 ILE A 470 -14.348 11.708 -10.139 1.00 64.12 H new ATOM 0 HD12 ILE A 470 -13.756 11.841 -8.466 1.00 64.12 H new ATOM 0 HD13 ILE A 470 -12.676 12.230 -9.826 1.00 64.12 H new ATOM 1412 N SER A 471 -9.253 7.516 -7.883 1.00 42.53 N ATOM 1413 CA SER A 471 -8.337 7.093 -6.831 1.00 32.11 C ATOM 1414 C SER A 471 -7.237 8.126 -6.595 1.00 33.14 C ATOM 1415 O SER A 471 -6.447 8.426 -7.491 1.00 25.12 O ATOM 1416 CB SER A 471 -7.709 5.753 -7.220 1.00 14.02 C ATOM 1417 OG SER A 471 -8.591 4.700 -6.853 1.00 0.13 O ATOM 0 H SER A 471 -8.945 7.290 -8.829 1.00 42.53 H new ATOM 0 HA SER A 471 -8.903 6.991 -5.905 1.00 32.11 H new ATOM 0 HB2 SER A 471 -7.517 5.725 -8.293 1.00 14.02 H new ATOM 0 HB3 SER A 471 -6.748 5.629 -6.721 1.00 14.02 H new ATOM 0 HG SER A 471 -8.194 3.839 -7.102 1.00 0.13 H new ATOM 1423 N VAL A 472 -7.183 8.646 -5.372 1.00 2.15 N ATOM 1424 CA VAL A 472 -6.165 9.625 -4.997 1.00 24.42 C ATOM 1425 C VAL A 472 -5.147 8.961 -4.079 1.00 53.50 C ATOM 1426 O VAL A 472 -5.474 8.575 -2.957 1.00 51.34 O ATOM 1427 CB VAL A 472 -6.809 10.811 -4.278 1.00 3.13 C ATOM 1428 CG1 VAL A 472 -5.798 11.954 -4.170 1.00 63.21 C ATOM 1429 CG2 VAL A 472 -8.030 11.285 -5.071 1.00 34.42 C ATOM 0 H VAL A 472 -7.832 8.406 -4.623 1.00 2.15 H new ATOM 0 HA VAL A 472 -5.669 9.989 -5.897 1.00 24.42 H new ATOM 0 HB VAL A 472 -7.119 10.505 -3.279 1.00 3.13 H new ATOM 0 HG11 VAL A 472 -6.258 12.799 -3.657 1.00 63.21 H new ATOM 0 HG12 VAL A 472 -4.927 11.618 -3.607 1.00 63.21 H new ATOM 0 HG13 VAL A 472 -5.488 12.261 -5.169 1.00 63.21 H new ATOM 0 HG21 VAL A 472 -8.490 12.130 -4.560 1.00 34.42 H new ATOM 0 HG22 VAL A 472 -7.719 11.591 -6.070 1.00 34.42 H new ATOM 0 HG23 VAL A 472 -8.751 10.472 -5.149 1.00 34.42 H new ATOM 1439 N CYS A 473 -3.919 8.802 -4.568 1.00 53.52 N ATOM 1440 CA CYS A 473 -2.866 8.150 -3.781 1.00 53.41 C ATOM 1441 C CYS A 473 -1.660 9.069 -3.581 1.00 10.12 C ATOM 1442 O CYS A 473 -1.492 10.060 -4.291 1.00 1.13 O ATOM 1443 CB CYS A 473 -2.431 6.862 -4.487 1.00 45.34 C ATOM 1444 SG CYS A 473 -0.898 6.239 -3.749 1.00 61.22 S ATOM 0 H CYS A 473 -3.627 9.111 -5.495 1.00 53.52 H new ATOM 0 HA CYS A 473 -3.270 7.918 -2.796 1.00 53.41 H new ATOM 0 HB2 CYS A 473 -3.216 6.110 -4.405 1.00 45.34 H new ATOM 0 HB3 CYS A 473 -2.282 7.053 -5.550 1.00 45.34 H new ATOM 0 HG CYS A 473 0.094 6.454 -4.562 1.00 61.22 H new ATOM 1450 N ASP A 474 -0.821 8.719 -2.601 1.00 42.30 N ATOM 1451 CA ASP A 474 0.382 9.497 -2.290 1.00 30.11 C ATOM 1452 C ASP A 474 1.634 8.683 -2.601 1.00 71.34 C ATOM 1453 O ASP A 474 1.708 7.495 -2.286 1.00 24.20 O ATOM 1454 CB ASP A 474 0.381 9.895 -0.811 1.00 72.21 C ATOM 1455 CG ASP A 474 1.719 10.529 -0.433 1.00 41.33 C ATOM 1456 OD1 ASP A 474 2.111 11.482 -1.088 1.00 34.22 O ATOM 1457 OD2 ASP A 474 2.332 10.051 0.507 1.00 33.54 O ATOM 0 H ASP A 474 -0.954 7.900 -2.008 1.00 42.30 H new ATOM 0 HA ASP A 474 0.383 10.397 -2.905 1.00 30.11 H new ATOM 0 HB2 ASP A 474 -0.430 10.597 -0.617 1.00 72.21 H new ATOM 0 HB3 ASP A 474 0.198 9.017 -0.191 1.00 72.21 H new ATOM 1462 N GLU A 475 2.618 9.332 -3.222 1.00 22.51 N ATOM 1463 CA GLU A 475 3.871 8.666 -3.577 1.00 31.40 C ATOM 1464 C GLU A 475 5.044 9.279 -2.816 1.00 72.24 C ATOM 1465 O GLU A 475 5.140 10.497 -2.680 1.00 34.11 O ATOM 1466 CB GLU A 475 4.123 8.796 -5.082 1.00 53.24 C ATOM 1467 CG GLU A 475 5.480 8.182 -5.430 1.00 52.32 C ATOM 1468 CD GLU A 475 5.597 7.995 -6.938 1.00 62.42 C ATOM 1469 OE1 GLU A 475 4.704 7.392 -7.511 1.00 24.35 O ATOM 1470 OE2 GLU A 475 6.576 8.458 -7.499 1.00 41.31 O ATOM 0 H GLU A 475 2.573 10.315 -3.489 1.00 22.51 H new ATOM 0 HA GLU A 475 3.786 7.613 -3.307 1.00 31.40 H new ATOM 0 HB2 GLU A 475 3.332 8.293 -5.638 1.00 53.24 H new ATOM 0 HB3 GLU A 475 4.101 9.846 -5.375 1.00 53.24 H new ATOM 0 HG2 GLU A 475 6.283 8.827 -5.072 1.00 52.32 H new ATOM 0 HG3 GLU A 475 5.594 7.222 -4.926 1.00 52.32 H new ATOM 1477 N ASP A 476 5.938 8.422 -2.327 1.00 22.23 N ATOM 1478 CA ASP A 476 7.115 8.875 -1.588 1.00 50.44 C ATOM 1479 C ASP A 476 8.371 8.277 -2.215 1.00 31.04 C ATOM 1480 O ASP A 476 8.550 8.329 -3.431 1.00 5.41 O ATOM 1481 CB ASP A 476 7.012 8.445 -0.122 1.00 22.42 C ATOM 1482 CG ASP A 476 5.594 8.678 0.392 1.00 35.43 C ATOM 1483 OD1 ASP A 476 5.251 9.824 0.623 1.00 52.14 O ATOM 1484 OD2 ASP A 476 4.874 7.705 0.548 1.00 42.42 O ATOM 0 H ASP A 476 5.870 7.409 -2.429 1.00 22.23 H new ATOM 0 HA ASP A 476 7.170 9.963 -1.633 1.00 50.44 H new ATOM 0 HB2 ASP A 476 7.275 7.392 -0.024 1.00 22.42 H new ATOM 0 HB3 ASP A 476 7.724 9.008 0.482 1.00 22.42 H new ATOM 1556 N ASN A 481 4.262 3.074 -0.767 1.00 54.21 N ATOM 1557 CA ASN A 481 3.319 4.140 -1.100 1.00 34.40 C ATOM 1558 C ASN A 481 2.227 4.241 -0.040 1.00 23.44 C ATOM 1559 O ASN A 481 2.154 3.416 0.871 1.00 45.01 O ATOM 1560 CB ASN A 481 2.683 3.867 -2.466 1.00 43.12 C ATOM 1561 CG ASN A 481 2.277 2.400 -2.567 1.00 61.24 C ATOM 1562 OD1 ASN A 481 1.052 2.092 -2.896 1.00 4.23 O flip ATOM 1563 ND2 ASN A 481 3.098 1.510 -2.340 1.00 4.24 N flip ATOM 0 HA ASN A 481 3.864 5.083 -1.135 1.00 34.40 H new ATOM 0 HB2 ASN A 481 1.810 4.505 -2.604 1.00 43.12 H new ATOM 0 HB3 ASN A 481 3.387 4.114 -3.260 1.00 43.12 H new ATOM 0 HD21 ASN A 481 4.055 1.752 -2.083 1.00 4.24 H new ATOM 0 HD22 ASN A 481 2.821 0.531 -2.409 1.00 4.24 H new ATOM 1570 N GLU A 482 1.381 5.261 -0.164 1.00 72.25 N ATOM 1571 CA GLU A 482 0.293 5.469 0.790 1.00 3.52 C ATOM 1572 C GLU A 482 -0.951 5.994 0.079 1.00 71.12 C ATOM 1573 O GLU A 482 -0.891 6.986 -0.647 1.00 3.13 O ATOM 1574 CB GLU A 482 0.728 6.469 1.863 1.00 13.32 C ATOM 1575 CG GLU A 482 -0.342 6.548 2.954 1.00 65.21 C ATOM 1576 CD GLU A 482 0.089 7.534 4.034 1.00 31.41 C ATOM 1577 OE1 GLU A 482 1.126 8.154 3.863 1.00 74.04 O ATOM 1578 OE2 GLU A 482 -0.624 7.655 5.017 1.00 23.34 O ATOM 0 H GLU A 482 1.427 5.954 -0.911 1.00 72.25 H new ATOM 0 HA GLU A 482 0.055 4.513 1.256 1.00 3.52 H new ATOM 0 HB2 GLU A 482 1.681 6.163 2.295 1.00 13.32 H new ATOM 0 HB3 GLU A 482 0.881 7.452 1.418 1.00 13.32 H new ATOM 0 HG2 GLU A 482 -1.292 6.862 2.521 1.00 65.21 H new ATOM 0 HG3 GLU A 482 -0.501 5.562 3.392 1.00 65.21 H new ATOM 1585 N PHE A 483 -2.079 5.322 0.294 1.00 51.30 N ATOM 1586 CA PHE A 483 -3.333 5.725 -0.326 1.00 5.44 C ATOM 1587 C PHE A 483 -4.001 6.829 0.491 1.00 55.43 C ATOM 1588 O PHE A 483 -4.083 6.743 1.716 1.00 13.42 O ATOM 1589 CB PHE A 483 -4.265 4.514 -0.418 1.00 42.03 C ATOM 1590 CG PHE A 483 -3.842 3.631 -1.570 1.00 43.41 C ATOM 1591 CD1 PHE A 483 -4.304 3.899 -2.864 1.00 14.21 C ATOM 1592 CD2 PHE A 483 -2.988 2.546 -1.343 1.00 72.25 C ATOM 1593 CE1 PHE A 483 -3.913 3.081 -3.930 1.00 52.35 C ATOM 1594 CE2 PHE A 483 -2.596 1.728 -2.409 1.00 30.40 C ATOM 1595 CZ PHE A 483 -3.058 1.996 -3.703 1.00 4.53 C ATOM 0 H PHE A 483 -2.148 4.498 0.892 1.00 51.30 H new ATOM 0 HA PHE A 483 -3.128 6.108 -1.326 1.00 5.44 H new ATOM 0 HB2 PHE A 483 -4.237 3.950 0.514 1.00 42.03 H new ATOM 0 HB3 PHE A 483 -5.294 4.845 -0.560 1.00 42.03 H new ATOM 0 HD1 PHE A 483 -4.962 4.737 -3.040 1.00 14.21 H new ATOM 0 HD2 PHE A 483 -2.631 2.340 -0.345 1.00 72.25 H new ATOM 0 HE1 PHE A 483 -4.271 3.287 -4.928 1.00 52.35 H new ATOM 0 HE2 PHE A 483 -1.937 0.890 -2.233 1.00 30.40 H new ATOM 0 HZ PHE A 483 -2.755 1.366 -4.526 1.00 4.53 H new ATOM 1605 N ILE A 484 -4.477 7.867 -0.195 1.00 54.02 N ATOM 1606 CA ILE A 484 -5.138 8.983 0.480 1.00 63.30 C ATOM 1607 C ILE A 484 -6.640 8.737 0.581 1.00 22.14 C ATOM 1608 O ILE A 484 -7.167 8.503 1.668 1.00 44.11 O ATOM 1609 CB ILE A 484 -4.882 10.282 -0.287 1.00 34.43 C ATOM 1610 CG1 ILE A 484 -3.383 10.593 -0.281 1.00 71.01 C ATOM 1611 CG2 ILE A 484 -5.640 11.429 0.383 1.00 52.55 C ATOM 1612 CD1 ILE A 484 -3.075 11.671 -1.322 1.00 45.21 C ATOM 0 H ILE A 484 -4.418 7.959 -1.209 1.00 54.02 H new ATOM 0 HA ILE A 484 -4.728 9.068 1.486 1.00 63.30 H new ATOM 0 HB ILE A 484 -5.227 10.169 -1.315 1.00 34.43 H new ATOM 0 HG12 ILE A 484 -3.076 10.931 0.709 1.00 71.01 H new ATOM 0 HG13 ILE A 484 -2.814 9.690 -0.500 1.00 71.01 H new ATOM 0 HG21 ILE A 484 -5.457 12.354 -0.164 1.00 52.55 H new ATOM 0 HG22 ILE A 484 -6.708 11.210 0.380 1.00 52.55 H new ATOM 0 HG23 ILE A 484 -5.296 11.541 1.411 1.00 52.55 H new ATOM 0 HD11 ILE A 484 -2.007 11.889 -1.315 1.00 45.21 H new ATOM 0 HD12 ILE A 484 -3.366 11.316 -2.311 1.00 45.21 H new ATOM 0 HD13 ILE A 484 -3.632 12.577 -1.084 1.00 45.21 H new ATOM 1624 N GLY A 485 -7.325 8.794 -0.558 1.00 72.34 N ATOM 1625 CA GLY A 485 -8.768 8.578 -0.579 1.00 52.22 C ATOM 1626 C GLY A 485 -9.268 8.345 -2.001 1.00 64.10 C ATOM 1627 O GLY A 485 -8.604 8.711 -2.971 1.00 3.34 O ATOM 0 H GLY A 485 -6.909 8.986 -1.469 1.00 72.34 H new ATOM 0 HA2 GLY A 485 -9.019 7.719 0.043 1.00 52.22 H new ATOM 0 HA3 GLY A 485 -9.274 9.442 -0.149 1.00 52.22 H new ATOM 1631 N GLU A 486 -10.438 7.719 -2.119 1.00 23.12 N ATOM 1632 CA GLU A 486 -11.011 7.426 -3.434 1.00 45.41 C ATOM 1633 C GLU A 486 -12.506 7.738 -3.487 1.00 23.22 C ATOM 1634 O GLU A 486 -13.177 7.821 -2.458 1.00 51.32 O ATOM 1635 CB GLU A 486 -10.793 5.951 -3.775 1.00 31.10 C ATOM 1636 CG GLU A 486 -11.587 5.078 -2.801 1.00 15.22 C ATOM 1637 CD GLU A 486 -11.150 3.623 -2.929 1.00 1.24 C ATOM 1638 OE1 GLU A 486 -9.994 3.347 -2.653 1.00 2.40 O ATOM 1639 OE2 GLU A 486 -11.977 2.807 -3.300 1.00 4.54 O ATOM 0 H GLU A 486 -11.004 7.407 -1.330 1.00 23.12 H new ATOM 0 HA GLU A 486 -10.506 8.062 -4.161 1.00 45.41 H new ATOM 0 HB2 GLU A 486 -11.110 5.753 -4.799 1.00 31.10 H new ATOM 0 HB3 GLU A 486 -9.732 5.707 -3.717 1.00 31.10 H new ATOM 0 HG2 GLU A 486 -11.431 5.424 -1.779 1.00 15.22 H new ATOM 0 HG3 GLU A 486 -12.654 5.165 -3.008 1.00 15.22 H new ATOM 1646 N THR A 487 -13.015 7.897 -4.711 1.00 44.33 N ATOM 1647 CA THR A 487 -14.434 8.187 -4.933 1.00 31.24 C ATOM 1648 C THR A 487 -15.025 7.161 -5.895 1.00 33.05 C ATOM 1649 O THR A 487 -14.295 6.517 -6.649 1.00 51.24 O ATOM 1650 CB THR A 487 -14.620 9.590 -5.526 1.00 43.02 C ATOM 1651 OG1 THR A 487 -14.213 9.582 -6.885 1.00 22.31 O ATOM 1652 CG2 THR A 487 -13.792 10.618 -4.746 1.00 42.22 C ATOM 0 H THR A 487 -12.464 7.830 -5.566 1.00 44.33 H new ATOM 0 HA THR A 487 -14.945 8.138 -3.971 1.00 31.24 H new ATOM 0 HB THR A 487 -15.672 9.867 -5.456 1.00 43.02 H new ATOM 0 HG1 THR A 487 -14.834 10.123 -7.416 1.00 22.31 H new ATOM 0 HG21 THR A 487 -13.936 11.607 -5.181 1.00 42.22 H new ATOM 0 HG22 THR A 487 -14.113 10.629 -3.704 1.00 42.22 H new ATOM 0 HG23 THR A 487 -12.737 10.350 -4.797 1.00 42.22 H new ATOM 1660 N ARG A 488 -16.348 7.017 -5.875 1.00 35.54 N ATOM 1661 CA ARG A 488 -17.024 6.066 -6.758 1.00 34.22 C ATOM 1662 C ARG A 488 -18.323 6.662 -7.291 1.00 62.42 C ATOM 1663 O ARG A 488 -19.101 7.249 -6.540 1.00 44.11 O ATOM 1664 CB ARG A 488 -17.329 4.774 -5.998 1.00 52.23 C ATOM 1665 CG ARG A 488 -16.028 4.008 -5.751 1.00 32.15 C ATOM 1666 CD ARG A 488 -16.325 2.747 -4.937 1.00 74.44 C ATOM 1667 NE ARG A 488 -15.170 1.857 -4.947 1.00 71.42 N ATOM 1668 CZ ARG A 488 -14.817 1.201 -6.049 1.00 5.13 C ATOM 1669 NH1 ARG A 488 -15.509 1.350 -7.146 1.00 23.43 N ATOM 1670 NH2 ARG A 488 -13.780 0.409 -6.033 1.00 3.04 N ATOM 0 H ARG A 488 -16.971 7.542 -5.262 1.00 35.54 H new ATOM 0 HA ARG A 488 -16.365 5.847 -7.598 1.00 34.22 H new ATOM 0 HB2 ARG A 488 -17.814 5.004 -5.049 1.00 52.23 H new ATOM 0 HB3 ARG A 488 -18.023 4.158 -6.570 1.00 52.23 H new ATOM 0 HG2 ARG A 488 -15.565 3.740 -6.701 1.00 32.15 H new ATOM 0 HG3 ARG A 488 -15.318 4.639 -5.217 1.00 32.15 H new ATOM 0 HD2 ARG A 488 -16.575 3.018 -3.911 1.00 74.44 H new ATOM 0 HD3 ARG A 488 -17.192 2.234 -5.352 1.00 74.44 H new ATOM 0 HE ARG A 488 -14.623 1.735 -4.094 1.00 71.42 H new ATOM 0 HH11 ARG A 488 -16.320 1.969 -7.158 1.00 23.43 H new ATOM 0 HH12 ARG A 488 -15.239 0.847 -7.992 1.00 23.43 H new ATOM 0 HH21 ARG A 488 -13.240 0.293 -5.175 1.00 3.04 H new ATOM 0 HH22 ARG A 488 -13.509 -0.094 -6.878 1.00 3.04 H new ATOM 1684 N PHE A 489 -18.552 6.511 -8.594 1.00 30.42 N ATOM 1685 CA PHE A 489 -19.764 7.043 -9.217 1.00 41.24 C ATOM 1686 C PHE A 489 -20.217 6.155 -10.374 1.00 33.13 C ATOM 1687 O PHE A 489 -19.406 5.712 -11.185 1.00 71.23 O ATOM 1688 CB PHE A 489 -19.506 8.466 -9.729 1.00 71.42 C ATOM 1689 CG PHE A 489 -19.607 9.447 -8.583 1.00 2.31 C ATOM 1690 CD1 PHE A 489 -18.509 9.660 -7.743 1.00 70.30 C ATOM 1691 CD2 PHE A 489 -20.802 10.143 -8.363 1.00 24.04 C ATOM 1692 CE1 PHE A 489 -18.604 10.569 -6.682 1.00 54.02 C ATOM 1693 CE2 PHE A 489 -20.897 11.052 -7.303 1.00 4.14 C ATOM 1694 CZ PHE A 489 -19.799 11.265 -6.462 1.00 12.24 C ATOM 0 H PHE A 489 -17.921 6.029 -9.235 1.00 30.42 H new ATOM 0 HA PHE A 489 -20.554 7.063 -8.466 1.00 41.24 H new ATOM 0 HB2 PHE A 489 -18.518 8.525 -10.185 1.00 71.42 H new ATOM 0 HB3 PHE A 489 -20.230 8.721 -10.503 1.00 71.42 H new ATOM 0 HD1 PHE A 489 -17.587 9.123 -7.913 1.00 70.30 H new ATOM 0 HD2 PHE A 489 -21.650 9.978 -9.011 1.00 24.04 H new ATOM 0 HE1 PHE A 489 -17.756 10.733 -6.034 1.00 54.02 H new ATOM 0 HE2 PHE A 489 -21.818 11.589 -7.134 1.00 4.14 H new ATOM 0 HZ PHE A 489 -19.873 11.966 -5.644 1.00 12.24 H new ATOM 1704 N SER A 490 -21.523 5.916 -10.444 1.00 24.55 N ATOM 1705 CA SER A 490 -22.087 5.098 -11.509 1.00 72.54 C ATOM 1706 C SER A 490 -22.219 5.925 -12.781 1.00 14.02 C ATOM 1707 O SER A 490 -23.004 6.873 -12.834 1.00 62.42 O ATOM 1708 CB SER A 490 -23.460 4.574 -11.087 1.00 53.20 C ATOM 1709 OG SER A 490 -23.291 3.510 -10.159 1.00 63.40 O ATOM 0 H SER A 490 -22.207 6.276 -9.778 1.00 24.55 H new ATOM 0 HA SER A 490 -21.425 4.253 -11.700 1.00 72.54 H new ATOM 0 HB2 SER A 490 -24.045 5.376 -10.636 1.00 53.20 H new ATOM 0 HB3 SER A 490 -24.014 4.227 -11.959 1.00 53.20 H new ATOM 0 HG SER A 490 -24.169 3.173 -9.885 1.00 63.40 H new ATOM 1715 N LEU A 491 -21.437 5.580 -13.798 1.00 72.01 N ATOM 1716 CA LEU A 491 -21.481 6.329 -15.047 1.00 12.22 C ATOM 1717 C LEU A 491 -22.928 6.544 -15.483 1.00 0.10 C ATOM 1718 O LEU A 491 -23.259 7.564 -16.083 1.00 72.11 O ATOM 1719 CB LEU A 491 -20.706 5.588 -16.145 1.00 5.44 C ATOM 1720 CG LEU A 491 -19.195 5.844 -15.987 1.00 35.23 C ATOM 1721 CD1 LEU A 491 -18.407 4.671 -16.581 1.00 3.24 C ATOM 1722 CD2 LEU A 491 -18.805 7.133 -16.724 1.00 52.05 C ATOM 0 H LEU A 491 -20.777 4.802 -13.784 1.00 72.01 H new ATOM 0 HA LEU A 491 -21.013 7.300 -14.884 1.00 12.22 H new ATOM 0 HB2 LEU A 491 -20.910 4.519 -16.087 1.00 5.44 H new ATOM 0 HB3 LEU A 491 -21.039 5.924 -17.127 1.00 5.44 H new ATOM 0 HG LEU A 491 -18.963 5.944 -14.927 1.00 35.23 H new ATOM 0 HD11 LEU A 491 -17.339 4.856 -16.467 1.00 3.24 H new ATOM 0 HD12 LEU A 491 -18.674 3.752 -16.059 1.00 3.24 H new ATOM 0 HD13 LEU A 491 -18.647 4.570 -17.639 1.00 3.24 H new ATOM 0 HD21 LEU A 491 -17.735 7.309 -16.609 1.00 52.05 H new ATOM 0 HD22 LEU A 491 -19.044 7.033 -17.783 1.00 52.05 H new ATOM 0 HD23 LEU A 491 -19.358 7.973 -16.305 1.00 52.05 H new ATOM 1734 N LYS A 492 -23.787 5.581 -15.175 1.00 72.13 N ATOM 1735 CA LYS A 492 -25.191 5.683 -15.541 1.00 31.05 C ATOM 1736 C LYS A 492 -25.744 7.064 -15.190 1.00 0.33 C ATOM 1737 O LYS A 492 -26.740 7.505 -15.762 1.00 42.51 O ATOM 1738 CB LYS A 492 -25.998 4.609 -14.805 1.00 23.25 C ATOM 1739 CG LYS A 492 -25.210 3.296 -14.767 1.00 54.24 C ATOM 1740 CD LYS A 492 -26.116 2.175 -14.253 1.00 4.33 C ATOM 1741 CE LYS A 492 -25.414 0.827 -14.434 1.00 2.22 C ATOM 1742 NZ LYS A 492 -23.949 0.996 -14.217 1.00 2.21 N ATOM 0 H LYS A 492 -23.538 4.727 -14.676 1.00 72.13 H new ATOM 0 HA LYS A 492 -25.277 5.535 -16.617 1.00 31.05 H new ATOM 0 HB2 LYS A 492 -26.219 4.940 -13.790 1.00 23.25 H new ATOM 0 HB3 LYS A 492 -26.954 4.455 -15.305 1.00 23.25 H new ATOM 0 HG2 LYS A 492 -24.840 3.052 -15.763 1.00 54.24 H new ATOM 0 HG3 LYS A 492 -24.339 3.400 -14.120 1.00 54.24 H new ATOM 0 HD2 LYS A 492 -26.351 2.336 -13.201 1.00 4.33 H new ATOM 0 HD3 LYS A 492 -27.062 2.180 -14.795 1.00 4.33 H new ATOM 0 HE2 LYS A 492 -25.815 0.099 -13.729 1.00 2.22 H new ATOM 0 HE3 LYS A 492 -25.602 0.439 -15.435 1.00 2.22 H new ATOM 0 HZ1 LYS A 492 -23.497 0.061 -14.155 1.00 2.21 H new ATOM 0 HZ2 LYS A 492 -23.539 1.526 -15.012 1.00 2.21 H new ATOM 0 HZ3 LYS A 492 -23.787 1.518 -13.332 1.00 2.21 H new ATOM 1756 N LYS A 493 -25.103 7.736 -14.236 1.00 52.43 N ATOM 1757 CA LYS A 493 -25.552 9.053 -13.807 1.00 23.14 C ATOM 1758 C LYS A 493 -25.140 10.143 -14.799 1.00 30.34 C ATOM 1759 O LYS A 493 -25.555 11.294 -14.668 1.00 14.03 O ATOM 1760 CB LYS A 493 -24.960 9.358 -12.431 1.00 32.43 C ATOM 1761 CG LYS A 493 -25.692 8.542 -11.360 1.00 12.04 C ATOM 1762 CD LYS A 493 -24.834 8.466 -10.094 1.00 23.13 C ATOM 1763 CE LYS A 493 -25.699 8.009 -8.917 1.00 12.13 C ATOM 1764 NZ LYS A 493 -26.784 9.002 -8.683 1.00 60.53 N ATOM 0 H LYS A 493 -24.276 7.390 -13.749 1.00 52.43 H new ATOM 0 HA LYS A 493 -26.641 9.045 -13.759 1.00 23.14 H new ATOM 0 HB2 LYS A 493 -23.897 9.118 -12.421 1.00 32.43 H new ATOM 0 HB3 LYS A 493 -25.049 10.423 -12.214 1.00 32.43 H new ATOM 0 HG2 LYS A 493 -26.654 9.002 -11.132 1.00 12.04 H new ATOM 0 HG3 LYS A 493 -25.899 7.538 -11.732 1.00 12.04 H new ATOM 0 HD2 LYS A 493 -24.008 7.771 -10.243 1.00 23.13 H new ATOM 0 HD3 LYS A 493 -24.396 9.441 -9.880 1.00 23.13 H new ATOM 0 HE2 LYS A 493 -26.127 7.029 -9.126 1.00 12.13 H new ATOM 0 HE3 LYS A 493 -25.087 7.905 -8.021 1.00 12.13 H new ATOM 0 HZ1 LYS A 493 -26.840 9.223 -7.668 1.00 60.53 H new ATOM 0 HZ2 LYS A 493 -26.580 9.872 -9.216 1.00 60.53 H new ATOM 0 HZ3 LYS A 493 -27.691 8.606 -9.002 1.00 60.53 H new ATOM 1778 N LEU A 494 -24.319 9.784 -15.784 1.00 32.25 N ATOM 1779 CA LEU A 494 -23.864 10.749 -16.776 1.00 2.33 C ATOM 1780 C LEU A 494 -24.863 10.857 -17.923 1.00 53.33 C ATOM 1781 O LEU A 494 -25.388 9.854 -18.407 1.00 32.35 O ATOM 1782 CB LEU A 494 -22.494 10.326 -17.324 1.00 54.25 C ATOM 1783 CG LEU A 494 -21.371 10.779 -16.374 1.00 31.50 C ATOM 1784 CD1 LEU A 494 -21.203 12.308 -16.431 1.00 22.52 C ATOM 1785 CD2 LEU A 494 -21.707 10.349 -14.940 1.00 22.12 C ATOM 0 H LEU A 494 -23.959 8.839 -15.914 1.00 32.25 H new ATOM 0 HA LEU A 494 -23.780 11.723 -16.295 1.00 2.33 H new ATOM 0 HB2 LEU A 494 -22.462 9.243 -17.444 1.00 54.25 H new ATOM 0 HB3 LEU A 494 -22.341 10.761 -18.312 1.00 54.25 H new ATOM 0 HG LEU A 494 -20.436 10.313 -16.686 1.00 31.50 H new ATOM 0 HD11 LEU A 494 -20.405 12.612 -15.753 1.00 22.52 H new ATOM 0 HD12 LEU A 494 -20.950 12.609 -17.448 1.00 22.52 H new ATOM 0 HD13 LEU A 494 -22.135 12.788 -16.132 1.00 22.52 H new ATOM 0 HD21 LEU A 494 -20.911 10.670 -14.268 1.00 22.12 H new ATOM 0 HD22 LEU A 494 -22.648 10.807 -14.634 1.00 22.12 H new ATOM 0 HD23 LEU A 494 -21.801 9.264 -14.898 1.00 22.12 H new ATOM 1797 N LYS A 495 -25.111 12.090 -18.350 1.00 24.31 N ATOM 1798 CA LYS A 495 -26.035 12.364 -19.443 1.00 24.24 C ATOM 1799 C LYS A 495 -25.259 12.844 -20.669 1.00 2.43 C ATOM 1800 O LYS A 495 -24.301 13.606 -20.546 1.00 72.21 O ATOM 1801 CB LYS A 495 -27.035 13.442 -19.001 1.00 3.23 C ATOM 1802 CG LYS A 495 -28.236 12.797 -18.288 1.00 61.14 C ATOM 1803 CD LYS A 495 -29.282 12.355 -19.317 1.00 31.01 C ATOM 1804 CE LYS A 495 -30.509 11.801 -18.591 1.00 43.54 C ATOM 1805 NZ LYS A 495 -31.458 11.227 -19.587 1.00 70.44 N ATOM 0 H LYS A 495 -24.680 12.923 -17.950 1.00 24.31 H new ATOM 0 HA LYS A 495 -26.575 11.453 -19.702 1.00 24.24 H new ATOM 0 HB2 LYS A 495 -26.545 14.150 -18.333 1.00 3.23 H new ATOM 0 HB3 LYS A 495 -27.378 14.006 -19.868 1.00 3.23 H new ATOM 0 HG2 LYS A 495 -27.904 11.939 -17.703 1.00 61.14 H new ATOM 0 HG3 LYS A 495 -28.679 13.507 -17.589 1.00 61.14 H new ATOM 0 HD2 LYS A 495 -29.568 13.198 -19.946 1.00 31.01 H new ATOM 0 HD3 LYS A 495 -28.862 11.595 -19.975 1.00 31.01 H new ATOM 0 HE2 LYS A 495 -30.207 11.035 -17.877 1.00 43.54 H new ATOM 0 HE3 LYS A 495 -30.997 12.593 -18.022 1.00 43.54 H new ATOM 0 HZ1 LYS A 495 -32.293 10.850 -19.094 1.00 70.44 H new ATOM 0 HZ2 LYS A 495 -31.755 11.970 -20.252 1.00 70.44 H new ATOM 0 HZ3 LYS A 495 -30.990 10.460 -20.111 1.00 70.44 H new ATOM 1819 N ALA A 496 -25.667 12.390 -21.849 1.00 4.44 N ATOM 1820 CA ALA A 496 -24.992 12.783 -23.082 1.00 22.40 C ATOM 1821 C ALA A 496 -24.957 14.306 -23.217 1.00 31.44 C ATOM 1822 O ALA A 496 -25.975 14.976 -23.048 1.00 22.02 O ATOM 1823 CB ALA A 496 -25.716 12.164 -24.287 1.00 74.02 C ATOM 0 H ALA A 496 -26.455 11.755 -21.978 1.00 4.44 H new ATOM 0 HA ALA A 496 -23.965 12.418 -23.050 1.00 22.40 H new ATOM 0 HB1 ALA A 496 -25.210 12.459 -25.206 1.00 74.02 H new ATOM 0 HB2 ALA A 496 -25.705 11.078 -24.199 1.00 74.02 H new ATOM 0 HB3 ALA A 496 -26.747 12.516 -24.312 1.00 74.02 H new ATOM 1829 N ASN A 497 -23.772 14.840 -23.519 1.00 52.52 N ATOM 1830 CA ASN A 497 -23.593 16.284 -23.677 1.00 23.32 C ATOM 1831 C ASN A 497 -23.948 17.025 -22.392 1.00 44.02 C ATOM 1832 O ASN A 497 -24.470 18.139 -22.433 1.00 21.44 O ATOM 1833 CB ASN A 497 -24.459 16.812 -24.827 1.00 74.50 C ATOM 1834 CG ASN A 497 -23.958 16.267 -26.161 1.00 43.33 C ATOM 1835 OD1 ASN A 497 -24.697 16.262 -27.146 1.00 65.03 O ATOM 1836 ND2 ASN A 497 -22.740 15.806 -26.258 1.00 54.45 N ATOM 0 H ASN A 497 -22.922 14.294 -23.659 1.00 52.52 H new ATOM 0 HA ASN A 497 -22.542 16.463 -23.906 1.00 23.32 H new ATOM 0 HB2 ASN A 497 -25.497 16.519 -24.674 1.00 74.50 H new ATOM 0 HB3 ASN A 497 -24.434 17.902 -24.839 1.00 74.50 H new ATOM 0 HD21 ASN A 497 -22.402 15.442 -27.149 1.00 54.45 H new ATOM 0 HD22 ASN A 497 -22.127 15.810 -25.443 1.00 54.45 H new ATOM 1843 N GLN A 498 -23.650 16.406 -21.251 1.00 13.13 N ATOM 1844 CA GLN A 498 -23.931 17.021 -19.952 1.00 62.43 C ATOM 1845 C GLN A 498 -22.663 17.036 -19.095 1.00 14.32 C ATOM 1846 O GLN A 498 -21.824 16.133 -19.190 1.00 21.42 O ATOM 1847 CB GLN A 498 -25.054 16.240 -19.235 1.00 51.34 C ATOM 1848 CG GLN A 498 -26.184 17.189 -18.820 1.00 54.42 C ATOM 1849 CD GLN A 498 -26.983 17.610 -20.049 1.00 60.14 C ATOM 1850 OE1 GLN A 498 -27.245 16.730 -20.978 1.00 10.05 O flip ATOM 1851 NE2 GLN A 498 -27.378 18.770 -20.166 1.00 42.23 N flip ATOM 0 H GLN A 498 -23.216 15.484 -21.198 1.00 13.13 H new ATOM 0 HA GLN A 498 -24.260 18.049 -20.106 1.00 62.43 H new ATOM 0 HB2 GLN A 498 -25.445 15.465 -19.894 1.00 51.34 H new ATOM 0 HB3 GLN A 498 -24.652 15.737 -18.356 1.00 51.34 H new ATOM 0 HG2 GLN A 498 -26.839 16.697 -18.100 1.00 54.42 H new ATOM 0 HG3 GLN A 498 -25.770 18.068 -18.326 1.00 54.42 H new ATOM 0 HE21 GLN A 498 -27.172 19.455 -19.439 1.00 42.23 H new ATOM 0 HE22 GLN A 498 -27.912 19.046 -20.990 1.00 42.23 H new ATOM 1860 N ARG A 499 -22.537 18.062 -18.250 1.00 54.44 N ATOM 1861 CA ARG A 499 -21.383 18.195 -17.362 1.00 21.23 C ATOM 1862 C ARG A 499 -21.857 18.335 -15.917 1.00 65.30 C ATOM 1863 O ARG A 499 -22.728 19.155 -15.625 1.00 72.32 O ATOM 1864 CB ARG A 499 -20.561 19.427 -17.751 1.00 33.00 C ATOM 1865 CG ARG A 499 -19.176 19.346 -17.106 1.00 63.35 C ATOM 1866 CD ARG A 499 -18.328 20.533 -17.567 1.00 40.42 C ATOM 1867 NE ARG A 499 -19.125 21.754 -17.561 1.00 53.21 N ATOM 1868 CZ ARG A 499 -19.440 22.364 -16.424 1.00 30.34 C ATOM 1869 NH1 ARG A 499 -19.035 21.870 -15.285 1.00 44.44 N ATOM 1870 NH2 ARG A 499 -20.154 23.457 -16.444 1.00 10.11 N ATOM 0 H ARG A 499 -23.222 18.813 -18.163 1.00 54.44 H new ATOM 0 HA ARG A 499 -20.761 17.305 -17.456 1.00 21.23 H new ATOM 0 HB2 ARG A 499 -20.465 19.485 -18.835 1.00 33.00 H new ATOM 0 HB3 ARG A 499 -21.071 20.334 -17.427 1.00 33.00 H new ATOM 0 HG2 ARG A 499 -19.268 19.351 -16.020 1.00 63.35 H new ATOM 0 HG3 ARG A 499 -18.690 18.410 -17.380 1.00 63.35 H new ATOM 0 HD2 ARG A 499 -17.466 20.650 -16.911 1.00 40.42 H new ATOM 0 HD3 ARG A 499 -17.943 20.346 -18.569 1.00 40.42 H new ATOM 0 HE ARG A 499 -19.446 22.147 -18.446 1.00 53.21 H new ATOM 0 HH11 ARG A 499 -18.477 21.016 -15.269 1.00 44.44 H new ATOM 0 HH12 ARG A 499 -19.277 22.338 -14.411 1.00 44.44 H new ATOM 0 HH21 ARG A 499 -20.470 23.843 -17.333 1.00 10.11 H new ATOM 0 HH22 ARG A 499 -20.395 23.925 -15.570 1.00 10.11 H new ATOM 1884 N LYS A 500 -21.290 17.534 -15.017 1.00 20.55 N ATOM 1885 CA LYS A 500 -21.679 17.584 -13.604 1.00 33.31 C ATOM 1886 C LYS A 500 -20.456 17.746 -12.706 1.00 61.32 C ATOM 1887 O LYS A 500 -19.397 17.175 -12.971 1.00 54.45 O ATOM 1888 CB LYS A 500 -22.420 16.298 -13.229 1.00 3.04 C ATOM 1889 CG LYS A 500 -23.114 16.467 -11.866 1.00 25.52 C ATOM 1890 CD LYS A 500 -24.501 17.094 -12.055 1.00 75.11 C ATOM 1891 CE LYS A 500 -25.220 17.154 -10.707 1.00 75.40 C ATOM 1892 NZ LYS A 500 -25.671 15.787 -10.323 1.00 13.13 N ATOM 0 H LYS A 500 -20.567 16.848 -15.235 1.00 20.55 H new ATOM 0 HA LYS A 500 -22.332 18.445 -13.458 1.00 33.31 H new ATOM 0 HB2 LYS A 500 -23.158 16.058 -13.994 1.00 3.04 H new ATOM 0 HB3 LYS A 500 -21.720 15.464 -13.188 1.00 3.04 H new ATOM 0 HG2 LYS A 500 -23.208 15.499 -11.374 1.00 25.52 H new ATOM 0 HG3 LYS A 500 -22.507 17.097 -11.216 1.00 25.52 H new ATOM 0 HD2 LYS A 500 -24.405 18.096 -12.473 1.00 75.11 H new ATOM 0 HD3 LYS A 500 -25.084 16.507 -12.765 1.00 75.11 H new ATOM 0 HE2 LYS A 500 -24.553 17.556 -9.945 1.00 75.40 H new ATOM 0 HE3 LYS A 500 -26.075 17.827 -10.769 1.00 75.40 H new ATOM 0 HZ1 LYS A 500 -26.368 15.855 -9.554 1.00 13.13 H new ATOM 0 HZ2 LYS A 500 -26.107 15.322 -11.145 1.00 13.13 H new ATOM 0 HZ3 LYS A 500 -24.854 15.229 -10.002 1.00 13.13 H new ATOM 1906 N ASN A 501 -20.614 18.526 -11.636 1.00 72.23 N ATOM 1907 CA ASN A 501 -19.526 18.760 -10.684 1.00 2.34 C ATOM 1908 C ASN A 501 -19.890 18.184 -9.320 1.00 20.12 C ATOM 1909 O ASN A 501 -20.971 18.452 -8.796 1.00 1.42 O ATOM 1910 CB ASN A 501 -19.266 20.262 -10.552 1.00 34.45 C ATOM 1911 CG ASN A 501 -18.074 20.506 -9.633 1.00 14.33 C ATOM 1912 OD1 ASN A 501 -16.926 20.403 -10.064 1.00 15.04 O ATOM 1913 ND2 ASN A 501 -18.279 20.823 -8.384 1.00 64.14 N ATOM 0 H ASN A 501 -21.484 19.006 -11.406 1.00 72.23 H new ATOM 0 HA ASN A 501 -18.626 18.267 -11.051 1.00 2.34 H new ATOM 0 HB2 ASN A 501 -19.073 20.694 -11.534 1.00 34.45 H new ATOM 0 HB3 ASN A 501 -20.151 20.759 -10.154 1.00 34.45 H new ATOM 0 HD21 ASN A 501 -17.487 20.986 -7.763 1.00 64.14 H new ATOM 0 HD22 ASN A 501 -19.231 20.908 -8.029 1.00 64.14 H new ATOM 1920 N PHE A 502 -18.988 17.383 -8.752 1.00 23.14 N ATOM 1921 CA PHE A 502 -19.233 16.764 -7.448 1.00 44.41 C ATOM 1922 C PHE A 502 -18.221 17.229 -6.409 1.00 13.10 C ATOM 1923 O PHE A 502 -17.053 17.468 -6.719 1.00 43.01 O ATOM 1924 CB PHE A 502 -19.143 15.240 -7.564 1.00 61.01 C ATOM 1925 CG PHE A 502 -19.874 14.764 -8.799 1.00 25.42 C ATOM 1926 CD1 PHE A 502 -19.333 15.001 -10.069 1.00 35.42 C ATOM 1927 CD2 PHE A 502 -21.085 14.073 -8.674 1.00 40.31 C ATOM 1928 CE1 PHE A 502 -20.004 14.547 -11.212 1.00 11.23 C ATOM 1929 CE2 PHE A 502 -21.757 13.622 -9.815 1.00 23.42 C ATOM 1930 CZ PHE A 502 -21.216 13.857 -11.084 1.00 14.34 C ATOM 0 H PHE A 502 -18.088 17.149 -9.170 1.00 23.14 H new ATOM 0 HA PHE A 502 -20.231 17.064 -7.129 1.00 44.41 H new ATOM 0 HB2 PHE A 502 -18.098 14.933 -7.611 1.00 61.01 H new ATOM 0 HB3 PHE A 502 -19.573 14.775 -6.677 1.00 61.01 H new ATOM 0 HD1 PHE A 502 -18.399 15.534 -10.167 1.00 35.42 H new ATOM 0 HD2 PHE A 502 -21.501 13.888 -7.695 1.00 40.31 H new ATOM 0 HE1 PHE A 502 -19.587 14.729 -12.191 1.00 11.23 H new ATOM 0 HE2 PHE A 502 -22.693 13.093 -9.717 1.00 23.42 H new ATOM 0 HZ PHE A 502 -21.733 13.506 -11.965 1.00 14.34 H new ATOM 1940 N ASN A 503 -18.688 17.325 -5.171 1.00 33.34 N ATOM 1941 CA ASN A 503 -17.852 17.726 -4.045 1.00 73.32 C ATOM 1942 C ASN A 503 -18.217 16.855 -2.852 1.00 63.20 C ATOM 1943 O ASN A 503 -19.247 17.074 -2.213 1.00 13.23 O ATOM 1944 CB ASN A 503 -18.093 19.197 -3.704 1.00 45.11 C ATOM 1945 CG ASN A 503 -16.988 19.709 -2.788 1.00 2.12 C ATOM 1946 OD1 ASN A 503 -16.278 18.917 -2.167 1.00 21.43 O ATOM 1947 ND2 ASN A 503 -16.797 20.995 -2.665 1.00 53.43 N ATOM 0 H ASN A 503 -19.656 17.127 -4.918 1.00 33.34 H new ATOM 0 HA ASN A 503 -16.800 17.602 -4.300 1.00 73.32 H new ATOM 0 HB2 ASN A 503 -18.123 19.790 -4.618 1.00 45.11 H new ATOM 0 HB3 ASN A 503 -19.062 19.312 -3.218 1.00 45.11 H new ATOM 0 HD21 ASN A 503 -16.059 21.345 -2.054 1.00 53.43 H new ATOM 0 HD22 ASN A 503 -17.386 21.650 -3.180 1.00 53.43 H new ATOM 1954 N ILE A 504 -17.402 15.839 -2.579 1.00 54.42 N ATOM 1955 CA ILE A 504 -17.707 14.918 -1.479 1.00 41.33 C ATOM 1956 C ILE A 504 -16.467 14.533 -0.678 1.00 64.21 C ATOM 1957 O ILE A 504 -15.336 14.839 -1.057 1.00 65.21 O ATOM 1958 CB ILE A 504 -18.387 13.658 -2.039 1.00 55.32 C ATOM 1959 CG1 ILE A 504 -17.765 13.286 -3.386 1.00 1.50 C ATOM 1960 CG2 ILE A 504 -19.880 13.927 -2.240 1.00 23.35 C ATOM 1961 CD1 ILE A 504 -16.253 13.109 -3.236 1.00 71.40 C ATOM 0 H ILE A 504 -16.543 15.632 -3.089 1.00 54.42 H new ATOM 0 HA ILE A 504 -18.380 15.434 -0.794 1.00 41.33 H new ATOM 0 HB ILE A 504 -18.249 12.839 -1.333 1.00 55.32 H new ATOM 0 HG12 ILE A 504 -18.212 12.364 -3.759 1.00 1.50 H new ATOM 0 HG13 ILE A 504 -17.977 14.063 -4.120 1.00 1.50 H new ATOM 0 HG21 ILE A 504 -20.361 13.033 -2.637 1.00 23.35 H new ATOM 0 HG22 ILE A 504 -20.334 14.189 -1.285 1.00 23.35 H new ATOM 0 HG23 ILE A 504 -20.010 14.751 -2.942 1.00 23.35 H new ATOM 0 HD11 ILE A 504 -15.820 12.844 -4.201 1.00 71.40 H new ATOM 0 HD12 ILE A 504 -15.811 14.041 -2.883 1.00 71.40 H new ATOM 0 HD13 ILE A 504 -16.049 12.316 -2.517 1.00 71.40 H new ATOM 1973 N CYS A 505 -16.709 13.856 0.446 1.00 61.03 N ATOM 1974 CA CYS A 505 -15.640 13.415 1.329 1.00 61.12 C ATOM 1975 C CYS A 505 -15.207 11.993 0.984 1.00 12.12 C ATOM 1976 O CYS A 505 -16.039 11.128 0.708 1.00 64.43 O ATOM 1977 CB CYS A 505 -16.129 13.469 2.778 1.00 41.02 C ATOM 1978 SG CYS A 505 -17.858 12.934 2.851 1.00 1.42 S ATOM 0 H CYS A 505 -17.645 13.602 0.763 1.00 61.03 H new ATOM 0 HA CYS A 505 -14.782 14.076 1.202 1.00 61.12 H new ATOM 0 HB2 CYS A 505 -15.511 12.827 3.406 1.00 41.02 H new ATOM 0 HB3 CYS A 505 -16.034 14.482 3.168 1.00 41.02 H new ATOM 0 HG CYS A 505 -18.039 11.938 2.035 1.00 1.42 H new ATOM 1984 N LEU A 506 -13.899 11.756 1.015 1.00 63.45 N ATOM 1985 CA LEU A 506 -13.364 10.433 0.718 1.00 24.03 C ATOM 1986 C LEU A 506 -13.485 9.524 1.938 1.00 3.31 C ATOM 1987 O LEU A 506 -13.490 9.995 3.075 1.00 20.11 O ATOM 1988 CB LEU A 506 -11.896 10.546 0.310 1.00 24.13 C ATOM 1989 CG LEU A 506 -11.741 11.663 -0.721 1.00 11.32 C ATOM 1990 CD1 LEU A 506 -10.277 11.762 -1.156 1.00 12.12 C ATOM 1991 CD2 LEU A 506 -12.621 11.354 -1.937 1.00 53.33 C ATOM 0 H LEU A 506 -13.195 12.458 1.241 1.00 63.45 H new ATOM 0 HA LEU A 506 -13.938 10.003 -0.103 1.00 24.03 H new ATOM 0 HB2 LEU A 506 -11.279 10.755 1.184 1.00 24.13 H new ATOM 0 HB3 LEU A 506 -11.549 9.600 -0.107 1.00 24.13 H new ATOM 0 HG LEU A 506 -12.048 12.612 -0.281 1.00 11.32 H new ATOM 0 HD11 LEU A 506 -10.169 12.559 -1.891 1.00 12.12 H new ATOM 0 HD12 LEU A 506 -9.654 11.981 -0.289 1.00 12.12 H new ATOM 0 HD13 LEU A 506 -9.964 10.816 -1.598 1.00 12.12 H new ATOM 0 HD21 LEU A 506 -12.513 12.149 -2.675 1.00 53.33 H new ATOM 0 HD22 LEU A 506 -12.313 10.406 -2.377 1.00 53.33 H new ATOM 0 HD23 LEU A 506 -13.663 11.288 -1.625 1.00 53.33 H new