USER MOD reduce.3.24.130724 H: found=0, std=0, add=971, rem=0, adj=40 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 HE2:sc= -4.79! C(o=-16!,f=-17!) USER MOD Set 1.2: A 434 ASN :FLIP amide:sc= -11.2! C(o=-17!,f=-16!) USER MOD Set 2.1: A 398 ASN :FLIP amide:sc= -1.73! C(o=-4.1!,f=-1.4!) USER MOD Set 2.2: A 454 GLN : amide:sc= 0.376 K(o=-1.4,f=-4.2) USER MOD Set 3.1: A 394 GLN : amide:sc= -2.37! C(o=-6.4!,f=-7.5!) USER MOD Set 3.2: A 497 ASN :FLIP amide:sc= -4.06! C(o=-12!,f=-6.4!) USER MOD Set 4.1: A 389 SER OG : rot -83:sc= 0.651 USER MOD Set 4.2: A 402 THR OG1 : rot 23:sc= -1.25! USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 396 ASN :FLIP amide:sc= 0 F(o=-2.1!,f=0) USER MOD Single : A 397 SER OG : rot 71:sc= 0.436 USER MOD Single : A 400 GLN :FLIP amide:sc= -0.625 F(o=-2.6,f=-0.62) USER MOD Single : A 401 CYS SG : rot -127:sc= -5.15! USER MOD Single : A 407 LYS NZ :NH3+ -158:sc= -0.0696 (180deg=-0.505) USER MOD Single : A 410 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 412 MET CE :methyl 162:sc= -0.324 (180deg=-0.947) USER MOD Single : A 414 SER OG : rot 180:sc= 0 USER MOD Single : A 415 ASN :FLIP amide:sc= -1.9 F(o=-4!,f=-1.9) USER MOD Single : A 421 TYR OH : rot 180:sc= -0.708 USER MOD Single : A 423 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 431 SER OG : rot 180:sc= 0 USER MOD Single : A 432 LYS NZ :NH3+ -167:sc=-0.00165 (180deg=-0.158) USER MOD Single : A 433 SER OG : rot -49:sc= 1.14 USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 438 THR OG1 : rot -130:sc= -2.94! USER MOD Single : A 439 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 440 THR OG1 : rot 180:sc= -0.608 USER MOD Single : A 443 ASN :FLIP amide:sc= -0.229 F(o=-2.4!,f=-0.23) USER MOD Single : A 444 THR OG1 : rot 82:sc= -0.711! USER MOD Single : A 446 ASN :FLIP amide:sc= 0.234 F(o=-4.8!,f=0.23) USER MOD Single : A 450 ASN : amide:sc= -0.665 X(o=-0.67,f=-0.5) USER MOD Single : A 452 THR OG1 : rot 180:sc= -1.33 USER MOD Single : A 455 TYR OH : rot -130:sc= -4.72! USER MOD Single : A 456 HIS : no HD1:sc= -0.605 X(o=-0.6,f=-0.53) USER MOD Single : A 459 THR OG1 : rot 180:sc= 0 USER MOD Single : A 463 MET CE :methyl -133:sc= -1.45 (180deg=-6.39!) USER MOD Single : A 464 GLN : amide:sc= -0.213 K(o=-0.21,f=-2.4!) USER MOD Single : A 466 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 467 THR OG1 : rot 180:sc= 0 USER MOD Single : A 471 SER OG : rot 180:sc= 0 USER MOD Single : A 473 CYS SG : rot -89:sc= -5.7! USER MOD Single : A 481 ASN :FLIP amide:sc= -0.946! C(o=-1.5!,f=-0.95!) USER MOD Single : A 487 THR OG1 : rot 145:sc= -1.24 USER MOD Single : A 490 SER OG : rot 150:sc= -0.837 USER MOD Single : A 492 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 493 LYS NZ :NH3+ 148:sc= -0.317 (180deg=-1.42!) USER MOD Single : A 495 LYS NZ :NH3+ -164:sc= -0.0174 (180deg=-0.32) USER MOD Single : A 498 GLN :FLIP amide:sc= -0.0665 F(o=-0.87,f=-0.066) USER MOD Single : A 500 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.153) USER MOD Single : A 501 ASN : amide:sc= -0.0955 K(o=-0.095,f=-2.8!) USER MOD Single : A 503 ASN :FLIP amide:sc= -1.55 F(o=-5!,f=-1.6) USER MOD Single : A 505 CYS SG : rot -53:sc= 0.592 USER MOD ----------------------------------------------------------------- ATOM 8 N ALA A 385 -11.599 16.052 1.287 1.00 10.04 N ATOM 9 CA ALA A 385 -12.667 16.333 0.328 1.00 43.31 C ATOM 10 C ALA A 385 -12.098 16.353 -1.083 1.00 54.14 C ATOM 11 O ALA A 385 -10.910 16.613 -1.274 1.00 71.03 O ATOM 12 CB ALA A 385 -13.321 17.681 0.646 1.00 52.31 C ATOM 0 HA ALA A 385 -13.423 15.551 0.399 1.00 43.31 H new ATOM 0 HB1 ALA A 385 -14.114 17.879 -0.075 1.00 52.31 H new ATOM 0 HB2 ALA A 385 -13.742 17.653 1.651 1.00 52.31 H new ATOM 0 HB3 ALA A 385 -12.572 18.471 0.588 1.00 52.31 H new ATOM 18 N LEU A 386 -12.942 16.073 -2.075 1.00 35.42 N ATOM 19 CA LEU A 386 -12.479 16.064 -3.459 1.00 41.23 C ATOM 20 C LEU A 386 -13.512 16.674 -4.390 1.00 71.33 C ATOM 21 O LEU A 386 -14.714 16.406 -4.293 1.00 52.31 O ATOM 22 CB LEU A 386 -12.185 14.638 -3.912 1.00 12.25 C ATOM 23 CG LEU A 386 -11.223 14.639 -5.111 1.00 75.44 C ATOM 24 CD1 LEU A 386 -9.806 15.043 -4.665 1.00 75.23 C ATOM 25 CD2 LEU A 386 -11.192 13.232 -5.723 1.00 73.01 C ATOM 0 H LEU A 386 -13.930 15.854 -1.950 1.00 35.42 H new ATOM 0 HA LEU A 386 -11.568 16.661 -3.502 1.00 41.23 H new ATOM 0 HB2 LEU A 386 -11.749 14.072 -3.089 1.00 12.25 H new ATOM 0 HB3 LEU A 386 -13.115 14.138 -4.185 1.00 12.25 H new ATOM 0 HG LEU A 386 -11.570 15.361 -5.850 1.00 75.44 H new ATOM 0 HD11 LEU A 386 -9.138 15.038 -5.526 1.00 75.23 H new ATOM 0 HD12 LEU A 386 -9.832 16.043 -4.232 1.00 75.23 H new ATOM 0 HD13 LEU A 386 -9.443 14.334 -3.921 1.00 75.23 H new ATOM 0 HD21 LEU A 386 -10.512 13.221 -6.575 1.00 73.01 H new ATOM 0 HD22 LEU A 386 -10.848 12.517 -4.975 1.00 73.01 H new ATOM 0 HD23 LEU A 386 -12.193 12.957 -6.054 1.00 73.01 H new ATOM 37 N GLU A 387 -13.004 17.502 -5.282 1.00 62.45 N ATOM 38 CA GLU A 387 -13.814 18.200 -6.266 1.00 10.24 C ATOM 39 C GLU A 387 -13.361 17.822 -7.674 1.00 73.04 C ATOM 40 O GLU A 387 -12.200 18.032 -8.039 1.00 35.14 O ATOM 41 CB GLU A 387 -13.661 19.712 -6.059 1.00 32.24 C ATOM 42 CG GLU A 387 -14.731 20.220 -5.087 1.00 61.24 C ATOM 43 CD GLU A 387 -14.585 21.725 -4.891 1.00 43.35 C ATOM 44 OE1 GLU A 387 -13.725 22.122 -4.123 1.00 33.43 O ATOM 45 OE2 GLU A 387 -15.336 22.459 -5.512 1.00 73.33 O ATOM 0 H GLU A 387 -12.008 17.712 -5.346 1.00 62.45 H new ATOM 0 HA GLU A 387 -14.860 17.917 -6.145 1.00 10.24 H new ATOM 0 HB2 GLU A 387 -12.668 19.935 -5.668 1.00 32.24 H new ATOM 0 HB3 GLU A 387 -13.751 20.229 -7.014 1.00 32.24 H new ATOM 0 HG2 GLU A 387 -15.724 19.990 -5.473 1.00 61.24 H new ATOM 0 HG3 GLU A 387 -14.636 19.709 -4.129 1.00 61.24 H new ATOM 52 N PHE A 388 -14.287 17.269 -8.457 1.00 42.44 N ATOM 53 CA PHE A 388 -13.985 16.866 -9.832 1.00 14.25 C ATOM 54 C PHE A 388 -15.144 17.219 -10.760 1.00 42.21 C ATOM 55 O PHE A 388 -16.299 17.265 -10.339 1.00 24.20 O ATOM 56 CB PHE A 388 -13.714 15.355 -9.901 1.00 50.54 C ATOM 57 CG PHE A 388 -14.645 14.613 -8.970 1.00 11.41 C ATOM 58 CD1 PHE A 388 -14.462 14.697 -7.584 1.00 65.04 C ATOM 59 CD2 PHE A 388 -15.681 13.828 -9.492 1.00 41.42 C ATOM 60 CE1 PHE A 388 -15.316 14.000 -6.722 1.00 70.34 C ATOM 61 CE2 PHE A 388 -16.533 13.129 -8.629 1.00 20.25 C ATOM 62 CZ PHE A 388 -16.351 13.215 -7.244 1.00 34.21 C ATOM 0 H PHE A 388 -15.248 17.090 -8.166 1.00 42.44 H new ATOM 0 HA PHE A 388 -13.094 17.404 -10.155 1.00 14.25 H new ATOM 0 HB2 PHE A 388 -13.851 15.000 -10.922 1.00 50.54 H new ATOM 0 HB3 PHE A 388 -12.678 15.151 -9.629 1.00 50.54 H new ATOM 0 HD1 PHE A 388 -13.662 15.300 -7.181 1.00 65.04 H new ATOM 0 HD2 PHE A 388 -15.822 13.762 -10.561 1.00 41.42 H new ATOM 0 HE1 PHE A 388 -15.177 14.068 -5.653 1.00 70.34 H new ATOM 0 HE2 PHE A 388 -17.331 12.523 -9.032 1.00 20.25 H new ATOM 0 HZ PHE A 388 -17.009 12.676 -6.578 1.00 34.21 H new ATOM 72 N SER A 389 -14.822 17.455 -12.030 1.00 71.41 N ATOM 73 CA SER A 389 -15.831 17.792 -13.033 1.00 3.23 C ATOM 74 C SER A 389 -15.861 16.715 -14.109 1.00 55.42 C ATOM 75 O SER A 389 -14.815 16.302 -14.606 1.00 64.24 O ATOM 76 CB SER A 389 -15.508 19.145 -13.668 1.00 73.12 C ATOM 77 OG SER A 389 -16.099 19.210 -14.960 1.00 55.20 O ATOM 0 H SER A 389 -13.868 17.419 -12.390 1.00 71.41 H new ATOM 0 HA SER A 389 -16.807 17.851 -12.551 1.00 3.23 H new ATOM 0 HB2 SER A 389 -15.885 19.953 -13.042 1.00 73.12 H new ATOM 0 HB3 SER A 389 -14.429 19.277 -13.742 1.00 73.12 H new ATOM 0 HG SER A 389 -15.516 18.763 -15.609 1.00 55.20 H new ATOM 83 N LEU A 390 -17.059 16.252 -14.460 1.00 40.22 N ATOM 84 CA LEU A 390 -17.202 15.206 -15.474 1.00 4.01 C ATOM 85 C LEU A 390 -18.057 15.683 -16.644 1.00 5.22 C ATOM 86 O LEU A 390 -19.057 16.374 -16.457 1.00 64.45 O ATOM 87 CB LEU A 390 -17.844 13.966 -14.849 1.00 32.02 C ATOM 88 CG LEU A 390 -17.077 13.571 -13.581 1.00 32.12 C ATOM 89 CD1 LEU A 390 -17.778 12.391 -12.903 1.00 33.02 C ATOM 90 CD2 LEU A 390 -15.641 13.172 -13.947 1.00 31.33 C ATOM 0 H LEU A 390 -17.939 16.580 -14.062 1.00 40.22 H new ATOM 0 HA LEU A 390 -16.209 14.962 -15.850 1.00 4.01 H new ATOM 0 HB2 LEU A 390 -18.887 14.168 -14.607 1.00 32.02 H new ATOM 0 HB3 LEU A 390 -17.836 13.142 -15.562 1.00 32.02 H new ATOM 0 HG LEU A 390 -17.052 14.420 -12.898 1.00 32.12 H new ATOM 0 HD11 LEU A 390 -17.231 12.112 -12.002 1.00 33.02 H new ATOM 0 HD12 LEU A 390 -18.795 12.677 -12.636 1.00 33.02 H new ATOM 0 HD13 LEU A 390 -17.807 11.543 -13.587 1.00 33.02 H new ATOM 0 HD21 LEU A 390 -15.100 12.892 -13.043 1.00 31.33 H new ATOM 0 HD22 LEU A 390 -15.662 12.326 -14.634 1.00 31.33 H new ATOM 0 HD23 LEU A 390 -15.140 14.014 -14.424 1.00 31.33 H new ATOM 102 N LEU A 391 -17.650 15.297 -17.851 1.00 41.03 N ATOM 103 CA LEU A 391 -18.371 15.668 -19.067 1.00 2.11 C ATOM 104 C LEU A 391 -18.544 14.448 -19.958 1.00 52.42 C ATOM 105 O LEU A 391 -17.561 13.860 -20.409 1.00 53.02 O ATOM 106 CB LEU A 391 -17.586 16.741 -19.836 1.00 70.32 C ATOM 107 CG LEU A 391 -18.181 16.946 -21.235 1.00 4.41 C ATOM 108 CD1 LEU A 391 -19.668 17.291 -21.127 1.00 10.02 C ATOM 109 CD2 LEU A 391 -17.434 18.088 -21.924 1.00 61.35 C ATOM 0 H LEU A 391 -16.821 14.725 -18.014 1.00 41.03 H new ATOM 0 HA LEU A 391 -19.349 16.060 -18.787 1.00 2.11 H new ATOM 0 HB2 LEU A 391 -17.608 17.681 -19.284 1.00 70.32 H new ATOM 0 HB3 LEU A 391 -16.540 16.445 -19.919 1.00 70.32 H new ATOM 0 HG LEU A 391 -18.077 16.030 -21.816 1.00 4.41 H new ATOM 0 HD11 LEU A 391 -20.082 17.435 -22.125 1.00 10.02 H new ATOM 0 HD12 LEU A 391 -20.195 16.477 -20.630 1.00 10.02 H new ATOM 0 HD13 LEU A 391 -19.788 18.207 -20.549 1.00 10.02 H new ATOM 0 HD21 LEU A 391 -17.847 18.244 -22.920 1.00 61.35 H new ATOM 0 HD22 LEU A 391 -17.544 19.001 -21.338 1.00 61.35 H new ATOM 0 HD23 LEU A 391 -16.377 17.835 -22.005 1.00 61.35 H new ATOM 121 N TYR A 392 -19.791 14.083 -20.231 1.00 53.11 N ATOM 122 CA TYR A 392 -20.060 12.939 -21.099 1.00 40.03 C ATOM 123 C TYR A 392 -20.526 13.440 -22.459 1.00 10.43 C ATOM 124 O TYR A 392 -21.627 13.977 -22.590 1.00 42.52 O ATOM 125 CB TYR A 392 -21.118 12.027 -20.464 1.00 31.53 C ATOM 126 CG TYR A 392 -21.679 11.043 -21.479 1.00 32.33 C ATOM 127 CD1 TYR A 392 -20.902 10.588 -22.561 1.00 54.42 C ATOM 128 CD2 TYR A 392 -22.991 10.580 -21.326 1.00 44.21 C ATOM 129 CE1 TYR A 392 -21.445 9.680 -23.480 1.00 31.23 C ATOM 130 CE2 TYR A 392 -23.530 9.672 -22.246 1.00 52.33 C ATOM 131 CZ TYR A 392 -22.758 9.223 -23.321 1.00 42.52 C ATOM 132 OH TYR A 392 -23.290 8.328 -24.228 1.00 13.11 O ATOM 0 H TYR A 392 -20.622 14.553 -19.871 1.00 53.11 H new ATOM 0 HA TYR A 392 -19.148 12.357 -21.228 1.00 40.03 H new ATOM 0 HB2 TYR A 392 -20.677 11.481 -19.630 1.00 31.53 H new ATOM 0 HB3 TYR A 392 -21.927 12.633 -20.056 1.00 31.53 H new ATOM 0 HD1 TYR A 392 -19.888 10.939 -22.683 1.00 54.42 H new ATOM 0 HD2 TYR A 392 -23.590 10.924 -20.496 1.00 44.21 H new ATOM 0 HE1 TYR A 392 -20.850 9.333 -24.312 1.00 31.23 H new ATOM 0 HE2 TYR A 392 -24.543 9.318 -22.125 1.00 52.33 H new ATOM 0 HH TYR A 392 -24.211 8.111 -23.972 1.00 13.11 H new ATOM 142 N ASP A 393 -19.680 13.268 -23.472 1.00 72.15 N ATOM 143 CA ASP A 393 -20.005 13.711 -24.824 1.00 71.44 C ATOM 144 C ASP A 393 -20.427 12.504 -25.665 1.00 75.43 C ATOM 145 O ASP A 393 -19.754 11.473 -25.668 1.00 10.03 O ATOM 146 CB ASP A 393 -18.774 14.431 -25.418 1.00 61.04 C ATOM 147 CG ASP A 393 -18.518 14.004 -26.863 1.00 53.24 C ATOM 148 OD1 ASP A 393 -18.104 12.873 -27.061 1.00 54.44 O ATOM 149 OD2 ASP A 393 -18.740 14.813 -27.748 1.00 63.20 O ATOM 0 H ASP A 393 -18.765 12.825 -23.382 1.00 72.15 H new ATOM 0 HA ASP A 393 -20.839 14.413 -24.815 1.00 71.44 H new ATOM 0 HB2 ASP A 393 -18.928 15.509 -25.378 1.00 61.04 H new ATOM 0 HB3 ASP A 393 -17.895 14.212 -24.812 1.00 61.04 H new ATOM 154 N GLN A 394 -21.566 12.628 -26.347 1.00 33.31 N ATOM 155 CA GLN A 394 -22.099 11.536 -27.153 1.00 72.32 C ATOM 156 C GLN A 394 -21.651 11.614 -28.613 1.00 62.55 C ATOM 157 O GLN A 394 -21.383 10.590 -29.241 1.00 61.15 O ATOM 158 CB GLN A 394 -23.620 11.580 -27.079 1.00 70.34 C ATOM 159 CG GLN A 394 -24.095 13.013 -27.290 1.00 24.03 C ATOM 160 CD GLN A 394 -25.564 13.027 -27.706 1.00 42.25 C ATOM 161 OE1 GLN A 394 -26.379 12.302 -27.136 1.00 33.22 O ATOM 162 NE2 GLN A 394 -25.951 13.811 -28.675 1.00 1.25 N ATOM 0 H GLN A 394 -22.135 13.474 -26.356 1.00 33.31 H new ATOM 0 HA GLN A 394 -21.714 10.598 -26.753 1.00 72.32 H new ATOM 0 HB2 GLN A 394 -24.051 10.927 -27.838 1.00 70.34 H new ATOM 0 HB3 GLN A 394 -23.959 11.211 -26.111 1.00 70.34 H new ATOM 0 HG2 GLN A 394 -23.964 13.586 -26.372 1.00 24.03 H new ATOM 0 HG3 GLN A 394 -23.488 13.496 -28.056 1.00 24.03 H new ATOM 0 HE21 GLN A 394 -25.274 14.411 -29.146 1.00 1.25 H new ATOM 0 HE22 GLN A 394 -26.930 13.823 -28.961 1.00 1.25 H new ATOM 171 N ASP A 395 -21.595 12.822 -29.150 1.00 1.25 N ATOM 172 CA ASP A 395 -21.206 13.010 -30.546 1.00 44.52 C ATOM 173 C ASP A 395 -19.961 12.197 -30.879 1.00 73.50 C ATOM 174 O ASP A 395 -19.876 11.578 -31.940 1.00 53.24 O ATOM 175 CB ASP A 395 -20.937 14.491 -30.817 1.00 44.41 C ATOM 176 CG ASP A 395 -22.241 15.279 -30.746 1.00 32.40 C ATOM 177 OD1 ASP A 395 -22.909 15.190 -29.730 1.00 12.34 O ATOM 178 OD2 ASP A 395 -22.551 15.960 -31.709 1.00 64.35 O ATOM 0 H ASP A 395 -21.811 13.683 -28.649 1.00 1.25 H new ATOM 0 HA ASP A 395 -22.025 12.665 -31.177 1.00 44.52 H new ATOM 0 HB2 ASP A 395 -20.227 14.880 -30.087 1.00 44.41 H new ATOM 0 HB3 ASP A 395 -20.482 14.613 -31.800 1.00 44.41 H new ATOM 183 N ASN A 396 -18.999 12.205 -29.966 1.00 5.21 N ATOM 184 CA ASN A 396 -17.756 11.473 -30.156 1.00 74.33 C ATOM 185 C ASN A 396 -17.651 10.347 -29.130 1.00 20.14 C ATOM 186 O ASN A 396 -16.657 9.625 -29.087 1.00 45.14 O ATOM 187 CB ASN A 396 -16.578 12.440 -29.999 1.00 13.23 C ATOM 188 CG ASN A 396 -16.254 13.106 -31.334 1.00 31.43 C ATOM 189 OD1 ASN A 396 -17.206 13.304 -32.203 1.00 4.45 O flip ATOM 190 ND2 ASN A 396 -15.100 13.453 -31.591 1.00 2.24 N flip ATOM 0 H ASN A 396 -19.057 12.713 -29.083 1.00 5.21 H new ATOM 0 HA ASN A 396 -17.738 11.035 -31.154 1.00 74.33 H new ATOM 0 HB2 ASN A 396 -16.820 13.200 -29.256 1.00 13.23 H new ATOM 0 HB3 ASN A 396 -15.704 11.902 -29.632 1.00 13.23 H new ATOM 0 HD21 ASN A 396 -14.357 13.297 -30.910 1.00 2.24 H new ATOM 0 HD22 ASN A 396 -14.888 13.896 -32.485 1.00 2.24 H new ATOM 197 N SER A 397 -18.684 10.207 -28.304 1.00 75.22 N ATOM 198 CA SER A 397 -18.686 9.168 -27.281 1.00 33.22 C ATOM 199 C SER A 397 -17.381 9.235 -26.507 1.00 31.22 C ATOM 200 O SER A 397 -16.672 8.239 -26.363 1.00 73.34 O ATOM 201 CB SER A 397 -18.837 7.790 -27.926 1.00 74.54 C ATOM 202 OG SER A 397 -17.573 7.360 -28.413 1.00 33.23 O ATOM 0 H SER A 397 -19.520 10.792 -28.322 1.00 75.22 H new ATOM 0 HA SER A 397 -19.526 9.327 -26.604 1.00 33.22 H new ATOM 0 HB2 SER A 397 -19.222 7.075 -27.199 1.00 74.54 H new ATOM 0 HB3 SER A 397 -19.558 7.834 -28.742 1.00 74.54 H new ATOM 0 HG SER A 397 -16.988 7.143 -27.657 1.00 33.23 H new ATOM 208 N ASN A 398 -17.062 10.435 -26.038 1.00 51.41 N ATOM 209 CA ASN A 398 -15.827 10.670 -25.302 1.00 31.45 C ATOM 210 C ASN A 398 -16.119 10.992 -23.841 1.00 53.11 C ATOM 211 O ASN A 398 -16.790 11.979 -23.535 1.00 44.02 O ATOM 212 CB ASN A 398 -15.087 11.847 -25.949 1.00 41.22 C ATOM 213 CG ASN A 398 -14.250 11.362 -27.128 1.00 61.43 C ATOM 214 OD1 ASN A 398 -14.762 10.506 -27.966 1.00 74.33 O flip ATOM 215 ND2 ASN A 398 -13.101 11.773 -27.287 1.00 13.33 N flip ATOM 0 H ASN A 398 -17.645 11.264 -26.155 1.00 51.41 H new ATOM 0 HA ASN A 398 -15.214 9.770 -25.337 1.00 31.45 H new ATOM 0 HB2 ASN A 398 -15.804 12.595 -26.287 1.00 41.22 H new ATOM 0 HB3 ASN A 398 -14.445 12.331 -25.213 1.00 41.22 H new ATOM 0 HD21 ASN A 398 -12.703 12.443 -26.629 1.00 13.33 H new ATOM 0 HD22 ASN A 398 -12.546 11.443 -28.077 1.00 13.33 H new ATOM 222 N LEU A 399 -15.600 10.161 -22.944 1.00 1.32 N ATOM 223 CA LEU A 399 -15.788 10.367 -21.527 1.00 75.40 C ATOM 224 C LEU A 399 -14.656 11.239 -20.995 1.00 51.01 C ATOM 225 O LEU A 399 -13.509 10.800 -20.921 1.00 3.20 O ATOM 226 CB LEU A 399 -15.775 9.003 -20.856 1.00 64.31 C ATOM 227 CG LEU A 399 -15.697 9.145 -19.345 1.00 14.33 C ATOM 228 CD1 LEU A 399 -16.824 10.054 -18.848 1.00 70.40 C ATOM 229 CD2 LEU A 399 -15.846 7.756 -18.744 1.00 12.13 C ATOM 0 H LEU A 399 -15.046 9.338 -23.182 1.00 1.32 H new ATOM 0 HA LEU A 399 -16.733 10.869 -21.322 1.00 75.40 H new ATOM 0 HB2 LEU A 399 -16.674 8.451 -21.128 1.00 64.31 H new ATOM 0 HB3 LEU A 399 -14.924 8.424 -21.216 1.00 64.31 H new ATOM 0 HG LEU A 399 -14.746 9.589 -19.050 1.00 14.33 H new ATOM 0 HD11 LEU A 399 -16.762 10.151 -17.764 1.00 70.40 H new ATOM 0 HD12 LEU A 399 -16.727 11.038 -19.307 1.00 70.40 H new ATOM 0 HD13 LEU A 399 -17.787 9.621 -19.119 1.00 70.40 H new ATOM 0 HD21 LEU A 399 -15.794 7.822 -17.657 1.00 12.13 H new ATOM 0 HD22 LEU A 399 -16.808 7.334 -19.037 1.00 12.13 H new ATOM 0 HD23 LEU A 399 -15.043 7.114 -19.107 1.00 12.13 H new ATOM 241 N GLN A 400 -14.980 12.479 -20.644 1.00 4.11 N ATOM 242 CA GLN A 400 -13.976 13.413 -20.141 1.00 35.50 C ATOM 243 C GLN A 400 -14.166 13.676 -18.652 1.00 32.43 C ATOM 244 O GLN A 400 -15.257 14.025 -18.202 1.00 75.22 O ATOM 245 CB GLN A 400 -14.076 14.729 -20.916 1.00 60.54 C ATOM 246 CG GLN A 400 -13.538 14.548 -22.354 1.00 25.22 C ATOM 247 CD GLN A 400 -12.720 15.765 -22.774 1.00 54.53 C ATOM 248 OE1 GLN A 400 -11.921 16.323 -21.911 1.00 72.54 O flip ATOM 249 NE2 GLN A 400 -12.815 16.216 -23.915 1.00 43.24 N flip ATOM 0 H GLN A 400 -15.925 12.860 -20.698 1.00 4.11 H new ATOM 0 HA GLN A 400 -12.990 12.971 -20.283 1.00 35.50 H new ATOM 0 HB2 GLN A 400 -15.113 15.062 -20.948 1.00 60.54 H new ATOM 0 HB3 GLN A 400 -13.508 15.505 -20.403 1.00 60.54 H new ATOM 0 HG2 GLN A 400 -12.921 13.651 -22.408 1.00 25.22 H new ATOM 0 HG3 GLN A 400 -14.369 14.405 -23.045 1.00 25.22 H new ATOM 0 HE21 GLN A 400 -13.443 15.775 -24.587 1.00 43.24 H new ATOM 0 HE22 GLN A 400 -12.266 17.031 -24.189 1.00 43.24 H new ATOM 258 N CYS A 401 -13.082 13.512 -17.896 1.00 32.10 N ATOM 259 CA CYS A 401 -13.106 13.738 -16.452 1.00 53.22 C ATOM 260 C CYS A 401 -12.118 14.836 -16.084 1.00 62.12 C ATOM 261 O CYS A 401 -10.955 14.791 -16.486 1.00 52.34 O ATOM 262 CB CYS A 401 -12.728 12.457 -15.711 1.00 70.44 C ATOM 263 SG CYS A 401 -12.661 12.790 -13.933 1.00 65.13 S ATOM 0 H CYS A 401 -12.174 13.223 -18.260 1.00 32.10 H new ATOM 0 HA CYS A 401 -14.114 14.038 -16.164 1.00 53.22 H new ATOM 0 HB2 CYS A 401 -13.458 11.675 -15.919 1.00 70.44 H new ATOM 0 HB3 CYS A 401 -11.762 12.093 -16.061 1.00 70.44 H new ATOM 0 HG CYS A 401 -11.515 12.398 -13.461 1.00 65.13 H new ATOM 269 N THR A 402 -12.584 15.825 -15.324 1.00 23.35 N ATOM 270 CA THR A 402 -11.728 16.935 -14.914 1.00 3.24 C ATOM 271 C THR A 402 -11.602 16.988 -13.392 1.00 53.12 C ATOM 272 O THR A 402 -12.500 17.476 -12.707 1.00 24.15 O ATOM 273 CB THR A 402 -12.321 18.260 -15.432 1.00 5.31 C ATOM 274 OG1 THR A 402 -13.712 18.092 -15.661 1.00 54.30 O ATOM 275 CG2 THR A 402 -11.641 18.667 -16.742 1.00 21.42 C ATOM 0 H THR A 402 -13.543 15.880 -14.982 1.00 23.35 H new ATOM 0 HA THR A 402 -10.735 16.785 -15.338 1.00 3.24 H new ATOM 0 HB THR A 402 -12.156 19.039 -14.687 1.00 5.31 H new ATOM 0 HG1 THR A 402 -14.043 17.341 -15.125 1.00 54.30 H new ATOM 0 HG21 THR A 402 -12.068 19.604 -17.098 1.00 21.42 H new ATOM 0 HG22 THR A 402 -10.572 18.797 -16.572 1.00 21.42 H new ATOM 0 HG23 THR A 402 -11.798 17.890 -17.490 1.00 21.42 H new ATOM 283 N ILE A 403 -10.475 16.510 -12.868 1.00 72.44 N ATOM 284 CA ILE A 403 -10.247 16.541 -11.440 1.00 71.13 C ATOM 285 C ILE A 403 -9.781 17.942 -11.054 1.00 13.41 C ATOM 286 O ILE A 403 -8.750 18.417 -11.532 1.00 32.24 O ATOM 287 CB ILE A 403 -9.215 15.474 -11.070 1.00 34.11 C ATOM 288 CG1 ILE A 403 -8.878 15.547 -9.590 1.00 22.11 C ATOM 289 CG2 ILE A 403 -7.934 15.668 -11.871 1.00 55.41 C ATOM 290 CD1 ILE A 403 -10.094 15.150 -8.759 1.00 2.34 C ATOM 0 H ILE A 403 -9.716 16.101 -13.413 1.00 72.44 H new ATOM 0 HA ILE A 403 -11.163 16.319 -10.892 1.00 71.13 H new ATOM 0 HB ILE A 403 -9.648 14.500 -11.300 1.00 34.11 H new ATOM 0 HG12 ILE A 403 -8.042 14.885 -9.366 1.00 22.11 H new ATOM 0 HG13 ILE A 403 -8.563 16.557 -9.329 1.00 22.11 H new ATOM 0 HG21 ILE A 403 -7.212 14.900 -11.594 1.00 55.41 H new ATOM 0 HG22 ILE A 403 -8.155 15.591 -12.936 1.00 55.41 H new ATOM 0 HG23 ILE A 403 -7.517 16.652 -11.657 1.00 55.41 H new ATOM 0 HD11 ILE A 403 -9.844 15.205 -7.699 1.00 2.34 H new ATOM 0 HD12 ILE A 403 -10.919 15.830 -8.973 1.00 2.34 H new ATOM 0 HD13 ILE A 403 -10.389 14.131 -9.010 1.00 2.34 H new ATOM 302 N ILE A 404 -10.575 18.622 -10.234 1.00 32.24 N ATOM 303 CA ILE A 404 -10.260 19.993 -9.844 1.00 33.01 C ATOM 304 C ILE A 404 -9.243 20.073 -8.709 1.00 45.42 C ATOM 305 O ILE A 404 -8.099 20.480 -8.926 1.00 4.41 O ATOM 306 CB ILE A 404 -11.537 20.724 -9.426 1.00 64.55 C ATOM 307 CG1 ILE A 404 -12.569 20.625 -10.553 1.00 60.41 C ATOM 308 CG2 ILE A 404 -11.217 22.195 -9.158 1.00 44.30 C ATOM 309 CD1 ILE A 404 -13.911 21.169 -10.064 1.00 63.21 C ATOM 0 H ILE A 404 -11.435 18.251 -9.829 1.00 32.24 H new ATOM 0 HA ILE A 404 -9.813 20.469 -10.717 1.00 33.01 H new ATOM 0 HB ILE A 404 -11.939 20.269 -8.521 1.00 64.55 H new ATOM 0 HG12 ILE A 404 -12.230 21.190 -11.421 1.00 60.41 H new ATOM 0 HG13 ILE A 404 -12.679 19.588 -10.870 1.00 60.41 H new ATOM 0 HG21 ILE A 404 -12.126 22.717 -8.860 1.00 44.30 H new ATOM 0 HG22 ILE A 404 -10.479 22.267 -8.359 1.00 44.30 H new ATOM 0 HG23 ILE A 404 -10.817 22.651 -10.064 1.00 44.30 H new ATOM 0 HD11 ILE A 404 -14.646 21.099 -10.866 1.00 63.21 H new ATOM 0 HD12 ILE A 404 -14.250 20.585 -9.208 1.00 63.21 H new ATOM 0 HD13 ILE A 404 -13.795 22.212 -9.768 1.00 63.21 H new ATOM 321 N ARG A 405 -9.655 19.723 -7.492 1.00 71.02 N ATOM 322 CA ARG A 405 -8.729 19.831 -6.366 1.00 44.21 C ATOM 323 C ARG A 405 -9.166 19.029 -5.142 1.00 34.22 C ATOM 324 O ARG A 405 -10.335 18.674 -4.989 1.00 45.45 O ATOM 325 CB ARG A 405 -8.613 21.304 -5.969 1.00 34.15 C ATOM 326 CG ARG A 405 -9.892 21.754 -5.254 1.00 15.23 C ATOM 327 CD ARG A 405 -9.944 23.282 -5.209 1.00 52.33 C ATOM 328 NE ARG A 405 -11.168 23.727 -4.554 1.00 63.30 N ATOM 329 CZ ARG A 405 -11.304 24.979 -4.131 1.00 75.40 C ATOM 330 NH1 ARG A 405 -10.333 25.834 -4.298 1.00 0.12 N ATOM 331 NH2 ARG A 405 -12.411 25.353 -3.547 1.00 2.42 N ATOM 0 H ARG A 405 -10.586 19.375 -7.264 1.00 71.02 H new ATOM 0 HA ARG A 405 -7.775 19.420 -6.695 1.00 44.21 H new ATOM 0 HB2 ARG A 405 -7.752 21.447 -5.316 1.00 34.15 H new ATOM 0 HB3 ARG A 405 -8.447 21.916 -6.855 1.00 34.15 H new ATOM 0 HG2 ARG A 405 -10.767 21.365 -5.774 1.00 15.23 H new ATOM 0 HG3 ARG A 405 -9.917 21.349 -4.242 1.00 15.23 H new ATOM 0 HD2 ARG A 405 -9.076 23.667 -4.673 1.00 52.33 H new ATOM 0 HD3 ARG A 405 -9.898 23.684 -6.221 1.00 52.33 H new ATOM 0 HE ARG A 405 -11.933 23.066 -4.418 1.00 63.30 H new ATOM 0 HH11 ARG A 405 -9.469 25.541 -4.754 1.00 0.12 H new ATOM 0 HH12 ARG A 405 -10.438 26.795 -3.973 1.00 0.12 H new ATOM 0 HH21 ARG A 405 -13.170 24.684 -3.416 1.00 2.42 H new ATOM 0 HH22 ARG A 405 -12.517 26.314 -3.222 1.00 2.42 H new ATOM 345 N ALA A 406 -8.197 18.786 -4.256 1.00 52.15 N ATOM 346 CA ALA A 406 -8.438 18.068 -3.005 1.00 0.20 C ATOM 347 C ALA A 406 -8.289 19.046 -1.844 1.00 52.33 C ATOM 348 O ALA A 406 -7.545 20.022 -1.948 1.00 12.24 O ATOM 349 CB ALA A 406 -7.432 16.924 -2.849 1.00 62.10 C ATOM 0 H ALA A 406 -7.229 19.080 -4.386 1.00 52.15 H new ATOM 0 HA ALA A 406 -9.443 17.647 -3.013 1.00 0.20 H new ATOM 0 HB1 ALA A 406 -7.622 16.397 -1.914 1.00 62.10 H new ATOM 0 HB2 ALA A 406 -7.537 16.231 -3.684 1.00 62.10 H new ATOM 0 HB3 ALA A 406 -6.420 17.328 -2.838 1.00 62.10 H new ATOM 355 N LYS A 407 -9.004 18.803 -0.746 1.00 1.23 N ATOM 356 CA LYS A 407 -8.938 19.702 0.409 1.00 71.23 C ATOM 357 C LYS A 407 -8.592 18.957 1.696 1.00 41.02 C ATOM 358 O LYS A 407 -9.234 17.966 2.050 1.00 53.23 O ATOM 359 CB LYS A 407 -10.282 20.415 0.586 1.00 41.31 C ATOM 360 CG LYS A 407 -10.099 21.650 1.472 1.00 64.14 C ATOM 361 CD LYS A 407 -11.465 22.258 1.790 1.00 64.04 C ATOM 362 CE LYS A 407 -11.291 23.428 2.761 1.00 22.43 C ATOM 363 NZ LYS A 407 -10.817 22.914 4.076 1.00 3.24 N ATOM 0 H LYS A 407 -9.627 18.004 -0.630 1.00 1.23 H new ATOM 0 HA LYS A 407 -8.146 20.426 0.215 1.00 71.23 H new ATOM 0 HB2 LYS A 407 -10.680 20.708 -0.386 1.00 41.31 H new ATOM 0 HB3 LYS A 407 -11.008 19.737 1.036 1.00 41.31 H new ATOM 0 HG2 LYS A 407 -9.588 21.376 2.395 1.00 64.14 H new ATOM 0 HG3 LYS A 407 -9.472 22.384 0.966 1.00 64.14 H new ATOM 0 HD2 LYS A 407 -11.944 22.601 0.873 1.00 64.04 H new ATOM 0 HD3 LYS A 407 -12.118 21.503 2.228 1.00 64.04 H new ATOM 0 HE2 LYS A 407 -10.575 24.145 2.359 1.00 22.43 H new ATOM 0 HE3 LYS A 407 -12.236 23.956 2.884 1.00 22.43 H new ATOM 0 HZ1 LYS A 407 -11.047 23.602 4.821 1.00 3.24 H new ATOM 0 HZ2 LYS A 407 -11.285 22.009 4.284 1.00 3.24 H new ATOM 0 HZ3 LYS A 407 -9.787 22.772 4.042 1.00 3.24 H new ATOM 377 N GLY A 408 -7.584 19.469 2.399 1.00 23.32 N ATOM 378 CA GLY A 408 -7.155 18.890 3.666 1.00 14.51 C ATOM 379 C GLY A 408 -6.668 17.455 3.513 1.00 4.31 C ATOM 380 O GLY A 408 -7.465 16.517 3.510 1.00 2.11 O ATOM 0 H GLY A 408 -7.048 20.287 2.109 1.00 23.32 H new ATOM 0 HA2 GLY A 408 -6.356 19.499 4.089 1.00 14.51 H new ATOM 0 HA3 GLY A 408 -7.984 18.916 4.373 1.00 14.51 H new ATOM 384 N LEU A 409 -5.347 17.288 3.422 1.00 5.11 N ATOM 385 CA LEU A 409 -4.758 15.950 3.309 1.00 22.04 C ATOM 386 C LEU A 409 -4.032 15.587 4.607 1.00 4.14 C ATOM 387 O LEU A 409 -3.174 16.331 5.084 1.00 65.42 O ATOM 388 CB LEU A 409 -3.777 15.892 2.133 1.00 0.22 C ATOM 389 CG LEU A 409 -4.487 16.276 0.826 1.00 25.44 C ATOM 390 CD1 LEU A 409 -3.530 16.060 -0.347 1.00 31.33 C ATOM 391 CD2 LEU A 409 -5.739 15.407 0.625 1.00 43.11 C ATOM 0 H LEU A 409 -4.671 18.052 3.424 1.00 5.11 H new ATOM 0 HA LEU A 409 -5.560 15.233 3.132 1.00 22.04 H new ATOM 0 HB2 LEU A 409 -2.942 16.569 2.314 1.00 0.22 H new ATOM 0 HB3 LEU A 409 -3.361 14.888 2.047 1.00 0.22 H new ATOM 0 HG LEU A 409 -4.786 17.323 0.877 1.00 25.44 H new ATOM 0 HD11 LEU A 409 -4.028 16.331 -1.278 1.00 31.33 H new ATOM 0 HD12 LEU A 409 -2.645 16.683 -0.214 1.00 31.33 H new ATOM 0 HD13 LEU A 409 -3.233 15.012 -0.386 1.00 31.33 H new ATOM 0 HD21 LEU A 409 -6.233 15.690 -0.305 1.00 43.11 H new ATOM 0 HD22 LEU A 409 -5.449 14.357 0.578 1.00 43.11 H new ATOM 0 HD23 LEU A 409 -6.424 15.557 1.460 1.00 43.11 H new ATOM 403 N LYS A 410 -4.399 14.440 5.176 1.00 23.24 N ATOM 404 CA LYS A 410 -3.806 13.967 6.427 1.00 42.30 C ATOM 405 C LYS A 410 -2.317 13.641 6.251 1.00 34.31 C ATOM 406 O LYS A 410 -1.899 13.213 5.174 1.00 32.23 O ATOM 407 CB LYS A 410 -4.553 12.716 6.902 1.00 51.34 C ATOM 408 CG LYS A 410 -6.050 12.881 6.625 1.00 53.24 C ATOM 409 CD LYS A 410 -6.836 11.828 7.410 1.00 12.32 C ATOM 410 CE LYS A 410 -6.467 10.431 6.906 1.00 35.25 C ATOM 411 NZ LYS A 410 -7.492 9.451 7.368 1.00 12.45 N ATOM 0 H LYS A 410 -5.108 13.818 4.788 1.00 23.24 H new ATOM 0 HA LYS A 410 -3.893 14.760 7.169 1.00 42.30 H new ATOM 0 HB2 LYS A 410 -4.172 11.834 6.387 1.00 51.34 H new ATOM 0 HB3 LYS A 410 -4.384 12.561 7.968 1.00 51.34 H new ATOM 0 HG2 LYS A 410 -6.375 13.881 6.912 1.00 53.24 H new ATOM 0 HG3 LYS A 410 -6.247 12.776 5.558 1.00 53.24 H new ATOM 0 HD2 LYS A 410 -6.614 11.912 8.474 1.00 12.32 H new ATOM 0 HD3 LYS A 410 -7.907 11.997 7.293 1.00 12.32 H new ATOM 0 HE2 LYS A 410 -6.410 10.428 5.817 1.00 35.25 H new ATOM 0 HE3 LYS A 410 -5.482 10.147 7.277 1.00 35.25 H new ATOM 0 HZ1 LYS A 410 -7.243 8.501 7.026 1.00 12.45 H new ATOM 0 HZ2 LYS A 410 -7.525 9.447 8.407 1.00 12.45 H new ATOM 0 HZ3 LYS A 410 -8.424 9.720 6.993 1.00 12.45 H new ATOM 425 N PRO A 411 -1.514 13.833 7.280 1.00 41.52 N ATOM 426 CA PRO A 411 -0.052 13.552 7.234 1.00 14.11 C ATOM 427 C PRO A 411 0.285 12.396 6.296 1.00 42.30 C ATOM 428 O PRO A 411 -0.518 11.481 6.114 1.00 51.20 O ATOM 429 CB PRO A 411 0.266 13.217 8.687 1.00 24.13 C ATOM 430 CG PRO A 411 -0.666 14.076 9.488 1.00 75.41 C ATOM 431 CD PRO A 411 -1.906 14.334 8.611 1.00 1.21 C ATOM 0 HA PRO A 411 0.532 14.386 6.844 1.00 14.11 H new ATOM 0 HB2 PRO A 411 0.106 12.159 8.894 1.00 24.13 H new ATOM 0 HB3 PRO A 411 1.307 13.434 8.925 1.00 24.13 H new ATOM 0 HG2 PRO A 411 -0.947 13.579 10.416 1.00 75.41 H new ATOM 0 HG3 PRO A 411 -0.185 15.015 9.762 1.00 75.41 H new ATOM 0 HD2 PRO A 411 -2.781 13.809 8.993 1.00 1.21 H new ATOM 0 HD3 PRO A 411 -2.159 15.394 8.580 1.00 1.21 H new ATOM 439 N MET A 412 1.461 12.465 5.675 1.00 4.51 N ATOM 440 CA MET A 412 1.879 11.441 4.717 1.00 42.41 C ATOM 441 C MET A 412 3.262 10.874 4.995 1.00 5.44 C ATOM 442 O MET A 412 3.408 9.703 5.346 1.00 54.44 O ATOM 443 CB MET A 412 1.877 12.050 3.319 1.00 34.44 C ATOM 444 CG MET A 412 0.447 12.080 2.770 1.00 42.13 C ATOM 445 SD MET A 412 -0.089 10.392 2.388 1.00 52.32 S ATOM 446 CE MET A 412 -1.810 10.566 2.922 1.00 14.24 C ATOM 0 H MET A 412 2.139 13.214 5.816 1.00 4.51 H new ATOM 0 HA MET A 412 1.172 10.616 4.807 1.00 42.41 H new ATOM 0 HB2 MET A 412 2.285 13.060 3.351 1.00 34.44 H new ATOM 0 HB3 MET A 412 2.519 11.468 2.657 1.00 34.44 H new ATOM 0 HG2 MET A 412 -0.225 12.530 3.501 1.00 42.13 H new ATOM 0 HG3 MET A 412 0.403 12.699 1.874 1.00 42.13 H new ATOM 0 HE1 MET A 412 -2.408 9.763 2.491 1.00 14.24 H new ATOM 0 HE2 MET A 412 -1.861 10.513 4.010 1.00 14.24 H new ATOM 0 HE3 MET A 412 -2.199 11.527 2.587 1.00 14.24 H new ATOM 456 N ASP A 413 4.273 11.703 4.808 1.00 25.23 N ATOM 457 CA ASP A 413 5.648 11.267 5.011 1.00 32.14 C ATOM 458 C ASP A 413 6.074 11.485 6.452 1.00 41.24 C ATOM 459 O ASP A 413 5.682 12.467 7.081 1.00 13.02 O ATOM 460 CB ASP A 413 6.578 12.040 4.075 1.00 12.53 C ATOM 461 CG ASP A 413 6.034 11.994 2.649 1.00 4.40 C ATOM 462 OD1 ASP A 413 4.995 11.385 2.454 1.00 20.14 O ATOM 463 OD2 ASP A 413 6.664 12.567 1.775 1.00 3.22 O ATOM 0 H ASP A 413 4.172 12.676 4.518 1.00 25.23 H new ATOM 0 HA ASP A 413 5.710 10.202 4.789 1.00 32.14 H new ATOM 0 HB2 ASP A 413 6.665 13.074 4.407 1.00 12.53 H new ATOM 0 HB3 ASP A 413 7.579 11.610 4.106 1.00 12.53 H new ATOM 468 N SER A 414 6.888 10.572 6.972 1.00 1.11 N ATOM 469 CA SER A 414 7.362 10.702 8.339 1.00 5.01 C ATOM 470 C SER A 414 7.902 12.108 8.541 1.00 42.20 C ATOM 471 O SER A 414 7.945 12.620 9.659 1.00 42.51 O ATOM 472 CB SER A 414 8.463 9.677 8.618 1.00 60.24 C ATOM 473 OG SER A 414 7.910 8.369 8.565 1.00 51.54 O ATOM 0 H SER A 414 7.227 9.748 6.475 1.00 1.11 H new ATOM 0 HA SER A 414 6.537 10.519 9.028 1.00 5.01 H new ATOM 0 HB2 SER A 414 9.263 9.776 7.884 1.00 60.24 H new ATOM 0 HB3 SER A 414 8.905 9.858 9.598 1.00 60.24 H new ATOM 0 HG SER A 414 8.613 7.709 8.742 1.00 51.54 H new ATOM 479 N ASN A 415 8.308 12.725 7.435 1.00 11.43 N ATOM 480 CA ASN A 415 8.843 14.076 7.479 1.00 52.52 C ATOM 481 C ASN A 415 7.713 15.095 7.587 1.00 15.04 C ATOM 482 O ASN A 415 7.928 16.215 8.052 1.00 5.42 O ATOM 483 CB ASN A 415 9.665 14.354 6.219 1.00 53.51 C ATOM 484 CG ASN A 415 10.362 15.705 6.339 1.00 25.14 C ATOM 485 OD1 ASN A 415 9.646 16.791 6.442 1.00 31.03 O flip ATOM 486 ND2 ASN A 415 11.591 15.773 6.339 1.00 22.31 N flip ATOM 0 H ASN A 415 8.276 12.311 6.503 1.00 11.43 H new ATOM 0 HA ASN A 415 9.483 14.165 8.356 1.00 52.52 H new ATOM 0 HB2 ASN A 415 10.404 13.566 6.076 1.00 53.51 H new ATOM 0 HB3 ASN A 415 9.017 14.346 5.343 1.00 53.51 H new ATOM 0 HD21 ASN A 415 12.149 14.923 6.258 1.00 22.31 H new ATOM 0 HD22 ASN A 415 12.052 16.679 6.420 1.00 22.31 H new ATOM 493 N GLY A 416 6.502 14.712 7.167 1.00 71.23 N ATOM 494 CA GLY A 416 5.367 15.624 7.246 1.00 23.35 C ATOM 495 C GLY A 416 5.113 16.292 5.905 1.00 22.13 C ATOM 496 O GLY A 416 4.294 17.205 5.802 1.00 42.43 O ATOM 0 H GLY A 416 6.289 13.794 6.777 1.00 71.23 H new ATOM 0 HA2 GLY A 416 4.477 15.077 7.559 1.00 23.35 H new ATOM 0 HA3 GLY A 416 5.558 16.383 8.005 1.00 23.35 H new ATOM 500 N LEU A 417 5.800 15.816 4.870 1.00 21.52 N ATOM 501 CA LEU A 417 5.617 16.357 3.531 1.00 14.03 C ATOM 502 C LEU A 417 4.666 15.451 2.770 1.00 42.22 C ATOM 503 O LEU A 417 4.104 14.517 3.349 1.00 70.03 O ATOM 504 CB LEU A 417 6.958 16.428 2.796 1.00 40.10 C ATOM 505 CG LEU A 417 8.012 17.069 3.700 1.00 24.45 C ATOM 506 CD1 LEU A 417 9.291 17.306 2.895 1.00 71.12 C ATOM 507 CD2 LEU A 417 7.491 18.409 4.234 1.00 52.43 C ATOM 0 H LEU A 417 6.484 15.062 4.934 1.00 21.52 H new ATOM 0 HA LEU A 417 5.207 17.365 3.598 1.00 14.03 H new ATOM 0 HB2 LEU A 417 7.276 15.427 2.504 1.00 40.10 H new ATOM 0 HB3 LEU A 417 6.850 17.008 1.880 1.00 40.10 H new ATOM 0 HG LEU A 417 8.222 16.405 4.538 1.00 24.45 H new ATOM 0 HD11 LEU A 417 10.045 17.763 3.536 1.00 71.12 H new ATOM 0 HD12 LEU A 417 9.665 16.354 2.517 1.00 71.12 H new ATOM 0 HD13 LEU A 417 9.076 17.970 2.058 1.00 71.12 H new ATOM 0 HD21 LEU A 417 8.245 18.862 4.878 1.00 52.43 H new ATOM 0 HD22 LEU A 417 7.279 19.076 3.398 1.00 52.43 H new ATOM 0 HD23 LEU A 417 6.578 18.243 4.806 1.00 52.43 H new ATOM 519 N ALA A 418 4.483 15.708 1.482 1.00 60.41 N ATOM 520 CA ALA A 418 3.583 14.876 0.702 1.00 75.42 C ATOM 521 C ALA A 418 3.647 15.196 -0.783 1.00 24.41 C ATOM 522 O ALA A 418 3.724 16.359 -1.185 1.00 73.51 O ATOM 523 CB ALA A 418 2.147 15.078 1.175 1.00 24.42 C ATOM 0 H ALA A 418 4.933 16.465 0.968 1.00 60.41 H new ATOM 0 HA ALA A 418 3.899 13.843 0.848 1.00 75.42 H new ATOM 0 HB1 ALA A 418 1.478 14.451 0.585 1.00 24.42 H new ATOM 0 HB2 ALA A 418 2.068 14.804 2.227 1.00 24.42 H new ATOM 0 HB3 ALA A 418 1.867 16.124 1.051 1.00 24.42 H new ATOM 529 N ASP A 419 3.556 14.142 -1.585 1.00 53.41 N ATOM 530 CA ASP A 419 3.542 14.267 -3.035 1.00 72.43 C ATOM 531 C ASP A 419 2.334 13.487 -3.549 1.00 40.25 C ATOM 532 O ASP A 419 2.430 12.292 -3.829 1.00 40.31 O ATOM 533 CB ASP A 419 4.831 13.693 -3.629 1.00 14.10 C ATOM 534 CG ASP A 419 6.023 14.098 -2.770 1.00 72.42 C ATOM 535 OD1 ASP A 419 6.373 15.267 -2.789 1.00 54.50 O ATOM 536 OD2 ASP A 419 6.569 13.232 -2.104 1.00 42.45 O ATOM 0 H ASP A 419 3.490 13.181 -1.249 1.00 53.41 H new ATOM 0 HA ASP A 419 3.477 15.315 -3.328 1.00 72.43 H new ATOM 0 HB2 ASP A 419 4.764 12.606 -3.684 1.00 14.10 H new ATOM 0 HB3 ASP A 419 4.966 14.056 -4.648 1.00 14.10 H new ATOM 541 N PRO A 420 1.197 14.127 -3.629 1.00 71.22 N ATOM 542 CA PRO A 420 -0.065 13.477 -4.061 1.00 5.41 C ATOM 543 C PRO A 420 -0.284 13.474 -5.571 1.00 42.12 C ATOM 544 O PRO A 420 0.144 14.379 -6.288 1.00 53.22 O ATOM 545 CB PRO A 420 -1.122 14.319 -3.345 1.00 14.21 C ATOM 546 CG PRO A 420 -0.547 15.702 -3.298 1.00 24.21 C ATOM 547 CD PRO A 420 0.982 15.548 -3.308 1.00 71.42 C ATOM 0 HA PRO A 420 -0.082 12.416 -3.813 1.00 5.41 H new ATOM 0 HB2 PRO A 420 -2.070 14.303 -3.883 1.00 14.21 H new ATOM 0 HB3 PRO A 420 -1.318 13.938 -2.343 1.00 14.21 H new ATOM 0 HG2 PRO A 420 -0.882 16.289 -4.153 1.00 24.21 H new ATOM 0 HG3 PRO A 420 -0.877 16.227 -2.402 1.00 24.21 H new ATOM 0 HD2 PRO A 420 1.443 16.199 -4.051 1.00 71.42 H new ATOM 0 HD3 PRO A 420 1.415 15.809 -2.342 1.00 71.42 H new ATOM 555 N TYR A 421 -0.975 12.434 -6.026 1.00 21.15 N ATOM 556 CA TYR A 421 -1.295 12.269 -7.439 1.00 4.42 C ATOM 557 C TYR A 421 -2.636 11.557 -7.580 1.00 70.13 C ATOM 558 O TYR A 421 -3.115 10.933 -6.632 1.00 15.32 O ATOM 559 CB TYR A 421 -0.196 11.469 -8.143 1.00 65.32 C ATOM 560 CG TYR A 421 -0.168 10.057 -7.614 1.00 1.22 C ATOM 561 CD1 TYR A 421 0.551 9.757 -6.451 1.00 21.12 C ATOM 562 CD2 TYR A 421 -0.850 9.044 -8.295 1.00 54.20 C ATOM 563 CE1 TYR A 421 0.585 8.443 -5.969 1.00 33.12 C ATOM 564 CE2 TYR A 421 -0.817 7.730 -7.811 1.00 14.15 C ATOM 565 CZ TYR A 421 -0.100 7.431 -6.650 1.00 54.20 C ATOM 566 OH TYR A 421 -0.064 6.134 -6.177 1.00 35.24 O ATOM 0 H TYR A 421 -1.327 11.686 -5.429 1.00 21.15 H new ATOM 0 HA TYR A 421 -1.360 13.252 -7.906 1.00 4.42 H new ATOM 0 HB2 TYR A 421 -0.373 11.460 -9.218 1.00 65.32 H new ATOM 0 HB3 TYR A 421 0.771 11.945 -7.983 1.00 65.32 H new ATOM 0 HD1 TYR A 421 1.079 10.539 -5.926 1.00 21.12 H new ATOM 0 HD2 TYR A 421 -1.402 9.275 -9.194 1.00 54.20 H new ATOM 0 HE1 TYR A 421 1.140 8.211 -5.072 1.00 33.12 H new ATOM 0 HE2 TYR A 421 -1.346 6.948 -8.335 1.00 14.15 H new ATOM 0 HH TYR A 421 -0.593 5.556 -6.766 1.00 35.24 H new ATOM 576 N VAL A 422 -3.250 11.668 -8.757 1.00 42.30 N ATOM 577 CA VAL A 422 -4.553 11.046 -8.997 1.00 13.44 C ATOM 578 C VAL A 422 -4.473 9.979 -10.090 1.00 50.32 C ATOM 579 O VAL A 422 -3.671 10.079 -11.018 1.00 22.42 O ATOM 580 CB VAL A 422 -5.566 12.118 -9.407 1.00 13.21 C ATOM 581 CG1 VAL A 422 -6.897 11.453 -9.744 1.00 3.23 C ATOM 582 CG2 VAL A 422 -5.764 13.121 -8.261 1.00 31.33 C ATOM 0 H VAL A 422 -2.871 12.179 -9.554 1.00 42.30 H new ATOM 0 HA VAL A 422 -4.870 10.563 -8.073 1.00 13.44 H new ATOM 0 HB VAL A 422 -5.192 12.650 -10.281 1.00 13.21 H new ATOM 0 HG11 VAL A 422 -7.620 12.214 -10.036 1.00 3.23 H new ATOM 0 HG12 VAL A 422 -6.756 10.752 -10.567 1.00 3.23 H new ATOM 0 HG13 VAL A 422 -7.267 10.917 -8.870 1.00 3.23 H new ATOM 0 HG21 VAL A 422 -6.486 13.880 -8.562 1.00 31.33 H new ATOM 0 HG22 VAL A 422 -6.134 12.598 -7.379 1.00 31.33 H new ATOM 0 HG23 VAL A 422 -4.813 13.599 -8.027 1.00 31.33 H new ATOM 592 N LYS A 423 -5.328 8.964 -9.967 1.00 75.34 N ATOM 593 CA LYS A 423 -5.383 7.872 -10.941 1.00 4.15 C ATOM 594 C LYS A 423 -6.838 7.502 -11.218 1.00 75.11 C ATOM 595 O LYS A 423 -7.575 7.128 -10.305 1.00 73.23 O ATOM 596 CB LYS A 423 -4.647 6.636 -10.404 1.00 1.33 C ATOM 597 CG LYS A 423 -3.143 6.774 -10.634 1.00 1.45 C ATOM 598 CD LYS A 423 -2.431 5.487 -10.196 1.00 32.35 C ATOM 599 CE LYS A 423 -2.837 4.319 -11.105 1.00 10.22 C ATOM 600 NZ LYS A 423 -1.726 3.326 -11.155 1.00 22.14 N ATOM 0 H LYS A 423 -5.994 8.874 -9.200 1.00 75.34 H new ATOM 0 HA LYS A 423 -4.902 8.205 -11.861 1.00 4.15 H new ATOM 0 HB2 LYS A 423 -4.850 6.517 -9.340 1.00 1.33 H new ATOM 0 HB3 LYS A 423 -5.017 5.739 -10.901 1.00 1.33 H new ATOM 0 HG2 LYS A 423 -2.943 6.971 -11.687 1.00 1.45 H new ATOM 0 HG3 LYS A 423 -2.756 7.624 -10.072 1.00 1.45 H new ATOM 0 HD2 LYS A 423 -1.351 5.629 -10.235 1.00 32.35 H new ATOM 0 HD3 LYS A 423 -2.685 5.257 -9.161 1.00 32.35 H new ATOM 0 HE2 LYS A 423 -3.745 3.848 -10.728 1.00 10.22 H new ATOM 0 HE3 LYS A 423 -3.060 4.684 -12.108 1.00 10.22 H new ATOM 0 HZ1 LYS A 423 -1.997 2.532 -11.770 1.00 22.14 H new ATOM 0 HZ2 LYS A 423 -0.871 3.781 -11.533 1.00 22.14 H new ATOM 0 HZ3 LYS A 423 -1.534 2.971 -10.196 1.00 22.14 H new ATOM 614 N LEU A 424 -7.247 7.607 -12.477 1.00 15.11 N ATOM 615 CA LEU A 424 -8.612 7.282 -12.861 1.00 34.33 C ATOM 616 C LEU A 424 -8.695 5.831 -13.333 1.00 24.30 C ATOM 617 O LEU A 424 -7.876 5.379 -14.132 1.00 64.11 O ATOM 618 CB LEU A 424 -9.043 8.219 -13.999 1.00 73.54 C ATOM 619 CG LEU A 424 -10.184 9.137 -13.551 1.00 3.15 C ATOM 620 CD1 LEU A 424 -9.688 10.127 -12.488 1.00 43.52 C ATOM 621 CD2 LEU A 424 -10.681 9.915 -14.763 1.00 25.11 C ATOM 0 H LEU A 424 -6.653 7.914 -13.247 1.00 15.11 H new ATOM 0 HA LEU A 424 -9.271 7.409 -12.002 1.00 34.33 H new ATOM 0 HB2 LEU A 424 -8.193 8.820 -14.322 1.00 73.54 H new ATOM 0 HB3 LEU A 424 -9.362 7.630 -14.859 1.00 73.54 H new ATOM 0 HG LEU A 424 -10.986 8.536 -13.123 1.00 3.15 H new ATOM 0 HD11 LEU A 424 -10.511 10.772 -12.180 1.00 43.52 H new ATOM 0 HD12 LEU A 424 -9.315 9.577 -11.624 1.00 43.52 H new ATOM 0 HD13 LEU A 424 -8.885 10.736 -12.904 1.00 43.52 H new ATOM 0 HD21 LEU A 424 -11.495 10.575 -14.463 1.00 25.11 H new ATOM 0 HD22 LEU A 424 -9.865 10.509 -15.174 1.00 25.11 H new ATOM 0 HD23 LEU A 424 -11.040 9.218 -15.521 1.00 25.11 H new ATOM 633 N HIS A 425 -9.692 5.110 -12.830 1.00 4.33 N ATOM 634 CA HIS A 425 -9.883 3.710 -13.202 1.00 54.30 C ATOM 635 C HIS A 425 -11.369 3.404 -13.368 1.00 71.10 C ATOM 636 O HIS A 425 -12.188 3.768 -12.522 1.00 21.21 O ATOM 637 CB HIS A 425 -9.277 2.798 -12.125 1.00 43.30 C ATOM 638 CG HIS A 425 -8.919 1.463 -12.724 1.00 64.52 C ATOM 639 ND1 HIS A 425 -7.657 0.908 -12.586 1.00 15.41 N ATOM 640 CD2 HIS A 425 -9.645 0.564 -13.465 1.00 54.12 C ATOM 641 CE1 HIS A 425 -7.661 -0.274 -13.230 1.00 60.44 C ATOM 642 NE2 HIS A 425 -8.849 -0.532 -13.784 1.00 74.54 N ATOM 0 H HIS A 425 -10.378 5.469 -12.166 1.00 4.33 H new ATOM 0 HA HIS A 425 -9.380 3.526 -14.152 1.00 54.30 H new ATOM 0 HB2 HIS A 425 -8.389 3.265 -11.699 1.00 43.30 H new ATOM 0 HB3 HIS A 425 -9.988 2.662 -11.310 1.00 43.30 H new ATOM 0 HD1 HIS A 425 -6.868 1.320 -12.087 1.00 15.41 H new ATOM 0 HD2 HIS A 425 -10.678 0.688 -13.756 1.00 54.12 H new ATOM 0 HE1 HIS A 425 -6.808 -0.933 -13.291 1.00 60.44 H new ATOM 651 N LEU A 426 -11.709 2.737 -14.468 1.00 14.52 N ATOM 652 CA LEU A 426 -13.101 2.383 -14.747 1.00 23.04 C ATOM 653 C LEU A 426 -13.324 0.900 -14.491 1.00 73.24 C ATOM 654 O LEU A 426 -12.637 0.049 -15.057 1.00 13.21 O ATOM 655 CB LEU A 426 -13.442 2.722 -16.205 1.00 14.44 C ATOM 656 CG LEU A 426 -13.840 4.199 -16.319 1.00 72.44 C ATOM 657 CD1 LEU A 426 -12.813 5.075 -15.592 1.00 40.20 C ATOM 658 CD2 LEU A 426 -13.900 4.602 -17.795 1.00 65.30 C ATOM 0 H LEU A 426 -11.044 2.431 -15.179 1.00 14.52 H new ATOM 0 HA LEU A 426 -13.752 2.955 -14.087 1.00 23.04 H new ATOM 0 HB2 LEU A 426 -12.584 2.517 -16.845 1.00 14.44 H new ATOM 0 HB3 LEU A 426 -14.258 2.089 -16.553 1.00 14.44 H new ATOM 0 HG LEU A 426 -14.819 4.340 -15.862 1.00 72.44 H new ATOM 0 HD11 LEU A 426 -13.103 6.122 -15.678 1.00 40.20 H new ATOM 0 HD12 LEU A 426 -12.775 4.794 -14.540 1.00 40.20 H new ATOM 0 HD13 LEU A 426 -11.830 4.933 -16.041 1.00 40.20 H new ATOM 0 HD21 LEU A 426 -14.183 5.652 -17.874 1.00 65.30 H new ATOM 0 HD22 LEU A 426 -12.922 4.454 -18.253 1.00 65.30 H new ATOM 0 HD23 LEU A 426 -14.638 3.987 -18.310 1.00 65.30 H new ATOM 670 N LEU A 427 -14.295 0.602 -13.634 1.00 41.31 N ATOM 671 CA LEU A 427 -14.613 -0.789 -13.304 1.00 62.43 C ATOM 672 C LEU A 427 -16.130 -1.016 -13.303 1.00 24.53 C ATOM 673 O LEU A 427 -16.885 -0.119 -12.931 1.00 11.44 O ATOM 674 CB LEU A 427 -14.045 -1.141 -11.923 1.00 21.01 C ATOM 675 CG LEU A 427 -12.515 -0.940 -11.914 1.00 2.35 C ATOM 676 CD1 LEU A 427 -12.173 0.448 -11.360 1.00 70.22 C ATOM 677 CD2 LEU A 427 -11.859 -2.007 -11.032 1.00 31.35 C ATOM 0 H LEU A 427 -14.872 1.295 -13.158 1.00 41.31 H new ATOM 0 HA LEU A 427 -14.163 -1.431 -14.061 1.00 62.43 H new ATOM 0 HB2 LEU A 427 -14.507 -0.514 -11.160 1.00 21.01 H new ATOM 0 HB3 LEU A 427 -14.286 -2.175 -11.675 1.00 21.01 H new ATOM 0 HG LEU A 427 -12.142 -1.026 -12.935 1.00 2.35 H new ATOM 0 HD11 LEU A 427 -11.091 0.582 -11.357 1.00 70.22 H new ATOM 0 HD12 LEU A 427 -12.632 1.213 -11.987 1.00 70.22 H new ATOM 0 HD13 LEU A 427 -12.553 0.537 -10.342 1.00 70.22 H new ATOM 0 HD21 LEU A 427 -10.779 -1.862 -11.028 1.00 31.35 H new ATOM 0 HD22 LEU A 427 -12.240 -1.923 -10.014 1.00 31.35 H new ATOM 0 HD23 LEU A 427 -12.091 -2.997 -11.425 1.00 31.35 H new ATOM 689 N PRO A 428 -16.598 -2.187 -13.689 1.00 13.12 N ATOM 690 CA PRO A 428 -15.746 -3.328 -14.154 1.00 20.35 C ATOM 691 C PRO A 428 -15.269 -3.125 -15.592 1.00 21.02 C ATOM 692 O PRO A 428 -16.001 -2.592 -16.426 1.00 1.12 O ATOM 693 CB PRO A 428 -16.686 -4.532 -14.053 1.00 62.42 C ATOM 694 CG PRO A 428 -18.051 -3.969 -14.278 1.00 0.24 C ATOM 695 CD PRO A 428 -18.028 -2.544 -13.714 1.00 22.51 C ATOM 0 HA PRO A 428 -14.836 -3.441 -13.564 1.00 20.35 H new ATOM 0 HB2 PRO A 428 -16.442 -5.288 -14.799 1.00 62.42 H new ATOM 0 HB3 PRO A 428 -16.612 -5.011 -13.077 1.00 62.42 H new ATOM 0 HG2 PRO A 428 -18.299 -3.963 -15.339 1.00 0.24 H new ATOM 0 HG3 PRO A 428 -18.808 -4.573 -13.777 1.00 0.24 H new ATOM 0 HD2 PRO A 428 -18.599 -1.859 -14.341 1.00 22.51 H new ATOM 0 HD3 PRO A 428 -18.466 -2.503 -12.717 1.00 22.51 H new ATOM 703 N GLY A 429 -14.042 -3.550 -15.878 1.00 22.12 N ATOM 704 CA GLY A 429 -13.495 -3.400 -17.222 1.00 42.31 C ATOM 705 C GLY A 429 -12.123 -4.056 -17.335 1.00 0.22 C ATOM 706 O GLY A 429 -11.562 -4.523 -16.344 1.00 24.15 O ATOM 0 H GLY A 429 -13.415 -3.995 -15.208 1.00 22.12 H new ATOM 0 HA2 GLY A 429 -14.176 -3.847 -17.947 1.00 42.31 H new ATOM 0 HA3 GLY A 429 -13.416 -2.341 -17.470 1.00 42.31 H new ATOM 710 N ALA A 430 -11.590 -4.086 -18.553 1.00 34.32 N ATOM 711 CA ALA A 430 -10.281 -4.686 -18.792 1.00 72.13 C ATOM 712 C ALA A 430 -9.168 -3.702 -18.444 1.00 3.32 C ATOM 713 O ALA A 430 -9.028 -2.658 -19.079 1.00 22.42 O ATOM 714 CB ALA A 430 -10.157 -5.100 -20.259 1.00 2.21 C ATOM 0 H ALA A 430 -12.041 -3.705 -19.385 1.00 34.32 H new ATOM 0 HA ALA A 430 -10.184 -5.566 -18.156 1.00 72.13 H new ATOM 0 HB1 ALA A 430 -9.178 -5.547 -20.429 1.00 2.21 H new ATOM 0 HB2 ALA A 430 -10.934 -5.826 -20.499 1.00 2.21 H new ATOM 0 HB3 ALA A 430 -10.271 -4.223 -20.896 1.00 2.21 H new ATOM 720 N SER A 431 -8.379 -4.047 -17.431 1.00 42.11 N ATOM 721 CA SER A 431 -7.278 -3.191 -16.999 1.00 20.21 C ATOM 722 C SER A 431 -6.404 -2.792 -18.185 1.00 52.23 C ATOM 723 O SER A 431 -5.505 -1.962 -18.052 1.00 3.22 O ATOM 724 CB SER A 431 -6.434 -3.928 -15.955 1.00 2.40 C ATOM 725 OG SER A 431 -5.875 -2.983 -15.052 1.00 23.21 O ATOM 0 H SER A 431 -8.480 -4.909 -16.896 1.00 42.11 H new ATOM 0 HA SER A 431 -7.694 -2.284 -16.559 1.00 20.21 H new ATOM 0 HB2 SER A 431 -7.050 -4.646 -15.413 1.00 2.40 H new ATOM 0 HB3 SER A 431 -5.641 -4.494 -16.445 1.00 2.40 H new ATOM 0 HG SER A 431 -5.335 -3.451 -14.381 1.00 23.21 H new ATOM 731 N LYS A 432 -6.674 -3.398 -19.338 1.00 43.31 N ATOM 732 CA LYS A 432 -5.915 -3.118 -20.556 1.00 73.14 C ATOM 733 C LYS A 432 -5.443 -1.670 -20.601 1.00 32.14 C ATOM 734 O LYS A 432 -4.243 -1.396 -20.573 1.00 64.12 O ATOM 735 CB LYS A 432 -6.781 -3.408 -21.786 1.00 23.23 C ATOM 736 CG LYS A 432 -7.025 -4.921 -21.913 1.00 14.12 C ATOM 737 CD LYS A 432 -5.876 -5.575 -22.691 1.00 51.13 C ATOM 738 CE LYS A 432 -6.172 -7.064 -22.879 1.00 21.31 C ATOM 739 NZ LYS A 432 -6.037 -7.767 -21.573 1.00 43.01 N ATOM 0 H LYS A 432 -7.415 -4.089 -19.456 1.00 43.31 H new ATOM 0 HA LYS A 432 -5.037 -3.764 -20.557 1.00 73.14 H new ATOM 0 HB2 LYS A 432 -7.733 -2.884 -21.702 1.00 23.23 H new ATOM 0 HB3 LYS A 432 -6.289 -3.034 -22.684 1.00 23.23 H new ATOM 0 HG2 LYS A 432 -7.106 -5.369 -20.923 1.00 14.12 H new ATOM 0 HG3 LYS A 432 -7.971 -5.103 -22.423 1.00 14.12 H new ATOM 0 HD2 LYS A 432 -5.757 -5.091 -23.661 1.00 51.13 H new ATOM 0 HD3 LYS A 432 -4.937 -5.445 -22.153 1.00 51.13 H new ATOM 0 HE2 LYS A 432 -7.179 -7.198 -23.274 1.00 21.31 H new ATOM 0 HE3 LYS A 432 -5.484 -7.493 -23.608 1.00 21.31 H new ATOM 0 HZ1 LYS A 432 -6.019 -8.795 -21.732 1.00 43.01 H new ATOM 0 HZ2 LYS A 432 -5.153 -7.473 -21.110 1.00 43.01 H new ATOM 0 HZ3 LYS A 432 -6.844 -7.525 -20.964 1.00 43.01 H new ATOM 753 N SER A 433 -6.393 -0.750 -20.678 1.00 34.32 N ATOM 754 CA SER A 433 -6.062 0.673 -20.737 1.00 1.33 C ATOM 755 C SER A 433 -7.154 1.527 -20.096 1.00 10.40 C ATOM 756 O SER A 433 -7.142 2.752 -20.219 1.00 62.45 O ATOM 757 CB SER A 433 -5.874 1.102 -22.193 1.00 10.03 C ATOM 758 OG SER A 433 -5.610 2.497 -22.241 1.00 21.44 O ATOM 0 H SER A 433 -7.392 -0.956 -20.701 1.00 34.32 H new ATOM 0 HA SER A 433 -5.137 0.824 -20.181 1.00 1.33 H new ATOM 0 HB2 SER A 433 -5.050 0.549 -22.644 1.00 10.03 H new ATOM 0 HB3 SER A 433 -6.768 0.869 -22.771 1.00 10.03 H new ATOM 0 HG SER A 433 -6.277 2.975 -21.705 1.00 21.44 H new ATOM 764 N ASN A 434 -8.095 0.884 -19.412 1.00 61.20 N ATOM 765 CA ASN A 434 -9.176 1.607 -18.764 1.00 52.53 C ATOM 766 C ASN A 434 -8.661 2.358 -17.537 1.00 20.13 C ATOM 767 O ASN A 434 -9.430 2.698 -16.636 1.00 43.13 O ATOM 768 CB ASN A 434 -10.273 0.620 -18.357 1.00 75.42 C ATOM 769 CG ASN A 434 -9.861 -0.171 -17.115 1.00 21.45 C ATOM 770 OD1 ASN A 434 -9.866 -1.474 -17.154 1.00 22.25 O flip ATOM 771 ND2 ASN A 434 -9.534 0.412 -16.082 1.00 42.13 N flip ATOM 0 H ASN A 434 -8.129 -0.129 -19.294 1.00 61.20 H new ATOM 0 HA ASN A 434 -9.585 2.337 -19.463 1.00 52.53 H new ATOM 0 HB2 ASN A 434 -11.199 1.160 -18.159 1.00 75.42 H new ATOM 0 HB3 ASN A 434 -10.474 -0.066 -19.180 1.00 75.42 H new ATOM 0 HD21 ASN A 434 -9.530 1.432 -16.051 1.00 42.13 H new ATOM 0 HD22 ASN A 434 -9.267 -0.124 -15.256 1.00 42.13 H new ATOM 778 N LYS A 435 -7.351 2.605 -17.504 1.00 44.11 N ATOM 779 CA LYS A 435 -6.730 3.298 -16.388 1.00 34.11 C ATOM 780 C LYS A 435 -5.804 4.413 -16.885 1.00 32.25 C ATOM 781 O LYS A 435 -4.863 4.160 -17.637 1.00 44.31 O ATOM 782 CB LYS A 435 -5.926 2.288 -15.560 1.00 32.33 C ATOM 783 CG LYS A 435 -5.500 1.109 -16.447 1.00 45.44 C ATOM 784 CD LYS A 435 -4.371 0.319 -15.765 1.00 63.41 C ATOM 785 CE LYS A 435 -3.010 0.927 -16.125 1.00 73.34 C ATOM 786 NZ LYS A 435 -1.991 0.485 -15.132 1.00 41.12 N ATOM 0 H LYS A 435 -6.702 2.332 -18.243 1.00 44.11 H new ATOM 0 HA LYS A 435 -7.509 3.751 -15.774 1.00 34.11 H new ATOM 0 HB2 LYS A 435 -5.046 2.771 -15.135 1.00 32.33 H new ATOM 0 HB3 LYS A 435 -6.527 1.928 -14.725 1.00 32.33 H new ATOM 0 HG2 LYS A 435 -6.353 0.455 -16.631 1.00 45.44 H new ATOM 0 HG3 LYS A 435 -5.164 1.476 -17.417 1.00 45.44 H new ATOM 0 HD2 LYS A 435 -4.509 0.332 -14.684 1.00 63.41 H new ATOM 0 HD3 LYS A 435 -4.406 -0.724 -16.078 1.00 63.41 H new ATOM 0 HE2 LYS A 435 -2.715 0.617 -17.128 1.00 73.34 H new ATOM 0 HE3 LYS A 435 -3.077 2.015 -16.134 1.00 73.34 H new ATOM 0 HZ1 LYS A 435 -1.068 0.897 -15.375 1.00 41.12 H new ATOM 0 HZ2 LYS A 435 -2.272 0.802 -14.182 1.00 41.12 H new ATOM 0 HZ3 LYS A 435 -1.921 -0.553 -15.144 1.00 41.12 H new ATOM 800 N LEU A 436 -6.070 5.640 -16.438 1.00 44.04 N ATOM 801 CA LEU A 436 -5.248 6.793 -16.816 1.00 4.44 C ATOM 802 C LEU A 436 -4.680 7.449 -15.566 1.00 25.43 C ATOM 803 O LEU A 436 -5.387 7.630 -14.575 1.00 53.44 O ATOM 804 CB LEU A 436 -6.082 7.819 -17.598 1.00 74.23 C ATOM 805 CG LEU A 436 -6.198 7.391 -19.072 1.00 74.33 C ATOM 806 CD1 LEU A 436 -7.452 8.012 -19.696 1.00 51.21 C ATOM 807 CD2 LEU A 436 -4.968 7.868 -19.855 1.00 50.52 C ATOM 0 H LEU A 436 -6.846 5.863 -15.815 1.00 44.04 H new ATOM 0 HA LEU A 436 -4.434 6.445 -17.452 1.00 4.44 H new ATOM 0 HB2 LEU A 436 -7.075 7.905 -17.157 1.00 74.23 H new ATOM 0 HB3 LEU A 436 -5.618 8.803 -17.532 1.00 74.23 H new ATOM 0 HG LEU A 436 -6.262 6.304 -19.116 1.00 74.33 H new ATOM 0 HD11 LEU A 436 -7.529 7.706 -20.739 1.00 51.21 H new ATOM 0 HD12 LEU A 436 -8.334 7.674 -19.152 1.00 51.21 H new ATOM 0 HD13 LEU A 436 -7.386 9.099 -19.641 1.00 51.21 H new ATOM 0 HD21 LEU A 436 -5.058 7.561 -20.897 1.00 50.52 H new ATOM 0 HD22 LEU A 436 -4.902 8.955 -19.801 1.00 50.52 H new ATOM 0 HD23 LEU A 436 -4.069 7.428 -19.424 1.00 50.52 H new ATOM 819 N ARG A 437 -3.395 7.783 -15.608 1.00 62.41 N ATOM 820 CA ARG A 437 -2.736 8.397 -14.458 1.00 11.24 C ATOM 821 C ARG A 437 -2.626 9.908 -14.621 1.00 25.52 C ATOM 822 O ARG A 437 -2.329 10.416 -15.703 1.00 53.14 O ATOM 823 CB ARG A 437 -1.338 7.801 -14.285 1.00 62.41 C ATOM 824 CG ARG A 437 -0.492 8.118 -15.519 1.00 15.34 C ATOM 825 CD ARG A 437 0.800 7.301 -15.476 1.00 23.51 C ATOM 826 NE ARG A 437 1.708 7.736 -16.531 1.00 31.31 N ATOM 827 CZ ARG A 437 2.318 8.915 -16.472 1.00 53.30 C ATOM 828 NH1 ARG A 437 2.107 9.707 -15.455 1.00 12.42 N ATOM 829 NH2 ARG A 437 3.125 9.282 -17.430 1.00 33.11 N ATOM 0 H ARG A 437 -2.792 7.641 -16.418 1.00 62.41 H new ATOM 0 HA ARG A 437 -3.341 8.192 -13.575 1.00 11.24 H new ATOM 0 HB2 ARG A 437 -0.865 8.209 -13.392 1.00 62.41 H new ATOM 0 HB3 ARG A 437 -1.406 6.722 -14.145 1.00 62.41 H new ATOM 0 HG2 ARG A 437 -1.051 7.886 -16.426 1.00 15.34 H new ATOM 0 HG3 ARG A 437 -0.261 9.183 -15.551 1.00 15.34 H new ATOM 0 HD2 ARG A 437 1.279 7.416 -14.504 1.00 23.51 H new ATOM 0 HD3 ARG A 437 0.573 6.242 -15.596 1.00 23.51 H new ATOM 0 HE ARG A 437 1.878 7.124 -17.329 1.00 31.31 H new ATOM 0 HH11 ARG A 437 1.475 9.420 -14.708 1.00 12.42 H new ATOM 0 HH12 ARG A 437 2.574 10.612 -15.408 1.00 12.42 H new ATOM 0 HH21 ARG A 437 3.288 8.664 -18.225 1.00 33.11 H new ATOM 0 HH22 ARG A 437 3.593 10.187 -17.384 1.00 33.11 H new ATOM 843 N THR A 438 -2.875 10.610 -13.524 1.00 31.11 N ATOM 844 CA THR A 438 -2.820 12.067 -13.501 1.00 54.11 C ATOM 845 C THR A 438 -1.414 12.544 -13.134 1.00 23.14 C ATOM 846 O THR A 438 -0.546 11.741 -12.792 1.00 33.23 O ATOM 847 CB THR A 438 -3.827 12.569 -12.457 1.00 24.24 C ATOM 848 OG1 THR A 438 -4.868 11.611 -12.327 1.00 5.12 O ATOM 849 CG2 THR A 438 -4.430 13.908 -12.876 1.00 10.23 C ATOM 0 H THR A 438 -3.120 10.189 -12.628 1.00 31.11 H new ATOM 0 HA THR A 438 -3.066 12.460 -14.487 1.00 54.11 H new ATOM 0 HB THR A 438 -3.309 12.706 -11.508 1.00 24.24 H new ATOM 0 HG1 THR A 438 -5.736 12.060 -12.397 1.00 5.12 H new ATOM 0 HG21 THR A 438 -5.140 14.240 -12.119 1.00 10.23 H new ATOM 0 HG22 THR A 438 -3.636 14.648 -12.979 1.00 10.23 H new ATOM 0 HG23 THR A 438 -4.945 13.793 -13.830 1.00 10.23 H new ATOM 857 N LYS A 439 -1.205 13.855 -13.192 1.00 0.13 N ATOM 858 CA LYS A 439 0.088 14.431 -12.849 1.00 45.04 C ATOM 859 C LYS A 439 0.322 14.315 -11.343 1.00 71.11 C ATOM 860 O LYS A 439 -0.625 14.147 -10.575 1.00 73.03 O ATOM 861 CB LYS A 439 0.124 15.904 -13.272 1.00 2.51 C ATOM 862 CG LYS A 439 0.390 16.014 -14.783 1.00 35.43 C ATOM 863 CD LYS A 439 1.898 16.006 -15.052 1.00 41.21 C ATOM 864 CE LYS A 439 2.149 16.195 -16.550 1.00 15.11 C ATOM 865 NZ LYS A 439 3.603 16.040 -16.834 1.00 61.11 N ATOM 0 H LYS A 439 -1.912 14.535 -13.472 1.00 0.13 H new ATOM 0 HA LYS A 439 0.875 13.889 -13.373 1.00 45.04 H new ATOM 0 HB2 LYS A 439 -0.823 16.384 -13.026 1.00 2.51 H new ATOM 0 HB3 LYS A 439 0.902 16.430 -12.719 1.00 2.51 H new ATOM 0 HG2 LYS A 439 -0.085 15.184 -15.306 1.00 35.43 H new ATOM 0 HG3 LYS A 439 -0.052 16.931 -15.173 1.00 35.43 H new ATOM 0 HD2 LYS A 439 2.383 16.802 -14.488 1.00 41.21 H new ATOM 0 HD3 LYS A 439 2.334 15.065 -14.715 1.00 41.21 H new ATOM 0 HE2 LYS A 439 1.576 15.464 -17.121 1.00 15.11 H new ATOM 0 HE3 LYS A 439 1.809 17.182 -16.865 1.00 15.11 H new ATOM 0 HZ1 LYS A 439 3.774 16.168 -17.852 1.00 61.11 H new ATOM 0 HZ2 LYS A 439 4.139 16.754 -16.300 1.00 61.11 H new ATOM 0 HZ3 LYS A 439 3.913 15.089 -16.548 1.00 61.11 H new ATOM 879 N THR A 440 1.587 14.393 -10.924 1.00 23.10 N ATOM 880 CA THR A 440 1.928 14.280 -9.503 1.00 64.31 C ATOM 881 C THR A 440 2.522 15.582 -8.968 1.00 73.20 C ATOM 882 O THR A 440 3.513 16.088 -9.495 1.00 4.12 O ATOM 883 CB THR A 440 2.942 13.147 -9.308 1.00 51.51 C ATOM 884 OG1 THR A 440 2.345 11.912 -9.681 1.00 70.53 O ATOM 885 CG2 THR A 440 3.377 13.086 -7.841 1.00 51.03 C ATOM 0 H THR A 440 2.386 14.533 -11.542 1.00 23.10 H new ATOM 0 HA THR A 440 1.012 14.067 -8.952 1.00 64.31 H new ATOM 0 HB THR A 440 3.817 13.333 -9.931 1.00 51.51 H new ATOM 0 HG1 THR A 440 2.992 11.186 -9.559 1.00 70.53 H new ATOM 0 HG21 THR A 440 4.098 12.279 -7.708 1.00 51.03 H new ATOM 0 HG22 THR A 440 3.837 14.033 -7.558 1.00 51.03 H new ATOM 0 HG23 THR A 440 2.507 12.903 -7.211 1.00 51.03 H new ATOM 893 N LEU A 441 1.917 16.107 -7.903 1.00 72.31 N ATOM 894 CA LEU A 441 2.387 17.331 -7.278 1.00 4.04 C ATOM 895 C LEU A 441 3.311 16.984 -6.114 1.00 33.32 C ATOM 896 O LEU A 441 3.228 15.892 -5.554 1.00 0.20 O ATOM 897 CB LEU A 441 1.186 18.139 -6.776 1.00 73.30 C ATOM 898 CG LEU A 441 0.581 18.935 -7.935 1.00 63.15 C ATOM 899 CD1 LEU A 441 0.066 17.970 -9.005 1.00 53.42 C ATOM 900 CD2 LEU A 441 -0.578 19.791 -7.419 1.00 32.44 C ATOM 0 H LEU A 441 1.096 15.697 -7.457 1.00 72.31 H new ATOM 0 HA LEU A 441 2.939 17.928 -8.004 1.00 4.04 H new ATOM 0 HB2 LEU A 441 0.437 17.470 -6.351 1.00 73.30 H new ATOM 0 HB3 LEU A 441 1.497 18.816 -5.980 1.00 73.30 H new ATOM 0 HG LEU A 441 1.345 19.582 -8.367 1.00 63.15 H new ATOM 0 HD11 LEU A 441 -0.365 18.538 -9.830 1.00 53.42 H new ATOM 0 HD12 LEU A 441 0.892 17.362 -9.375 1.00 53.42 H new ATOM 0 HD13 LEU A 441 -0.697 17.322 -8.574 1.00 53.42 H new ATOM 0 HD21 LEU A 441 -1.008 20.357 -8.245 1.00 32.44 H new ATOM 0 HD22 LEU A 441 -1.342 19.146 -6.985 1.00 32.44 H new ATOM 0 HD23 LEU A 441 -0.211 20.480 -6.659 1.00 32.44 H new ATOM 912 N ARG A 442 4.208 17.906 -5.778 1.00 31.41 N ATOM 913 CA ARG A 442 5.174 17.675 -4.696 1.00 74.32 C ATOM 914 C ARG A 442 5.018 18.675 -3.550 1.00 21.34 C ATOM 915 O ARG A 442 4.533 19.792 -3.734 1.00 73.05 O ATOM 916 CB ARG A 442 6.594 17.774 -5.255 1.00 40.20 C ATOM 917 CG ARG A 442 6.749 19.086 -6.028 1.00 45.02 C ATOM 918 CD ARG A 442 8.227 19.328 -6.332 1.00 61.25 C ATOM 919 NE ARG A 442 8.952 19.637 -5.104 1.00 32.24 N ATOM 920 CZ ARG A 442 10.194 20.105 -5.138 1.00 71.14 C ATOM 921 NH1 ARG A 442 10.789 20.297 -6.285 1.00 34.52 N ATOM 922 NH2 ARG A 442 10.822 20.373 -4.026 1.00 64.22 N ATOM 0 H ARG A 442 4.290 18.815 -6.232 1.00 31.41 H new ATOM 0 HA ARG A 442 4.982 16.680 -4.295 1.00 74.32 H new ATOM 0 HB2 ARG A 442 7.320 17.730 -4.443 1.00 40.20 H new ATOM 0 HB3 ARG A 442 6.798 16.927 -5.910 1.00 40.20 H new ATOM 0 HG2 ARG A 442 6.178 19.043 -6.956 1.00 45.02 H new ATOM 0 HG3 ARG A 442 6.347 19.914 -5.444 1.00 45.02 H new ATOM 0 HD2 ARG A 442 8.658 18.445 -6.804 1.00 61.25 H new ATOM 0 HD3 ARG A 442 8.330 20.150 -7.040 1.00 61.25 H new ATOM 0 HE ARG A 442 8.496 19.491 -4.203 1.00 32.24 H new ATOM 0 HH11 ARG A 442 10.299 20.087 -7.155 1.00 34.52 H new ATOM 0 HH12 ARG A 442 11.743 20.657 -6.311 1.00 34.52 H new ATOM 0 HH21 ARG A 442 10.359 20.223 -3.130 1.00 64.22 H new ATOM 0 HH22 ARG A 442 11.776 20.732 -4.053 1.00 64.22 H new ATOM 936 N ASN A 443 5.468 18.251 -2.369 1.00 24.52 N ATOM 937 CA ASN A 443 5.428 19.087 -1.167 1.00 43.41 C ATOM 938 C ASN A 443 4.136 19.893 -1.063 1.00 2.01 C ATOM 939 O ASN A 443 4.107 21.075 -1.406 1.00 15.14 O ATOM 940 CB ASN A 443 6.620 20.045 -1.167 1.00 24.23 C ATOM 941 CG ASN A 443 7.923 19.256 -1.100 1.00 53.02 C ATOM 942 OD1 ASN A 443 7.883 17.955 -0.996 1.00 51.13 O flip ATOM 943 ND2 ASN A 443 9.007 19.839 -1.142 1.00 40.41 N flip ATOM 0 H ASN A 443 5.868 17.325 -2.218 1.00 24.52 H new ATOM 0 HA ASN A 443 5.473 18.419 -0.306 1.00 43.41 H new ATOM 0 HB2 ASN A 443 6.603 20.659 -2.067 1.00 24.23 H new ATOM 0 HB3 ASN A 443 6.552 20.723 -0.317 1.00 24.23 H new ATOM 0 HD21 ASN A 443 9.037 20.855 -1.223 1.00 40.41 H new ATOM 0 HD22 ASN A 443 9.875 19.306 -1.096 1.00 40.41 H new ATOM 950 N THR A 444 3.072 19.259 -0.574 1.00 24.04 N ATOM 951 CA THR A 444 1.794 19.955 -0.422 1.00 13.44 C ATOM 952 C THR A 444 0.902 19.269 0.613 1.00 65.43 C ATOM 953 O THR A 444 1.270 18.252 1.196 1.00 2.51 O ATOM 954 CB THR A 444 1.060 20.014 -1.763 1.00 52.24 C ATOM 955 OG1 THR A 444 -0.302 20.360 -1.537 1.00 75.00 O ATOM 956 CG2 THR A 444 1.136 18.650 -2.452 1.00 60.02 C ATOM 0 H THR A 444 3.066 18.282 -0.281 1.00 24.04 H new ATOM 0 HA THR A 444 2.010 20.966 -0.076 1.00 13.44 H new ATOM 0 HB THR A 444 1.527 20.764 -2.402 1.00 52.24 H new ATOM 0 HG1 THR A 444 -0.380 21.331 -1.434 1.00 75.00 H new ATOM 0 HG21 THR A 444 0.612 18.695 -3.407 1.00 60.02 H new ATOM 0 HG22 THR A 444 2.180 18.386 -2.623 1.00 60.02 H new ATOM 0 HG23 THR A 444 0.670 17.896 -1.818 1.00 60.02 H new ATOM 964 N ARG A 445 -0.280 19.844 0.823 1.00 23.24 N ATOM 965 CA ARG A 445 -1.249 19.306 1.776 1.00 50.23 C ATOM 966 C ARG A 445 -2.656 19.644 1.297 1.00 75.31 C ATOM 967 O ARG A 445 -3.655 19.128 1.812 1.00 20.31 O ATOM 968 CB ARG A 445 -1.016 19.906 3.164 1.00 44.14 C ATOM 969 CG ARG A 445 -1.221 21.421 3.108 1.00 31.31 C ATOM 970 CD ARG A 445 -0.687 22.057 4.392 1.00 60.23 C ATOM 971 NE ARG A 445 -1.082 21.264 5.551 1.00 31.02 N ATOM 972 CZ ARG A 445 -0.782 21.653 6.785 1.00 14.30 C ATOM 973 NH1 ARG A 445 -0.122 22.763 6.976 1.00 50.24 N ATOM 974 NH2 ARG A 445 -1.147 20.926 7.805 1.00 22.22 N ATOM 0 H ARG A 445 -0.592 20.688 0.343 1.00 23.24 H new ATOM 0 HA ARG A 445 -1.130 18.224 1.841 1.00 50.23 H new ATOM 0 HB2 ARG A 445 -1.704 19.462 3.884 1.00 44.14 H new ATOM 0 HB3 ARG A 445 -0.006 19.678 3.505 1.00 44.14 H new ATOM 0 HG2 ARG A 445 -0.705 21.836 2.242 1.00 31.31 H new ATOM 0 HG3 ARG A 445 -2.280 21.651 2.989 1.00 31.31 H new ATOM 0 HD2 ARG A 445 0.400 22.130 4.346 1.00 60.23 H new ATOM 0 HD3 ARG A 445 -1.070 23.073 4.490 1.00 60.23 H new ATOM 0 HE ARG A 445 -1.598 20.395 5.411 1.00 31.02 H new ATOM 0 HH11 ARG A 445 0.163 23.331 6.178 1.00 50.24 H new ATOM 0 HH12 ARG A 445 0.109 23.063 7.923 1.00 50.24 H new ATOM 0 HH21 ARG A 445 -1.663 20.059 7.655 1.00 22.22 H new ATOM 0 HH22 ARG A 445 -0.917 21.225 8.753 1.00 22.22 H new ATOM 988 N ASN A 446 -2.705 20.524 0.298 1.00 72.21 N ATOM 989 CA ASN A 446 -3.952 20.973 -0.303 1.00 43.52 C ATOM 990 C ASN A 446 -3.688 21.256 -1.785 1.00 20.41 C ATOM 991 O ASN A 446 -3.542 22.408 -2.195 1.00 72.12 O ATOM 992 CB ASN A 446 -4.430 22.242 0.409 1.00 22.51 C ATOM 993 CG ASN A 446 -5.939 22.400 0.259 1.00 34.34 C ATOM 994 OD1 ASN A 446 -6.718 22.049 1.247 1.00 2.44 O flip ATOM 995 ND2 ASN A 446 -6.419 22.852 -0.779 1.00 13.10 N flip ATOM 0 H ASN A 446 -1.874 20.946 -0.117 1.00 72.21 H new ATOM 0 HA ASN A 446 -4.726 20.212 -0.206 1.00 43.52 H new ATOM 0 HB2 ASN A 446 -4.166 22.195 1.466 1.00 22.51 H new ATOM 0 HB3 ASN A 446 -3.924 23.113 -0.007 1.00 22.51 H new ATOM 0 HD21 ASN A 446 -5.806 23.125 -1.548 1.00 13.10 H new ATOM 0 HD22 ASN A 446 -7.430 22.954 -0.871 1.00 13.10 H new ATOM 1002 N PRO A 447 -3.557 20.219 -2.570 1.00 12.41 N ATOM 1003 CA PRO A 447 -3.222 20.322 -4.022 1.00 10.03 C ATOM 1004 C PRO A 447 -4.417 20.545 -4.945 1.00 14.23 C ATOM 1005 O PRO A 447 -5.534 20.107 -4.674 1.00 31.12 O ATOM 1006 CB PRO A 447 -2.595 18.959 -4.298 1.00 72.20 C ATOM 1007 CG PRO A 447 -3.365 18.022 -3.429 1.00 64.41 C ATOM 1008 CD PRO A 447 -3.715 18.811 -2.161 1.00 12.45 C ATOM 0 HA PRO A 447 -2.590 21.188 -4.220 1.00 10.03 H new ATOM 0 HB2 PRO A 447 -2.679 18.687 -5.350 1.00 72.20 H new ATOM 0 HB3 PRO A 447 -1.533 18.951 -4.051 1.00 72.20 H new ATOM 0 HG2 PRO A 447 -4.267 17.674 -3.933 1.00 64.41 H new ATOM 0 HG3 PRO A 447 -2.774 17.139 -3.188 1.00 64.41 H new ATOM 0 HD2 PRO A 447 -4.732 18.603 -1.828 1.00 12.45 H new ATOM 0 HD3 PRO A 447 -3.050 18.557 -1.335 1.00 12.45 H new ATOM 1016 N VAL A 448 -4.131 21.207 -6.064 1.00 11.32 N ATOM 1017 CA VAL A 448 -5.127 21.480 -7.093 1.00 1.23 C ATOM 1018 C VAL A 448 -4.616 20.921 -8.415 1.00 35.52 C ATOM 1019 O VAL A 448 -3.594 21.368 -8.932 1.00 44.35 O ATOM 1020 CB VAL A 448 -5.363 22.987 -7.215 1.00 23.22 C ATOM 1021 CG1 VAL A 448 -6.252 23.266 -8.435 1.00 64.45 C ATOM 1022 CG2 VAL A 448 -6.048 23.507 -5.935 1.00 74.33 C ATOM 0 H VAL A 448 -3.202 21.568 -6.281 1.00 11.32 H new ATOM 0 HA VAL A 448 -6.073 21.008 -6.828 1.00 1.23 H new ATOM 0 HB VAL A 448 -4.409 23.498 -7.341 1.00 23.22 H new ATOM 0 HG11 VAL A 448 -6.422 24.339 -8.524 1.00 64.45 H new ATOM 0 HG12 VAL A 448 -5.759 22.901 -9.336 1.00 64.45 H new ATOM 0 HG13 VAL A 448 -7.208 22.757 -8.313 1.00 64.45 H new ATOM 0 HG21 VAL A 448 -6.216 24.580 -6.023 1.00 74.33 H new ATOM 0 HG22 VAL A 448 -7.004 23.000 -5.802 1.00 74.33 H new ATOM 0 HG23 VAL A 448 -5.409 23.309 -5.074 1.00 74.33 H new ATOM 1032 N TRP A 449 -5.309 19.916 -8.945 1.00 54.24 N ATOM 1033 CA TRP A 449 -4.874 19.286 -10.191 1.00 63.24 C ATOM 1034 C TRP A 449 -5.434 19.997 -11.414 1.00 12.04 C ATOM 1035 O TRP A 449 -4.693 20.303 -12.348 1.00 34.41 O ATOM 1036 CB TRP A 449 -5.313 17.818 -10.206 1.00 53.40 C ATOM 1037 CG TRP A 449 -4.401 17.013 -9.338 1.00 13.11 C ATOM 1038 CD1 TRP A 449 -3.102 16.750 -9.607 1.00 53.33 C ATOM 1039 CD2 TRP A 449 -4.694 16.365 -8.067 1.00 51.22 C ATOM 1040 NE1 TRP A 449 -2.580 15.982 -8.583 1.00 70.52 N ATOM 1041 CE2 TRP A 449 -3.523 15.719 -7.612 1.00 64.25 C ATOM 1042 CE3 TRP A 449 -5.853 16.277 -7.275 1.00 61.42 C ATOM 1043 CZ2 TRP A 449 -3.499 15.010 -6.413 1.00 2.32 C ATOM 1044 CZ3 TRP A 449 -5.832 15.563 -6.066 1.00 34.33 C ATOM 1045 CH2 TRP A 449 -4.658 14.930 -5.637 1.00 10.22 C ATOM 0 H TRP A 449 -6.160 19.525 -8.540 1.00 54.24 H new ATOM 0 HA TRP A 449 -3.787 19.354 -10.235 1.00 63.24 H new ATOM 0 HB2 TRP A 449 -6.340 17.731 -9.851 1.00 53.40 H new ATOM 0 HB3 TRP A 449 -5.295 17.433 -11.226 1.00 53.40 H new ATOM 0 HD1 TRP A 449 -2.561 17.085 -10.479 1.00 53.33 H new ATOM 0 HE1 TRP A 449 -1.616 15.651 -8.550 1.00 70.52 H new ATOM 0 HE3 TRP A 449 -6.763 16.761 -7.598 1.00 61.42 H new ATOM 0 HZ2 TRP A 449 -2.591 14.526 -6.086 1.00 2.32 H new ATOM 0 HZ3 TRP A 449 -6.726 15.501 -5.463 1.00 34.33 H new ATOM 0 HH2 TRP A 449 -4.649 14.381 -4.707 1.00 10.22 H new ATOM 1056 N ASN A 450 -6.738 20.246 -11.424 1.00 73.22 N ATOM 1057 CA ASN A 450 -7.353 20.904 -12.569 1.00 34.35 C ATOM 1058 C ASN A 450 -6.832 20.276 -13.851 1.00 34.52 C ATOM 1059 O ASN A 450 -6.425 20.966 -14.785 1.00 22.41 O ATOM 1060 CB ASN A 450 -7.025 22.388 -12.547 1.00 64.30 C ATOM 1061 CG ASN A 450 -7.777 23.111 -13.658 1.00 41.54 C ATOM 1062 OD1 ASN A 450 -7.169 23.821 -14.460 1.00 22.33 O ATOM 1063 ND2 ASN A 450 -9.071 22.973 -13.753 1.00 52.45 N ATOM 0 H ASN A 450 -7.379 20.008 -10.668 1.00 73.22 H new ATOM 0 HA ASN A 450 -8.435 20.781 -12.521 1.00 34.35 H new ATOM 0 HB2 ASN A 450 -7.294 22.813 -11.580 1.00 64.30 H new ATOM 0 HB3 ASN A 450 -5.952 22.532 -12.671 1.00 64.30 H new ATOM 0 HD21 ASN A 450 -9.582 23.454 -14.493 1.00 52.45 H new ATOM 0 HD22 ASN A 450 -9.571 22.384 -13.087 1.00 52.45 H new ATOM 1070 N GLU A 451 -6.850 18.952 -13.869 1.00 54.51 N ATOM 1071 CA GLU A 451 -6.381 18.184 -15.017 1.00 13.40 C ATOM 1072 C GLU A 451 -7.554 17.510 -15.717 1.00 62.10 C ATOM 1073 O GLU A 451 -8.493 17.042 -15.065 1.00 63.13 O ATOM 1074 CB GLU A 451 -5.382 17.122 -14.557 1.00 15.53 C ATOM 1075 CG GLU A 451 -4.894 16.325 -15.769 1.00 11.41 C ATOM 1076 CD GLU A 451 -3.580 15.622 -15.443 1.00 51.31 C ATOM 1077 OE1 GLU A 451 -2.723 16.258 -14.853 1.00 34.41 O ATOM 1078 OE2 GLU A 451 -3.451 14.461 -15.789 1.00 32.53 O ATOM 0 H GLU A 451 -7.187 18.381 -13.094 1.00 54.51 H new ATOM 0 HA GLU A 451 -5.893 18.863 -15.716 1.00 13.40 H new ATOM 0 HB2 GLU A 451 -4.538 17.594 -14.054 1.00 15.53 H new ATOM 0 HB3 GLU A 451 -5.851 16.455 -13.834 1.00 15.53 H new ATOM 0 HG2 GLU A 451 -5.646 15.591 -16.057 1.00 11.41 H new ATOM 0 HG3 GLU A 451 -4.757 16.992 -16.620 1.00 11.41 H new ATOM 1085 N THR A 452 -7.493 17.471 -17.048 1.00 74.20 N ATOM 1086 CA THR A 452 -8.553 16.865 -17.850 1.00 22.31 C ATOM 1087 C THR A 452 -8.123 15.516 -18.418 1.00 5.33 C ATOM 1088 O THR A 452 -7.355 15.451 -19.378 1.00 51.01 O ATOM 1089 CB THR A 452 -8.919 17.799 -19.008 1.00 50.30 C ATOM 1090 OG1 THR A 452 -9.421 19.021 -18.488 1.00 13.24 O ATOM 1091 CG2 THR A 452 -9.984 17.139 -19.887 1.00 71.53 C ATOM 0 H THR A 452 -6.720 17.852 -17.593 1.00 74.20 H new ATOM 0 HA THR A 452 -9.414 16.708 -17.201 1.00 22.31 H new ATOM 0 HB THR A 452 -8.031 17.996 -19.608 1.00 50.30 H new ATOM 0 HG1 THR A 452 -9.654 19.620 -19.228 1.00 13.24 H new ATOM 0 HG21 THR A 452 -10.242 17.806 -20.709 1.00 71.53 H new ATOM 0 HG22 THR A 452 -9.596 16.202 -20.288 1.00 71.53 H new ATOM 0 HG23 THR A 452 -10.874 16.937 -19.291 1.00 71.53 H new ATOM 1099 N LEU A 453 -8.649 14.439 -17.838 1.00 20.24 N ATOM 1100 CA LEU A 453 -8.345 13.096 -18.308 1.00 44.22 C ATOM 1101 C LEU A 453 -9.455 12.644 -19.254 1.00 5.33 C ATOM 1102 O LEU A 453 -10.635 12.707 -18.907 1.00 42.14 O ATOM 1103 CB LEU A 453 -8.250 12.148 -17.113 1.00 10.01 C ATOM 1104 CG LEU A 453 -6.910 12.338 -16.395 1.00 62.24 C ATOM 1105 CD1 LEU A 453 -6.921 11.553 -15.079 1.00 24.21 C ATOM 1106 CD2 LEU A 453 -5.747 11.846 -17.279 1.00 65.25 C ATOM 0 H LEU A 453 -9.287 14.474 -17.043 1.00 20.24 H new ATOM 0 HA LEU A 453 -7.392 13.089 -18.837 1.00 44.22 H new ATOM 0 HB2 LEU A 453 -9.072 12.338 -16.422 1.00 10.01 H new ATOM 0 HB3 LEU A 453 -8.348 11.116 -17.449 1.00 10.01 H new ATOM 0 HG LEU A 453 -6.769 13.399 -16.191 1.00 62.24 H new ATOM 0 HD11 LEU A 453 -5.968 11.687 -14.567 1.00 24.21 H new ATOM 0 HD12 LEU A 453 -7.728 11.918 -14.444 1.00 24.21 H new ATOM 0 HD13 LEU A 453 -7.074 10.494 -15.288 1.00 24.21 H new ATOM 0 HD21 LEU A 453 -4.804 11.989 -16.752 1.00 65.25 H new ATOM 0 HD22 LEU A 453 -5.882 10.787 -17.501 1.00 65.25 H new ATOM 0 HD23 LEU A 453 -5.732 12.413 -18.210 1.00 65.25 H new ATOM 1118 N GLN A 454 -9.081 12.220 -20.463 1.00 64.34 N ATOM 1119 CA GLN A 454 -10.071 11.803 -21.461 1.00 3.21 C ATOM 1120 C GLN A 454 -10.001 10.307 -21.754 1.00 3.35 C ATOM 1121 O GLN A 454 -8.920 9.727 -21.861 1.00 30.14 O ATOM 1122 CB GLN A 454 -9.844 12.583 -22.760 1.00 60.35 C ATOM 1123 CG GLN A 454 -10.789 12.065 -23.849 1.00 11.53 C ATOM 1124 CD GLN A 454 -10.882 13.078 -24.985 1.00 71.42 C ATOM 1125 OE1 GLN A 454 -11.947 13.649 -25.222 1.00 72.15 O ATOM 1126 NE2 GLN A 454 -9.826 13.337 -25.705 1.00 34.31 N ATOM 0 H GLN A 454 -8.111 12.156 -20.773 1.00 64.34 H new ATOM 0 HA GLN A 454 -11.059 12.015 -21.053 1.00 3.21 H new ATOM 0 HB2 GLN A 454 -10.017 13.646 -22.591 1.00 60.35 H new ATOM 0 HB3 GLN A 454 -8.809 12.476 -23.083 1.00 60.35 H new ATOM 0 HG2 GLN A 454 -10.428 11.110 -24.231 1.00 11.53 H new ATOM 0 HG3 GLN A 454 -11.779 11.886 -23.428 1.00 11.53 H new ATOM 0 HE21 GLN A 454 -8.945 12.863 -25.507 1.00 34.31 H new ATOM 0 HE22 GLN A 454 -9.881 14.014 -26.466 1.00 34.31 H new ATOM 1135 N TYR A 455 -11.179 9.701 -21.905 1.00 23.04 N ATOM 1136 CA TYR A 455 -11.288 8.275 -22.214 1.00 53.03 C ATOM 1137 C TYR A 455 -11.999 8.107 -23.558 1.00 74.30 C ATOM 1138 O TYR A 455 -13.224 8.225 -23.641 1.00 43.22 O ATOM 1139 CB TYR A 455 -12.088 7.555 -21.110 1.00 12.22 C ATOM 1140 CG TYR A 455 -11.151 6.873 -20.134 1.00 73.11 C ATOM 1141 CD1 TYR A 455 -10.280 5.872 -20.584 1.00 12.21 C ATOM 1142 CD2 TYR A 455 -11.161 7.233 -18.780 1.00 1.23 C ATOM 1143 CE1 TYR A 455 -9.421 5.235 -19.682 1.00 65.31 C ATOM 1144 CE2 TYR A 455 -10.301 6.595 -17.880 1.00 74.32 C ATOM 1145 CZ TYR A 455 -9.431 5.596 -18.331 1.00 71.23 C ATOM 1146 OH TYR A 455 -8.583 4.969 -17.441 1.00 3.14 O ATOM 0 H TYR A 455 -12.076 10.179 -21.818 1.00 23.04 H new ATOM 0 HA TYR A 455 -10.291 7.839 -22.267 1.00 53.03 H new ATOM 0 HB2 TYR A 455 -12.715 8.272 -20.580 1.00 12.22 H new ATOM 0 HB3 TYR A 455 -12.755 6.818 -21.558 1.00 12.22 H new ATOM 0 HD1 TYR A 455 -10.272 5.592 -21.627 1.00 12.21 H new ATOM 0 HD2 TYR A 455 -11.833 8.003 -18.431 1.00 1.23 H new ATOM 0 HE1 TYR A 455 -8.750 4.464 -20.029 1.00 65.31 H new ATOM 0 HE2 TYR A 455 -10.308 6.874 -16.837 1.00 74.32 H new ATOM 0 HH TYR A 455 -9.093 4.665 -16.662 1.00 3.14 H new ATOM 1156 N HIS A 456 -11.225 7.842 -24.607 1.00 74.41 N ATOM 1157 CA HIS A 456 -11.784 7.671 -25.943 1.00 15.45 C ATOM 1158 C HIS A 456 -11.959 6.189 -26.268 1.00 52.50 C ATOM 1159 O HIS A 456 -11.029 5.396 -26.124 1.00 33.43 O ATOM 1160 CB HIS A 456 -10.855 8.325 -26.970 1.00 33.23 C ATOM 1161 CG HIS A 456 -9.424 8.140 -26.545 1.00 12.24 C ATOM 1162 ND1 HIS A 456 -8.693 9.157 -25.951 1.00 65.35 N ATOM 1163 CD2 HIS A 456 -8.575 7.064 -26.621 1.00 43.54 C ATOM 1164 CE1 HIS A 456 -7.462 8.676 -25.695 1.00 2.12 C ATOM 1165 NE2 HIS A 456 -7.337 7.405 -26.084 1.00 51.34 N ATOM 0 H HIS A 456 -10.211 7.741 -24.557 1.00 74.41 H new ATOM 0 HA HIS A 456 -12.764 8.148 -25.980 1.00 15.45 H new ATOM 0 HB2 HIS A 456 -11.013 7.882 -27.953 1.00 33.23 H new ATOM 0 HB3 HIS A 456 -11.084 9.387 -27.059 1.00 33.23 H new ATOM 0 HD2 HIS A 456 -8.829 6.099 -27.035 1.00 43.54 H new ATOM 0 HE1 HIS A 456 -6.672 9.248 -25.232 1.00 2.12 H new ATOM 0 HE2 HIS A 456 -6.511 6.811 -26.005 1.00 51.34 H new ATOM 1174 N GLY A 457 -13.164 5.828 -26.703 1.00 61.32 N ATOM 1175 CA GLY A 457 -13.472 4.440 -27.047 1.00 3.15 C ATOM 1176 C GLY A 457 -14.637 3.932 -26.206 1.00 44.30 C ATOM 1177 O GLY A 457 -14.986 2.753 -26.254 1.00 44.44 O ATOM 0 H GLY A 457 -13.943 6.475 -26.826 1.00 61.32 H new ATOM 0 HA2 GLY A 457 -13.720 4.367 -28.106 1.00 3.15 H new ATOM 0 HA3 GLY A 457 -12.595 3.814 -26.881 1.00 3.15 H new ATOM 1181 N ILE A 458 -15.231 4.837 -25.434 1.00 22.13 N ATOM 1182 CA ILE A 458 -16.357 4.485 -24.576 1.00 11.42 C ATOM 1183 C ILE A 458 -17.667 4.574 -25.351 1.00 2.03 C ATOM 1184 O ILE A 458 -17.823 5.421 -26.232 1.00 42.21 O ATOM 1185 CB ILE A 458 -16.410 5.436 -23.376 1.00 60.40 C ATOM 1186 CG1 ILE A 458 -15.081 5.377 -22.596 1.00 62.43 C ATOM 1187 CG2 ILE A 458 -17.577 5.045 -22.464 1.00 62.13 C ATOM 1188 CD1 ILE A 458 -15.084 4.213 -21.596 1.00 11.25 C ATOM 0 H ILE A 458 -14.952 5.817 -25.385 1.00 22.13 H new ATOM 0 HA ILE A 458 -16.221 3.461 -24.228 1.00 11.42 H new ATOM 0 HB ILE A 458 -16.560 6.456 -23.731 1.00 60.40 H new ATOM 0 HG12 ILE A 458 -14.251 5.261 -23.293 1.00 62.43 H new ATOM 0 HG13 ILE A 458 -14.924 6.316 -22.066 1.00 62.43 H new ATOM 0 HG21 ILE A 458 -17.614 5.722 -21.610 1.00 62.13 H new ATOM 0 HG22 ILE A 458 -18.512 5.111 -23.021 1.00 62.13 H new ATOM 0 HG23 ILE A 458 -17.436 4.023 -22.111 1.00 62.13 H new ATOM 0 HD11 ILE A 458 -14.136 4.193 -21.058 1.00 11.25 H new ATOM 0 HD12 ILE A 458 -15.901 4.345 -20.886 1.00 11.25 H new ATOM 0 HD13 ILE A 458 -15.217 3.273 -22.132 1.00 11.25 H new ATOM 1200 N THR A 459 -18.610 3.696 -25.014 1.00 71.24 N ATOM 1201 CA THR A 459 -19.914 3.676 -25.679 1.00 15.22 C ATOM 1202 C THR A 459 -21.034 3.820 -24.653 1.00 42.42 C ATOM 1203 O THR A 459 -20.882 3.430 -23.496 1.00 44.31 O ATOM 1204 CB THR A 459 -20.088 2.363 -26.444 1.00 52.52 C ATOM 1205 OG1 THR A 459 -18.952 2.144 -27.270 1.00 44.24 O ATOM 1206 CG2 THR A 459 -21.345 2.439 -27.312 1.00 43.14 C ATOM 0 H THR A 459 -18.497 2.990 -24.286 1.00 71.24 H new ATOM 0 HA THR A 459 -19.962 4.512 -26.377 1.00 15.22 H new ATOM 0 HB THR A 459 -20.187 1.540 -25.736 1.00 52.52 H new ATOM 0 HG1 THR A 459 -19.061 1.302 -27.760 1.00 44.24 H new ATOM 0 HG21 THR A 459 -21.468 1.503 -27.857 1.00 43.14 H new ATOM 0 HG22 THR A 459 -22.215 2.607 -26.678 1.00 43.14 H new ATOM 0 HG23 THR A 459 -21.248 3.261 -28.021 1.00 43.14 H new ATOM 1214 N GLU A 460 -22.159 4.382 -25.085 1.00 40.24 N ATOM 1215 CA GLU A 460 -23.298 4.572 -24.194 1.00 23.41 C ATOM 1216 C GLU A 460 -23.547 3.312 -23.369 1.00 33.21 C ATOM 1217 O GLU A 460 -23.907 3.388 -22.194 1.00 71.14 O ATOM 1218 CB GLU A 460 -24.549 4.906 -25.009 1.00 72.43 C ATOM 1219 CG GLU A 460 -25.697 5.258 -24.060 1.00 23.32 C ATOM 1220 CD GLU A 460 -26.934 5.647 -24.862 1.00 43.31 C ATOM 1221 OE1 GLU A 460 -26.827 6.545 -25.682 1.00 21.20 O ATOM 1222 OE2 GLU A 460 -27.972 5.042 -24.645 1.00 12.30 O ATOM 0 H GLU A 460 -22.306 4.711 -26.039 1.00 40.24 H new ATOM 0 HA GLU A 460 -23.074 5.398 -23.519 1.00 23.41 H new ATOM 0 HB2 GLU A 460 -24.347 5.742 -25.679 1.00 72.43 H new ATOM 0 HB3 GLU A 460 -24.827 4.057 -25.634 1.00 72.43 H new ATOM 0 HG2 GLU A 460 -25.923 4.407 -23.417 1.00 23.32 H new ATOM 0 HG3 GLU A 460 -25.402 6.080 -23.408 1.00 23.32 H new ATOM 1229 N GLU A 461 -23.348 2.156 -23.993 1.00 54.21 N ATOM 1230 CA GLU A 461 -23.551 0.887 -23.306 1.00 2.12 C ATOM 1231 C GLU A 461 -22.637 0.793 -22.088 1.00 22.34 C ATOM 1232 O GLU A 461 -23.042 0.312 -21.031 1.00 11.43 O ATOM 1233 CB GLU A 461 -23.259 -0.276 -24.258 1.00 22.50 C ATOM 1234 CG GLU A 461 -23.712 -1.590 -23.622 1.00 40.01 C ATOM 1235 CD GLU A 461 -25.233 -1.629 -23.522 1.00 25.14 C ATOM 1236 OE1 GLU A 461 -25.865 -1.906 -24.528 1.00 64.43 O ATOM 1237 OE2 GLU A 461 -25.743 -1.382 -22.442 1.00 2.15 O ATOM 0 H GLU A 461 -23.049 2.072 -24.965 1.00 54.21 H new ATOM 0 HA GLU A 461 -24.589 0.832 -22.977 1.00 2.12 H new ATOM 0 HB2 GLU A 461 -23.776 -0.122 -25.205 1.00 22.50 H new ATOM 0 HB3 GLU A 461 -22.193 -0.317 -24.481 1.00 22.50 H new ATOM 0 HG2 GLU A 461 -23.358 -2.432 -24.217 1.00 40.01 H new ATOM 0 HG3 GLU A 461 -23.272 -1.693 -22.630 1.00 40.01 H new ATOM 1244 N ASP A 462 -21.403 1.262 -22.246 1.00 42.14 N ATOM 1245 CA ASP A 462 -20.440 1.233 -21.155 1.00 74.11 C ATOM 1246 C ASP A 462 -20.773 2.307 -20.124 1.00 60.53 C ATOM 1247 O ASP A 462 -20.582 2.112 -18.924 1.00 74.02 O ATOM 1248 CB ASP A 462 -19.029 1.466 -21.710 1.00 70.12 C ATOM 1249 CG ASP A 462 -18.456 0.162 -22.258 1.00 43.12 C ATOM 1250 OD1 ASP A 462 -19.207 -0.586 -22.861 1.00 72.13 O ATOM 1251 OD2 ASP A 462 -17.273 -0.068 -22.068 1.00 12.23 O ATOM 0 H ASP A 462 -21.050 1.664 -23.114 1.00 42.14 H new ATOM 0 HA ASP A 462 -20.484 0.258 -20.670 1.00 74.11 H new ATOM 0 HB2 ASP A 462 -19.060 2.218 -22.499 1.00 70.12 H new ATOM 0 HB3 ASP A 462 -18.381 1.855 -20.924 1.00 70.12 H new ATOM 1256 N MET A 463 -21.269 3.440 -20.604 1.00 21.33 N ATOM 1257 CA MET A 463 -21.627 4.541 -19.731 1.00 51.41 C ATOM 1258 C MET A 463 -22.697 4.115 -18.733 1.00 50.43 C ATOM 1259 O MET A 463 -22.730 4.593 -17.599 1.00 62.54 O ATOM 1260 CB MET A 463 -22.148 5.702 -20.570 1.00 4.40 C ATOM 1261 CG MET A 463 -21.048 6.189 -21.516 1.00 71.51 C ATOM 1262 SD MET A 463 -19.700 6.925 -20.558 1.00 51.34 S ATOM 1263 CE MET A 463 -20.618 8.341 -19.899 1.00 0.14 C ATOM 0 H MET A 463 -21.431 3.617 -21.595 1.00 21.33 H new ATOM 0 HA MET A 463 -20.740 4.849 -19.177 1.00 51.41 H new ATOM 0 HB2 MET A 463 -23.020 5.387 -21.143 1.00 4.40 H new ATOM 0 HB3 MET A 463 -22.470 6.517 -19.921 1.00 4.40 H new ATOM 0 HG2 MET A 463 -20.672 5.357 -22.111 1.00 71.51 H new ATOM 0 HG3 MET A 463 -21.453 6.922 -22.214 1.00 71.51 H new ATOM 0 HE1 MET A 463 -20.027 9.248 -20.024 1.00 0.14 H new ATOM 0 HE2 MET A 463 -21.561 8.445 -20.436 1.00 0.14 H new ATOM 0 HE3 MET A 463 -20.820 8.183 -18.840 1.00 0.14 H new ATOM 1273 N GLN A 464 -23.578 3.220 -19.166 1.00 72.45 N ATOM 1274 CA GLN A 464 -24.656 2.741 -18.306 1.00 65.32 C ATOM 1275 C GLN A 464 -24.268 1.440 -17.608 1.00 75.55 C ATOM 1276 O GLN A 464 -25.059 0.883 -16.846 1.00 3.41 O ATOM 1277 CB GLN A 464 -25.916 2.509 -19.141 1.00 41.22 C ATOM 1278 CG GLN A 464 -26.379 3.835 -19.747 1.00 42.41 C ATOM 1279 CD GLN A 464 -27.630 3.616 -20.590 1.00 34.12 C ATOM 1280 OE1 GLN A 464 -27.690 4.055 -21.739 1.00 4.43 O ATOM 1281 NE2 GLN A 464 -28.639 2.958 -20.086 1.00 11.51 N ATOM 0 H GLN A 464 -23.568 2.813 -20.101 1.00 72.45 H new ATOM 0 HA GLN A 464 -24.845 3.499 -17.546 1.00 65.32 H new ATOM 0 HB2 GLN A 464 -25.713 1.787 -19.932 1.00 41.22 H new ATOM 0 HB3 GLN A 464 -26.705 2.087 -18.519 1.00 41.22 H new ATOM 0 HG2 GLN A 464 -26.586 4.554 -18.954 1.00 42.41 H new ATOM 0 HG3 GLN A 464 -25.586 4.259 -20.362 1.00 42.41 H new ATOM 0 HE21 GLN A 464 -28.587 2.595 -19.134 1.00 11.51 H new ATOM 0 HE22 GLN A 464 -29.479 2.807 -20.644 1.00 11.51 H new ATOM 1290 N ARG A 465 -23.063 0.943 -17.891 1.00 63.42 N ATOM 1291 CA ARG A 465 -22.607 -0.319 -17.300 1.00 70.32 C ATOM 1292 C ARG A 465 -21.351 -0.155 -16.440 1.00 61.14 C ATOM 1293 O ARG A 465 -21.127 -0.946 -15.524 1.00 0.31 O ATOM 1294 CB ARG A 465 -22.317 -1.323 -18.415 1.00 43.32 C ATOM 1295 CG ARG A 465 -22.062 -2.704 -17.808 1.00 22.22 C ATOM 1296 CD ARG A 465 -21.792 -3.710 -18.928 1.00 31.21 C ATOM 1297 NE ARG A 465 -20.461 -3.501 -19.485 1.00 22.05 N ATOM 1298 CZ ARG A 465 -19.371 -3.866 -18.819 1.00 25.11 C ATOM 1299 NH1 ARG A 465 -19.481 -4.422 -17.644 1.00 53.05 N ATOM 1300 NH2 ARG A 465 -18.192 -3.668 -19.339 1.00 51.30 N ATOM 0 H ARG A 465 -22.392 1.387 -18.517 1.00 63.42 H new ATOM 0 HA ARG A 465 -23.405 -0.674 -16.648 1.00 70.32 H new ATOM 0 HB2 ARG A 465 -23.159 -1.368 -19.106 1.00 43.32 H new ATOM 0 HB3 ARG A 465 -21.449 -1.002 -18.991 1.00 43.32 H new ATOM 0 HG2 ARG A 465 -21.211 -2.663 -17.128 1.00 22.22 H new ATOM 0 HG3 ARG A 465 -22.924 -3.020 -17.221 1.00 22.22 H new ATOM 0 HD2 ARG A 465 -21.877 -4.726 -18.542 1.00 31.21 H new ATOM 0 HD3 ARG A 465 -22.542 -3.603 -19.711 1.00 31.21 H new ATOM 0 HE ARG A 465 -20.365 -3.067 -20.403 1.00 22.05 H new ATOM 0 HH11 ARG A 465 -20.404 -4.576 -17.237 1.00 53.05 H new ATOM 0 HH12 ARG A 465 -18.644 -4.702 -17.132 1.00 53.05 H new ATOM 0 HH21 ARG A 465 -18.106 -3.233 -20.257 1.00 51.30 H new ATOM 0 HH22 ARG A 465 -17.355 -3.948 -18.827 1.00 51.30 H new ATOM 1314 N LYS A 466 -20.511 0.838 -16.740 1.00 53.51 N ATOM 1315 CA LYS A 466 -19.277 1.020 -15.976 1.00 50.40 C ATOM 1316 C LYS A 466 -19.420 2.038 -14.844 1.00 0.54 C ATOM 1317 O LYS A 466 -20.432 2.735 -14.707 1.00 42.13 O ATOM 1318 CB LYS A 466 -18.148 1.449 -16.916 1.00 11.12 C ATOM 1319 CG LYS A 466 -17.499 0.211 -17.543 1.00 51.44 C ATOM 1320 CD LYS A 466 -16.542 0.648 -18.663 1.00 34.41 C ATOM 1321 CE LYS A 466 -15.256 -0.183 -18.613 1.00 10.34 C ATOM 1322 NZ LYS A 466 -14.503 -0.009 -19.887 1.00 55.14 N ATOM 0 H LYS A 466 -20.658 1.514 -17.489 1.00 53.51 H new ATOM 0 HA LYS A 466 -19.044 0.061 -15.513 1.00 50.40 H new ATOM 0 HB2 LYS A 466 -18.540 2.101 -17.697 1.00 11.12 H new ATOM 0 HB3 LYS A 466 -17.402 2.023 -16.366 1.00 11.12 H new ATOM 0 HG2 LYS A 466 -16.955 -0.352 -16.784 1.00 51.44 H new ATOM 0 HG3 LYS A 466 -18.266 -0.452 -17.943 1.00 51.44 H new ATOM 0 HD2 LYS A 466 -17.025 0.526 -19.632 1.00 34.41 H new ATOM 0 HD3 LYS A 466 -16.304 1.706 -18.556 1.00 34.41 H new ATOM 0 HE2 LYS A 466 -14.641 0.129 -17.769 1.00 10.34 H new ATOM 0 HE3 LYS A 466 -15.496 -1.235 -18.461 1.00 10.34 H new ATOM 0 HZ1 LYS A 466 -13.630 -0.573 -19.854 1.00 55.14 H new ATOM 0 HZ2 LYS A 466 -15.091 -0.327 -20.684 1.00 55.14 H new ATOM 0 HZ3 LYS A 466 -14.262 0.995 -20.014 1.00 55.14 H new ATOM 1336 N THR A 467 -18.367 2.100 -14.034 1.00 3.41 N ATOM 1337 CA THR A 467 -18.314 3.003 -12.885 1.00 74.24 C ATOM 1338 C THR A 467 -17.014 3.800 -12.886 1.00 41.11 C ATOM 1339 O THR A 467 -15.923 3.228 -12.935 1.00 1.31 O ATOM 1340 CB THR A 467 -18.412 2.184 -11.593 1.00 5.21 C ATOM 1341 OG1 THR A 467 -19.529 1.311 -11.673 1.00 73.13 O ATOM 1342 CG2 THR A 467 -18.578 3.114 -10.388 1.00 4.34 C ATOM 0 H THR A 467 -17.530 1.530 -14.153 1.00 3.41 H new ATOM 0 HA THR A 467 -19.149 3.701 -12.948 1.00 74.24 H new ATOM 0 HB THR A 467 -17.497 1.604 -11.469 1.00 5.21 H new ATOM 0 HG1 THR A 467 -19.593 0.785 -10.849 1.00 73.13 H new ATOM 0 HG21 THR A 467 -18.646 2.520 -9.477 1.00 4.34 H new ATOM 0 HG22 THR A 467 -17.719 3.781 -10.322 1.00 4.34 H new ATOM 0 HG23 THR A 467 -19.487 3.704 -10.506 1.00 4.34 H new ATOM 1350 N LEU A 468 -17.141 5.123 -12.827 1.00 1.22 N ATOM 1351 CA LEU A 468 -15.982 6.000 -12.815 1.00 41.15 C ATOM 1352 C LEU A 468 -15.437 6.144 -11.397 1.00 22.31 C ATOM 1353 O LEU A 468 -16.113 6.678 -10.517 1.00 2.11 O ATOM 1354 CB LEU A 468 -16.394 7.374 -13.339 1.00 42.32 C ATOM 1355 CG LEU A 468 -15.144 8.250 -13.578 1.00 2.20 C ATOM 1356 CD1 LEU A 468 -14.753 8.208 -15.060 1.00 32.23 C ATOM 1357 CD2 LEU A 468 -15.438 9.701 -13.172 1.00 54.44 C ATOM 0 H LEU A 468 -18.037 5.608 -12.787 1.00 1.22 H new ATOM 0 HA LEU A 468 -15.204 5.572 -13.448 1.00 41.15 H new ATOM 0 HB2 LEU A 468 -16.953 7.264 -14.268 1.00 42.32 H new ATOM 0 HB3 LEU A 468 -17.057 7.861 -12.623 1.00 42.32 H new ATOM 0 HG LEU A 468 -14.322 7.863 -12.975 1.00 2.20 H new ATOM 0 HD11 LEU A 468 -13.871 8.828 -15.221 1.00 32.23 H new ATOM 0 HD12 LEU A 468 -14.532 7.180 -15.349 1.00 32.23 H new ATOM 0 HD13 LEU A 468 -15.577 8.586 -15.665 1.00 32.23 H new ATOM 0 HD21 LEU A 468 -14.553 10.313 -13.343 1.00 54.44 H new ATOM 0 HD22 LEU A 468 -16.266 10.085 -13.768 1.00 54.44 H new ATOM 0 HD23 LEU A 468 -15.705 9.736 -12.116 1.00 54.44 H new ATOM 1369 N ARG A 469 -14.213 5.667 -11.182 1.00 10.01 N ATOM 1370 CA ARG A 469 -13.583 5.751 -9.864 1.00 13.32 C ATOM 1371 C ARG A 469 -12.370 6.679 -9.918 1.00 24.25 C ATOM 1372 O ARG A 469 -11.549 6.593 -10.832 1.00 52.23 O ATOM 1373 CB ARG A 469 -13.166 4.345 -9.407 1.00 21.43 C ATOM 1374 CG ARG A 469 -12.088 4.432 -8.318 1.00 41.11 C ATOM 1375 CD ARG A 469 -11.975 3.086 -7.600 1.00 0.21 C ATOM 1376 NE ARG A 469 -10.767 3.050 -6.783 1.00 4.30 N ATOM 1377 CZ ARG A 469 -9.577 2.822 -7.328 1.00 43.33 C ATOM 1378 NH1 ARG A 469 -9.474 2.625 -8.613 1.00 44.22 N ATOM 1379 NH2 ARG A 469 -8.510 2.793 -6.576 1.00 31.41 N ATOM 0 H ARG A 469 -13.640 5.221 -11.898 1.00 10.01 H new ATOM 0 HA ARG A 469 -14.295 6.161 -9.148 1.00 13.32 H new ATOM 0 HB2 ARG A 469 -14.034 3.808 -9.026 1.00 21.43 H new ATOM 0 HB3 ARG A 469 -12.788 3.777 -10.257 1.00 21.43 H new ATOM 0 HG2 ARG A 469 -11.129 4.701 -8.762 1.00 41.11 H new ATOM 0 HG3 ARG A 469 -12.340 5.216 -7.604 1.00 41.11 H new ATOM 0 HD2 ARG A 469 -12.852 2.926 -6.973 1.00 0.21 H new ATOM 0 HD3 ARG A 469 -11.953 2.277 -8.330 1.00 0.21 H new ATOM 0 HE ARG A 469 -10.837 3.202 -5.777 1.00 4.30 H new ATOM 0 HH11 ARG A 469 -10.307 2.646 -9.201 1.00 44.22 H new ATOM 0 HH12 ARG A 469 -8.560 2.450 -9.030 1.00 44.22 H new ATOM 0 HH21 ARG A 469 -8.590 2.945 -5.571 1.00 31.41 H new ATOM 0 HH22 ARG A 469 -7.596 2.618 -6.994 1.00 31.41 H new ATOM 1393 N ILE A 470 -12.263 7.563 -8.926 1.00 4.15 N ATOM 1394 CA ILE A 470 -11.144 8.506 -8.854 1.00 51.42 C ATOM 1395 C ILE A 470 -10.242 8.137 -7.684 1.00 51.24 C ATOM 1396 O ILE A 470 -10.584 8.376 -6.528 1.00 42.35 O ATOM 1397 CB ILE A 470 -11.681 9.931 -8.673 1.00 60.33 C ATOM 1398 CG1 ILE A 470 -12.888 10.126 -9.597 1.00 50.24 C ATOM 1399 CG2 ILE A 470 -10.593 10.960 -9.016 1.00 43.41 C ATOM 1400 CD1 ILE A 470 -13.368 11.574 -9.526 1.00 64.12 C ATOM 0 H ILE A 470 -12.935 7.647 -8.163 1.00 4.15 H new ATOM 0 HA ILE A 470 -10.568 8.458 -9.778 1.00 51.42 H new ATOM 0 HB ILE A 470 -11.979 10.076 -7.635 1.00 60.33 H new ATOM 0 HG12 ILE A 470 -12.617 9.873 -10.622 1.00 50.24 H new ATOM 0 HG13 ILE A 470 -13.693 9.452 -9.305 1.00 50.24 H new ATOM 0 HG21 ILE A 470 -10.989 11.967 -8.883 1.00 43.41 H new ATOM 0 HG22 ILE A 470 -9.736 10.817 -8.357 1.00 43.41 H new ATOM 0 HG23 ILE A 470 -10.280 10.827 -10.052 1.00 43.41 H new ATOM 0 HD11 ILE A 470 -14.226 11.706 -10.185 1.00 64.12 H new ATOM 0 HD12 ILE A 470 -13.657 11.812 -8.502 1.00 64.12 H new ATOM 0 HD13 ILE A 470 -12.564 12.240 -9.840 1.00 64.12 H new ATOM 1412 N SER A 471 -9.098 7.531 -7.991 1.00 42.53 N ATOM 1413 CA SER A 471 -8.163 7.106 -6.953 1.00 32.11 C ATOM 1414 C SER A 471 -7.093 8.163 -6.694 1.00 33.14 C ATOM 1415 O SER A 471 -6.324 8.519 -7.587 1.00 25.12 O ATOM 1416 CB SER A 471 -7.488 5.800 -7.372 1.00 14.02 C ATOM 1417 OG SER A 471 -6.651 5.344 -6.317 1.00 0.13 O ATOM 0 H SER A 471 -8.797 7.324 -8.944 1.00 42.53 H new ATOM 0 HA SER A 471 -8.730 6.960 -6.033 1.00 32.11 H new ATOM 0 HB2 SER A 471 -8.241 5.047 -7.606 1.00 14.02 H new ATOM 0 HB3 SER A 471 -6.900 5.955 -8.277 1.00 14.02 H new ATOM 0 HG SER A 471 -6.218 4.506 -6.582 1.00 0.13 H new ATOM 1423 N VAL A 472 -7.040 8.640 -5.453 1.00 2.15 N ATOM 1424 CA VAL A 472 -6.050 9.638 -5.052 1.00 24.42 C ATOM 1425 C VAL A 472 -5.044 8.993 -4.106 1.00 53.50 C ATOM 1426 O VAL A 472 -5.388 8.627 -2.982 1.00 51.34 O ATOM 1427 CB VAL A 472 -6.739 10.812 -4.353 1.00 3.13 C ATOM 1428 CG1 VAL A 472 -5.777 11.999 -4.272 1.00 63.21 C ATOM 1429 CG2 VAL A 472 -7.980 11.222 -5.150 1.00 34.42 C ATOM 0 H VAL A 472 -7.672 8.351 -4.706 1.00 2.15 H new ATOM 0 HA VAL A 472 -5.535 10.011 -5.937 1.00 24.42 H new ATOM 0 HB VAL A 472 -7.031 10.511 -3.347 1.00 3.13 H new ATOM 0 HG11 VAL A 472 -6.270 12.834 -3.774 1.00 63.21 H new ATOM 0 HG12 VAL A 472 -4.891 11.711 -3.706 1.00 63.21 H new ATOM 0 HG13 VAL A 472 -5.484 12.299 -5.278 1.00 63.21 H new ATOM 0 HG21 VAL A 472 -8.472 12.058 -4.653 1.00 34.42 H new ATOM 0 HG22 VAL A 472 -7.684 11.521 -6.156 1.00 34.42 H new ATOM 0 HG23 VAL A 472 -8.669 10.379 -5.210 1.00 34.42 H new ATOM 1439 N CYS A 473 -3.810 8.824 -4.576 1.00 53.52 N ATOM 1440 CA CYS A 473 -2.771 8.184 -3.765 1.00 53.41 C ATOM 1441 C CYS A 473 -1.576 9.114 -3.536 1.00 10.12 C ATOM 1442 O CYS A 473 -1.428 10.138 -4.203 1.00 1.13 O ATOM 1443 CB CYS A 473 -2.305 6.908 -4.474 1.00 45.34 C ATOM 1444 SG CYS A 473 -3.262 5.491 -3.877 1.00 61.22 S ATOM 0 H CYS A 473 -3.505 9.117 -5.504 1.00 53.52 H new ATOM 0 HA CYS A 473 -3.194 7.946 -2.789 1.00 53.41 H new ATOM 0 HB2 CYS A 473 -2.429 7.014 -5.552 1.00 45.34 H new ATOM 0 HB3 CYS A 473 -1.243 6.745 -4.289 1.00 45.34 H new ATOM 0 HG CYS A 473 -2.674 4.977 -2.838 1.00 61.22 H new ATOM 1450 N ASP A 474 -0.719 8.727 -2.584 1.00 42.30 N ATOM 1451 CA ASP A 474 0.478 9.503 -2.252 1.00 30.11 C ATOM 1452 C ASP A 474 1.732 8.708 -2.607 1.00 71.34 C ATOM 1453 O ASP A 474 1.816 7.511 -2.333 1.00 24.20 O ATOM 1454 CB ASP A 474 0.491 9.834 -0.756 1.00 72.21 C ATOM 1455 CG ASP A 474 1.821 10.477 -0.368 1.00 41.33 C ATOM 1456 OD1 ASP A 474 2.204 11.442 -1.012 1.00 34.22 O ATOM 1457 OD2 ASP A 474 2.438 9.995 0.567 1.00 33.54 O ATOM 0 H ASP A 474 -0.834 7.879 -2.030 1.00 42.30 H new ATOM 0 HA ASP A 474 0.464 10.429 -2.826 1.00 30.11 H new ATOM 0 HB2 ASP A 474 -0.331 10.510 -0.519 1.00 72.21 H new ATOM 0 HB3 ASP A 474 0.335 8.926 -0.174 1.00 72.21 H new ATOM 1462 N GLU A 475 2.704 9.381 -3.220 1.00 22.51 N ATOM 1463 CA GLU A 475 3.955 8.731 -3.615 1.00 31.40 C ATOM 1464 C GLU A 475 5.141 9.327 -2.861 1.00 72.24 C ATOM 1465 O GLU A 475 5.242 10.543 -2.703 1.00 34.11 O ATOM 1466 CB GLU A 475 4.176 8.903 -5.120 1.00 53.24 C ATOM 1467 CG GLU A 475 5.523 8.293 -5.513 1.00 52.32 C ATOM 1468 CD GLU A 475 5.607 8.147 -7.028 1.00 62.42 C ATOM 1469 OE1 GLU A 475 4.618 7.748 -7.621 1.00 24.35 O ATOM 1470 OE2 GLU A 475 6.659 8.436 -7.574 1.00 41.31 O ATOM 0 H GLU A 475 2.651 10.372 -3.454 1.00 22.51 H new ATOM 0 HA GLU A 475 3.880 7.672 -3.369 1.00 31.40 H new ATOM 0 HB2 GLU A 475 3.371 8.420 -5.674 1.00 53.24 H new ATOM 0 HB3 GLU A 475 4.154 9.961 -5.383 1.00 53.24 H new ATOM 0 HG2 GLU A 475 6.336 8.925 -5.155 1.00 52.32 H new ATOM 0 HG3 GLU A 475 5.643 7.319 -5.038 1.00 52.32 H new ATOM 1477 N ASP A 476 6.043 8.460 -2.405 1.00 22.23 N ATOM 1478 CA ASP A 476 7.235 8.898 -1.681 1.00 50.44 C ATOM 1479 C ASP A 476 8.474 8.295 -2.335 1.00 31.04 C ATOM 1480 O ASP A 476 8.644 8.386 -3.552 1.00 5.41 O ATOM 1481 CB ASP A 476 7.153 8.449 -0.219 1.00 22.42 C ATOM 1482 CG ASP A 476 5.760 8.728 0.336 1.00 35.43 C ATOM 1483 OD1 ASP A 476 5.513 9.857 0.722 1.00 52.14 O ATOM 1484 OD2 ASP A 476 4.962 7.806 0.368 1.00 42.42 O ATOM 0 H ASP A 476 5.971 7.450 -2.524 1.00 22.23 H new ATOM 0 HA ASP A 476 7.297 9.986 -1.715 1.00 50.44 H new ATOM 0 HB2 ASP A 476 7.377 7.385 -0.144 1.00 22.42 H new ATOM 0 HB3 ASP A 476 7.901 8.975 0.374 1.00 22.42 H new ATOM 1556 N ASN A 481 4.181 3.231 -0.207 1.00 54.21 N ATOM 1557 CA ASN A 481 3.255 4.325 -0.491 1.00 34.40 C ATOM 1558 C ASN A 481 2.040 4.249 0.429 1.00 23.44 C ATOM 1559 O ASN A 481 1.887 3.296 1.194 1.00 45.01 O ATOM 1560 CB ASN A 481 2.798 4.258 -1.950 1.00 43.12 C ATOM 1561 CG ASN A 481 2.448 2.821 -2.321 1.00 61.24 C ATOM 1562 OD1 ASN A 481 1.969 2.561 -3.507 1.00 4.23 O flip ATOM 1563 ND2 ASN A 481 2.613 1.912 -1.508 1.00 4.24 N flip ATOM 0 HA ASN A 481 3.772 5.269 -0.316 1.00 34.40 H new ATOM 0 HB2 ASN A 481 1.931 4.902 -2.098 1.00 43.12 H new ATOM 0 HB3 ASN A 481 3.587 4.629 -2.604 1.00 43.12 H new ATOM 0 HD21 ASN A 481 2.988 2.118 -0.582 1.00 4.24 H new ATOM 0 HD22 ASN A 481 2.375 0.953 -1.760 1.00 4.24 H new ATOM 1570 N GLU A 482 1.179 5.261 0.351 1.00 72.25 N ATOM 1571 CA GLU A 482 -0.023 5.304 1.182 1.00 3.52 C ATOM 1572 C GLU A 482 -1.192 5.901 0.405 1.00 71.12 C ATOM 1573 O GLU A 482 -1.041 6.907 -0.288 1.00 3.13 O ATOM 1574 CB GLU A 482 0.240 6.145 2.433 1.00 13.32 C ATOM 1575 CG GLU A 482 1.457 5.589 3.175 1.00 65.21 C ATOM 1576 CD GLU A 482 1.643 6.329 4.497 1.00 31.41 C ATOM 1577 OE1 GLU A 482 1.015 5.935 5.466 1.00 23.34 O ATOM 1578 OE2 GLU A 482 2.411 7.277 4.520 1.00 74.04 O ATOM 0 H GLU A 482 1.290 6.058 -0.275 1.00 72.25 H new ATOM 0 HA GLU A 482 -0.278 4.285 1.473 1.00 3.52 H new ATOM 0 HB2 GLU A 482 0.414 7.185 2.155 1.00 13.32 H new ATOM 0 HB3 GLU A 482 -0.634 6.131 3.084 1.00 13.32 H new ATOM 0 HG2 GLU A 482 1.325 4.523 3.361 1.00 65.21 H new ATOM 0 HG3 GLU A 482 2.350 5.697 2.559 1.00 65.21 H new ATOM 1585 N PHE A 483 -2.359 5.274 0.528 1.00 51.30 N ATOM 1586 CA PHE A 483 -3.549 5.746 -0.161 1.00 5.44 C ATOM 1587 C PHE A 483 -4.165 6.924 0.588 1.00 55.43 C ATOM 1588 O PHE A 483 -4.293 6.896 1.812 1.00 13.42 O ATOM 1589 CB PHE A 483 -4.565 4.607 -0.259 1.00 42.03 C ATOM 1590 CG PHE A 483 -4.149 3.642 -1.347 1.00 43.41 C ATOM 1591 CD1 PHE A 483 -2.969 2.901 -1.209 1.00 72.25 C ATOM 1592 CD2 PHE A 483 -4.941 3.488 -2.493 1.00 14.21 C ATOM 1593 CE1 PHE A 483 -2.583 2.007 -2.214 1.00 30.40 C ATOM 1594 CE2 PHE A 483 -4.553 2.595 -3.498 1.00 52.35 C ATOM 1595 CZ PHE A 483 -3.373 1.854 -3.359 1.00 4.53 C ATOM 0 H PHE A 483 -2.502 4.440 1.098 1.00 51.30 H new ATOM 0 HA PHE A 483 -3.272 6.076 -1.162 1.00 5.44 H new ATOM 0 HB2 PHE A 483 -4.634 4.085 0.696 1.00 42.03 H new ATOM 0 HB3 PHE A 483 -5.555 5.008 -0.475 1.00 42.03 H new ATOM 0 HD1 PHE A 483 -2.357 3.019 -0.327 1.00 72.25 H new ATOM 0 HD2 PHE A 483 -5.851 4.059 -2.600 1.00 14.21 H new ATOM 0 HE1 PHE A 483 -1.674 1.434 -2.106 1.00 30.40 H new ATOM 0 HE2 PHE A 483 -5.164 2.477 -4.381 1.00 52.35 H new ATOM 0 HZ PHE A 483 -3.073 1.165 -4.135 1.00 4.53 H new ATOM 1605 N ILE A 484 -4.547 7.961 -0.155 1.00 54.02 N ATOM 1606 CA ILE A 484 -5.151 9.146 0.452 1.00 63.30 C ATOM 1607 C ILE A 484 -6.665 8.987 0.543 1.00 22.14 C ATOM 1608 O ILE A 484 -7.243 9.078 1.625 1.00 44.11 O ATOM 1609 CB ILE A 484 -4.814 10.385 -0.379 1.00 34.43 C ATOM 1610 CG1 ILE A 484 -3.293 10.533 -0.482 1.00 71.01 C ATOM 1611 CG2 ILE A 484 -5.399 11.628 0.292 1.00 52.55 C ATOM 1612 CD1 ILE A 484 -2.947 11.545 -1.576 1.00 45.21 C ATOM 0 H ILE A 484 -4.450 8.006 -1.169 1.00 54.02 H new ATOM 0 HA ILE A 484 -4.749 9.263 1.458 1.00 63.30 H new ATOM 0 HB ILE A 484 -5.239 10.276 -1.377 1.00 34.43 H new ATOM 0 HG12 ILE A 484 -2.884 10.862 0.474 1.00 71.01 H new ATOM 0 HG13 ILE A 484 -2.838 9.568 -0.708 1.00 71.01 H new ATOM 0 HG21 ILE A 484 -5.158 12.510 -0.302 1.00 52.55 H new ATOM 0 HG22 ILE A 484 -6.482 11.526 0.366 1.00 52.55 H new ATOM 0 HG23 ILE A 484 -4.975 11.736 1.290 1.00 52.55 H new ATOM 0 HD11 ILE A 484 -1.864 11.648 -1.647 1.00 45.21 H new ATOM 0 HD12 ILE A 484 -3.342 11.198 -2.531 1.00 45.21 H new ATOM 0 HD13 ILE A 484 -3.388 12.511 -1.331 1.00 45.21 H new ATOM 1624 N GLY A 485 -7.300 8.750 -0.600 1.00 72.34 N ATOM 1625 CA GLY A 485 -8.748 8.581 -0.635 1.00 52.22 C ATOM 1626 C GLY A 485 -9.236 8.350 -2.063 1.00 64.10 C ATOM 1627 O GLY A 485 -8.609 8.798 -3.023 1.00 3.34 O ATOM 0 H GLY A 485 -6.840 8.671 -1.507 1.00 72.34 H new ATOM 0 HA2 GLY A 485 -9.035 7.737 -0.008 1.00 52.22 H new ATOM 0 HA3 GLY A 485 -9.231 9.465 -0.220 1.00 52.22 H new ATOM 1631 N GLU A 486 -10.353 7.635 -2.195 1.00 23.12 N ATOM 1632 CA GLU A 486 -10.911 7.333 -3.515 1.00 45.41 C ATOM 1633 C GLU A 486 -12.408 7.631 -3.578 1.00 23.22 C ATOM 1634 O GLU A 486 -13.087 7.704 -2.553 1.00 51.32 O ATOM 1635 CB GLU A 486 -10.676 5.859 -3.847 1.00 31.10 C ATOM 1636 CG GLU A 486 -11.128 4.991 -2.672 1.00 15.22 C ATOM 1637 CD GLU A 486 -11.206 3.530 -3.101 1.00 1.24 C ATOM 1638 OE1 GLU A 486 -10.747 3.228 -4.191 1.00 4.54 O ATOM 1639 OE2 GLU A 486 -11.723 2.735 -2.335 1.00 2.40 O ATOM 0 H GLU A 486 -10.886 7.256 -1.412 1.00 23.12 H new ATOM 0 HA GLU A 486 -10.407 7.970 -4.242 1.00 45.41 H new ATOM 0 HB2 GLU A 486 -11.227 5.586 -4.747 1.00 31.10 H new ATOM 0 HB3 GLU A 486 -9.620 5.686 -4.055 1.00 31.10 H new ATOM 0 HG2 GLU A 486 -10.430 5.098 -1.841 1.00 15.22 H new ATOM 0 HG3 GLU A 486 -12.102 5.326 -2.315 1.00 15.22 H new ATOM 1646 N THR A 487 -12.911 7.789 -4.804 1.00 44.33 N ATOM 1647 CA THR A 487 -14.331 8.066 -5.032 1.00 31.24 C ATOM 1648 C THR A 487 -14.906 7.036 -5.999 1.00 33.05 C ATOM 1649 O THR A 487 -14.168 6.423 -6.771 1.00 51.24 O ATOM 1650 CB THR A 487 -14.527 9.468 -5.621 1.00 43.02 C ATOM 1651 OG1 THR A 487 -14.091 9.474 -6.971 1.00 22.31 O ATOM 1652 CG2 THR A 487 -13.732 10.503 -4.818 1.00 42.22 C ATOM 0 H THR A 487 -12.354 7.730 -5.657 1.00 44.33 H new ATOM 0 HA THR A 487 -14.847 8.010 -4.074 1.00 31.24 H new ATOM 0 HB THR A 487 -15.584 9.728 -5.573 1.00 43.02 H new ATOM 0 HG1 THR A 487 -14.663 10.071 -7.497 1.00 22.31 H new ATOM 0 HG21 THR A 487 -13.883 11.492 -5.250 1.00 42.22 H new ATOM 0 HG22 THR A 487 -14.075 10.503 -3.783 1.00 42.22 H new ATOM 0 HG23 THR A 487 -12.672 10.251 -4.849 1.00 42.22 H new ATOM 1660 N ARG A 488 -16.224 6.856 -5.963 1.00 35.54 N ATOM 1661 CA ARG A 488 -16.886 5.899 -6.849 1.00 34.22 C ATOM 1662 C ARG A 488 -18.210 6.464 -7.352 1.00 62.42 C ATOM 1663 O ARG A 488 -19.016 6.972 -6.571 1.00 44.11 O ATOM 1664 CB ARG A 488 -17.140 4.589 -6.100 1.00 52.23 C ATOM 1665 CG ARG A 488 -17.617 3.521 -7.087 1.00 32.15 C ATOM 1666 CD ARG A 488 -17.790 2.189 -6.354 1.00 74.44 C ATOM 1667 NE ARG A 488 -18.531 1.249 -7.185 1.00 71.42 N ATOM 1668 CZ ARG A 488 -18.760 0.004 -6.779 1.00 5.13 C ATOM 1669 NH1 ARG A 488 -18.318 -0.394 -5.617 1.00 23.43 N ATOM 1670 NH2 ARG A 488 -19.426 -0.819 -7.541 1.00 3.04 N ATOM 0 H ARG A 488 -16.852 7.356 -5.334 1.00 35.54 H new ATOM 0 HA ARG A 488 -16.236 5.711 -7.704 1.00 34.22 H new ATOM 0 HB2 ARG A 488 -16.228 4.259 -5.603 1.00 52.23 H new ATOM 0 HB3 ARG A 488 -17.889 4.741 -5.323 1.00 52.23 H new ATOM 0 HG2 ARG A 488 -18.561 3.825 -7.539 1.00 32.15 H new ATOM 0 HG3 ARG A 488 -16.896 3.411 -7.897 1.00 32.15 H new ATOM 0 HD2 ARG A 488 -16.814 1.774 -6.105 1.00 74.44 H new ATOM 0 HD3 ARG A 488 -18.318 2.349 -5.414 1.00 74.44 H new ATOM 0 HE ARG A 488 -18.880 1.552 -8.094 1.00 71.42 H new ATOM 0 HH11 ARG A 488 -17.797 0.250 -5.021 1.00 23.43 H new ATOM 0 HH12 ARG A 488 -18.493 -1.349 -5.305 1.00 23.43 H new ATOM 0 HH21 ARG A 488 -19.771 -0.507 -8.449 1.00 3.04 H new ATOM 0 HH22 ARG A 488 -19.601 -1.774 -7.229 1.00 3.04 H new ATOM 1684 N PHE A 489 -18.433 6.373 -8.662 1.00 30.42 N ATOM 1685 CA PHE A 489 -19.670 6.881 -9.257 1.00 41.24 C ATOM 1686 C PHE A 489 -20.079 6.034 -10.459 1.00 33.13 C ATOM 1687 O PHE A 489 -19.247 5.674 -11.291 1.00 71.23 O ATOM 1688 CB PHE A 489 -19.476 8.339 -9.696 1.00 71.42 C ATOM 1689 CG PHE A 489 -19.597 9.252 -8.498 1.00 2.31 C ATOM 1690 CD1 PHE A 489 -18.483 9.498 -7.688 1.00 70.30 C ATOM 1691 CD2 PHE A 489 -20.826 9.854 -8.199 1.00 24.04 C ATOM 1692 CE1 PHE A 489 -18.597 10.345 -6.579 1.00 54.02 C ATOM 1693 CE2 PHE A 489 -20.940 10.700 -7.090 1.00 4.14 C ATOM 1694 CZ PHE A 489 -19.826 10.946 -6.280 1.00 12.24 C ATOM 0 H PHE A 489 -17.781 5.957 -9.327 1.00 30.42 H new ATOM 0 HA PHE A 489 -20.460 6.827 -8.508 1.00 41.24 H new ATOM 0 HB2 PHE A 489 -18.498 8.462 -10.162 1.00 71.42 H new ATOM 0 HB3 PHE A 489 -20.221 8.606 -10.445 1.00 71.42 H new ATOM 0 HD1 PHE A 489 -17.535 9.034 -7.918 1.00 70.30 H new ATOM 0 HD2 PHE A 489 -21.686 9.665 -8.825 1.00 24.04 H new ATOM 0 HE1 PHE A 489 -17.737 10.535 -5.954 1.00 54.02 H new ATOM 0 HE2 PHE A 489 -21.888 11.163 -6.859 1.00 4.14 H new ATOM 0 HZ PHE A 489 -19.914 11.599 -5.424 1.00 12.24 H new ATOM 1704 N SER A 490 -21.372 5.731 -10.548 1.00 24.55 N ATOM 1705 CA SER A 490 -21.889 4.938 -11.657 1.00 72.54 C ATOM 1706 C SER A 490 -22.085 5.828 -12.882 1.00 14.02 C ATOM 1707 O SER A 490 -22.898 6.752 -12.863 1.00 62.42 O ATOM 1708 CB SER A 490 -23.217 4.284 -11.251 1.00 53.20 C ATOM 1709 OG SER A 490 -23.248 2.948 -11.734 1.00 63.40 O ATOM 0 H SER A 490 -22.076 6.021 -9.869 1.00 24.55 H new ATOM 0 HA SER A 490 -21.174 4.154 -11.906 1.00 72.54 H new ATOM 0 HB2 SER A 490 -23.324 4.294 -10.166 1.00 53.20 H new ATOM 0 HB3 SER A 490 -24.054 4.850 -11.659 1.00 53.20 H new ATOM 0 HG SER A 490 -23.788 2.395 -11.132 1.00 63.40 H new ATOM 1715 N LEU A 491 -21.320 5.561 -13.936 1.00 72.01 N ATOM 1716 CA LEU A 491 -21.417 6.375 -15.143 1.00 12.22 C ATOM 1717 C LEU A 491 -22.877 6.570 -15.543 1.00 0.10 C ATOM 1718 O LEU A 491 -23.236 7.585 -16.136 1.00 72.11 O ATOM 1719 CB LEU A 491 -20.636 5.722 -16.290 1.00 5.44 C ATOM 1720 CG LEU A 491 -19.133 6.029 -16.141 1.00 35.23 C ATOM 1721 CD1 LEU A 491 -18.314 4.927 -16.813 1.00 3.24 C ATOM 1722 CD2 LEU A 491 -18.805 7.371 -16.807 1.00 52.05 C ATOM 0 H LEU A 491 -20.639 4.803 -13.980 1.00 72.01 H new ATOM 0 HA LEU A 491 -20.982 7.352 -14.934 1.00 12.22 H new ATOM 0 HB2 LEU A 491 -20.798 4.644 -16.285 1.00 5.44 H new ATOM 0 HB3 LEU A 491 -20.999 6.095 -17.248 1.00 5.44 H new ATOM 0 HG LEU A 491 -18.887 6.078 -15.080 1.00 35.23 H new ATOM 0 HD11 LEU A 491 -17.252 5.147 -16.706 1.00 3.24 H new ATOM 0 HD12 LEU A 491 -18.536 3.970 -16.341 1.00 3.24 H new ATOM 0 HD13 LEU A 491 -18.570 4.878 -17.871 1.00 3.24 H new ATOM 0 HD21 LEU A 491 -17.741 7.581 -16.698 1.00 52.05 H new ATOM 0 HD22 LEU A 491 -19.058 7.323 -17.866 1.00 52.05 H new ATOM 0 HD23 LEU A 491 -19.382 8.164 -16.331 1.00 52.05 H new ATOM 1734 N LYS A 492 -23.716 5.595 -15.221 1.00 72.13 N ATOM 1735 CA LYS A 492 -25.133 5.680 -15.558 1.00 31.05 C ATOM 1736 C LYS A 492 -25.706 7.044 -15.170 1.00 0.33 C ATOM 1737 O LYS A 492 -26.703 7.491 -15.740 1.00 42.51 O ATOM 1738 CB LYS A 492 -25.916 4.562 -14.846 1.00 23.25 C ATOM 1739 CG LYS A 492 -24.976 3.400 -14.510 1.00 54.24 C ATOM 1740 CD LYS A 492 -25.797 2.144 -14.210 1.00 4.33 C ATOM 1741 CE LYS A 492 -24.856 0.989 -13.861 1.00 2.22 C ATOM 1742 NZ LYS A 492 -25.640 -0.274 -13.747 1.00 2.21 N ATOM 0 H LYS A 492 -23.445 4.742 -14.731 1.00 72.13 H new ATOM 0 HA LYS A 492 -25.233 5.558 -16.636 1.00 31.05 H new ATOM 0 HB2 LYS A 492 -26.371 4.949 -13.934 1.00 23.25 H new ATOM 0 HB3 LYS A 492 -26.728 4.212 -15.483 1.00 23.25 H new ATOM 0 HG2 LYS A 492 -24.300 3.214 -15.344 1.00 54.24 H new ATOM 0 HG3 LYS A 492 -24.358 3.656 -13.650 1.00 54.24 H new ATOM 0 HD2 LYS A 492 -26.480 2.333 -13.382 1.00 4.33 H new ATOM 0 HD3 LYS A 492 -26.408 1.881 -15.074 1.00 4.33 H new ATOM 0 HE2 LYS A 492 -24.089 0.886 -14.629 1.00 2.22 H new ATOM 0 HE3 LYS A 492 -24.341 1.196 -12.923 1.00 2.22 H new ATOM 0 HZ1 LYS A 492 -25.001 -1.059 -13.510 1.00 2.21 H new ATOM 0 HZ2 LYS A 492 -26.356 -0.172 -12.999 1.00 2.21 H new ATOM 0 HZ3 LYS A 492 -26.111 -0.473 -14.652 1.00 2.21 H new ATOM 1756 N LYS A 493 -25.087 7.695 -14.189 1.00 52.43 N ATOM 1757 CA LYS A 493 -25.560 8.993 -13.728 1.00 23.14 C ATOM 1758 C LYS A 493 -25.169 10.113 -14.693 1.00 30.34 C ATOM 1759 O LYS A 493 -25.652 11.238 -14.569 1.00 14.03 O ATOM 1760 CB LYS A 493 -24.972 9.279 -12.345 1.00 32.43 C ATOM 1761 CG LYS A 493 -25.705 8.439 -11.290 1.00 12.04 C ATOM 1762 CD LYS A 493 -25.010 8.580 -9.928 1.00 23.13 C ATOM 1763 CE LYS A 493 -25.457 9.875 -9.242 1.00 12.13 C ATOM 1764 NZ LYS A 493 -26.941 9.875 -9.094 1.00 60.53 N ATOM 0 H LYS A 493 -24.262 7.346 -13.702 1.00 52.43 H new ATOM 0 HA LYS A 493 -26.648 8.961 -13.679 1.00 23.14 H new ATOM 0 HB2 LYS A 493 -23.908 9.045 -12.336 1.00 32.43 H new ATOM 0 HB3 LYS A 493 -25.067 10.339 -12.111 1.00 32.43 H new ATOM 0 HG2 LYS A 493 -26.743 8.763 -11.213 1.00 12.04 H new ATOM 0 HG3 LYS A 493 -25.719 7.392 -11.593 1.00 12.04 H new ATOM 0 HD2 LYS A 493 -25.250 7.724 -9.298 1.00 23.13 H new ATOM 0 HD3 LYS A 493 -23.928 8.584 -10.061 1.00 23.13 H new ATOM 0 HE2 LYS A 493 -24.984 9.963 -8.264 1.00 12.13 H new ATOM 0 HE3 LYS A 493 -25.140 10.737 -9.828 1.00 12.13 H new ATOM 0 HZ1 LYS A 493 -27.204 10.391 -8.230 1.00 60.53 H new ATOM 0 HZ2 LYS A 493 -27.372 10.339 -9.919 1.00 60.53 H new ATOM 0 HZ3 LYS A 493 -27.283 8.895 -9.029 1.00 60.53 H new ATOM 1778 N LEU A 494 -24.293 9.810 -15.647 1.00 32.25 N ATOM 1779 CA LEU A 494 -23.852 10.811 -16.610 1.00 2.33 C ATOM 1780 C LEU A 494 -24.813 10.879 -17.794 1.00 53.33 C ATOM 1781 O LEU A 494 -25.187 9.857 -18.368 1.00 32.35 O ATOM 1782 CB LEU A 494 -22.442 10.465 -17.106 1.00 54.25 C ATOM 1783 CG LEU A 494 -21.388 10.913 -16.080 1.00 31.50 C ATOM 1784 CD1 LEU A 494 -21.273 12.448 -16.057 1.00 22.52 C ATOM 1785 CD2 LEU A 494 -21.781 10.406 -14.686 1.00 22.12 C ATOM 0 H LEU A 494 -23.878 8.887 -15.773 1.00 32.25 H new ATOM 0 HA LEU A 494 -23.837 11.784 -16.119 1.00 2.33 H new ATOM 0 HB2 LEU A 494 -22.362 9.391 -17.274 1.00 54.25 H new ATOM 0 HB3 LEU A 494 -22.257 10.952 -18.063 1.00 54.25 H new ATOM 0 HG LEU A 494 -20.423 10.495 -16.365 1.00 31.50 H new ATOM 0 HD11 LEU A 494 -20.522 12.746 -15.325 1.00 22.52 H new ATOM 0 HD12 LEU A 494 -20.979 12.806 -17.044 1.00 22.52 H new ATOM 0 HD13 LEU A 494 -22.236 12.881 -15.786 1.00 22.52 H new ATOM 0 HD21 LEU A 494 -21.033 10.724 -13.959 1.00 22.12 H new ATOM 0 HD22 LEU A 494 -22.753 10.816 -14.410 1.00 22.12 H new ATOM 0 HD23 LEU A 494 -21.836 9.317 -14.697 1.00 22.12 H new ATOM 1797 N LYS A 495 -25.201 12.099 -18.151 1.00 24.31 N ATOM 1798 CA LYS A 495 -26.113 12.329 -19.266 1.00 24.24 C ATOM 1799 C LYS A 495 -25.335 12.823 -20.485 1.00 2.43 C ATOM 1800 O LYS A 495 -24.398 13.609 -20.355 1.00 72.21 O ATOM 1801 CB LYS A 495 -27.162 13.373 -18.858 1.00 3.23 C ATOM 1802 CG LYS A 495 -28.330 12.695 -18.122 1.00 61.14 C ATOM 1803 CD LYS A 495 -29.364 12.190 -19.134 1.00 31.01 C ATOM 1804 CE LYS A 495 -30.553 11.580 -18.388 1.00 43.54 C ATOM 1805 NZ LYS A 495 -30.113 10.346 -17.677 1.00 70.44 N ATOM 0 H LYS A 495 -24.895 12.950 -17.680 1.00 24.31 H new ATOM 0 HA LYS A 495 -26.611 11.394 -19.523 1.00 24.24 H new ATOM 0 HB2 LYS A 495 -26.705 14.125 -18.215 1.00 3.23 H new ATOM 0 HB3 LYS A 495 -27.532 13.892 -19.742 1.00 3.23 H new ATOM 0 HG2 LYS A 495 -27.959 11.864 -17.523 1.00 61.14 H new ATOM 0 HG3 LYS A 495 -28.796 13.401 -17.434 1.00 61.14 H new ATOM 0 HD2 LYS A 495 -29.701 13.011 -19.767 1.00 31.01 H new ATOM 0 HD3 LYS A 495 -28.913 11.446 -19.791 1.00 31.01 H new ATOM 0 HE2 LYS A 495 -30.956 12.299 -17.675 1.00 43.54 H new ATOM 0 HE3 LYS A 495 -31.353 11.343 -19.089 1.00 43.54 H new ATOM 0 HZ1 LYS A 495 -30.946 9.788 -17.401 1.00 70.44 H new ATOM 0 HZ2 LYS A 495 -29.510 9.779 -18.307 1.00 70.44 H new ATOM 0 HZ3 LYS A 495 -29.575 10.608 -16.826 1.00 70.44 H new ATOM 1819 N ALA A 496 -25.717 12.351 -21.667 1.00 4.44 N ATOM 1820 CA ALA A 496 -25.039 12.756 -22.893 1.00 22.40 C ATOM 1821 C ALA A 496 -25.088 14.276 -23.061 1.00 31.44 C ATOM 1822 O ALA A 496 -26.135 14.896 -22.878 1.00 22.02 O ATOM 1823 CB ALA A 496 -25.701 12.075 -24.098 1.00 74.02 C ATOM 0 H ALA A 496 -26.485 11.694 -21.802 1.00 4.44 H new ATOM 0 HA ALA A 496 -23.995 12.450 -22.832 1.00 22.40 H new ATOM 0 HB1 ALA A 496 -25.192 12.379 -25.013 1.00 74.02 H new ATOM 0 HB2 ALA A 496 -25.632 10.993 -23.987 1.00 74.02 H new ATOM 0 HB3 ALA A 496 -26.749 12.368 -24.151 1.00 74.02 H new ATOM 1829 N ASN A 497 -23.941 14.862 -23.406 1.00 52.52 N ATOM 1830 CA ASN A 497 -23.838 16.310 -23.601 1.00 23.32 C ATOM 1831 C ASN A 497 -24.145 17.066 -22.314 1.00 44.02 C ATOM 1832 O ASN A 497 -24.706 18.161 -22.351 1.00 21.44 O ATOM 1833 CB ASN A 497 -24.791 16.775 -24.706 1.00 74.50 C ATOM 1834 CG ASN A 497 -24.436 16.094 -26.022 1.00 43.33 C ATOM 1835 OD1 ASN A 497 -25.370 15.498 -26.708 1.00 65.03 O flip ATOM 1836 ND2 ASN A 497 -23.277 16.105 -26.434 1.00 54.45 N flip ATOM 0 H ASN A 497 -23.068 14.356 -23.557 1.00 52.52 H new ATOM 0 HA ASN A 497 -22.811 16.527 -23.895 1.00 23.32 H new ATOM 0 HB2 ASN A 497 -25.820 16.541 -24.432 1.00 74.50 H new ATOM 0 HB3 ASN A 497 -24.729 17.857 -24.819 1.00 74.50 H new ATOM 0 HD21 ASN A 497 -22.548 16.572 -25.895 1.00 54.45 H new ATOM 0 HD22 ASN A 497 -23.045 15.647 -27.315 1.00 54.45 H new ATOM 1843 N GLN A 498 -23.767 16.484 -21.178 1.00 13.13 N ATOM 1844 CA GLN A 498 -23.998 17.122 -19.880 1.00 62.43 C ATOM 1845 C GLN A 498 -22.690 17.201 -19.092 1.00 14.32 C ATOM 1846 O GLN A 498 -21.826 16.323 -19.207 1.00 21.42 O ATOM 1847 CB GLN A 498 -25.059 16.329 -19.086 1.00 51.34 C ATOM 1848 CG GLN A 498 -26.224 17.243 -18.687 1.00 54.42 C ATOM 1849 CD GLN A 498 -27.061 17.579 -19.915 1.00 60.14 C ATOM 1850 OE1 GLN A 498 -27.292 16.654 -20.809 1.00 10.05 O flip ATOM 1851 NE2 GLN A 498 -27.520 18.711 -20.066 1.00 42.23 N flip ATOM 0 H GLN A 498 -23.302 15.577 -21.127 1.00 13.13 H new ATOM 0 HA GLN A 498 -24.366 18.135 -20.042 1.00 62.43 H new ATOM 0 HB2 GLN A 498 -25.429 15.500 -19.689 1.00 51.34 H new ATOM 0 HB3 GLN A 498 -24.606 15.896 -18.194 1.00 51.34 H new ATOM 0 HG2 GLN A 498 -26.843 16.751 -17.937 1.00 54.42 H new ATOM 0 HG3 GLN A 498 -25.842 18.158 -18.235 1.00 54.42 H new ATOM 0 HE21 GLN A 498 -27.339 19.432 -19.368 1.00 42.23 H new ATOM 0 HE22 GLN A 498 -28.081 18.928 -20.890 1.00 42.23 H new ATOM 1860 N ARG A 499 -22.561 18.254 -18.281 1.00 54.44 N ATOM 1861 CA ARG A 499 -21.373 18.455 -17.453 1.00 21.23 C ATOM 1862 C ARG A 499 -21.789 18.611 -15.995 1.00 65.30 C ATOM 1863 O ARG A 499 -22.566 19.506 -15.662 1.00 72.32 O ATOM 1864 CB ARG A 499 -20.630 19.717 -17.901 1.00 33.00 C ATOM 1865 CG ARG A 499 -19.239 19.744 -17.264 1.00 63.35 C ATOM 1866 CD ARG A 499 -18.513 21.024 -17.680 1.00 40.42 C ATOM 1867 NE ARG A 499 -17.140 21.009 -17.186 1.00 53.21 N ATOM 1868 CZ ARG A 499 -16.177 20.376 -17.849 1.00 30.34 C ATOM 1869 NH1 ARG A 499 -16.451 19.755 -18.963 1.00 44.44 N ATOM 1870 NH2 ARG A 499 -14.957 20.376 -17.385 1.00 10.11 N ATOM 0 H ARG A 499 -23.268 18.982 -18.181 1.00 54.44 H new ATOM 0 HA ARG A 499 -20.716 17.592 -17.560 1.00 21.23 H new ATOM 0 HB2 ARG A 499 -20.544 19.735 -18.987 1.00 33.00 H new ATOM 0 HB3 ARG A 499 -21.192 20.605 -17.611 1.00 33.00 H new ATOM 0 HG2 ARG A 499 -19.323 19.698 -16.178 1.00 63.35 H new ATOM 0 HG3 ARG A 499 -18.667 18.871 -17.577 1.00 63.35 H new ATOM 0 HD2 ARG A 499 -18.515 21.115 -18.766 1.00 40.42 H new ATOM 0 HD3 ARG A 499 -19.039 21.893 -17.286 1.00 40.42 H new ATOM 0 HE ARG A 499 -16.915 21.493 -16.317 1.00 53.21 H new ATOM 0 HH11 ARG A 499 -17.404 19.755 -19.326 1.00 44.44 H new ATOM 0 HH12 ARG A 499 -15.712 19.270 -19.471 1.00 44.44 H new ATOM 0 HH21 ARG A 499 -14.743 20.862 -16.514 1.00 10.11 H new ATOM 0 HH22 ARG A 499 -14.218 19.890 -17.893 1.00 10.11 H new ATOM 1884 N LYS A 500 -21.284 17.737 -15.125 1.00 20.55 N ATOM 1885 CA LYS A 500 -21.631 17.796 -13.706 1.00 33.31 C ATOM 1886 C LYS A 500 -20.387 17.920 -12.835 1.00 61.32 C ATOM 1887 O LYS A 500 -19.322 17.404 -13.169 1.00 54.45 O ATOM 1888 CB LYS A 500 -22.393 16.536 -13.310 1.00 3.04 C ATOM 1889 CG LYS A 500 -23.720 16.476 -14.070 1.00 25.52 C ATOM 1890 CD LYS A 500 -24.663 15.515 -13.353 1.00 75.11 C ATOM 1891 CE LYS A 500 -25.887 15.245 -14.230 1.00 75.40 C ATOM 1892 NZ LYS A 500 -26.667 16.504 -14.397 1.00 13.13 N ATOM 0 H LYS A 500 -20.640 16.987 -15.374 1.00 20.55 H new ATOM 0 HA LYS A 500 -22.253 18.677 -13.550 1.00 33.31 H new ATOM 0 HB2 LYS A 500 -21.795 15.652 -13.533 1.00 3.04 H new ATOM 0 HB3 LYS A 500 -22.578 16.533 -12.236 1.00 3.04 H new ATOM 0 HG2 LYS A 500 -24.166 17.469 -14.126 1.00 25.52 H new ATOM 0 HG3 LYS A 500 -23.552 16.144 -15.094 1.00 25.52 H new ATOM 0 HD2 LYS A 500 -24.147 14.580 -13.133 1.00 75.11 H new ATOM 0 HD3 LYS A 500 -24.974 15.939 -12.398 1.00 75.11 H new ATOM 0 HE2 LYS A 500 -25.574 14.867 -15.203 1.00 75.40 H new ATOM 0 HE3 LYS A 500 -26.511 14.476 -13.775 1.00 75.40 H new ATOM 0 HZ1 LYS A 500 -27.594 16.285 -14.815 1.00 13.13 H new ATOM 0 HZ2 LYS A 500 -26.803 16.954 -13.469 1.00 13.13 H new ATOM 0 HZ3 LYS A 500 -26.149 17.153 -15.024 1.00 13.13 H new ATOM 1906 N ASN A 501 -20.547 18.605 -11.705 1.00 72.23 N ATOM 1907 CA ASN A 501 -19.451 18.800 -10.758 1.00 2.34 C ATOM 1908 C ASN A 501 -19.834 18.214 -9.403 1.00 20.12 C ATOM 1909 O ASN A 501 -20.918 18.490 -8.889 1.00 1.42 O ATOM 1910 CB ASN A 501 -19.148 20.292 -10.605 1.00 34.45 C ATOM 1911 CG ASN A 501 -17.857 20.485 -9.818 1.00 14.33 C ATOM 1912 OD1 ASN A 501 -16.793 20.044 -10.252 1.00 15.04 O ATOM 1913 ND2 ASN A 501 -17.886 21.121 -8.679 1.00 64.14 N ATOM 0 H ASN A 501 -21.427 19.035 -11.422 1.00 72.23 H new ATOM 0 HA ASN A 501 -18.562 18.294 -11.135 1.00 2.34 H new ATOM 0 HB2 ASN A 501 -19.057 20.755 -11.587 1.00 34.45 H new ATOM 0 HB3 ASN A 501 -19.973 20.788 -10.094 1.00 34.45 H new ATOM 0 HD21 ASN A 501 -17.026 21.253 -8.147 1.00 64.14 H new ATOM 0 HD22 ASN A 501 -18.769 21.486 -8.321 1.00 64.14 H new ATOM 1920 N PHE A 502 -18.950 17.397 -8.834 1.00 23.14 N ATOM 1921 CA PHE A 502 -19.223 16.765 -7.542 1.00 44.41 C ATOM 1922 C PHE A 502 -18.169 17.133 -6.507 1.00 13.10 C ATOM 1923 O PHE A 502 -16.971 17.169 -6.796 1.00 43.01 O ATOM 1924 CB PHE A 502 -19.258 15.246 -7.705 1.00 61.01 C ATOM 1925 CG PHE A 502 -20.083 14.882 -8.916 1.00 25.42 C ATOM 1926 CD1 PHE A 502 -19.535 15.004 -10.198 1.00 35.42 C ATOM 1927 CD2 PHE A 502 -21.395 14.419 -8.757 1.00 40.31 C ATOM 1928 CE1 PHE A 502 -20.298 14.662 -11.321 1.00 11.23 C ATOM 1929 CE2 PHE A 502 -22.158 14.079 -9.880 1.00 23.42 C ATOM 1930 CZ PHE A 502 -21.610 14.199 -11.162 1.00 14.34 C ATOM 0 H PHE A 502 -18.046 17.158 -9.241 1.00 23.14 H new ATOM 0 HA PHE A 502 -20.190 17.127 -7.193 1.00 44.41 H new ATOM 0 HB2 PHE A 502 -18.245 14.859 -7.814 1.00 61.01 H new ATOM 0 HB3 PHE A 502 -19.681 14.785 -6.813 1.00 61.01 H new ATOM 0 HD1 PHE A 502 -18.524 15.362 -10.321 1.00 35.42 H new ATOM 0 HD2 PHE A 502 -21.818 14.324 -7.768 1.00 40.31 H new ATOM 0 HE1 PHE A 502 -19.875 14.755 -12.310 1.00 11.23 H new ATOM 0 HE2 PHE A 502 -23.170 13.724 -9.757 1.00 23.42 H new ATOM 0 HZ PHE A 502 -22.198 13.935 -12.028 1.00 14.34 H new ATOM 1940 N ASN A 503 -18.640 17.380 -5.290 1.00 33.34 N ATOM 1941 CA ASN A 503 -17.775 17.724 -4.168 1.00 73.32 C ATOM 1942 C ASN A 503 -18.163 16.851 -2.984 1.00 63.20 C ATOM 1943 O ASN A 503 -19.199 17.077 -2.358 1.00 13.23 O ATOM 1944 CB ASN A 503 -17.955 19.195 -3.796 1.00 45.11 C ATOM 1945 CG ASN A 503 -16.863 19.626 -2.824 1.00 2.12 C ATOM 1946 OD1 ASN A 503 -16.127 18.721 -2.242 1.00 21.43 O flip ATOM 1947 ND2 ASN A 503 -16.676 20.820 -2.589 1.00 53.43 N flip ATOM 0 H ASN A 503 -19.632 17.347 -5.054 1.00 33.34 H new ATOM 0 HA ASN A 503 -16.732 17.559 -4.440 1.00 73.32 H new ATOM 0 HB2 ASN A 503 -17.918 19.812 -4.694 1.00 45.11 H new ATOM 0 HB3 ASN A 503 -18.935 19.347 -3.345 1.00 45.11 H new ATOM 0 HD21 ASN A 503 -17.253 21.526 -3.046 1.00 53.43 H new ATOM 0 HD22 ASN A 503 -15.944 21.103 -1.938 1.00 53.43 H new ATOM 1954 N ILE A 504 -17.360 15.829 -2.701 1.00 54.42 N ATOM 1955 CA ILE A 504 -17.689 14.914 -1.604 1.00 41.33 C ATOM 1956 C ILE A 504 -16.462 14.513 -0.789 1.00 64.21 C ATOM 1957 O ILE A 504 -15.324 14.803 -1.157 1.00 65.21 O ATOM 1958 CB ILE A 504 -18.382 13.664 -2.168 1.00 55.32 C ATOM 1959 CG1 ILE A 504 -17.744 13.267 -3.499 1.00 1.50 C ATOM 1960 CG2 ILE A 504 -19.866 13.966 -2.402 1.00 23.35 C ATOM 1961 CD1 ILE A 504 -16.243 13.033 -3.314 1.00 71.40 C ATOM 0 H ILE A 504 -16.497 15.614 -3.200 1.00 54.42 H new ATOM 0 HA ILE A 504 -18.361 15.441 -0.927 1.00 41.33 H new ATOM 0 HB ILE A 504 -18.273 12.847 -1.454 1.00 55.32 H new ATOM 0 HG12 ILE A 504 -18.216 12.362 -3.882 1.00 1.50 H new ATOM 0 HG13 ILE A 504 -17.909 14.051 -4.238 1.00 1.50 H new ATOM 0 HG21 ILE A 504 -20.359 13.080 -2.802 1.00 23.35 H new ATOM 0 HG22 ILE A 504 -20.334 14.246 -1.458 1.00 23.35 H new ATOM 0 HG23 ILE A 504 -19.963 14.787 -3.112 1.00 23.35 H new ATOM 0 HD11 ILE A 504 -15.798 12.751 -4.268 1.00 71.40 H new ATOM 0 HD12 ILE A 504 -15.774 13.948 -2.952 1.00 71.40 H new ATOM 0 HD13 ILE A 504 -16.086 12.234 -2.590 1.00 71.40 H new ATOM 1973 N CYS A 505 -16.726 13.843 0.333 1.00 61.03 N ATOM 1974 CA CYS A 505 -15.668 13.388 1.229 1.00 61.12 C ATOM 1975 C CYS A 505 -15.218 11.978 0.863 1.00 12.12 C ATOM 1976 O CYS A 505 -16.040 11.111 0.567 1.00 64.43 O ATOM 1977 CB CYS A 505 -16.174 13.400 2.673 1.00 41.02 C ATOM 1978 SG CYS A 505 -14.928 12.654 3.754 1.00 1.42 S ATOM 0 H CYS A 505 -17.668 13.604 0.642 1.00 61.03 H new ATOM 0 HA CYS A 505 -14.819 14.064 1.129 1.00 61.12 H new ATOM 0 HB2 CYS A 505 -16.380 14.423 2.989 1.00 41.02 H new ATOM 0 HB3 CYS A 505 -17.111 12.849 2.746 1.00 41.02 H new ATOM 0 HG CYS A 505 -14.601 11.482 3.295 1.00 1.42 H new ATOM 1984 N LEU A 506 -13.908 11.755 0.896 1.00 63.45 N ATOM 1985 CA LEU A 506 -13.360 10.443 0.575 1.00 24.03 C ATOM 1986 C LEU A 506 -13.508 9.499 1.765 1.00 3.31 C ATOM 1987 O LEU A 506 -13.529 9.934 2.916 1.00 20.11 O ATOM 1988 CB LEU A 506 -11.881 10.571 0.206 1.00 24.13 C ATOM 1989 CG LEU A 506 -11.713 11.670 -0.846 1.00 11.32 C ATOM 1990 CD1 LEU A 506 -10.242 11.767 -1.257 1.00 12.12 C ATOM 1991 CD2 LEU A 506 -12.570 11.336 -2.072 1.00 53.33 C ATOM 0 H LEU A 506 -13.212 12.459 1.140 1.00 63.45 H new ATOM 0 HA LEU A 506 -13.911 10.035 -0.272 1.00 24.03 H new ATOM 0 HB2 LEU A 506 -11.293 10.808 1.093 1.00 24.13 H new ATOM 0 HB3 LEU A 506 -11.508 9.622 -0.180 1.00 24.13 H new ATOM 0 HG LEU A 506 -12.033 12.625 -0.429 1.00 11.32 H new ATOM 0 HD11 LEU A 506 -10.124 12.550 -2.006 1.00 12.12 H new ATOM 0 HD12 LEU A 506 -9.635 12.006 -0.384 1.00 12.12 H new ATOM 0 HD13 LEU A 506 -9.917 10.814 -1.674 1.00 12.12 H new ATOM 0 HD21 LEU A 506 -12.452 12.118 -2.822 1.00 53.33 H new ATOM 0 HD22 LEU A 506 -12.251 10.381 -2.489 1.00 53.33 H new ATOM 0 HD23 LEU A 506 -13.617 11.272 -1.777 1.00 53.33 H new