USER MOD reduce.3.24.130724 H: found=0, std=0, add=592, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 591 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 393 SER OG : rot 107:sc= 1.45 USER MOD Set 1.2: A 397 LYS NZ :NH3+ 152:sc= 1.57 (180deg=0.0395) USER MOD Set 1.3: A 398 TYR OH : rot 180:sc= 0.699 USER MOD Set 1.4: A 410 TYR OH : rot 30:sc= 0.743 USER MOD Set 2.1: A 405 LYS NZ :NH3+ 159:sc= 1.3 (180deg=0) USER MOD Set 2.2: A 409 HIS : no HE2:sc= 0.91 K(o=2.2,f=-11!) USER MOD Single : A 374 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 375 HIS : no HD1:sc= -0.913 K(o=-0.91,f=-2.2!) USER MOD Single : A 379 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 381 GLN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 389 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 390 ASN : amide:sc= -0.197 X(o=-0.2,f=-0.15) USER MOD Single : A 402 ASN : amide:sc= 0.503 K(o=0.5,f=-0.91) USER MOD Single : A 404 SER OG : rot 180:sc= 0.00042 USER MOD Single : A 411 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0198) USER MOD Single : A 413 ASN : amide:sc= 0.877 K(o=0.88,f=-7!) USER MOD Single : A 414 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 416 THR OG1 : rot 180:sc= 0.205 USER MOD Single : A 417 SER OG : rot 180:sc= 0.0068 USER MOD Single : A 419 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 426 THR OG1 : rot 71:sc= 0.855 USER MOD Single : A 427 MET CE :methyl 175:sc= 0 (180deg=-0.0686) USER MOD Single : A 428 LYS NZ :NH3+ 169:sc= 1.22 (180deg=1.09) USER MOD Single : A 429 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 431 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 434 SER OG : rot 180:sc= 0 USER MOD Single : A 435 SER OG : rot 180:sc= 0.00416 USER MOD Single : A 437 SER OG : rot 79:sc= 0.382 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 373 -39.555 12.358 17.354 1.00 0.00 N ATOM 2 CA GLU A 373 -38.148 12.588 17.721 1.00 0.00 C ATOM 3 C GLU A 373 -37.238 12.600 16.488 1.00 0.00 C ATOM 4 O GLU A 373 -36.747 13.654 16.090 1.00 0.00 O ATOM 5 CB GLU A 373 -37.673 11.541 18.737 1.00 0.00 C ATOM 6 CG GLU A 373 -38.543 11.487 19.999 1.00 0.00 C ATOM 7 CD GLU A 373 -38.061 10.365 20.908 1.00 0.00 C ATOM 8 OE1 GLU A 373 -38.166 9.204 20.456 1.00 0.00 O ATOM 9 OE2 GLU A 373 -37.583 10.688 22.015 1.00 0.00 O ATOM 0 HA GLU A 373 -38.086 13.572 18.185 1.00 0.00 H new ATOM 0 HB2 GLU A 373 -37.670 10.559 18.263 1.00 0.00 H new ATOM 0 HB3 GLU A 373 -36.644 11.761 19.022 1.00 0.00 H new ATOM 0 HG2 GLU A 373 -38.496 12.440 20.526 1.00 0.00 H new ATOM 0 HG3 GLU A 373 -39.586 11.325 19.727 1.00 0.00 H new ATOM 16 N LYS A 374 -37.005 11.424 15.891 1.00 0.00 N ATOM 17 CA LYS A 374 -36.145 11.248 14.727 1.00 0.00 C ATOM 18 C LYS A 374 -36.783 11.822 13.458 1.00 0.00 C ATOM 19 O LYS A 374 -37.355 11.086 12.656 1.00 0.00 O ATOM 20 CB LYS A 374 -35.732 9.771 14.577 1.00 0.00 C ATOM 21 CG LYS A 374 -36.888 8.757 14.666 1.00 0.00 C ATOM 22 CD LYS A 374 -36.900 8.039 16.027 1.00 0.00 C ATOM 23 CE LYS A 374 -38.150 7.172 16.226 1.00 0.00 C ATOM 24 NZ LYS A 374 -38.200 6.031 15.290 1.00 0.00 N ATOM 0 H LYS A 374 -37.422 10.552 16.216 1.00 0.00 H new ATOM 0 HA LYS A 374 -35.231 11.821 14.885 1.00 0.00 H new ATOM 0 HB2 LYS A 374 -35.232 9.645 13.616 1.00 0.00 H new ATOM 0 HB3 LYS A 374 -35.001 9.534 15.350 1.00 0.00 H new ATOM 0 HG2 LYS A 374 -37.837 9.271 14.515 1.00 0.00 H new ATOM 0 HG3 LYS A 374 -36.793 8.023 13.866 1.00 0.00 H new ATOM 0 HD2 LYS A 374 -36.011 7.413 16.111 1.00 0.00 H new ATOM 0 HD3 LYS A 374 -36.845 8.780 16.825 1.00 0.00 H new ATOM 0 HE2 LYS A 374 -38.171 6.799 17.250 1.00 0.00 H new ATOM 0 HE3 LYS A 374 -39.040 7.787 16.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 374 -39.062 5.476 15.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 374 -38.208 6.384 14.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 374 -37.365 5.427 15.434 1.00 0.00 H new ATOM 38 N HIS A 375 -36.669 13.142 13.285 1.00 0.00 N ATOM 39 CA HIS A 375 -37.190 13.888 12.147 1.00 0.00 C ATOM 40 C HIS A 375 -36.015 14.538 11.415 1.00 0.00 C ATOM 41 O HIS A 375 -35.886 15.759 11.391 1.00 0.00 O ATOM 42 CB HIS A 375 -38.210 14.920 12.645 1.00 0.00 C ATOM 43 CG HIS A 375 -39.268 14.314 13.527 1.00 0.00 C ATOM 44 ND1 HIS A 375 -40.045 13.235 13.131 1.00 0.00 N ATOM 45 CD2 HIS A 375 -39.688 14.621 14.798 1.00 0.00 C ATOM 46 CE1 HIS A 375 -40.872 12.948 14.150 1.00 0.00 C ATOM 47 NE2 HIS A 375 -40.703 13.757 15.200 1.00 0.00 N ATOM 0 H HIS A 375 -36.193 13.738 13.962 1.00 0.00 H new ATOM 0 HA HIS A 375 -37.706 13.233 11.445 1.00 0.00 H new ATOM 0 HB2 HIS A 375 -37.689 15.703 13.196 1.00 0.00 H new ATOM 0 HB3 HIS A 375 -38.687 15.396 11.788 1.00 0.00 H new ATOM 0 HD2 HIS A 375 -39.287 15.421 15.402 1.00 0.00 H new ATOM 0 HE1 HIS A 375 -41.597 12.148 14.123 1.00 0.00 H new ATOM 0 HE2 HIS A 375 -41.202 13.744 16.090 1.00 0.00 H new ATOM 55 N ARG A 376 -35.147 13.707 10.830 1.00 0.00 N ATOM 56 CA ARG A 376 -33.963 14.160 10.113 1.00 0.00 C ATOM 57 C ARG A 376 -33.587 13.171 9.007 1.00 0.00 C ATOM 58 O ARG A 376 -32.428 12.784 8.875 1.00 0.00 O ATOM 59 CB ARG A 376 -32.822 14.424 11.114 1.00 0.00 C ATOM 60 CG ARG A 376 -32.509 13.222 12.020 1.00 0.00 C ATOM 61 CD ARG A 376 -31.405 13.584 13.018 1.00 0.00 C ATOM 62 NE ARG A 376 -31.090 12.448 13.896 1.00 0.00 N ATOM 63 CZ ARG A 376 -30.241 12.493 14.937 1.00 0.00 C ATOM 64 NH1 ARG A 376 -29.607 13.632 15.247 1.00 0.00 N ATOM 65 NH2 ARG A 376 -30.026 11.391 15.668 1.00 0.00 N ATOM 0 H ARG A 376 -35.252 12.693 10.844 1.00 0.00 H new ATOM 0 HA ARG A 376 -34.171 15.104 9.609 1.00 0.00 H new ATOM 0 HB2 ARG A 376 -31.922 14.697 10.563 1.00 0.00 H new ATOM 0 HB3 ARG A 376 -33.086 15.279 11.737 1.00 0.00 H new ATOM 0 HG2 ARG A 376 -33.408 12.918 12.556 1.00 0.00 H new ATOM 0 HG3 ARG A 376 -32.196 12.372 11.413 1.00 0.00 H new ATOM 0 HD2 ARG A 376 -30.509 13.889 12.478 1.00 0.00 H new ATOM 0 HD3 ARG A 376 -31.720 14.436 13.620 1.00 0.00 H new ATOM 0 HE ARG A 376 -31.550 11.559 13.701 1.00 0.00 H new ATOM 0 HH11 ARG A 376 -29.767 14.472 14.692 1.00 0.00 H new ATOM 0 HH12 ARG A 376 -28.964 13.659 16.038 1.00 0.00 H new ATOM 0 HH21 ARG A 376 -30.506 10.522 15.434 1.00 0.00 H new ATOM 0 HH22 ARG A 376 -29.382 11.421 16.459 1.00 0.00 H new ATOM 79 N ALA A 377 -34.578 12.771 8.203 1.00 0.00 N ATOM 80 CA ALA A 377 -34.383 11.850 7.093 1.00 0.00 C ATOM 81 C ALA A 377 -33.648 12.568 5.960 1.00 0.00 C ATOM 82 O ALA A 377 -33.949 13.724 5.663 1.00 0.00 O ATOM 83 CB ALA A 377 -35.739 11.323 6.618 1.00 0.00 C ATOM 0 H ALA A 377 -35.543 13.083 8.310 1.00 0.00 H new ATOM 0 HA ALA A 377 -33.779 11.002 7.416 1.00 0.00 H new ATOM 0 HB1 ALA A 377 -35.591 10.634 5.787 1.00 0.00 H new ATOM 0 HB2 ALA A 377 -36.234 10.802 7.437 1.00 0.00 H new ATOM 0 HB3 ALA A 377 -36.359 12.157 6.291 1.00 0.00 H new ATOM 89 N ARG A 378 -32.680 11.886 5.335 1.00 0.00 N ATOM 90 CA ARG A 378 -31.876 12.408 4.236 1.00 0.00 C ATOM 91 C ARG A 378 -31.587 11.263 3.263 1.00 0.00 C ATOM 92 O ARG A 378 -31.719 10.096 3.629 1.00 0.00 O ATOM 93 CB ARG A 378 -30.566 13.014 4.766 1.00 0.00 C ATOM 94 CG ARG A 378 -30.817 14.109 5.811 1.00 0.00 C ATOM 95 CD ARG A 378 -29.521 14.834 6.193 1.00 0.00 C ATOM 96 NE ARG A 378 -29.720 15.712 7.358 1.00 0.00 N ATOM 97 CZ ARG A 378 -30.375 16.886 7.357 1.00 0.00 C ATOM 98 NH1 ARG A 378 -30.904 17.373 6.226 1.00 0.00 N ATOM 99 NH2 ARG A 378 -30.498 17.576 8.498 1.00 0.00 N ATOM 0 H ARG A 378 -32.432 10.930 5.591 1.00 0.00 H new ATOM 0 HA ARG A 378 -32.420 13.200 3.722 1.00 0.00 H new ATOM 0 HB2 ARG A 378 -29.955 12.226 5.207 1.00 0.00 H new ATOM 0 HB3 ARG A 378 -29.998 13.431 3.935 1.00 0.00 H new ATOM 0 HG2 ARG A 378 -31.535 14.829 5.419 1.00 0.00 H new ATOM 0 HG3 ARG A 378 -31.263 13.667 6.702 1.00 0.00 H new ATOM 0 HD2 ARG A 378 -28.745 14.102 6.416 1.00 0.00 H new ATOM 0 HD3 ARG A 378 -29.169 15.424 5.347 1.00 0.00 H new ATOM 0 HE ARG A 378 -29.325 15.402 8.246 1.00 0.00 H new ATOM 0 HH11 ARG A 378 -30.812 16.852 5.354 1.00 0.00 H new ATOM 0 HH12 ARG A 378 -31.399 18.265 6.237 1.00 0.00 H new ATOM 0 HH21 ARG A 378 -30.096 17.210 9.361 1.00 0.00 H new ATOM 0 HH22 ARG A 378 -30.994 18.467 8.504 1.00 0.00 H new ATOM 113 N LYS A 379 -31.181 11.592 2.030 1.00 0.00 N ATOM 114 CA LYS A 379 -30.874 10.622 0.979 1.00 0.00 C ATOM 115 C LYS A 379 -29.547 9.872 1.186 1.00 0.00 C ATOM 116 O LYS A 379 -28.857 9.545 0.222 1.00 0.00 O ATOM 117 CB LYS A 379 -30.994 11.295 -0.405 1.00 0.00 C ATOM 118 CG LYS A 379 -30.234 12.619 -0.619 1.00 0.00 C ATOM 119 CD LYS A 379 -28.709 12.496 -0.476 1.00 0.00 C ATOM 120 CE LYS A 379 -27.969 13.752 -0.961 1.00 0.00 C ATOM 121 NZ LYS A 379 -28.310 14.954 -0.180 1.00 0.00 N ATOM 0 H LYS A 379 -31.055 12.560 1.732 1.00 0.00 H new ATOM 0 HA LYS A 379 -31.620 9.829 1.035 1.00 0.00 H new ATOM 0 HB2 LYS A 379 -30.650 10.584 -1.156 1.00 0.00 H new ATOM 0 HB3 LYS A 379 -32.051 11.478 -0.600 1.00 0.00 H new ATOM 0 HG2 LYS A 379 -30.465 13.002 -1.613 1.00 0.00 H new ATOM 0 HG3 LYS A 379 -30.598 13.354 0.099 1.00 0.00 H new ATOM 0 HD2 LYS A 379 -28.459 12.312 0.569 1.00 0.00 H new ATOM 0 HD3 LYS A 379 -28.363 11.632 -1.044 1.00 0.00 H new ATOM 0 HE2 LYS A 379 -26.894 13.580 -0.903 1.00 0.00 H new ATOM 0 HE3 LYS A 379 -28.208 13.926 -2.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 379 -27.782 15.770 -0.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 379 -29.331 15.139 -0.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 379 -28.058 14.803 0.818 1.00 0.00 H new ATOM 135 N ARG A 380 -29.181 9.577 2.438 1.00 0.00 N ATOM 136 CA ARG A 380 -27.965 8.859 2.787 1.00 0.00 C ATOM 137 C ARG A 380 -28.270 7.360 2.725 1.00 0.00 C ATOM 138 O ARG A 380 -28.210 6.661 3.735 1.00 0.00 O ATOM 139 CB ARG A 380 -27.508 9.334 4.176 1.00 0.00 C ATOM 140 CG ARG A 380 -26.116 8.819 4.563 1.00 0.00 C ATOM 141 CD ARG A 380 -25.718 9.394 5.927 1.00 0.00 C ATOM 142 NE ARG A 380 -24.427 8.865 6.391 1.00 0.00 N ATOM 143 CZ ARG A 380 -24.245 7.678 6.995 1.00 0.00 C ATOM 144 NH1 ARG A 380 -25.269 6.827 7.148 1.00 0.00 N ATOM 145 NH2 ARG A 380 -23.031 7.344 7.450 1.00 0.00 N ATOM 0 H ARG A 380 -29.739 9.840 3.250 1.00 0.00 H new ATOM 0 HA ARG A 380 -27.146 9.055 2.095 1.00 0.00 H new ATOM 0 HB2 ARG A 380 -27.504 10.424 4.197 1.00 0.00 H new ATOM 0 HB3 ARG A 380 -28.231 9.004 4.922 1.00 0.00 H new ATOM 0 HG2 ARG A 380 -26.118 7.730 4.602 1.00 0.00 H new ATOM 0 HG3 ARG A 380 -25.386 9.109 3.807 1.00 0.00 H new ATOM 0 HD2 ARG A 380 -25.662 10.481 5.860 1.00 0.00 H new ATOM 0 HD3 ARG A 380 -26.491 9.159 6.659 1.00 0.00 H new ATOM 0 HE ARG A 380 -23.602 9.446 6.242 1.00 0.00 H new ATOM 0 HH11 ARG A 380 -26.196 7.078 6.805 1.00 0.00 H new ATOM 0 HH12 ARG A 380 -25.121 5.929 7.608 1.00 0.00 H new ATOM 0 HH21 ARG A 380 -22.249 7.989 7.338 1.00 0.00 H new ATOM 0 HH22 ARG A 380 -22.888 6.444 7.909 1.00 0.00 H new ATOM 159 N GLN A 381 -28.610 6.864 1.529 1.00 0.00 N ATOM 160 CA GLN A 381 -28.964 5.466 1.298 1.00 0.00 C ATOM 161 C GLN A 381 -27.722 4.573 1.158 1.00 0.00 C ATOM 162 O GLN A 381 -27.667 3.715 0.279 1.00 0.00 O ATOM 163 CB GLN A 381 -29.907 5.397 0.084 1.00 0.00 C ATOM 164 CG GLN A 381 -30.750 4.111 0.064 1.00 0.00 C ATOM 165 CD GLN A 381 -31.716 4.067 -1.119 1.00 0.00 C ATOM 166 OE1 GLN A 381 -31.831 5.022 -1.882 1.00 0.00 O ATOM 167 NE2 GLN A 381 -32.425 2.950 -1.277 1.00 0.00 N ATOM 0 H GLN A 381 -28.646 7.435 0.684 1.00 0.00 H new ATOM 0 HA GLN A 381 -29.490 5.068 2.166 1.00 0.00 H new ATOM 0 HB2 GLN A 381 -30.570 6.262 0.094 1.00 0.00 H new ATOM 0 HB3 GLN A 381 -29.319 5.456 -0.832 1.00 0.00 H new ATOM 0 HG2 GLN A 381 -30.088 3.246 0.021 1.00 0.00 H new ATOM 0 HG3 GLN A 381 -31.314 4.035 0.994 1.00 0.00 H new ATOM 0 HE21 GLN A 381 -32.306 2.174 -0.626 1.00 0.00 H new ATOM 0 HE22 GLN A 381 -33.086 2.871 -2.049 1.00 0.00 H new ATOM 176 N ALA A 382 -26.736 4.768 2.044 1.00 0.00 N ATOM 177 CA ALA A 382 -25.486 4.018 2.112 1.00 0.00 C ATOM 178 C ALA A 382 -24.691 4.003 0.795 1.00 0.00 C ATOM 179 O ALA A 382 -25.025 4.693 -0.167 1.00 0.00 O ATOM 180 CB ALA A 382 -25.779 2.604 2.635 1.00 0.00 C ATOM 0 H ALA A 382 -26.796 5.488 2.764 1.00 0.00 H new ATOM 0 HA ALA A 382 -24.827 4.535 2.810 1.00 0.00 H new ATOM 0 HB1 ALA A 382 -24.850 2.036 2.689 1.00 0.00 H new ATOM 0 HB2 ALA A 382 -26.223 2.668 3.628 1.00 0.00 H new ATOM 0 HB3 ALA A 382 -26.472 2.102 1.959 1.00 0.00 H new ATOM 186 N TRP A 383 -23.624 3.198 0.782 1.00 0.00 N ATOM 187 CA TRP A 383 -22.710 2.976 -0.326 1.00 0.00 C ATOM 188 C TRP A 383 -22.438 1.474 -0.361 1.00 0.00 C ATOM 189 O TRP A 383 -22.184 0.876 0.684 1.00 0.00 O ATOM 190 CB TRP A 383 -21.410 3.757 -0.095 1.00 0.00 C ATOM 191 CG TRP A 383 -21.249 5.001 -0.909 1.00 0.00 C ATOM 192 CD1 TRP A 383 -22.061 6.081 -0.894 1.00 0.00 C ATOM 193 CD2 TRP A 383 -20.204 5.305 -1.876 1.00 0.00 C ATOM 194 NE1 TRP A 383 -21.596 7.032 -1.780 1.00 0.00 N ATOM 195 CE2 TRP A 383 -20.447 6.600 -2.416 1.00 0.00 C ATOM 196 CE3 TRP A 383 -19.070 4.613 -2.346 1.00 0.00 C ATOM 197 CZ2 TRP A 383 -19.606 7.173 -3.380 1.00 0.00 C ATOM 198 CZ3 TRP A 383 -18.221 5.178 -3.312 1.00 0.00 C ATOM 199 CH2 TRP A 383 -18.491 6.453 -3.831 1.00 0.00 C ATOM 0 H TRP A 383 -23.365 2.651 1.603 1.00 0.00 H new ATOM 0 HA TRP A 383 -23.131 3.318 -1.271 1.00 0.00 H new ATOM 0 HB2 TRP A 383 -21.351 4.025 0.960 1.00 0.00 H new ATOM 0 HB3 TRP A 383 -20.569 3.096 -0.304 1.00 0.00 H new ATOM 0 HD1 TRP A 383 -22.943 6.185 -0.280 1.00 0.00 H new ATOM 0 HE1 TRP A 383 -22.042 7.935 -1.944 1.00 0.00 H new ATOM 0 HE3 TRP A 383 -18.850 3.630 -1.956 1.00 0.00 H new ATOM 0 HZ2 TRP A 383 -19.815 8.158 -3.771 1.00 0.00 H new ATOM 0 HZ3 TRP A 383 -17.357 4.629 -3.656 1.00 0.00 H new ATOM 0 HH2 TRP A 383 -17.839 6.880 -4.579 1.00 0.00 H new ATOM 210 N LEU A 384 -22.508 0.862 -1.546 1.00 0.00 N ATOM 211 CA LEU A 384 -22.295 -0.567 -1.709 1.00 0.00 C ATOM 212 C LEU A 384 -20.806 -0.923 -1.744 1.00 0.00 C ATOM 213 O LEU A 384 -19.945 -0.087 -2.012 1.00 0.00 O ATOM 214 CB LEU A 384 -22.997 -1.055 -2.985 1.00 0.00 C ATOM 215 CG LEU A 384 -24.503 -0.755 -3.047 1.00 0.00 C ATOM 216 CD1 LEU A 384 -25.043 -1.217 -4.406 1.00 0.00 C ATOM 217 CD2 LEU A 384 -25.279 -1.458 -1.926 1.00 0.00 C ATOM 0 H LEU A 384 -22.715 1.350 -2.417 1.00 0.00 H new ATOM 0 HA LEU A 384 -22.725 -1.072 -0.844 1.00 0.00 H new ATOM 0 HB2 LEU A 384 -22.514 -0.596 -3.847 1.00 0.00 H new ATOM 0 HB3 LEU A 384 -22.851 -2.132 -3.074 1.00 0.00 H new ATOM 0 HG LEU A 384 -24.640 0.319 -2.918 1.00 0.00 H new ATOM 0 HD11 LEU A 384 -26.112 -1.010 -4.463 1.00 0.00 H new ATOM 0 HD12 LEU A 384 -24.527 -0.682 -5.203 1.00 0.00 H new ATOM 0 HD13 LEU A 384 -24.875 -2.288 -4.519 1.00 0.00 H new ATOM 0 HD21 LEU A 384 -26.339 -1.217 -2.010 1.00 0.00 H new ATOM 0 HD22 LEU A 384 -25.145 -2.536 -2.011 1.00 0.00 H new ATOM 0 HD23 LEU A 384 -24.906 -1.121 -0.959 1.00 0.00 H new ATOM 229 N TRP A 385 -20.529 -2.203 -1.476 1.00 0.00 N ATOM 230 CA TRP A 385 -19.206 -2.815 -1.467 1.00 0.00 C ATOM 231 C TRP A 385 -18.460 -2.507 -2.768 1.00 0.00 C ATOM 232 O TRP A 385 -17.295 -2.111 -2.749 1.00 0.00 O ATOM 233 CB TRP A 385 -19.368 -4.333 -1.265 1.00 0.00 C ATOM 234 CG TRP A 385 -20.345 -5.013 -2.186 1.00 0.00 C ATOM 235 CD1 TRP A 385 -21.676 -5.123 -1.976 1.00 0.00 C ATOM 236 CD2 TRP A 385 -20.096 -5.673 -3.465 1.00 0.00 C ATOM 237 NE1 TRP A 385 -22.269 -5.792 -3.024 1.00 0.00 N ATOM 238 CE2 TRP A 385 -21.338 -6.155 -3.974 1.00 0.00 C ATOM 239 CE3 TRP A 385 -18.948 -5.912 -4.252 1.00 0.00 C ATOM 240 CZ2 TRP A 385 -21.435 -6.836 -5.196 1.00 0.00 C ATOM 241 CZ3 TRP A 385 -19.034 -6.593 -5.481 1.00 0.00 C ATOM 242 CH2 TRP A 385 -20.276 -7.054 -5.954 1.00 0.00 C ATOM 0 H TRP A 385 -21.265 -2.872 -1.248 1.00 0.00 H new ATOM 0 HA TRP A 385 -18.613 -2.404 -0.650 1.00 0.00 H new ATOM 0 HB2 TRP A 385 -18.393 -4.804 -1.388 1.00 0.00 H new ATOM 0 HB3 TRP A 385 -19.681 -4.513 -0.236 1.00 0.00 H new ATOM 0 HD1 TRP A 385 -22.199 -4.741 -1.111 1.00 0.00 H new ATOM 0 HE1 TRP A 385 -23.267 -5.993 -3.089 1.00 0.00 H new ATOM 0 HE3 TRP A 385 -17.986 -5.566 -3.904 1.00 0.00 H new ATOM 0 HZ2 TRP A 385 -22.393 -7.189 -5.550 1.00 0.00 H new ATOM 0 HZ3 TRP A 385 -18.141 -6.763 -6.064 1.00 0.00 H new ATOM 0 HH2 TRP A 385 -20.337 -7.574 -6.898 1.00 0.00 H new ATOM 253 N GLU A 386 -19.147 -2.691 -3.900 1.00 0.00 N ATOM 254 CA GLU A 386 -18.620 -2.445 -5.229 1.00 0.00 C ATOM 255 C GLU A 386 -18.140 -0.998 -5.350 1.00 0.00 C ATOM 256 O GLU A 386 -17.010 -0.767 -5.774 1.00 0.00 O ATOM 257 CB GLU A 386 -19.666 -2.844 -6.282 1.00 0.00 C ATOM 258 CG GLU A 386 -21.022 -2.141 -6.133 1.00 0.00 C ATOM 259 CD GLU A 386 -22.124 -2.925 -6.833 1.00 0.00 C ATOM 260 OE1 GLU A 386 -22.686 -3.821 -6.164 1.00 0.00 O ATOM 261 OE2 GLU A 386 -22.371 -2.629 -8.022 1.00 0.00 O ATOM 0 H GLU A 386 -20.111 -3.025 -3.908 1.00 0.00 H new ATOM 0 HA GLU A 386 -17.743 -3.066 -5.411 1.00 0.00 H new ATOM 0 HB2 GLU A 386 -19.266 -2.628 -7.273 1.00 0.00 H new ATOM 0 HB3 GLU A 386 -19.822 -3.921 -6.230 1.00 0.00 H new ATOM 0 HG2 GLU A 386 -21.264 -2.031 -5.076 1.00 0.00 H new ATOM 0 HG3 GLU A 386 -20.963 -1.137 -6.552 1.00 0.00 H new ATOM 268 N GLU A 387 -18.982 -0.035 -4.953 1.00 0.00 N ATOM 269 CA GLU A 387 -18.646 1.380 -4.990 1.00 0.00 C ATOM 270 C GLU A 387 -17.369 1.638 -4.184 1.00 0.00 C ATOM 271 O GLU A 387 -16.429 2.238 -4.701 1.00 0.00 O ATOM 272 CB GLU A 387 -19.782 2.231 -4.423 1.00 0.00 C ATOM 273 CG GLU A 387 -21.158 2.053 -5.062 1.00 0.00 C ATOM 274 CD GLU A 387 -22.171 2.885 -4.283 1.00 0.00 C ATOM 275 OE1 GLU A 387 -21.913 4.092 -4.093 1.00 0.00 O ATOM 276 OE2 GLU A 387 -23.202 2.318 -3.861 1.00 0.00 O ATOM 0 H GLU A 387 -19.919 -0.225 -4.596 1.00 0.00 H new ATOM 0 HA GLU A 387 -18.487 1.659 -6.032 1.00 0.00 H new ATOM 0 HB2 GLU A 387 -19.871 2.014 -3.358 1.00 0.00 H new ATOM 0 HB3 GLU A 387 -19.499 3.280 -4.512 1.00 0.00 H new ATOM 0 HG2 GLU A 387 -21.133 2.368 -6.105 1.00 0.00 H new ATOM 0 HG3 GLU A 387 -21.446 1.002 -5.053 1.00 0.00 H new ATOM 283 N ASP A 388 -17.330 1.185 -2.923 1.00 0.00 N ATOM 284 CA ASP A 388 -16.169 1.354 -2.053 1.00 0.00 C ATOM 285 C ASP A 388 -14.901 0.847 -2.746 1.00 0.00 C ATOM 286 O ASP A 388 -13.879 1.534 -2.738 1.00 0.00 O ATOM 287 CB ASP A 388 -16.379 0.632 -0.709 1.00 0.00 C ATOM 288 CG ASP A 388 -17.117 1.458 0.342 1.00 0.00 C ATOM 289 OD1 ASP A 388 -17.747 2.474 -0.018 1.00 0.00 O ATOM 290 OD2 ASP A 388 -17.011 1.089 1.532 1.00 0.00 O ATOM 0 H ASP A 388 -18.106 0.691 -2.482 1.00 0.00 H new ATOM 0 HA ASP A 388 -16.049 2.418 -1.849 1.00 0.00 H new ATOM 0 HB2 ASP A 388 -16.936 -0.288 -0.888 1.00 0.00 H new ATOM 0 HB3 ASP A 388 -15.407 0.343 -0.310 1.00 0.00 H new ATOM 295 N LYS A 389 -14.960 -0.345 -3.349 1.00 0.00 N ATOM 296 CA LYS A 389 -13.829 -0.941 -4.054 1.00 0.00 C ATOM 297 C LYS A 389 -13.414 -0.085 -5.257 1.00 0.00 C ATOM 298 O LYS A 389 -12.227 0.194 -5.433 1.00 0.00 O ATOM 299 CB LYS A 389 -14.177 -2.372 -4.481 1.00 0.00 C ATOM 300 CG LYS A 389 -14.288 -3.300 -3.263 1.00 0.00 C ATOM 301 CD LYS A 389 -15.083 -4.570 -3.586 1.00 0.00 C ATOM 302 CE LYS A 389 -14.421 -5.419 -4.678 1.00 0.00 C ATOM 303 NZ LYS A 389 -15.188 -6.652 -4.942 1.00 0.00 N ATOM 0 H LYS A 389 -15.800 -0.924 -3.360 1.00 0.00 H new ATOM 0 HA LYS A 389 -12.976 -0.980 -3.377 1.00 0.00 H new ATOM 0 HB2 LYS A 389 -15.119 -2.372 -5.030 1.00 0.00 H new ATOM 0 HB3 LYS A 389 -13.412 -2.748 -5.160 1.00 0.00 H new ATOM 0 HG2 LYS A 389 -13.289 -3.573 -2.922 1.00 0.00 H new ATOM 0 HG3 LYS A 389 -14.770 -2.768 -2.443 1.00 0.00 H new ATOM 0 HD2 LYS A 389 -15.189 -5.168 -2.681 1.00 0.00 H new ATOM 0 HD3 LYS A 389 -16.088 -4.294 -3.905 1.00 0.00 H new ATOM 0 HE2 LYS A 389 -14.340 -4.836 -5.595 1.00 0.00 H new ATOM 0 HE3 LYS A 389 -13.407 -5.678 -4.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 -14.714 -7.203 -5.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 -15.244 -7.219 -4.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 -16.148 -6.403 -5.255 1.00 0.00 H new ATOM 317 N ASN A 390 -14.384 0.333 -6.080 1.00 0.00 N ATOM 318 CA ASN A 390 -14.154 1.162 -7.259 1.00 0.00 C ATOM 319 C ASN A 390 -13.414 2.442 -6.859 1.00 0.00 C ATOM 320 O ASN A 390 -12.379 2.780 -7.431 1.00 0.00 O ATOM 321 CB ASN A 390 -15.490 1.529 -7.929 1.00 0.00 C ATOM 322 CG ASN A 390 -16.260 0.366 -8.556 1.00 0.00 C ATOM 323 OD1 ASN A 390 -17.480 0.294 -8.433 1.00 0.00 O ATOM 324 ND2 ASN A 390 -15.578 -0.539 -9.257 1.00 0.00 N ATOM 0 H ASN A 390 -15.366 0.098 -5.938 1.00 0.00 H new ATOM 0 HA ASN A 390 -13.548 0.597 -7.967 1.00 0.00 H new ATOM 0 HB2 ASN A 390 -16.129 2.005 -7.185 1.00 0.00 H new ATOM 0 HB3 ASN A 390 -15.295 2.271 -8.703 1.00 0.00 H new ATOM 0 HD21 ASN A 390 -16.069 -1.312 -9.705 1.00 0.00 H new ATOM 0 HD22 ASN A 390 -14.565 -0.458 -9.345 1.00 0.00 H new ATOM 331 N LEU A 391 -13.956 3.142 -5.860 1.00 0.00 N ATOM 332 CA LEU A 391 -13.406 4.375 -5.324 1.00 0.00 C ATOM 333 C LEU A 391 -11.991 4.137 -4.797 1.00 0.00 C ATOM 334 O LEU A 391 -11.066 4.836 -5.198 1.00 0.00 O ATOM 335 CB LEU A 391 -14.363 4.905 -4.243 1.00 0.00 C ATOM 336 CG LEU A 391 -13.774 6.010 -3.355 1.00 0.00 C ATOM 337 CD1 LEU A 391 -13.403 7.284 -4.119 1.00 0.00 C ATOM 338 CD2 LEU A 391 -14.771 6.352 -2.245 1.00 0.00 C ATOM 0 H LEU A 391 -14.815 2.852 -5.392 1.00 0.00 H new ATOM 0 HA LEU A 391 -13.320 5.132 -6.103 1.00 0.00 H new ATOM 0 HB2 LEU A 391 -15.262 5.287 -4.727 1.00 0.00 H new ATOM 0 HB3 LEU A 391 -14.671 4.073 -3.609 1.00 0.00 H new ATOM 0 HG LEU A 391 -12.845 5.617 -2.942 1.00 0.00 H new ATOM 0 HD11 LEU A 391 -12.994 8.018 -3.425 1.00 0.00 H new ATOM 0 HD12 LEU A 391 -12.658 7.049 -4.879 1.00 0.00 H new ATOM 0 HD13 LEU A 391 -14.293 7.693 -4.597 1.00 0.00 H new ATOM 0 HD21 LEU A 391 -14.356 7.137 -1.612 1.00 0.00 H new ATOM 0 HD22 LEU A 391 -15.704 6.699 -2.688 1.00 0.00 H new ATOM 0 HD23 LEU A 391 -14.964 5.464 -1.643 1.00 0.00 H new ATOM 350 N ARG A 392 -11.821 3.160 -3.898 1.00 0.00 N ATOM 351 CA ARG A 392 -10.536 2.834 -3.295 1.00 0.00 C ATOM 352 C ARG A 392 -9.461 2.587 -4.353 1.00 0.00 C ATOM 353 O ARG A 392 -8.387 3.182 -4.287 1.00 0.00 O ATOM 354 CB ARG A 392 -10.698 1.640 -2.345 1.00 0.00 C ATOM 355 CG ARG A 392 -9.397 1.330 -1.593 1.00 0.00 C ATOM 356 CD ARG A 392 -9.625 0.200 -0.585 1.00 0.00 C ATOM 357 NE ARG A 392 -8.409 -0.061 0.199 1.00 0.00 N ATOM 358 CZ ARG A 392 -8.265 -1.066 1.078 1.00 0.00 C ATOM 359 NH1 ARG A 392 -9.267 -1.930 1.292 1.00 0.00 N ATOM 360 NH2 ARG A 392 -7.112 -1.204 1.745 1.00 0.00 N ATOM 0 H ARG A 392 -12.585 2.570 -3.569 1.00 0.00 H new ATOM 0 HA ARG A 392 -10.196 3.690 -2.712 1.00 0.00 H new ATOM 0 HB2 ARG A 392 -11.491 1.851 -1.628 1.00 0.00 H new ATOM 0 HB3 ARG A 392 -11.007 0.763 -2.913 1.00 0.00 H new ATOM 0 HG2 ARG A 392 -8.619 1.044 -2.301 1.00 0.00 H new ATOM 0 HG3 ARG A 392 -9.046 2.223 -1.076 1.00 0.00 H new ATOM 0 HD2 ARG A 392 -10.443 0.465 0.084 1.00 0.00 H new ATOM 0 HD3 ARG A 392 -9.924 -0.706 -1.111 1.00 0.00 H new ATOM 0 HE ARG A 392 -7.617 0.567 0.066 1.00 0.00 H new ATOM 0 HH11 ARG A 392 -10.146 -1.827 0.786 1.00 0.00 H new ATOM 0 HH12 ARG A 392 -9.150 -2.691 1.961 1.00 0.00 H new ATOM 0 HH21 ARG A 392 -6.348 -0.547 1.584 1.00 0.00 H new ATOM 0 HH22 ARG A 392 -6.998 -1.966 2.414 1.00 0.00 H new ATOM 374 N SER A 393 -9.742 1.719 -5.331 1.00 0.00 N ATOM 375 CA SER A 393 -8.796 1.424 -6.400 1.00 0.00 C ATOM 376 C SER A 393 -8.490 2.696 -7.202 1.00 0.00 C ATOM 377 O SER A 393 -7.338 2.937 -7.574 1.00 0.00 O ATOM 378 CB SER A 393 -9.309 0.266 -7.263 1.00 0.00 C ATOM 379 OG SER A 393 -10.608 0.508 -7.759 1.00 0.00 O ATOM 0 H SER A 393 -10.623 1.209 -5.400 1.00 0.00 H new ATOM 0 HA SER A 393 -7.849 1.091 -5.975 1.00 0.00 H new ATOM 0 HB2 SER A 393 -8.627 0.107 -8.098 1.00 0.00 H new ATOM 0 HB3 SER A 393 -9.311 -0.651 -6.674 1.00 0.00 H new ATOM 0 HG SER A 393 -10.560 0.707 -8.717 1.00 0.00 H new ATOM 385 N GLY A 394 -9.514 3.524 -7.439 1.00 0.00 N ATOM 386 CA GLY A 394 -9.380 4.788 -8.136 1.00 0.00 C ATOM 387 C GLY A 394 -8.381 5.688 -7.412 1.00 0.00 C ATOM 388 O GLY A 394 -7.432 6.168 -8.031 1.00 0.00 O ATOM 0 H GLY A 394 -10.469 3.323 -7.144 1.00 0.00 H new ATOM 0 HA2 GLY A 394 -9.048 4.614 -9.159 1.00 0.00 H new ATOM 0 HA3 GLY A 394 -10.349 5.283 -8.196 1.00 0.00 H new ATOM 392 N VAL A 395 -8.579 5.906 -6.106 1.00 0.00 N ATOM 393 CA VAL A 395 -7.692 6.727 -5.290 1.00 0.00 C ATOM 394 C VAL A 395 -6.289 6.121 -5.257 1.00 0.00 C ATOM 395 O VAL A 395 -5.310 6.854 -5.352 1.00 0.00 O ATOM 396 CB VAL A 395 -8.255 6.920 -3.869 1.00 0.00 C ATOM 397 CG1 VAL A 395 -7.254 7.694 -2.999 1.00 0.00 C ATOM 398 CG2 VAL A 395 -9.566 7.714 -3.896 1.00 0.00 C ATOM 0 H VAL A 395 -9.365 5.513 -5.588 1.00 0.00 H new ATOM 0 HA VAL A 395 -7.626 7.715 -5.745 1.00 0.00 H new ATOM 0 HB VAL A 395 -8.434 5.927 -3.456 1.00 0.00 H new ATOM 0 HG11 VAL A 395 -7.665 7.823 -1.998 1.00 0.00 H new ATOM 0 HG12 VAL A 395 -6.319 7.138 -2.938 1.00 0.00 H new ATOM 0 HG13 VAL A 395 -7.066 8.672 -3.443 1.00 0.00 H new ATOM 0 HG21 VAL A 395 -9.939 7.834 -2.879 1.00 0.00 H new ATOM 0 HG22 VAL A 395 -9.388 8.695 -4.336 1.00 0.00 H new ATOM 0 HG23 VAL A 395 -10.304 7.178 -4.492 1.00 0.00 H new ATOM 408 N ARG A 396 -6.169 4.794 -5.123 1.00 0.00 N ATOM 409 CA ARG A 396 -4.868 4.140 -5.085 1.00 0.00 C ATOM 410 C ARG A 396 -4.033 4.508 -6.316 1.00 0.00 C ATOM 411 O ARG A 396 -2.849 4.807 -6.187 1.00 0.00 O ATOM 412 CB ARG A 396 -5.036 2.618 -4.956 1.00 0.00 C ATOM 413 CG ARG A 396 -3.674 1.934 -4.767 1.00 0.00 C ATOM 414 CD ARG A 396 -3.817 0.415 -4.638 1.00 0.00 C ATOM 415 NE ARG A 396 -2.496 -0.216 -4.491 1.00 0.00 N ATOM 416 CZ ARG A 396 -2.272 -1.538 -4.415 1.00 0.00 C ATOM 417 NH1 ARG A 396 -3.294 -2.403 -4.466 1.00 0.00 N ATOM 418 NH2 ARG A 396 -1.017 -1.992 -4.291 1.00 0.00 N ATOM 0 H ARG A 396 -6.962 4.157 -5.040 1.00 0.00 H new ATOM 0 HA ARG A 396 -4.329 4.495 -4.207 1.00 0.00 H new ATOM 0 HB2 ARG A 396 -5.684 2.389 -4.110 1.00 0.00 H new ATOM 0 HB3 ARG A 396 -5.525 2.225 -5.847 1.00 0.00 H new ATOM 0 HG2 ARG A 396 -3.028 2.168 -5.613 1.00 0.00 H new ATOM 0 HG3 ARG A 396 -3.188 2.331 -3.876 1.00 0.00 H new ATOM 0 HD2 ARG A 396 -4.440 0.174 -3.776 1.00 0.00 H new ATOM 0 HD3 ARG A 396 -4.322 0.015 -5.518 1.00 0.00 H new ATOM 0 HE ARG A 396 -1.685 0.400 -4.443 1.00 0.00 H new ATOM 0 HH11 ARG A 396 -4.249 -2.059 -4.563 1.00 0.00 H new ATOM 0 HH12 ARG A 396 -3.117 -3.406 -4.408 1.00 0.00 H new ATOM 0 HH21 ARG A 396 -0.238 -1.334 -4.255 1.00 0.00 H new ATOM 0 HH22 ARG A 396 -0.841 -2.995 -4.233 1.00 0.00 H new ATOM 432 N LYS A 397 -4.645 4.478 -7.506 1.00 0.00 N ATOM 433 CA LYS A 397 -3.948 4.790 -8.745 1.00 0.00 C ATOM 434 C LYS A 397 -3.816 6.289 -9.027 1.00 0.00 C ATOM 435 O LYS A 397 -2.713 6.786 -9.240 1.00 0.00 O ATOM 436 CB LYS A 397 -4.687 4.144 -9.921 1.00 0.00 C ATOM 437 CG LYS A 397 -4.546 2.619 -9.935 1.00 0.00 C ATOM 438 CD LYS A 397 -5.235 2.041 -11.178 1.00 0.00 C ATOM 439 CE LYS A 397 -6.754 1.978 -10.986 1.00 0.00 C ATOM 440 NZ LYS A 397 -7.455 1.663 -12.244 1.00 0.00 N ATOM 0 H LYS A 397 -5.629 4.238 -7.630 1.00 0.00 H new ATOM 0 HA LYS A 397 -2.939 4.394 -8.629 1.00 0.00 H new ATOM 0 HB2 LYS A 397 -5.743 4.408 -9.871 1.00 0.00 H new ATOM 0 HB3 LYS A 397 -4.301 4.550 -10.856 1.00 0.00 H new ATOM 0 HG2 LYS A 397 -3.492 2.343 -9.932 1.00 0.00 H new ATOM 0 HG3 LYS A 397 -4.989 2.196 -9.033 1.00 0.00 H new ATOM 0 HD2 LYS A 397 -5.000 2.656 -12.047 1.00 0.00 H new ATOM 0 HD3 LYS A 397 -4.849 1.042 -11.380 1.00 0.00 H new ATOM 0 HE2 LYS A 397 -6.994 1.223 -10.238 1.00 0.00 H new ATOM 0 HE3 LYS A 397 -7.111 2.933 -10.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 397 -8.349 1.176 -12.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 397 -7.655 2.544 -12.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 397 -6.856 1.047 -12.830 1.00 0.00 H new ATOM 454 N TYR A 398 -4.950 6.992 -9.097 1.00 0.00 N ATOM 455 CA TYR A 398 -5.026 8.398 -9.483 1.00 0.00 C ATOM 456 C TYR A 398 -4.825 9.396 -8.339 1.00 0.00 C ATOM 457 O TYR A 398 -4.667 10.586 -8.604 1.00 0.00 O ATOM 458 CB TYR A 398 -6.358 8.636 -10.217 1.00 0.00 C ATOM 459 CG TYR A 398 -6.816 7.482 -11.104 1.00 0.00 C ATOM 460 CD1 TYR A 398 -5.914 6.819 -11.961 1.00 0.00 C ATOM 461 CD2 TYR A 398 -8.156 7.060 -11.058 1.00 0.00 C ATOM 462 CE1 TYR A 398 -6.349 5.740 -12.750 1.00 0.00 C ATOM 463 CE2 TYR A 398 -8.592 5.983 -11.847 1.00 0.00 C ATOM 464 CZ TYR A 398 -7.689 5.320 -12.692 1.00 0.00 C ATOM 465 OH TYR A 398 -8.112 4.265 -13.451 1.00 0.00 O ATOM 0 H TYR A 398 -5.861 6.587 -8.881 1.00 0.00 H new ATOM 0 HA TYR A 398 -4.182 8.592 -10.145 1.00 0.00 H new ATOM 0 HB2 TYR A 398 -7.133 8.837 -9.477 1.00 0.00 H new ATOM 0 HB3 TYR A 398 -6.263 9.532 -10.831 1.00 0.00 H new ATOM 0 HD1 TYR A 398 -4.885 7.141 -12.012 1.00 0.00 H new ATOM 0 HD2 TYR A 398 -8.856 7.568 -10.411 1.00 0.00 H new ATOM 0 HE1 TYR A 398 -5.653 5.233 -13.402 1.00 0.00 H new ATOM 0 HE2 TYR A 398 -9.623 5.665 -11.803 1.00 0.00 H new ATOM 0 HH TYR A 398 -9.066 4.107 -13.289 1.00 0.00 H new ATOM 475 N GLY A 399 -4.830 8.936 -7.085 1.00 0.00 N ATOM 476 CA GLY A 399 -4.654 9.793 -5.921 1.00 0.00 C ATOM 477 C GLY A 399 -5.941 10.541 -5.575 1.00 0.00 C ATOM 478 O GLY A 399 -6.904 10.542 -6.344 1.00 0.00 O ATOM 0 H GLY A 399 -4.958 7.951 -6.853 1.00 0.00 H new ATOM 0 HA2 GLY A 399 -4.342 9.190 -5.068 1.00 0.00 H new ATOM 0 HA3 GLY A 399 -3.856 10.510 -6.113 1.00 0.00 H new ATOM 482 N GLU A 400 -5.950 11.194 -4.408 1.00 0.00 N ATOM 483 CA GLU A 400 -7.086 11.982 -3.954 1.00 0.00 C ATOM 484 C GLU A 400 -7.187 13.245 -4.814 1.00 0.00 C ATOM 485 O GLU A 400 -6.297 13.533 -5.617 1.00 0.00 O ATOM 486 CB GLU A 400 -6.930 12.327 -2.465 1.00 0.00 C ATOM 487 CG GLU A 400 -6.925 11.057 -1.605 1.00 0.00 C ATOM 488 CD GLU A 400 -6.855 11.348 -0.109 1.00 0.00 C ATOM 489 OE1 GLU A 400 -7.264 12.454 0.302 1.00 0.00 O ATOM 490 OE2 GLU A 400 -6.448 10.420 0.626 1.00 0.00 O ATOM 0 H GLU A 400 -5.166 11.187 -3.756 1.00 0.00 H new ATOM 0 HA GLU A 400 -8.007 11.409 -4.062 1.00 0.00 H new ATOM 0 HB2 GLU A 400 -6.003 12.879 -2.311 1.00 0.00 H new ATOM 0 HB3 GLU A 400 -7.745 12.980 -2.152 1.00 0.00 H new ATOM 0 HG2 GLU A 400 -7.825 10.480 -1.815 1.00 0.00 H new ATOM 0 HG3 GLU A 400 -6.075 10.437 -1.889 1.00 0.00 H new ATOM 497 N GLY A 401 -8.279 14.002 -4.673 1.00 0.00 N ATOM 498 CA GLY A 401 -8.494 15.222 -5.442 1.00 0.00 C ATOM 499 C GLY A 401 -8.982 14.930 -6.863 1.00 0.00 C ATOM 500 O GLY A 401 -9.863 15.624 -7.365 1.00 0.00 O ATOM 0 H GLY A 401 -9.034 13.784 -4.023 1.00 0.00 H new ATOM 0 HA2 GLY A 401 -9.225 15.848 -4.930 1.00 0.00 H new ATOM 0 HA3 GLY A 401 -7.564 15.789 -5.488 1.00 0.00 H new ATOM 504 N ASN A 402 -8.415 13.904 -7.510 1.00 0.00 N ATOM 505 CA ASN A 402 -8.719 13.460 -8.865 1.00 0.00 C ATOM 506 C ASN A 402 -10.051 12.697 -8.924 1.00 0.00 C ATOM 507 O ASN A 402 -10.150 11.632 -9.535 1.00 0.00 O ATOM 508 CB ASN A 402 -7.547 12.598 -9.366 1.00 0.00 C ATOM 509 CG ASN A 402 -6.255 13.398 -9.529 1.00 0.00 C ATOM 510 OD1 ASN A 402 -5.909 13.781 -10.644 1.00 0.00 O ATOM 511 ND2 ASN A 402 -5.530 13.658 -8.440 1.00 0.00 N ATOM 0 H ASN A 402 -7.692 13.333 -7.072 1.00 0.00 H new ATOM 0 HA ASN A 402 -8.838 14.326 -9.516 1.00 0.00 H new ATOM 0 HB2 ASN A 402 -7.377 11.780 -8.666 1.00 0.00 H new ATOM 0 HB3 ASN A 402 -7.815 12.149 -10.322 1.00 0.00 H new ATOM 0 HD21 ASN A 402 -4.662 14.188 -8.520 1.00 0.00 H new ATOM 0 HD22 ASN A 402 -5.843 13.327 -7.528 1.00 0.00 H new ATOM 518 N TRP A 403 -11.091 13.251 -8.292 1.00 0.00 N ATOM 519 CA TRP A 403 -12.425 12.676 -8.237 1.00 0.00 C ATOM 520 C TRP A 403 -13.010 12.552 -9.642 1.00 0.00 C ATOM 521 O TRP A 403 -13.666 11.562 -9.950 1.00 0.00 O ATOM 522 CB TRP A 403 -13.308 13.517 -7.310 1.00 0.00 C ATOM 523 CG TRP A 403 -12.667 13.889 -6.007 1.00 0.00 C ATOM 524 CD1 TRP A 403 -12.426 15.151 -5.583 1.00 0.00 C ATOM 525 CD2 TRP A 403 -12.167 13.015 -4.951 1.00 0.00 C ATOM 526 NE1 TRP A 403 -11.811 15.123 -4.349 1.00 0.00 N ATOM 527 CE2 TRP A 403 -11.628 13.828 -3.912 1.00 0.00 C ATOM 528 CE3 TRP A 403 -12.110 11.617 -4.764 1.00 0.00 C ATOM 529 CZ2 TRP A 403 -11.058 13.286 -2.751 1.00 0.00 C ATOM 530 CZ3 TRP A 403 -11.541 11.061 -3.604 1.00 0.00 C ATOM 531 CH2 TRP A 403 -11.015 11.892 -2.602 1.00 0.00 C ATOM 0 H TRP A 403 -11.018 14.137 -7.792 1.00 0.00 H new ATOM 0 HA TRP A 403 -12.376 11.668 -7.825 1.00 0.00 H new ATOM 0 HB2 TRP A 403 -13.595 14.430 -7.832 1.00 0.00 H new ATOM 0 HB3 TRP A 403 -14.225 12.965 -7.104 1.00 0.00 H new ATOM 0 HD1 TRP A 403 -12.678 16.048 -6.130 1.00 0.00 H new ATOM 0 HE1 TRP A 403 -11.528 15.953 -3.827 1.00 0.00 H new ATOM 0 HE3 TRP A 403 -12.510 10.963 -5.525 1.00 0.00 H new ATOM 0 HZ2 TRP A 403 -10.658 13.932 -1.983 1.00 0.00 H new ATOM 0 HZ3 TRP A 403 -11.509 9.988 -3.483 1.00 0.00 H new ATOM 0 HH2 TRP A 403 -10.577 11.457 -1.716 1.00 0.00 H new ATOM 542 N SER A 404 -12.756 13.548 -10.500 1.00 0.00 N ATOM 543 CA SER A 404 -13.217 13.556 -11.879 1.00 0.00 C ATOM 544 C SER A 404 -12.697 12.316 -12.610 1.00 0.00 C ATOM 545 O SER A 404 -13.471 11.600 -13.241 1.00 0.00 O ATOM 546 CB SER A 404 -12.751 14.845 -12.562 1.00 0.00 C ATOM 547 OG SER A 404 -13.119 15.960 -11.776 1.00 0.00 O ATOM 0 H SER A 404 -12.218 14.376 -10.246 1.00 0.00 H new ATOM 0 HA SER A 404 -14.306 13.527 -11.907 1.00 0.00 H new ATOM 0 HB2 SER A 404 -11.670 14.825 -12.699 1.00 0.00 H new ATOM 0 HB3 SER A 404 -13.196 14.924 -13.554 1.00 0.00 H new ATOM 0 HG SER A 404 -12.818 16.783 -12.215 1.00 0.00 H new ATOM 553 N LYS A 405 -11.387 12.053 -12.512 1.00 0.00 N ATOM 554 CA LYS A 405 -10.780 10.888 -13.140 1.00 0.00 C ATOM 555 C LYS A 405 -11.438 9.620 -12.606 1.00 0.00 C ATOM 556 O LYS A 405 -11.853 8.777 -13.396 1.00 0.00 O ATOM 557 CB LYS A 405 -9.263 10.861 -12.911 1.00 0.00 C ATOM 558 CG LYS A 405 -8.546 11.900 -13.781 1.00 0.00 C ATOM 559 CD LYS A 405 -7.022 11.873 -13.591 1.00 0.00 C ATOM 560 CE LYS A 405 -6.347 10.524 -13.888 1.00 0.00 C ATOM 561 NZ LYS A 405 -6.658 10.006 -15.233 1.00 0.00 N ATOM 0 H LYS A 405 -10.730 12.640 -11.999 1.00 0.00 H new ATOM 0 HA LYS A 405 -10.942 10.945 -14.216 1.00 0.00 H new ATOM 0 HB2 LYS A 405 -9.049 11.055 -11.860 1.00 0.00 H new ATOM 0 HB3 LYS A 405 -8.877 9.867 -13.137 1.00 0.00 H new ATOM 0 HG2 LYS A 405 -8.782 11.717 -14.829 1.00 0.00 H new ATOM 0 HG3 LYS A 405 -8.922 12.894 -13.539 1.00 0.00 H new ATOM 0 HD2 LYS A 405 -6.579 12.632 -14.235 1.00 0.00 H new ATOM 0 HD3 LYS A 405 -6.795 12.155 -12.563 1.00 0.00 H new ATOM 0 HE2 LYS A 405 -5.267 10.635 -13.789 1.00 0.00 H new ATOM 0 HE3 LYS A 405 -6.663 9.794 -13.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 405 -5.933 9.317 -15.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 405 -7.589 9.543 -15.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 405 -6.672 10.793 -15.913 1.00 0.00 H new ATOM 575 N ILE A 406 -11.544 9.486 -11.278 1.00 0.00 N ATOM 576 CA ILE A 406 -12.167 8.319 -10.663 1.00 0.00 C ATOM 577 C ILE A 406 -13.566 8.100 -11.254 1.00 0.00 C ATOM 578 O ILE A 406 -13.868 6.998 -11.696 1.00 0.00 O ATOM 579 CB ILE A 406 -12.169 8.446 -9.126 1.00 0.00 C ATOM 580 CG1 ILE A 406 -10.719 8.426 -8.607 1.00 0.00 C ATOM 581 CG2 ILE A 406 -12.965 7.291 -8.499 1.00 0.00 C ATOM 582 CD1 ILE A 406 -10.585 8.801 -7.132 1.00 0.00 C ATOM 0 H ILE A 406 -11.203 10.178 -10.611 1.00 0.00 H new ATOM 0 HA ILE A 406 -11.582 7.428 -10.892 1.00 0.00 H new ATOM 0 HB ILE A 406 -12.641 9.388 -8.846 1.00 0.00 H new ATOM 0 HG12 ILE A 406 -10.303 7.430 -8.758 1.00 0.00 H new ATOM 0 HG13 ILE A 406 -10.120 9.115 -9.203 1.00 0.00 H new ATOM 0 HG21 ILE A 406 -12.959 7.392 -7.414 1.00 0.00 H new ATOM 0 HG22 ILE A 406 -13.993 7.319 -8.860 1.00 0.00 H new ATOM 0 HG23 ILE A 406 -12.509 6.341 -8.778 1.00 0.00 H new ATOM 0 HD11 ILE A 406 -9.535 8.764 -6.841 1.00 0.00 H new ATOM 0 HD12 ILE A 406 -10.969 9.809 -6.976 1.00 0.00 H new ATOM 0 HD13 ILE A 406 -11.155 8.098 -6.525 1.00 0.00 H new ATOM 594 N LEU A 407 -14.403 9.142 -11.275 1.00 0.00 N ATOM 595 CA LEU A 407 -15.762 9.107 -11.809 1.00 0.00 C ATOM 596 C LEU A 407 -15.776 8.653 -13.274 1.00 0.00 C ATOM 597 O LEU A 407 -16.640 7.877 -13.675 1.00 0.00 O ATOM 598 CB LEU A 407 -16.388 10.507 -11.638 1.00 0.00 C ATOM 599 CG LEU A 407 -17.917 10.644 -11.775 1.00 0.00 C ATOM 600 CD1 LEU A 407 -18.431 10.497 -13.212 1.00 0.00 C ATOM 601 CD2 LEU A 407 -18.695 9.716 -10.835 1.00 0.00 C ATOM 0 H LEU A 407 -14.143 10.058 -10.910 1.00 0.00 H new ATOM 0 HA LEU A 407 -16.355 8.377 -11.259 1.00 0.00 H new ATOM 0 HB2 LEU A 407 -16.108 10.879 -10.652 1.00 0.00 H new ATOM 0 HB3 LEU A 407 -15.928 11.169 -12.371 1.00 0.00 H new ATOM 0 HG LEU A 407 -18.111 11.672 -11.469 1.00 0.00 H new ATOM 0 HD11 LEU A 407 -19.515 10.606 -13.223 1.00 0.00 H new ATOM 0 HD12 LEU A 407 -17.982 11.267 -13.840 1.00 0.00 H new ATOM 0 HD13 LEU A 407 -18.161 9.513 -13.596 1.00 0.00 H new ATOM 0 HD21 LEU A 407 -19.765 9.863 -10.982 1.00 0.00 H new ATOM 0 HD22 LEU A 407 -18.438 8.679 -11.052 1.00 0.00 H new ATOM 0 HD23 LEU A 407 -18.436 9.945 -9.801 1.00 0.00 H new ATOM 613 N LEU A 408 -14.831 9.138 -14.087 1.00 0.00 N ATOM 614 CA LEU A 408 -14.767 8.794 -15.502 1.00 0.00 C ATOM 615 C LEU A 408 -14.335 7.343 -15.720 1.00 0.00 C ATOM 616 O LEU A 408 -15.022 6.593 -16.412 1.00 0.00 O ATOM 617 CB LEU A 408 -13.830 9.765 -16.236 1.00 0.00 C ATOM 618 CG LEU A 408 -14.398 11.192 -16.335 1.00 0.00 C ATOM 619 CD1 LEU A 408 -13.269 12.170 -16.676 1.00 0.00 C ATOM 620 CD2 LEU A 408 -15.491 11.294 -17.407 1.00 0.00 C ATOM 0 H LEU A 408 -14.096 9.775 -13.780 1.00 0.00 H new ATOM 0 HA LEU A 408 -15.771 8.889 -15.916 1.00 0.00 H new ATOM 0 HB2 LEU A 408 -12.871 9.797 -15.718 1.00 0.00 H new ATOM 0 HB3 LEU A 408 -13.638 9.386 -17.240 1.00 0.00 H new ATOM 0 HG LEU A 408 -14.841 11.442 -15.371 1.00 0.00 H new ATOM 0 HD11 LEU A 408 -13.672 13.180 -16.746 1.00 0.00 H new ATOM 0 HD12 LEU A 408 -12.509 12.135 -15.895 1.00 0.00 H new ATOM 0 HD13 LEU A 408 -12.822 11.891 -17.630 1.00 0.00 H new ATOM 0 HD21 LEU A 408 -15.867 12.316 -17.447 1.00 0.00 H new ATOM 0 HD22 LEU A 408 -15.075 11.022 -18.377 1.00 0.00 H new ATOM 0 HD23 LEU A 408 -16.308 10.616 -17.159 1.00 0.00 H new ATOM 632 N HIS A 409 -13.194 6.947 -15.150 1.00 0.00 N ATOM 633 CA HIS A 409 -12.655 5.603 -15.300 1.00 0.00 C ATOM 634 C HIS A 409 -13.573 4.561 -14.660 1.00 0.00 C ATOM 635 O HIS A 409 -13.972 3.602 -15.318 1.00 0.00 O ATOM 636 CB HIS A 409 -11.243 5.538 -14.702 1.00 0.00 C ATOM 637 CG HIS A 409 -10.279 6.526 -15.312 1.00 0.00 C ATOM 638 ND1 HIS A 409 -9.987 6.558 -16.666 1.00 0.00 N ATOM 639 CD2 HIS A 409 -9.530 7.535 -14.761 1.00 0.00 C ATOM 640 CE1 HIS A 409 -9.104 7.553 -16.861 1.00 0.00 C ATOM 641 NE2 HIS A 409 -8.781 8.192 -15.733 1.00 0.00 N ATOM 0 H HIS A 409 -12.619 7.557 -14.569 1.00 0.00 H new ATOM 0 HA HIS A 409 -12.596 5.370 -16.363 1.00 0.00 H new ATOM 0 HB2 HIS A 409 -11.304 5.719 -13.629 1.00 0.00 H new ATOM 0 HB3 HIS A 409 -10.848 4.530 -14.834 1.00 0.00 H new ATOM 0 HD1 HIS A 409 -10.371 5.941 -17.382 1.00 0.00 H new ATOM 0 HD2 HIS A 409 -9.523 7.786 -13.711 1.00 0.00 H new ATOM 0 HE1 HIS A 409 -8.698 7.809 -17.829 1.00 0.00 H new ATOM 649 N TYR A 410 -13.900 4.751 -13.379 1.00 0.00 N ATOM 650 CA TYR A 410 -14.757 3.859 -12.618 1.00 0.00 C ATOM 651 C TYR A 410 -16.187 4.374 -12.654 1.00 0.00 C ATOM 652 O TYR A 410 -16.459 5.486 -12.216 1.00 0.00 O ATOM 653 CB TYR A 410 -14.277 3.751 -11.170 1.00 0.00 C ATOM 654 CG TYR A 410 -13.014 2.938 -11.019 1.00 0.00 C ATOM 655 CD1 TYR A 410 -13.102 1.544 -10.861 1.00 0.00 C ATOM 656 CD2 TYR A 410 -11.756 3.566 -11.045 1.00 0.00 C ATOM 657 CE1 TYR A 410 -11.936 0.776 -10.727 1.00 0.00 C ATOM 658 CE2 TYR A 410 -10.589 2.797 -10.914 1.00 0.00 C ATOM 659 CZ TYR A 410 -10.681 1.403 -10.754 1.00 0.00 C ATOM 660 OH TYR A 410 -9.545 0.659 -10.633 1.00 0.00 O ATOM 0 H TYR A 410 -13.566 5.548 -12.837 1.00 0.00 H new ATOM 0 HA TYR A 410 -14.716 2.867 -13.067 1.00 0.00 H new ATOM 0 HB2 TYR A 410 -14.105 4.753 -10.776 1.00 0.00 H new ATOM 0 HB3 TYR A 410 -15.065 3.301 -10.566 1.00 0.00 H new ATOM 0 HD1 TYR A 410 -14.069 1.064 -10.843 1.00 0.00 H new ATOM 0 HD2 TYR A 410 -11.688 4.637 -11.165 1.00 0.00 H new ATOM 0 HE1 TYR A 410 -12.004 -0.295 -10.603 1.00 0.00 H new ATOM 0 HE2 TYR A 410 -9.621 3.276 -10.936 1.00 0.00 H new ATOM 0 HH TYR A 410 -9.699 -0.235 -11.003 1.00 0.00 H new ATOM 670 N LYS A 411 -17.096 3.549 -13.173 1.00 0.00 N ATOM 671 CA LYS A 411 -18.507 3.872 -13.271 1.00 0.00 C ATOM 672 C LYS A 411 -19.145 3.578 -11.911 1.00 0.00 C ATOM 673 O LYS A 411 -18.741 2.635 -11.234 1.00 0.00 O ATOM 674 CB LYS A 411 -19.132 3.041 -14.400 1.00 0.00 C ATOM 675 CG LYS A 411 -18.821 3.585 -15.808 1.00 0.00 C ATOM 676 CD LYS A 411 -17.324 3.810 -16.086 1.00 0.00 C ATOM 677 CE LYS A 411 -17.030 4.179 -17.545 1.00 0.00 C ATOM 678 NZ LYS A 411 -17.223 3.044 -18.464 1.00 0.00 N ATOM 0 H LYS A 411 -16.863 2.626 -13.540 1.00 0.00 H new ATOM 0 HA LYS A 411 -18.670 4.922 -13.513 1.00 0.00 H new ATOM 0 HB2 LYS A 411 -18.771 2.015 -14.328 1.00 0.00 H new ATOM 0 HB3 LYS A 411 -20.213 3.009 -14.262 1.00 0.00 H new ATOM 0 HG2 LYS A 411 -19.215 2.889 -16.548 1.00 0.00 H new ATOM 0 HG3 LYS A 411 -19.349 4.529 -15.945 1.00 0.00 H new ATOM 0 HD2 LYS A 411 -16.955 4.603 -15.436 1.00 0.00 H new ATOM 0 HD3 LYS A 411 -16.773 2.905 -15.829 1.00 0.00 H new ATOM 0 HE2 LYS A 411 -17.679 5.001 -17.846 1.00 0.00 H new ATOM 0 HE3 LYS A 411 -16.004 4.537 -17.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 411 -16.931 3.320 -19.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 411 -16.648 2.238 -18.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 411 -18.227 2.771 -18.473 1.00 0.00 H new ATOM 692 N PHE A 412 -20.130 4.393 -11.515 1.00 0.00 N ATOM 693 CA PHE A 412 -20.835 4.266 -10.247 1.00 0.00 C ATOM 694 C PHE A 412 -22.344 4.355 -10.464 1.00 0.00 C ATOM 695 O PHE A 412 -22.815 4.852 -11.488 1.00 0.00 O ATOM 696 CB PHE A 412 -20.401 5.382 -9.290 1.00 0.00 C ATOM 697 CG PHE A 412 -18.998 5.278 -8.723 1.00 0.00 C ATOM 698 CD1 PHE A 412 -17.899 5.759 -9.455 1.00 0.00 C ATOM 699 CD2 PHE A 412 -18.791 4.705 -7.454 1.00 0.00 C ATOM 700 CE1 PHE A 412 -16.599 5.669 -8.925 1.00 0.00 C ATOM 701 CE2 PHE A 412 -17.493 4.620 -6.924 1.00 0.00 C ATOM 702 CZ PHE A 412 -16.394 5.100 -7.654 1.00 0.00 C ATOM 0 H PHE A 412 -20.461 5.173 -12.083 1.00 0.00 H new ATOM 0 HA PHE A 412 -20.590 3.296 -9.815 1.00 0.00 H new ATOM 0 HB2 PHE A 412 -20.488 6.334 -9.814 1.00 0.00 H new ATOM 0 HB3 PHE A 412 -21.104 5.411 -8.458 1.00 0.00 H new ATOM 0 HD1 PHE A 412 -18.053 6.200 -10.429 1.00 0.00 H new ATOM 0 HD2 PHE A 412 -19.631 4.330 -6.888 1.00 0.00 H new ATOM 0 HE1 PHE A 412 -15.758 6.037 -9.494 1.00 0.00 H new ATOM 0 HE2 PHE A 412 -17.339 4.183 -5.949 1.00 0.00 H new ATOM 0 HZ PHE A 412 -15.398 5.033 -7.243 1.00 0.00 H new ATOM 712 N ASN A 413 -23.095 3.882 -9.467 1.00 0.00 N ATOM 713 CA ASN A 413 -24.551 3.876 -9.415 1.00 0.00 C ATOM 714 C ASN A 413 -25.076 5.272 -9.064 1.00 0.00 C ATOM 715 O ASN A 413 -25.688 5.467 -8.017 1.00 0.00 O ATOM 716 CB ASN A 413 -25.024 2.809 -8.409 1.00 0.00 C ATOM 717 CG ASN A 413 -24.436 2.972 -7.004 1.00 0.00 C ATOM 718 OD1 ASN A 413 -23.569 3.812 -6.775 1.00 0.00 O ATOM 719 ND2 ASN A 413 -24.886 2.150 -6.058 1.00 0.00 N ATOM 0 H ASN A 413 -22.677 3.472 -8.632 1.00 0.00 H new ATOM 0 HA ASN A 413 -24.956 3.618 -10.394 1.00 0.00 H new ATOM 0 HB2 ASN A 413 -26.111 2.844 -8.343 1.00 0.00 H new ATOM 0 HB3 ASN A 413 -24.759 1.823 -8.790 1.00 0.00 H new ATOM 0 HD21 ASN A 413 -24.510 2.207 -5.112 1.00 0.00 H new ATOM 0 HD22 ASN A 413 -25.607 1.463 -6.280 1.00 0.00 H new ATOM 726 N ASN A 414 -24.832 6.240 -9.956 1.00 0.00 N ATOM 727 CA ASN A 414 -25.243 7.634 -9.822 1.00 0.00 C ATOM 728 C ASN A 414 -24.513 8.302 -8.657 1.00 0.00 C ATOM 729 O ASN A 414 -25.031 8.367 -7.542 1.00 0.00 O ATOM 730 CB ASN A 414 -26.770 7.778 -9.713 1.00 0.00 C ATOM 731 CG ASN A 414 -27.491 7.153 -10.904 1.00 0.00 C ATOM 732 OD1 ASN A 414 -28.036 6.058 -10.801 1.00 0.00 O ATOM 733 ND2 ASN A 414 -27.497 7.843 -12.045 1.00 0.00 N ATOM 0 H ASN A 414 -24.323 6.062 -10.822 1.00 0.00 H new ATOM 0 HA ASN A 414 -24.955 8.156 -10.734 1.00 0.00 H new ATOM 0 HB2 ASN A 414 -27.114 7.306 -8.793 1.00 0.00 H new ATOM 0 HB3 ASN A 414 -27.030 8.834 -9.645 1.00 0.00 H new ATOM 0 HD21 ASN A 414 -27.965 7.463 -12.868 1.00 0.00 H new ATOM 0 HD22 ASN A 414 -27.034 8.750 -12.095 1.00 0.00 H new ATOM 740 N ARG A 415 -23.302 8.802 -8.931 1.00 0.00 N ATOM 741 CA ARG A 415 -22.444 9.494 -7.976 1.00 0.00 C ATOM 742 C ARG A 415 -21.859 10.743 -8.644 1.00 0.00 C ATOM 743 O ARG A 415 -22.125 11.010 -9.814 1.00 0.00 O ATOM 744 CB ARG A 415 -21.351 8.550 -7.450 1.00 0.00 C ATOM 745 CG ARG A 415 -21.904 7.311 -6.728 1.00 0.00 C ATOM 746 CD ARG A 415 -22.619 7.638 -5.413 1.00 0.00 C ATOM 747 NE ARG A 415 -23.102 6.406 -4.774 1.00 0.00 N ATOM 748 CZ ARG A 415 -24.371 5.968 -4.717 1.00 0.00 C ATOM 749 NH1 ARG A 415 -25.359 6.609 -5.356 1.00 0.00 N ATOM 750 NH2 ARG A 415 -24.642 4.862 -4.014 1.00 0.00 N ATOM 0 H ARG A 415 -22.883 8.731 -9.858 1.00 0.00 H new ATOM 0 HA ARG A 415 -23.027 9.810 -7.111 1.00 0.00 H new ATOM 0 HB2 ARG A 415 -20.729 8.227 -8.285 1.00 0.00 H new ATOM 0 HB3 ARG A 415 -20.705 9.101 -6.766 1.00 0.00 H new ATOM 0 HG2 ARG A 415 -22.598 6.794 -7.391 1.00 0.00 H new ATOM 0 HG3 ARG A 415 -21.084 6.622 -6.525 1.00 0.00 H new ATOM 0 HD2 ARG A 415 -21.938 8.161 -4.741 1.00 0.00 H new ATOM 0 HD3 ARG A 415 -23.457 8.309 -5.604 1.00 0.00 H new ATOM 0 HE ARG A 415 -22.398 5.820 -4.325 1.00 0.00 H new ATOM 0 HH11 ARG A 415 -25.155 7.448 -5.900 1.00 0.00 H new ATOM 0 HH12 ARG A 415 -26.315 6.258 -5.299 1.00 0.00 H new ATOM 0 HH21 ARG A 415 -23.891 4.367 -3.533 1.00 0.00 H new ATOM 0 HH22 ARG A 415 -25.599 4.514 -3.959 1.00 0.00 H new ATOM 764 N THR A 416 -21.077 11.513 -7.882 1.00 0.00 N ATOM 765 CA THR A 416 -20.449 12.758 -8.302 1.00 0.00 C ATOM 766 C THR A 416 -19.101 12.916 -7.600 1.00 0.00 C ATOM 767 O THR A 416 -18.766 12.138 -6.707 1.00 0.00 O ATOM 768 CB THR A 416 -21.345 13.936 -7.876 1.00 0.00 C ATOM 769 OG1 THR A 416 -21.499 13.914 -6.468 1.00 0.00 O ATOM 770 CG2 THR A 416 -22.722 13.917 -8.546 1.00 0.00 C ATOM 0 H THR A 416 -20.858 11.271 -6.916 1.00 0.00 H new ATOM 0 HA THR A 416 -20.311 12.744 -9.383 1.00 0.00 H new ATOM 0 HB THR A 416 -20.852 14.853 -8.200 1.00 0.00 H new ATOM 0 HG1 THR A 416 -22.067 14.662 -6.189 1.00 0.00 H new ATOM 0 HG21 THR A 416 -23.305 14.772 -8.204 1.00 0.00 H new ATOM 0 HG22 THR A 416 -22.601 13.969 -9.628 1.00 0.00 H new ATOM 0 HG23 THR A 416 -23.242 12.996 -8.283 1.00 0.00 H new ATOM 778 N SER A 417 -18.349 13.957 -7.975 1.00 0.00 N ATOM 779 CA SER A 417 -17.077 14.293 -7.356 1.00 0.00 C ATOM 780 C SER A 417 -17.288 14.550 -5.860 1.00 0.00 C ATOM 781 O SER A 417 -16.444 14.190 -5.043 1.00 0.00 O ATOM 782 CB SER A 417 -16.483 15.515 -8.062 1.00 0.00 C ATOM 783 OG SER A 417 -17.449 16.542 -8.170 1.00 0.00 O ATOM 0 H SER A 417 -18.616 14.593 -8.726 1.00 0.00 H new ATOM 0 HA SER A 417 -16.374 13.466 -7.457 1.00 0.00 H new ATOM 0 HB2 SER A 417 -15.618 15.878 -7.507 1.00 0.00 H new ATOM 0 HB3 SER A 417 -16.130 15.233 -9.054 1.00 0.00 H new ATOM 0 HG SER A 417 -17.054 17.317 -8.622 1.00 0.00 H new ATOM 789 N VAL A 418 -18.428 15.163 -5.515 1.00 0.00 N ATOM 790 CA VAL A 418 -18.809 15.464 -4.146 1.00 0.00 C ATOM 791 C VAL A 418 -18.981 14.152 -3.379 1.00 0.00 C ATOM 792 O VAL A 418 -18.383 13.988 -2.319 1.00 0.00 O ATOM 793 CB VAL A 418 -20.090 16.320 -4.122 1.00 0.00 C ATOM 794 CG1 VAL A 418 -20.508 16.640 -2.681 1.00 0.00 C ATOM 795 CG2 VAL A 418 -19.881 17.639 -4.880 1.00 0.00 C ATOM 0 H VAL A 418 -19.119 15.466 -6.201 1.00 0.00 H new ATOM 0 HA VAL A 418 -18.028 16.048 -3.659 1.00 0.00 H new ATOM 0 HB VAL A 418 -20.875 15.741 -4.608 1.00 0.00 H new ATOM 0 HG11 VAL A 418 -21.415 17.245 -2.691 1.00 0.00 H new ATOM 0 HG12 VAL A 418 -20.697 15.711 -2.142 1.00 0.00 H new ATOM 0 HG13 VAL A 418 -19.709 17.191 -2.184 1.00 0.00 H new ATOM 0 HG21 VAL A 418 -20.799 18.226 -4.849 1.00 0.00 H new ATOM 0 HG22 VAL A 418 -19.074 18.203 -4.413 1.00 0.00 H new ATOM 0 HG23 VAL A 418 -19.622 17.426 -5.917 1.00 0.00 H new ATOM 805 N MET A 419 -19.782 13.219 -3.913 1.00 0.00 N ATOM 806 CA MET A 419 -20.002 11.927 -3.268 1.00 0.00 C ATOM 807 C MET A 419 -18.681 11.172 -3.088 1.00 0.00 C ATOM 808 O MET A 419 -18.437 10.624 -2.017 1.00 0.00 O ATOM 809 CB MET A 419 -20.993 11.079 -4.070 1.00 0.00 C ATOM 810 CG MET A 419 -22.430 11.604 -4.008 1.00 0.00 C ATOM 811 SD MET A 419 -23.262 11.289 -2.429 1.00 0.00 S ATOM 812 CE MET A 419 -24.916 11.894 -2.834 1.00 0.00 C ATOM 0 H MET A 419 -20.287 13.340 -4.791 1.00 0.00 H new ATOM 0 HA MET A 419 -20.427 12.115 -2.282 1.00 0.00 H new ATOM 0 HB2 MET A 419 -20.671 11.044 -5.111 1.00 0.00 H new ATOM 0 HB3 MET A 419 -20.971 10.056 -3.695 1.00 0.00 H new ATOM 0 HG2 MET A 419 -22.422 12.678 -4.195 1.00 0.00 H new ATOM 0 HG3 MET A 419 -23.009 11.145 -4.810 1.00 0.00 H new ATOM 0 HE1 MET A 419 -25.568 11.777 -1.969 1.00 0.00 H new ATOM 0 HE2 MET A 419 -24.861 12.948 -3.107 1.00 0.00 H new ATOM 0 HE3 MET A 419 -25.317 11.323 -3.671 1.00 0.00 H new ATOM 822 N LEU A 420 -17.829 11.143 -4.121 1.00 0.00 N ATOM 823 CA LEU A 420 -16.535 10.471 -4.067 1.00 0.00 C ATOM 824 C LEU A 420 -15.680 11.062 -2.943 1.00 0.00 C ATOM 825 O LEU A 420 -15.163 10.330 -2.098 1.00 0.00 O ATOM 826 CB LEU A 420 -15.811 10.612 -5.417 1.00 0.00 C ATOM 827 CG LEU A 420 -16.459 9.809 -6.555 1.00 0.00 C ATOM 828 CD1 LEU A 420 -15.943 10.304 -7.906 1.00 0.00 C ATOM 829 CD2 LEU A 420 -16.113 8.324 -6.466 1.00 0.00 C ATOM 0 H LEU A 420 -18.023 11.588 -5.018 1.00 0.00 H new ATOM 0 HA LEU A 420 -16.696 9.412 -3.863 1.00 0.00 H new ATOM 0 HB2 LEU A 420 -15.786 11.665 -5.697 1.00 0.00 H new ATOM 0 HB3 LEU A 420 -14.777 10.288 -5.300 1.00 0.00 H new ATOM 0 HG LEU A 420 -17.536 9.946 -6.462 1.00 0.00 H new ATOM 0 HD11 LEU A 420 -16.408 9.728 -8.706 1.00 0.00 H new ATOM 0 HD12 LEU A 420 -16.191 11.359 -8.026 1.00 0.00 H new ATOM 0 HD13 LEU A 420 -14.861 10.178 -7.950 1.00 0.00 H new ATOM 0 HD21 LEU A 420 -16.590 7.789 -7.288 1.00 0.00 H new ATOM 0 HD22 LEU A 420 -15.032 8.198 -6.529 1.00 0.00 H new ATOM 0 HD23 LEU A 420 -16.470 7.923 -5.517 1.00 0.00 H new ATOM 841 N LYS A 421 -15.542 12.392 -2.942 1.00 0.00 N ATOM 842 CA LYS A 421 -14.778 13.137 -1.956 1.00 0.00 C ATOM 843 C LYS A 421 -15.276 12.832 -0.543 1.00 0.00 C ATOM 844 O LYS A 421 -14.490 12.435 0.312 1.00 0.00 O ATOM 845 CB LYS A 421 -14.874 14.636 -2.283 1.00 0.00 C ATOM 846 CG LYS A 421 -14.020 15.515 -1.359 1.00 0.00 C ATOM 847 CD LYS A 421 -14.390 17.000 -1.488 1.00 0.00 C ATOM 848 CE LYS A 421 -14.179 17.548 -2.907 1.00 0.00 C ATOM 849 NZ LYS A 421 -14.487 18.989 -2.988 1.00 0.00 N ATOM 0 H LYS A 421 -15.973 12.989 -3.648 1.00 0.00 H new ATOM 0 HA LYS A 421 -13.731 12.836 -1.994 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -14.563 14.796 -3.315 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -15.915 14.950 -2.212 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -14.154 15.195 -0.326 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -12.966 15.380 -1.600 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -15.433 17.135 -1.203 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -13.791 17.581 -0.787 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -13.146 17.379 -3.212 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -14.812 17.001 -3.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -14.333 19.323 -3.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -15.480 19.147 -2.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -13.866 19.514 -2.339 1.00 0.00 H new ATOM 863 N ASP A 422 -16.576 13.029 -0.302 1.00 0.00 N ATOM 864 CA ASP A 422 -17.215 12.806 0.987 1.00 0.00 C ATOM 865 C ASP A 422 -17.032 11.365 1.463 1.00 0.00 C ATOM 866 O ASP A 422 -16.633 11.130 2.603 1.00 0.00 O ATOM 867 CB ASP A 422 -18.701 13.161 0.885 1.00 0.00 C ATOM 868 CG ASP A 422 -19.408 12.915 2.213 1.00 0.00 C ATOM 869 OD1 ASP A 422 -19.181 13.730 3.133 1.00 0.00 O ATOM 870 OD2 ASP A 422 -20.145 11.909 2.285 1.00 0.00 O ATOM 0 H ASP A 422 -17.224 13.356 -1.019 1.00 0.00 H new ATOM 0 HA ASP A 422 -16.739 13.450 1.727 1.00 0.00 H new ATOM 0 HB2 ASP A 422 -18.811 14.207 0.597 1.00 0.00 H new ATOM 0 HB3 ASP A 422 -19.169 12.564 0.102 1.00 0.00 H new ATOM 875 N ARG A 423 -17.320 10.396 0.589 1.00 0.00 N ATOM 876 CA ARG A 423 -17.191 8.988 0.917 1.00 0.00 C ATOM 877 C ARG A 423 -15.767 8.668 1.355 1.00 0.00 C ATOM 878 O ARG A 423 -15.576 8.042 2.399 1.00 0.00 O ATOM 879 CB ARG A 423 -17.599 8.106 -0.271 1.00 0.00 C ATOM 880 CG ARG A 423 -17.329 6.619 0.007 1.00 0.00 C ATOM 881 CD ARG A 423 -18.253 6.039 1.082 1.00 0.00 C ATOM 882 NE ARG A 423 -17.777 4.729 1.543 1.00 0.00 N ATOM 883 CZ ARG A 423 -17.111 4.518 2.690 1.00 0.00 C ATOM 884 NH1 ARG A 423 -16.606 5.548 3.387 1.00 0.00 N ATOM 885 NH2 ARG A 423 -16.936 3.272 3.142 1.00 0.00 N ATOM 0 H ARG A 423 -17.647 10.573 -0.361 1.00 0.00 H new ATOM 0 HA ARG A 423 -17.865 8.772 1.746 1.00 0.00 H new ATOM 0 HB2 ARG A 423 -18.658 8.250 -0.484 1.00 0.00 H new ATOM 0 HB3 ARG A 423 -17.050 8.416 -1.160 1.00 0.00 H new ATOM 0 HG2 ARG A 423 -17.453 6.053 -0.916 1.00 0.00 H new ATOM 0 HG3 ARG A 423 -16.292 6.495 0.320 1.00 0.00 H new ATOM 0 HD2 ARG A 423 -18.309 6.726 1.926 1.00 0.00 H new ATOM 0 HD3 ARG A 423 -19.263 5.942 0.683 1.00 0.00 H new ATOM 0 HE ARG A 423 -17.966 3.921 0.950 1.00 0.00 H new ATOM 0 HH11 ARG A 423 -16.726 6.502 3.047 1.00 0.00 H new ATOM 0 HH12 ARG A 423 -16.102 5.377 4.257 1.00 0.00 H new ATOM 0 HH21 ARG A 423 -17.308 2.482 2.616 1.00 0.00 H new ATOM 0 HH22 ARG A 423 -16.430 3.112 4.013 1.00 0.00 H new ATOM 899 N TRP A 424 -14.772 9.082 0.562 1.00 0.00 N ATOM 900 CA TRP A 424 -13.385 8.823 0.892 1.00 0.00 C ATOM 901 C TRP A 424 -13.029 9.513 2.208 1.00 0.00 C ATOM 902 O TRP A 424 -12.392 8.911 3.069 1.00 0.00 O ATOM 903 CB TRP A 424 -12.461 9.269 -0.238 1.00 0.00 C ATOM 904 CG TRP A 424 -11.035 8.909 0.022 1.00 0.00 C ATOM 905 CD1 TRP A 424 -10.060 9.775 0.363 1.00 0.00 C ATOM 906 CD2 TRP A 424 -10.405 7.594 -0.015 1.00 0.00 C ATOM 907 NE1 TRP A 424 -8.875 9.096 0.537 1.00 0.00 N ATOM 908 CE2 TRP A 424 -9.030 7.749 0.320 1.00 0.00 C ATOM 909 CE3 TRP A 424 -10.850 6.284 -0.293 1.00 0.00 C ATOM 910 CZ2 TRP A 424 -8.138 6.673 0.378 1.00 0.00 C ATOM 911 CZ3 TRP A 424 -9.964 5.191 -0.240 1.00 0.00 C ATOM 912 CH2 TRP A 424 -8.611 5.382 0.093 1.00 0.00 C ATOM 0 H TRP A 424 -14.911 9.596 -0.308 1.00 0.00 H new ATOM 0 HA TRP A 424 -13.247 7.749 1.016 1.00 0.00 H new ATOM 0 HB2 TRP A 424 -12.785 8.810 -1.172 1.00 0.00 H new ATOM 0 HB3 TRP A 424 -12.543 10.348 -0.368 1.00 0.00 H new ATOM 0 HD1 TRP A 424 -10.189 10.841 0.482 1.00 0.00 H new ATOM 0 HE1 TRP A 424 -7.993 9.538 0.795 1.00 0.00 H new ATOM 0 HE3 TRP A 424 -11.886 6.117 -0.550 1.00 0.00 H new ATOM 0 HZ2 TRP A 424 -7.102 6.833 0.638 1.00 0.00 H new ATOM 0 HZ3 TRP A 424 -10.327 4.197 -0.457 1.00 0.00 H new ATOM 0 HH2 TRP A 424 -7.938 4.538 0.129 1.00 0.00 H new ATOM 923 N ARG A 425 -13.458 10.769 2.374 1.00 0.00 N ATOM 924 CA ARG A 425 -13.224 11.539 3.586 1.00 0.00 C ATOM 925 C ARG A 425 -13.754 10.763 4.794 1.00 0.00 C ATOM 926 O ARG A 425 -13.092 10.717 5.827 1.00 0.00 O ATOM 927 CB ARG A 425 -13.859 12.928 3.450 1.00 0.00 C ATOM 928 CG ARG A 425 -13.439 13.869 4.583 1.00 0.00 C ATOM 929 CD ARG A 425 -14.009 15.267 4.314 1.00 0.00 C ATOM 930 NE ARG A 425 -13.555 16.252 5.308 1.00 0.00 N ATOM 931 CZ ARG A 425 -12.351 16.850 5.315 1.00 0.00 C ATOM 932 NH1 ARG A 425 -11.421 16.521 4.408 1.00 0.00 N ATOM 933 NH2 ARG A 425 -12.080 17.783 6.237 1.00 0.00 N ATOM 0 H ARG A 425 -13.981 11.278 1.661 1.00 0.00 H new ATOM 0 HA ARG A 425 -12.156 11.690 3.740 1.00 0.00 H new ATOM 0 HB2 ARG A 425 -13.573 13.364 2.493 1.00 0.00 H new ATOM 0 HB3 ARG A 425 -14.945 12.830 3.444 1.00 0.00 H new ATOM 0 HG2 ARG A 425 -13.803 13.492 5.539 1.00 0.00 H new ATOM 0 HG3 ARG A 425 -12.352 13.913 4.651 1.00 0.00 H new ATOM 0 HD2 ARG A 425 -13.710 15.594 3.318 1.00 0.00 H new ATOM 0 HD3 ARG A 425 -15.098 15.221 4.321 1.00 0.00 H new ATOM 0 HE ARG A 425 -14.207 16.501 6.052 1.00 0.00 H new ATOM 0 HH11 ARG A 425 -11.624 15.811 3.704 1.00 0.00 H new ATOM 0 HH12 ARG A 425 -10.510 16.980 4.422 1.00 0.00 H new ATOM 0 HH21 ARG A 425 -12.785 18.036 6.929 1.00 0.00 H new ATOM 0 HH22 ARG A 425 -11.168 18.240 6.247 1.00 0.00 H new ATOM 947 N THR A 426 -14.928 10.130 4.663 1.00 0.00 N ATOM 948 CA THR A 426 -15.519 9.324 5.723 1.00 0.00 C ATOM 949 C THR A 426 -14.577 8.171 6.097 1.00 0.00 C ATOM 950 O THR A 426 -14.496 7.808 7.270 1.00 0.00 O ATOM 951 CB THR A 426 -16.924 8.844 5.320 1.00 0.00 C ATOM 952 OG1 THR A 426 -17.728 9.949 4.964 1.00 0.00 O ATOM 953 CG2 THR A 426 -17.624 8.106 6.464 1.00 0.00 C ATOM 0 H THR A 426 -15.491 10.167 3.813 1.00 0.00 H new ATOM 0 HA THR A 426 -15.646 9.935 6.617 1.00 0.00 H new ATOM 0 HB THR A 426 -16.798 8.163 4.478 1.00 0.00 H new ATOM 0 HG1 THR A 426 -17.415 10.321 4.113 1.00 0.00 H new ATOM 0 HG21 THR A 426 -18.613 7.784 6.138 1.00 0.00 H new ATOM 0 HG22 THR A 426 -17.034 7.235 6.750 1.00 0.00 H new ATOM 0 HG23 THR A 426 -17.724 8.773 7.320 1.00 0.00 H new ATOM 961 N MET A 427 -13.838 7.604 5.130 1.00 0.00 N ATOM 962 CA MET A 427 -12.879 6.548 5.433 1.00 0.00 C ATOM 963 C MET A 427 -11.723 7.153 6.238 1.00 0.00 C ATOM 964 O MET A 427 -11.345 6.626 7.286 1.00 0.00 O ATOM 965 CB MET A 427 -12.321 5.865 4.174 1.00 0.00 C ATOM 966 CG MET A 427 -13.374 5.221 3.270 1.00 0.00 C ATOM 967 SD MET A 427 -12.647 4.301 1.888 1.00 0.00 S ATOM 968 CE MET A 427 -14.136 3.731 1.035 1.00 0.00 C ATOM 0 H MET A 427 -13.890 7.861 4.144 1.00 0.00 H new ATOM 0 HA MET A 427 -13.402 5.781 6.004 1.00 0.00 H new ATOM 0 HB2 MET A 427 -11.767 6.603 3.593 1.00 0.00 H new ATOM 0 HB3 MET A 427 -11.608 5.099 4.480 1.00 0.00 H new ATOM 0 HG2 MET A 427 -13.992 4.547 3.863 1.00 0.00 H new ATOM 0 HG3 MET A 427 -14.032 5.996 2.878 1.00 0.00 H new ATOM 0 HE1 MET A 427 -13.855 3.224 0.112 1.00 0.00 H new ATOM 0 HE2 MET A 427 -14.681 3.039 1.677 1.00 0.00 H new ATOM 0 HE3 MET A 427 -14.771 4.586 0.801 1.00 0.00 H new ATOM 978 N LYS A 428 -11.172 8.266 5.733 1.00 0.00 N ATOM 979 CA LYS A 428 -10.064 8.983 6.354 1.00 0.00 C ATOM 980 C LYS A 428 -10.383 9.416 7.789 1.00 0.00 C ATOM 981 O LYS A 428 -9.496 9.395 8.638 1.00 0.00 O ATOM 982 CB LYS A 428 -9.647 10.196 5.511 1.00 0.00 C ATOM 983 CG LYS A 428 -9.173 9.824 4.099 1.00 0.00 C ATOM 984 CD LYS A 428 -8.496 11.025 3.418 1.00 0.00 C ATOM 985 CE LYS A 428 -7.020 11.201 3.797 1.00 0.00 C ATOM 986 NZ LYS A 428 -6.162 10.108 3.303 1.00 0.00 N ATOM 0 H LYS A 428 -11.494 8.696 4.866 1.00 0.00 H new ATOM 0 HA LYS A 428 -9.228 8.285 6.400 1.00 0.00 H new ATOM 0 HB2 LYS A 428 -10.490 10.883 5.434 1.00 0.00 H new ATOM 0 HB3 LYS A 428 -8.848 10.729 6.026 1.00 0.00 H new ATOM 0 HG2 LYS A 428 -8.474 8.989 4.153 1.00 0.00 H new ATOM 0 HG3 LYS A 428 -10.022 9.492 3.501 1.00 0.00 H new ATOM 0 HD2 LYS A 428 -8.572 10.908 2.337 1.00 0.00 H new ATOM 0 HD3 LYS A 428 -9.039 11.933 3.680 1.00 0.00 H new ATOM 0 HE2 LYS A 428 -6.659 12.148 3.396 1.00 0.00 H new ATOM 0 HE3 LYS A 428 -6.934 11.260 4.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 -5.163 10.369 3.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 -6.361 9.241 3.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 -6.357 9.942 2.295 1.00 0.00 H new ATOM 1000 N LYS A 429 -11.635 9.814 8.058 1.00 0.00 N ATOM 1001 CA LYS A 429 -12.077 10.261 9.373 1.00 0.00 C ATOM 1002 C LYS A 429 -11.689 9.269 10.470 1.00 0.00 C ATOM 1003 O LYS A 429 -10.907 9.627 11.349 1.00 0.00 O ATOM 1004 CB LYS A 429 -13.593 10.523 9.389 1.00 0.00 C ATOM 1005 CG LYS A 429 -13.993 11.911 8.865 1.00 0.00 C ATOM 1006 CD LYS A 429 -13.541 13.095 9.737 1.00 0.00 C ATOM 1007 CE LYS A 429 -13.970 12.956 11.205 1.00 0.00 C ATOM 1008 NZ LYS A 429 -13.690 14.181 11.977 1.00 0.00 N ATOM 0 H LYS A 429 -12.373 9.832 7.354 1.00 0.00 H new ATOM 0 HA LYS A 429 -11.565 11.200 9.582 1.00 0.00 H new ATOM 0 HB2 LYS A 429 -14.089 9.762 8.787 1.00 0.00 H new ATOM 0 HB3 LYS A 429 -13.960 10.412 10.409 1.00 0.00 H new ATOM 0 HG2 LYS A 429 -13.578 12.038 7.865 1.00 0.00 H new ATOM 0 HG3 LYS A 429 -15.078 11.946 8.767 1.00 0.00 H new ATOM 0 HD2 LYS A 429 -12.456 13.182 9.688 1.00 0.00 H new ATOM 0 HD3 LYS A 429 -13.953 14.018 9.329 1.00 0.00 H new ATOM 0 HE2 LYS A 429 -15.036 12.732 11.252 1.00 0.00 H new ATOM 0 HE3 LYS A 429 -13.447 12.114 11.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 429 -13.994 14.047 12.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 429 -12.670 14.381 11.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 429 -14.209 14.980 11.560 1.00 0.00 H new ATOM 1022 N LEU A 430 -12.230 8.042 10.437 1.00 0.00 N ATOM 1023 CA LEU A 430 -11.913 7.051 11.461 1.00 0.00 C ATOM 1024 C LEU A 430 -12.334 5.631 11.065 1.00 0.00 C ATOM 1025 O LEU A 430 -12.823 4.884 11.912 1.00 0.00 O ATOM 1026 CB LEU A 430 -12.547 7.475 12.807 1.00 0.00 C ATOM 1027 CG LEU A 430 -11.819 6.903 14.037 1.00 0.00 C ATOM 1028 CD1 LEU A 430 -10.489 7.627 14.292 1.00 0.00 C ATOM 1029 CD2 LEU A 430 -12.711 7.061 15.274 1.00 0.00 C ATOM 0 H LEU A 430 -12.880 7.720 9.720 1.00 0.00 H new ATOM 0 HA LEU A 430 -10.829 7.019 11.569 1.00 0.00 H new ATOM 0 HB2 LEU A 430 -12.551 8.563 12.871 1.00 0.00 H new ATOM 0 HB3 LEU A 430 -13.587 7.151 12.827 1.00 0.00 H new ATOM 0 HG LEU A 430 -11.609 5.851 13.844 1.00 0.00 H new ATOM 0 HD11 LEU A 430 -10.003 7.197 15.168 1.00 0.00 H new ATOM 0 HD12 LEU A 430 -9.840 7.513 13.424 1.00 0.00 H new ATOM 0 HD13 LEU A 430 -10.679 8.686 14.466 1.00 0.00 H new ATOM 0 HD21 LEU A 430 -12.198 6.657 16.147 1.00 0.00 H new ATOM 0 HD22 LEU A 430 -12.925 8.118 15.436 1.00 0.00 H new ATOM 0 HD23 LEU A 430 -13.645 6.521 15.120 1.00 0.00 H new ATOM 1041 N LYS A 431 -12.144 5.227 9.800 1.00 0.00 N ATOM 1042 CA LYS A 431 -12.490 3.873 9.375 1.00 0.00 C ATOM 1043 C LYS A 431 -11.252 2.995 9.555 1.00 0.00 C ATOM 1044 O LYS A 431 -11.216 2.173 10.467 1.00 0.00 O ATOM 1045 CB LYS A 431 -13.072 3.881 7.954 1.00 0.00 C ATOM 1046 CG LYS A 431 -13.531 2.517 7.416 1.00 0.00 C ATOM 1047 CD LYS A 431 -14.292 1.627 8.411 1.00 0.00 C ATOM 1048 CE LYS A 431 -15.601 2.260 8.901 1.00 0.00 C ATOM 1049 NZ LYS A 431 -16.236 1.441 9.951 1.00 0.00 N ATOM 0 H LYS A 431 -11.756 5.816 9.063 1.00 0.00 H new ATOM 0 HA LYS A 431 -13.284 3.448 9.989 1.00 0.00 H new ATOM 0 HB2 LYS A 431 -13.921 4.564 7.932 1.00 0.00 H new ATOM 0 HB3 LYS A 431 -12.321 4.285 7.275 1.00 0.00 H new ATOM 0 HG2 LYS A 431 -14.168 2.686 6.548 1.00 0.00 H new ATOM 0 HG3 LYS A 431 -12.654 1.972 7.067 1.00 0.00 H new ATOM 0 HD2 LYS A 431 -14.512 0.670 7.939 1.00 0.00 H new ATOM 0 HD3 LYS A 431 -13.652 1.420 9.268 1.00 0.00 H new ATOM 0 HE2 LYS A 431 -15.401 3.259 9.288 1.00 0.00 H new ATOM 0 HE3 LYS A 431 -16.288 2.375 8.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 -17.118 1.896 10.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 -16.448 0.496 9.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 -15.590 1.353 10.761 1.00 0.00 H new ATOM 1063 N LEU A 432 -10.238 3.183 8.701 1.00 0.00 N ATOM 1064 CA LEU A 432 -8.963 2.468 8.750 1.00 0.00 C ATOM 1065 C LEU A 432 -7.978 3.039 7.721 1.00 0.00 C ATOM 1066 O LEU A 432 -7.255 2.295 7.063 1.00 0.00 O ATOM 1067 CB LEU A 432 -9.120 0.932 8.676 1.00 0.00 C ATOM 1068 CG LEU A 432 -10.142 0.378 7.669 1.00 0.00 C ATOM 1069 CD1 LEU A 432 -9.930 0.879 6.236 1.00 0.00 C ATOM 1070 CD2 LEU A 432 -10.077 -1.152 7.679 1.00 0.00 C ATOM 0 H LEU A 432 -10.287 3.856 7.936 1.00 0.00 H new ATOM 0 HA LEU A 432 -8.529 2.642 9.735 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -8.146 0.504 8.439 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -9.394 0.572 9.668 1.00 0.00 H new ATOM 0 HG LEU A 432 -11.120 0.739 7.986 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -10.688 0.446 5.583 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -10.011 1.966 6.215 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -8.940 0.582 5.889 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -10.799 -1.552 6.967 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -9.074 -1.475 7.399 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -10.311 -1.520 8.678 1.00 0.00 H new ATOM 1082 N ILE A 433 -7.945 4.372 7.590 1.00 0.00 N ATOM 1083 CA ILE A 433 -7.058 5.084 6.680 1.00 0.00 C ATOM 1084 C ILE A 433 -6.477 6.267 7.451 1.00 0.00 C ATOM 1085 O ILE A 433 -7.142 7.288 7.613 1.00 0.00 O ATOM 1086 CB ILE A 433 -7.799 5.520 5.398 1.00 0.00 C ATOM 1087 CG1 ILE A 433 -8.441 4.296 4.719 1.00 0.00 C ATOM 1088 CG2 ILE A 433 -6.822 6.237 4.451 1.00 0.00 C ATOM 1089 CD1 ILE A 433 -8.944 4.575 3.303 1.00 0.00 C ATOM 0 H ILE A 433 -8.550 4.992 8.128 1.00 0.00 H new ATOM 0 HA ILE A 433 -6.250 4.436 6.339 1.00 0.00 H new ATOM 0 HB ILE A 433 -8.596 6.217 5.656 1.00 0.00 H new ATOM 0 HG12 ILE A 433 -7.712 3.487 4.684 1.00 0.00 H new ATOM 0 HG13 ILE A 433 -9.274 3.948 5.329 1.00 0.00 H new ATOM 0 HG21 ILE A 433 -7.349 6.543 3.548 1.00 0.00 H new ATOM 0 HG22 ILE A 433 -6.413 7.117 4.948 1.00 0.00 H new ATOM 0 HG23 ILE A 433 -6.010 5.560 4.185 1.00 0.00 H new ATOM 0 HD11 ILE A 433 -9.383 3.668 2.888 1.00 0.00 H new ATOM 0 HD12 ILE A 433 -9.697 5.362 3.333 1.00 0.00 H new ATOM 0 HD13 ILE A 433 -8.111 4.894 2.677 1.00 0.00 H new ATOM 1101 N SER A 434 -5.238 6.125 7.930 1.00 0.00 N ATOM 1102 CA SER A 434 -4.552 7.168 8.678 1.00 0.00 C ATOM 1103 C SER A 434 -4.210 8.317 7.732 1.00 0.00 C ATOM 1104 O SER A 434 -3.277 8.197 6.939 1.00 0.00 O ATOM 1105 CB SER A 434 -3.289 6.594 9.331 1.00 0.00 C ATOM 1106 OG SER A 434 -3.642 5.576 10.246 1.00 0.00 O ATOM 0 H SER A 434 -4.685 5.277 7.806 1.00 0.00 H new ATOM 0 HA SER A 434 -5.197 7.547 9.470 1.00 0.00 H new ATOM 0 HB2 SER A 434 -2.624 6.193 8.566 1.00 0.00 H new ATOM 0 HB3 SER A 434 -2.743 7.385 9.846 1.00 0.00 H new ATOM 0 HG SER A 434 -2.831 5.212 10.659 1.00 0.00 H new ATOM 1112 N SER A 435 -4.972 9.417 7.818 1.00 0.00 N ATOM 1113 CA SER A 435 -4.811 10.614 7.003 1.00 0.00 C ATOM 1114 C SER A 435 -3.341 10.993 6.860 1.00 0.00 C ATOM 1115 O SER A 435 -2.847 11.129 5.742 1.00 0.00 O ATOM 1116 CB SER A 435 -5.627 11.759 7.613 1.00 0.00 C ATOM 1117 OG SER A 435 -6.971 11.351 7.742 1.00 0.00 O ATOM 0 H SER A 435 -5.742 9.493 8.482 1.00 0.00 H new ATOM 0 HA SER A 435 -5.184 10.412 5.999 1.00 0.00 H new ATOM 0 HB2 SER A 435 -5.222 12.032 8.587 1.00 0.00 H new ATOM 0 HB3 SER A 435 -5.562 12.645 6.981 1.00 0.00 H new ATOM 0 HG SER A 435 -7.498 12.079 8.133 1.00 0.00 H new ATOM 1123 N ASP A 436 -2.656 11.130 7.999 1.00 0.00 N ATOM 1124 CA ASP A 436 -1.237 11.419 8.047 1.00 0.00 C ATOM 1125 C ASP A 436 -0.518 10.074 8.123 1.00 0.00 C ATOM 1126 O ASP A 436 -0.864 9.227 8.945 1.00 0.00 O ATOM 1127 CB ASP A 436 -0.902 12.290 9.263 1.00 0.00 C ATOM 1128 CG ASP A 436 0.602 12.518 9.429 1.00 0.00 C ATOM 1129 OD1 ASP A 436 1.343 12.321 8.438 1.00 0.00 O ATOM 1130 OD2 ASP A 436 0.984 12.888 10.559 1.00 0.00 O ATOM 0 H ASP A 436 -3.085 11.040 8.920 1.00 0.00 H new ATOM 0 HA ASP A 436 -0.921 11.976 7.165 1.00 0.00 H new ATOM 0 HB2 ASP A 436 -1.403 13.253 9.164 1.00 0.00 H new ATOM 0 HB3 ASP A 436 -1.295 11.817 10.163 1.00 0.00 H new ATOM 1135 N SER A 437 0.478 9.896 7.258 1.00 0.00 N ATOM 1136 CA SER A 437 1.318 8.715 7.171 1.00 0.00 C ATOM 1137 C SER A 437 2.692 9.152 6.650 1.00 0.00 C ATOM 1138 O SER A 437 3.334 8.410 5.909 1.00 0.00 O ATOM 1139 CB SER A 437 0.661 7.665 6.263 1.00 0.00 C ATOM 1140 OG SER A 437 -0.554 7.187 6.814 1.00 0.00 O ATOM 0 H SER A 437 0.729 10.606 6.570 1.00 0.00 H new ATOM 0 HA SER A 437 1.442 8.249 8.149 1.00 0.00 H new ATOM 0 HB2 SER A 437 0.470 8.100 5.282 1.00 0.00 H new ATOM 0 HB3 SER A 437 1.347 6.831 6.114 1.00 0.00 H new ATOM 0 HG SER A 437 -1.265 7.843 6.658 1.00 0.00 H new ATOM 1146 N GLU A 438 3.137 10.361 7.025 1.00 0.00 N ATOM 1147 CA GLU A 438 4.416 10.907 6.596 1.00 0.00 C ATOM 1148 C GLU A 438 5.548 10.265 7.404 1.00 0.00 C ATOM 1149 O GLU A 438 5.459 10.177 8.628 1.00 0.00 O ATOM 1150 CB GLU A 438 4.385 12.435 6.739 1.00 0.00 C ATOM 1151 CG GLU A 438 5.598 13.099 6.075 1.00 0.00 C ATOM 1152 CD GLU A 438 5.466 14.619 6.070 1.00 0.00 C ATOM 1153 OE1 GLU A 438 4.762 15.123 5.167 1.00 0.00 O ATOM 1154 OE2 GLU A 438 6.068 15.251 6.964 1.00 0.00 O ATOM 0 H GLU A 438 2.611 10.984 7.638 1.00 0.00 H new ATOM 0 HA GLU A 438 4.599 10.676 5.547 1.00 0.00 H new ATOM 0 HB2 GLU A 438 3.470 12.822 6.292 1.00 0.00 H new ATOM 0 HB3 GLU A 438 4.360 12.700 7.796 1.00 0.00 H new ATOM 0 HG2 GLU A 438 6.507 12.813 6.604 1.00 0.00 H new ATOM 0 HG3 GLU A 438 5.698 12.737 5.052 1.00 0.00 H new ATOM 1161 N ASP A 439 6.600 9.816 6.712 1.00 0.00 N ATOM 1162 CA ASP A 439 7.776 9.175 7.281 1.00 0.00 C ATOM 1163 C ASP A 439 8.914 9.307 6.266 1.00 0.00 C ATOM 1164 O ASP A 439 8.580 9.213 5.061 1.00 0.00 O ATOM 1165 CB ASP A 439 7.468 7.701 7.582 1.00 0.00 C ATOM 1166 CG ASP A 439 8.660 6.978 8.204 1.00 0.00 C ATOM 1167 OD1 ASP A 439 8.973 7.294 9.373 1.00 0.00 O ATOM 1168 OD2 ASP A 439 9.216 6.093 7.518 1.00 0.00 O ATOM 1169 OXT ASP A 439 9.955 9.874 6.666 1.00 0.00 O ATOM 0 H ASP A 439 6.651 9.896 5.696 1.00 0.00 H new ATOM 0 HA ASP A 439 8.066 9.648 8.219 1.00 0.00 H new ATOM 0 HB2 ASP A 439 6.615 7.641 8.258 1.00 0.00 H new ATOM 0 HB3 ASP A 439 7.180 7.196 6.660 1.00 0.00 H new TER 1174 ASP A 439