USER MOD reduce.3.24.130724 H: found=0, std=0, add=819, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 822 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 270 SER OG : rot 180:sc= -0.433 USER MOD Set 1.2: B 68 HIS : no HD1:sc= -1.61 K(o=-2,f=-0.74) USER MOD Set 2.1: B 60 ASN : amide:sc= -0.942 K(o=-1.1,f=0.57) USER MOD Set 2.2: B 62 GLN : amide:sc= -0.109 K(o=-1.1,f=0.57) USER MOD Set 3.1: B 55 THR OG1 : rot 117:sc= 0.288 USER MOD Set 3.2: B 57 SER OG : rot 180:sc= 0.281 USER MOD Set 4.1: B 22 THR OG1 : rot 180:sc= -0.262 USER MOD Set 4.2: B 25 ASN : amide:sc= -2.45! K(o=-2.7!,f=-0.58) USER MOD Single : A 255 TYR OH : rot 180:sc= 0 USER MOD Single : A 265 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 272 LYS NZ :NH3+ 165:sc= -0.0474 (180deg=-0.286) USER MOD Single : A 274 SER OG : rot 56:sc= 0.124 USER MOD Single : A 276 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 277 SER OG : rot -10:sc= 0.866 USER MOD Single : B 1 MET CE :methyl -173:sc= -0.0736 (180deg=-0.186) USER MOD Single : B 1 MET N :NH3+ 174:sc= 0.836 (180deg=0.797) USER MOD Single : B 2 GLN : amide:sc= 0.0931 X(o=0.093,f=0) USER MOD Single : B 6 LYS NZ :NH3+ 179:sc= -2.37! (180deg=-2.47!) USER MOD Single : B 7 THR OG1 : rot 180:sc= 0 USER MOD Single : B 9 THR OG1 : rot 180:sc= 0 USER MOD Single : B 11 LYS NZ :NH3+ -169:sc= -0.0149 (180deg=-0.177) USER MOD Single : B 12 THR OG1 : rot 180:sc= -0.109 USER MOD Single : B 14 THR OG1 : rot -20:sc= 1.31 USER MOD Single : B 19 SER OG : rot 180:sc= -0.47 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 27 LYS NZ :NH3+ 168:sc= 0.0047 (180deg=-0.0692) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 29 LYS NZ :NH3+ -124:sc= 0.32 (180deg=-0.274) USER MOD Single : B 31 GLN : amide:sc= -1.16 K(o=-1.2,f=-3.2!) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN : amide:sc= -3.33! X(o=-3.3!,f=-3.3) USER MOD Single : B 41 GLN : amide:sc= -3.81! C(o=-3.8!,f=-8.5!) USER MOD Single : B 48 LYS NZ :NH3+ -114:sc= -2.04 (180deg=-4.48!) USER MOD Single : B 49 GLN : amide:sc= -6.47! C(o=-6.5!,f=-1.8!) USER MOD Single : B 59 TYR OH : rot 180:sc= -0.541 USER MOD Single : B 63 LYS NZ :NH3+ -142:sc= -3.12! (180deg=-5.8!) USER MOD Single : B 65 SER OG : rot 123:sc= 0.681 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 255 -24.604 6.060 -4.677 1.00 0.00 N ATOM 2 CA TYR A 255 -23.847 6.201 -3.406 1.00 0.00 C ATOM 3 C TYR A 255 -22.341 6.069 -3.635 1.00 0.00 C ATOM 4 O TYR A 255 -21.901 5.320 -4.508 1.00 0.00 O ATOM 5 CB TYR A 255 -24.350 5.141 -2.415 1.00 0.00 C ATOM 6 CG TYR A 255 -24.345 3.723 -2.953 1.00 0.00 C ATOM 7 CD1 TYR A 255 -23.155 3.066 -3.245 1.00 0.00 C ATOM 8 CD2 TYR A 255 -25.537 3.037 -3.158 1.00 0.00 C ATOM 9 CE1 TYR A 255 -23.152 1.772 -3.727 1.00 0.00 C ATOM 10 CE2 TYR A 255 -25.542 1.741 -3.639 1.00 0.00 C ATOM 11 CZ TYR A 255 -24.348 1.114 -3.923 1.00 0.00 C ATOM 12 OH TYR A 255 -24.349 -0.176 -4.402 1.00 0.00 O ATOM 0 HA TYR A 255 -24.016 7.196 -2.995 1.00 0.00 H new ATOM 0 HB2 TYR A 255 -23.731 5.178 -1.518 1.00 0.00 H new ATOM 0 HB3 TYR A 255 -25.365 5.398 -2.113 1.00 0.00 H new ATOM 0 HD1 TYR A 255 -22.216 3.577 -3.092 1.00 0.00 H new ATOM 0 HD2 TYR A 255 -26.475 3.525 -2.938 1.00 0.00 H new ATOM 0 HE1 TYR A 255 -22.218 1.278 -3.949 1.00 0.00 H new ATOM 0 HE2 TYR A 255 -26.477 1.222 -3.791 1.00 0.00 H new ATOM 0 HH TYR A 255 -25.272 -0.495 -4.482 1.00 0.00 H new ATOM 24 N PRO A 256 -21.525 6.805 -2.858 1.00 0.00 N ATOM 25 CA PRO A 256 -20.064 6.765 -2.986 1.00 0.00 C ATOM 26 C PRO A 256 -19.477 5.446 -2.495 1.00 0.00 C ATOM 27 O PRO A 256 -19.817 4.969 -1.412 1.00 0.00 O ATOM 28 CB PRO A 256 -19.599 7.922 -2.100 1.00 0.00 C ATOM 29 CG PRO A 256 -20.680 8.081 -1.089 1.00 0.00 C ATOM 30 CD PRO A 256 -21.961 7.734 -1.796 1.00 0.00 C ATOM 0 HA PRO A 256 -19.742 6.850 -4.024 1.00 0.00 H new ATOM 0 HB2 PRO A 256 -18.643 7.699 -1.626 1.00 0.00 H new ATOM 0 HB3 PRO A 256 -19.462 8.835 -2.680 1.00 0.00 H new ATOM 0 HG2 PRO A 256 -20.515 7.424 -0.235 1.00 0.00 H new ATOM 0 HG3 PRO A 256 -20.709 9.101 -0.706 1.00 0.00 H new ATOM 0 HD2 PRO A 256 -22.678 7.265 -1.122 1.00 0.00 H new ATOM 0 HD3 PRO A 256 -22.444 8.619 -2.210 1.00 0.00 H new ATOM 38 N GLU A 257 -18.591 4.861 -3.297 1.00 0.00 N ATOM 39 CA GLU A 257 -17.955 3.597 -2.941 1.00 0.00 C ATOM 40 C GLU A 257 -17.043 3.771 -1.729 1.00 0.00 C ATOM 41 O GLU A 257 -16.250 4.710 -1.667 1.00 0.00 O ATOM 42 CB GLU A 257 -17.162 3.049 -4.129 1.00 0.00 C ATOM 43 CG GLU A 257 -18.029 2.739 -5.340 1.00 0.00 C ATOM 44 CD GLU A 257 -17.234 2.186 -6.506 1.00 0.00 C ATOM 45 OE1 GLU A 257 -16.590 1.129 -6.337 1.00 0.00 O ATOM 46 OE2 GLU A 257 -17.261 2.806 -7.590 1.00 0.00 O ATOM 0 H GLU A 257 -18.298 5.242 -4.197 1.00 0.00 H new ATOM 0 HA GLU A 257 -18.736 2.882 -2.681 1.00 0.00 H new ATOM 0 HB2 GLU A 257 -16.399 3.774 -4.413 1.00 0.00 H new ATOM 0 HB3 GLU A 257 -16.641 2.142 -3.822 1.00 0.00 H new ATOM 0 HG2 GLU A 257 -18.797 2.020 -5.056 1.00 0.00 H new ATOM 0 HG3 GLU A 257 -18.543 3.647 -5.655 1.00 0.00 H new ATOM 53 N ASP A 258 -17.169 2.862 -0.766 1.00 0.00 N ATOM 54 CA ASP A 258 -16.362 2.915 0.451 1.00 0.00 C ATOM 55 C ASP A 258 -14.888 2.663 0.150 1.00 0.00 C ATOM 56 O ASP A 258 -14.012 3.354 0.672 1.00 0.00 O ATOM 57 CB ASP A 258 -16.867 1.889 1.467 1.00 0.00 C ATOM 58 CG ASP A 258 -16.057 1.899 2.748 1.00 0.00 C ATOM 59 OD1 ASP A 258 -16.013 2.955 3.414 1.00 0.00 O ATOM 60 OD2 ASP A 258 -15.468 0.851 3.087 1.00 0.00 O ATOM 0 H ASP A 258 -17.822 2.079 -0.804 1.00 0.00 H new ATOM 0 HA ASP A 258 -16.458 3.916 0.871 1.00 0.00 H new ATOM 0 HB2 ASP A 258 -17.912 2.095 1.699 1.00 0.00 H new ATOM 0 HB3 ASP A 258 -16.829 0.894 1.024 1.00 0.00 H new ATOM 65 N GLU A 259 -14.621 1.665 -0.685 1.00 0.00 N ATOM 66 CA GLU A 259 -13.253 1.314 -1.050 1.00 0.00 C ATOM 67 C GLU A 259 -12.540 2.490 -1.713 1.00 0.00 C ATOM 68 O GLU A 259 -11.374 2.764 -1.424 1.00 0.00 O ATOM 69 CB GLU A 259 -13.250 0.100 -1.982 1.00 0.00 C ATOM 70 CG GLU A 259 -14.028 0.320 -3.268 1.00 0.00 C ATOM 71 CD GLU A 259 -14.117 -0.930 -4.121 1.00 0.00 C ATOM 72 OE1 GLU A 259 -13.061 -1.418 -4.570 1.00 0.00 O ATOM 73 OE2 GLU A 259 -15.245 -1.420 -4.339 1.00 0.00 O ATOM 0 H GLU A 259 -15.335 1.083 -1.123 1.00 0.00 H new ATOM 0 HA GLU A 259 -12.713 1.063 -0.137 1.00 0.00 H new ATOM 0 HB2 GLU A 259 -12.220 -0.155 -2.229 1.00 0.00 H new ATOM 0 HB3 GLU A 259 -13.672 -0.755 -1.453 1.00 0.00 H new ATOM 0 HG2 GLU A 259 -15.034 0.661 -3.025 1.00 0.00 H new ATOM 0 HG3 GLU A 259 -13.553 1.114 -3.844 1.00 0.00 H new ATOM 80 N GLU A 260 -13.246 3.184 -2.601 1.00 0.00 N ATOM 81 CA GLU A 260 -12.678 4.331 -3.301 1.00 0.00 C ATOM 82 C GLU A 260 -12.416 5.479 -2.336 1.00 0.00 C ATOM 83 O GLU A 260 -11.376 6.135 -2.404 1.00 0.00 O ATOM 84 CB GLU A 260 -13.611 4.791 -4.424 1.00 0.00 C ATOM 85 CG GLU A 260 -13.737 3.788 -5.561 1.00 0.00 C ATOM 86 CD GLU A 260 -14.612 4.293 -6.692 1.00 0.00 C ATOM 87 OE1 GLU A 260 -15.138 5.421 -6.580 1.00 0.00 O ATOM 88 OE2 GLU A 260 -14.771 3.560 -7.690 1.00 0.00 O ATOM 0 H GLU A 260 -14.212 2.972 -2.852 1.00 0.00 H new ATOM 0 HA GLU A 260 -11.728 4.023 -3.738 1.00 0.00 H new ATOM 0 HB2 GLU A 260 -14.600 4.982 -4.008 1.00 0.00 H new ATOM 0 HB3 GLU A 260 -13.246 5.737 -4.824 1.00 0.00 H new ATOM 0 HG2 GLU A 260 -12.745 3.559 -5.949 1.00 0.00 H new ATOM 0 HG3 GLU A 260 -14.151 2.857 -5.174 1.00 0.00 H new ATOM 95 N GLU A 261 -13.364 5.713 -1.436 1.00 0.00 N ATOM 96 CA GLU A 261 -13.234 6.780 -0.452 1.00 0.00 C ATOM 97 C GLU A 261 -11.978 6.582 0.390 1.00 0.00 C ATOM 98 O GLU A 261 -11.205 7.516 0.601 1.00 0.00 O ATOM 99 CB GLU A 261 -14.471 6.820 0.448 1.00 0.00 C ATOM 100 CG GLU A 261 -14.414 7.895 1.519 1.00 0.00 C ATOM 101 CD GLU A 261 -14.288 9.290 0.938 1.00 0.00 C ATOM 102 OE1 GLU A 261 -15.192 9.700 0.181 1.00 0.00 O ATOM 103 OE2 GLU A 261 -13.286 9.972 1.240 1.00 0.00 O ATOM 0 H GLU A 261 -14.230 5.179 -1.368 1.00 0.00 H new ATOM 0 HA GLU A 261 -13.150 7.730 -0.980 1.00 0.00 H new ATOM 0 HB2 GLU A 261 -15.354 6.982 -0.170 1.00 0.00 H new ATOM 0 HB3 GLU A 261 -14.592 5.849 0.927 1.00 0.00 H new ATOM 0 HG2 GLU A 261 -15.314 7.840 2.132 1.00 0.00 H new ATOM 0 HG3 GLU A 261 -13.567 7.702 2.178 1.00 0.00 H new ATOM 110 N LEU A 262 -11.778 5.357 0.861 1.00 0.00 N ATOM 111 CA LEU A 262 -10.612 5.033 1.672 1.00 0.00 C ATOM 112 C LEU A 262 -9.328 5.208 0.871 1.00 0.00 C ATOM 113 O LEU A 262 -8.334 5.727 1.379 1.00 0.00 O ATOM 114 CB LEU A 262 -10.711 3.600 2.196 1.00 0.00 C ATOM 115 CG LEU A 262 -11.893 3.331 3.131 1.00 0.00 C ATOM 116 CD1 LEU A 262 -11.897 1.877 3.578 1.00 0.00 C ATOM 117 CD2 LEU A 262 -11.843 4.259 4.336 1.00 0.00 C ATOM 0 H LEU A 262 -12.408 4.572 0.695 1.00 0.00 H new ATOM 0 HA LEU A 262 -10.586 5.719 2.518 1.00 0.00 H new ATOM 0 HB2 LEU A 262 -10.779 2.922 1.345 1.00 0.00 H new ATOM 0 HB3 LEU A 262 -9.788 3.358 2.723 1.00 0.00 H new ATOM 0 HG LEU A 262 -12.816 3.527 2.585 1.00 0.00 H new ATOM 0 HD11 LEU A 262 -12.744 1.703 4.242 1.00 0.00 H new ATOM 0 HD12 LEU A 262 -11.980 1.228 2.706 1.00 0.00 H new ATOM 0 HD13 LEU A 262 -10.970 1.656 4.107 1.00 0.00 H new ATOM 0 HD21 LEU A 262 -12.691 4.053 4.989 1.00 0.00 H new ATOM 0 HD22 LEU A 262 -10.915 4.095 4.883 1.00 0.00 H new ATOM 0 HD23 LEU A 262 -11.887 5.295 4.000 1.00 0.00 H new ATOM 129 N ILE A 263 -9.358 4.770 -0.384 1.00 0.00 N ATOM 130 CA ILE A 263 -8.198 4.876 -1.261 1.00 0.00 C ATOM 131 C ILE A 263 -7.704 6.317 -1.364 1.00 0.00 C ATOM 132 O ILE A 263 -6.535 6.594 -1.104 1.00 0.00 O ATOM 133 CB ILE A 263 -8.518 4.336 -2.673 1.00 0.00 C ATOM 134 CG1 ILE A 263 -8.429 2.811 -2.697 1.00 0.00 C ATOM 135 CG2 ILE A 263 -7.593 4.947 -3.720 1.00 0.00 C ATOM 136 CD1 ILE A 263 -8.769 2.203 -4.042 1.00 0.00 C ATOM 0 H ILE A 263 -10.174 4.338 -0.816 1.00 0.00 H new ATOM 0 HA ILE A 263 -7.408 4.269 -0.819 1.00 0.00 H new ATOM 0 HB ILE A 263 -9.539 4.626 -2.921 1.00 0.00 H new ATOM 0 HG12 ILE A 263 -7.419 2.510 -2.417 1.00 0.00 H new ATOM 0 HG13 ILE A 263 -9.103 2.404 -1.943 1.00 0.00 H new ATOM 0 HG21 ILE A 263 -7.842 4.548 -4.703 1.00 0.00 H new ATOM 0 HG22 ILE A 263 -7.716 6.030 -3.726 1.00 0.00 H new ATOM 0 HG23 ILE A 263 -6.559 4.700 -3.480 1.00 0.00 H new ATOM 0 HD11 ILE A 263 -8.684 1.118 -3.983 1.00 0.00 H new ATOM 0 HD12 ILE A 263 -9.789 2.473 -4.316 1.00 0.00 H new ATOM 0 HD13 ILE A 263 -8.079 2.580 -4.797 1.00 0.00 H new ATOM 148 N ARG A 264 -8.593 7.229 -1.751 1.00 0.00 N ATOM 149 CA ARG A 264 -8.221 8.634 -1.894 1.00 0.00 C ATOM 150 C ARG A 264 -7.769 9.228 -0.568 1.00 0.00 C ATOM 151 O ARG A 264 -6.803 9.986 -0.530 1.00 0.00 O ATOM 152 CB ARG A 264 -9.370 9.451 -2.472 1.00 0.00 C ATOM 153 CG ARG A 264 -10.654 9.362 -1.664 1.00 0.00 C ATOM 154 CD ARG A 264 -11.792 10.121 -2.329 1.00 0.00 C ATOM 155 NE ARG A 264 -11.498 11.545 -2.469 1.00 0.00 N ATOM 156 CZ ARG A 264 -12.349 12.425 -2.987 1.00 0.00 C ATOM 157 NH1 ARG A 264 -13.546 12.030 -3.403 1.00 0.00 N ATOM 158 NH2 ARG A 264 -12.007 13.702 -3.085 1.00 0.00 N ATOM 0 H ARG A 264 -9.568 7.023 -1.969 1.00 0.00 H new ATOM 0 HA ARG A 264 -7.382 8.676 -2.589 1.00 0.00 H new ATOM 0 HB2 ARG A 264 -9.064 10.495 -2.537 1.00 0.00 H new ATOM 0 HB3 ARG A 264 -9.568 9.113 -3.489 1.00 0.00 H new ATOM 0 HG2 ARG A 264 -10.936 8.316 -1.543 1.00 0.00 H new ATOM 0 HG3 ARG A 264 -10.484 9.764 -0.665 1.00 0.00 H new ATOM 0 HD2 ARG A 264 -11.986 9.693 -3.313 1.00 0.00 H new ATOM 0 HD3 ARG A 264 -12.702 9.996 -1.742 1.00 0.00 H new ATOM 0 HE ARG A 264 -10.589 11.883 -2.152 1.00 0.00 H new ATOM 0 HH11 ARG A 264 -13.815 11.049 -3.326 1.00 0.00 H new ATOM 0 HH12 ARG A 264 -14.197 12.707 -3.800 1.00 0.00 H new ATOM 0 HH21 ARG A 264 -11.090 14.010 -2.763 1.00 0.00 H new ATOM 0 HH22 ARG A 264 -12.661 14.376 -3.483 1.00 0.00 H new ATOM 172 N LYS A 265 -8.450 8.877 0.522 1.00 0.00 N ATOM 173 CA LYS A 265 -8.063 9.385 1.833 1.00 0.00 C ATOM 174 C LYS A 265 -6.599 9.065 2.073 1.00 0.00 C ATOM 175 O LYS A 265 -5.818 9.919 2.498 1.00 0.00 O ATOM 176 CB LYS A 265 -8.919 8.765 2.937 1.00 0.00 C ATOM 177 CG LYS A 265 -10.353 9.264 2.956 1.00 0.00 C ATOM 178 CD LYS A 265 -11.145 8.630 4.088 1.00 0.00 C ATOM 179 CE LYS A 265 -12.527 9.250 4.214 1.00 0.00 C ATOM 180 NZ LYS A 265 -13.330 8.603 5.287 1.00 0.00 N ATOM 0 H LYS A 265 -9.258 8.254 0.523 1.00 0.00 H new ATOM 0 HA LYS A 265 -8.219 10.464 1.854 1.00 0.00 H new ATOM 0 HB2 LYS A 265 -8.923 7.682 2.815 1.00 0.00 H new ATOM 0 HB3 LYS A 265 -8.458 8.976 3.902 1.00 0.00 H new ATOM 0 HG2 LYS A 265 -10.361 10.348 3.067 1.00 0.00 H new ATOM 0 HG3 LYS A 265 -10.832 9.037 2.003 1.00 0.00 H new ATOM 0 HD2 LYS A 265 -11.240 7.559 3.912 1.00 0.00 H new ATOM 0 HD3 LYS A 265 -10.603 8.752 5.026 1.00 0.00 H new ATOM 0 HE2 LYS A 265 -12.429 10.315 4.426 1.00 0.00 H new ATOM 0 HE3 LYS A 265 -13.053 9.161 3.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 -14.265 9.054 5.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 -13.445 7.592 5.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 -12.841 8.710 6.199 1.00 0.00 H new ATOM 194 N ALA A 266 -6.234 7.829 1.758 1.00 0.00 N ATOM 195 CA ALA A 266 -4.863 7.376 1.895 1.00 0.00 C ATOM 196 C ALA A 266 -3.969 8.154 0.938 1.00 0.00 C ATOM 197 O ALA A 266 -2.820 8.465 1.253 1.00 0.00 O ATOM 198 CB ALA A 266 -4.777 5.882 1.622 1.00 0.00 C ATOM 0 H ALA A 266 -6.876 7.120 1.404 1.00 0.00 H new ATOM 0 HA ALA A 266 -4.522 7.556 2.915 1.00 0.00 H new ATOM 0 HB1 ALA A 266 -3.744 5.552 1.727 1.00 0.00 H new ATOM 0 HB2 ALA A 266 -5.404 5.345 2.334 1.00 0.00 H new ATOM 0 HB3 ALA A 266 -5.122 5.677 0.609 1.00 0.00 H new ATOM 204 N ILE A 267 -4.517 8.472 -0.234 1.00 0.00 N ATOM 205 CA ILE A 267 -3.786 9.223 -1.245 1.00 0.00 C ATOM 206 C ILE A 267 -3.419 10.613 -0.733 1.00 0.00 C ATOM 207 O ILE A 267 -2.289 11.074 -0.907 1.00 0.00 O ATOM 208 CB ILE A 267 -4.594 9.349 -2.554 1.00 0.00 C ATOM 209 CG1 ILE A 267 -4.804 7.963 -3.170 1.00 0.00 C ATOM 210 CG2 ILE A 267 -3.881 10.272 -3.535 1.00 0.00 C ATOM 211 CD1 ILE A 267 -5.643 7.969 -4.429 1.00 0.00 C ATOM 0 H ILE A 267 -5.467 8.219 -0.504 1.00 0.00 H new ATOM 0 HA ILE A 267 -2.872 8.668 -1.457 1.00 0.00 H new ATOM 0 HB ILE A 267 -5.568 9.784 -2.328 1.00 0.00 H new ATOM 0 HG12 ILE A 267 -3.831 7.526 -3.396 1.00 0.00 H new ATOM 0 HG13 ILE A 267 -5.280 7.317 -2.432 1.00 0.00 H new ATOM 0 HG21 ILE A 267 -4.465 10.349 -4.452 1.00 0.00 H new ATOM 0 HG22 ILE A 267 -3.772 11.261 -3.090 1.00 0.00 H new ATOM 0 HG23 ILE A 267 -2.896 9.867 -3.765 1.00 0.00 H new ATOM 0 HD11 ILE A 267 -5.745 6.950 -4.803 1.00 0.00 H new ATOM 0 HD12 ILE A 267 -6.630 8.374 -4.207 1.00 0.00 H new ATOM 0 HD13 ILE A 267 -5.159 8.587 -5.186 1.00 0.00 H new ATOM 223 N GLU A 268 -4.381 11.271 -0.093 1.00 0.00 N ATOM 224 CA GLU A 268 -4.166 12.604 0.453 1.00 0.00 C ATOM 225 C GLU A 268 -3.114 12.564 1.557 1.00 0.00 C ATOM 226 O GLU A 268 -2.241 13.430 1.626 1.00 0.00 O ATOM 227 CB GLU A 268 -5.477 13.174 0.997 1.00 0.00 C ATOM 228 CG GLU A 268 -5.362 14.609 1.486 1.00 0.00 C ATOM 229 CD GLU A 268 -4.977 15.574 0.380 1.00 0.00 C ATOM 230 OE1 GLU A 268 -5.737 15.682 -0.605 1.00 0.00 O ATOM 231 OE2 GLU A 268 -3.915 16.221 0.501 1.00 0.00 O ATOM 0 H GLU A 268 -5.319 10.900 0.060 1.00 0.00 H new ATOM 0 HA GLU A 268 -3.808 13.251 -0.348 1.00 0.00 H new ATOM 0 HB2 GLU A 268 -6.236 13.125 0.216 1.00 0.00 H new ATOM 0 HB3 GLU A 268 -5.823 12.546 1.818 1.00 0.00 H new ATOM 0 HG2 GLU A 268 -6.313 14.919 1.918 1.00 0.00 H new ATOM 0 HG3 GLU A 268 -4.619 14.659 2.282 1.00 0.00 H new ATOM 238 N LEU A 269 -3.204 11.552 2.417 1.00 0.00 N ATOM 239 CA LEU A 269 -2.257 11.398 3.517 1.00 0.00 C ATOM 240 C LEU A 269 -0.832 11.256 2.989 1.00 0.00 C ATOM 241 O LEU A 269 0.094 11.885 3.501 1.00 0.00 O ATOM 242 CB LEU A 269 -2.619 10.178 4.368 1.00 0.00 C ATOM 243 CG LEU A 269 -4.019 10.205 4.987 1.00 0.00 C ATOM 244 CD1 LEU A 269 -4.267 8.942 5.796 1.00 0.00 C ATOM 245 CD2 LEU A 269 -4.201 11.441 5.856 1.00 0.00 C ATOM 0 H LEU A 269 -3.921 10.828 2.373 1.00 0.00 H new ATOM 0 HA LEU A 269 -2.312 12.293 4.137 1.00 0.00 H new ATOM 0 HB2 LEU A 269 -2.530 9.285 3.750 1.00 0.00 H new ATOM 0 HB3 LEU A 269 -1.887 10.085 5.170 1.00 0.00 H new ATOM 0 HG LEU A 269 -4.749 10.247 4.179 1.00 0.00 H new ATOM 0 HD11 LEU A 269 -5.267 8.978 6.229 1.00 0.00 H new ATOM 0 HD12 LEU A 269 -4.184 8.071 5.146 1.00 0.00 H new ATOM 0 HD13 LEU A 269 -3.528 8.870 6.594 1.00 0.00 H new ATOM 0 HD21 LEU A 269 -5.203 11.439 6.286 1.00 0.00 H new ATOM 0 HD22 LEU A 269 -3.462 11.434 6.658 1.00 0.00 H new ATOM 0 HD23 LEU A 269 -4.068 12.336 5.248 1.00 0.00 H new ATOM 257 N SER A 270 -0.665 10.428 1.961 1.00 0.00 N ATOM 258 CA SER A 270 0.647 10.207 1.363 1.00 0.00 C ATOM 259 C SER A 270 1.221 11.512 0.825 1.00 0.00 C ATOM 260 O SER A 270 2.376 11.848 1.091 1.00 0.00 O ATOM 261 CB SER A 270 0.554 9.177 0.236 1.00 0.00 C ATOM 262 OG SER A 270 0.103 7.926 0.722 1.00 0.00 O ATOM 0 H SER A 270 -1.421 9.900 1.526 1.00 0.00 H new ATOM 0 HA SER A 270 1.312 9.826 2.138 1.00 0.00 H new ATOM 0 HB2 SER A 270 -0.127 9.538 -0.535 1.00 0.00 H new ATOM 0 HB3 SER A 270 1.531 9.057 -0.233 1.00 0.00 H new ATOM 0 HG SER A 270 0.051 7.287 -0.019 1.00 0.00 H new ATOM 268 N LEU A 271 0.406 12.247 0.074 1.00 0.00 N ATOM 269 CA LEU A 271 0.831 13.522 -0.494 1.00 0.00 C ATOM 270 C LEU A 271 1.237 14.489 0.612 1.00 0.00 C ATOM 271 O LEU A 271 2.192 15.252 0.466 1.00 0.00 O ATOM 272 CB LEU A 271 -0.290 14.133 -1.339 1.00 0.00 C ATOM 273 CG LEU A 271 -0.726 13.297 -2.546 1.00 0.00 C ATOM 274 CD1 LEU A 271 -1.889 13.965 -3.262 1.00 0.00 C ATOM 275 CD2 LEU A 271 0.440 13.088 -3.503 1.00 0.00 C ATOM 0 H LEU A 271 -0.552 11.982 -0.155 1.00 0.00 H new ATOM 0 HA LEU A 271 1.693 13.340 -1.135 1.00 0.00 H new ATOM 0 HB2 LEU A 271 -1.157 14.298 -0.699 1.00 0.00 H new ATOM 0 HB3 LEU A 271 0.036 15.111 -1.693 1.00 0.00 H new ATOM 0 HG LEU A 271 -1.054 12.321 -2.188 1.00 0.00 H new ATOM 0 HD11 LEU A 271 -2.187 13.358 -4.117 1.00 0.00 H new ATOM 0 HD12 LEU A 271 -2.731 14.063 -2.576 1.00 0.00 H new ATOM 0 HD13 LEU A 271 -1.585 14.953 -3.607 1.00 0.00 H new ATOM 0 HD21 LEU A 271 0.110 12.492 -4.354 1.00 0.00 H new ATOM 0 HD22 LEU A 271 0.800 14.055 -3.855 1.00 0.00 H new ATOM 0 HD23 LEU A 271 1.246 12.567 -2.986 1.00 0.00 H new ATOM 287 N LYS A 272 0.501 14.446 1.719 1.00 0.00 N ATOM 288 CA LYS A 272 0.774 15.310 2.861 1.00 0.00 C ATOM 289 C LYS A 272 2.192 15.079 3.375 1.00 0.00 C ATOM 290 O LYS A 272 2.931 16.028 3.636 1.00 0.00 O ATOM 291 CB LYS A 272 -0.255 15.046 3.969 1.00 0.00 C ATOM 292 CG LYS A 272 -0.245 16.071 5.098 1.00 0.00 C ATOM 293 CD LYS A 272 0.939 15.883 6.033 1.00 0.00 C ATOM 294 CE LYS A 272 0.925 16.903 7.161 1.00 0.00 C ATOM 295 NZ LYS A 272 -0.311 16.801 7.986 1.00 0.00 N ATOM 0 H LYS A 272 -0.293 13.818 1.849 1.00 0.00 H new ATOM 0 HA LYS A 272 0.693 16.351 2.548 1.00 0.00 H new ATOM 0 HB2 LYS A 272 -1.250 15.023 3.525 1.00 0.00 H new ATOM 0 HB3 LYS A 272 -0.071 14.058 4.391 1.00 0.00 H new ATOM 0 HG2 LYS A 272 -0.216 17.075 4.675 1.00 0.00 H new ATOM 0 HG3 LYS A 272 -1.171 15.992 5.667 1.00 0.00 H new ATOM 0 HD2 LYS A 272 0.918 14.876 6.451 1.00 0.00 H new ATOM 0 HD3 LYS A 272 1.867 15.975 5.469 1.00 0.00 H new ATOM 0 HE2 LYS A 272 1.799 16.754 7.796 1.00 0.00 H new ATOM 0 HE3 LYS A 272 1.001 17.907 6.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 272 -0.178 17.321 8.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 272 -1.112 17.210 7.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 272 -0.508 15.801 8.195 1.00 0.00 H new ATOM 309 N GLU A 273 2.566 13.810 3.512 1.00 0.00 N ATOM 310 CA GLU A 273 3.896 13.452 3.990 1.00 0.00 C ATOM 311 C GLU A 273 4.967 13.933 3.015 1.00 0.00 C ATOM 312 O GLU A 273 5.971 14.521 3.419 1.00 0.00 O ATOM 313 CB GLU A 273 4.004 11.935 4.170 1.00 0.00 C ATOM 314 CG GLU A 273 5.334 11.482 4.756 1.00 0.00 C ATOM 315 CD GLU A 273 5.559 11.982 6.172 1.00 0.00 C ATOM 316 OE1 GLU A 273 4.650 12.636 6.726 1.00 0.00 O ATOM 317 OE2 GLU A 273 6.644 11.714 6.729 1.00 0.00 O ATOM 0 H GLU A 273 1.966 13.013 3.299 1.00 0.00 H new ATOM 0 HA GLU A 273 4.055 13.939 4.952 1.00 0.00 H new ATOM 0 HB2 GLU A 273 3.197 11.597 4.819 1.00 0.00 H new ATOM 0 HB3 GLU A 273 3.859 11.452 3.204 1.00 0.00 H new ATOM 0 HG2 GLU A 273 5.375 10.393 4.750 1.00 0.00 H new ATOM 0 HG3 GLU A 273 6.145 11.835 4.119 1.00 0.00 H new ATOM 324 N SER A 274 4.743 13.672 1.731 1.00 0.00 N ATOM 325 CA SER A 274 5.680 14.068 0.685 1.00 0.00 C ATOM 326 C SER A 274 5.541 15.551 0.346 1.00 0.00 C ATOM 327 O SER A 274 5.281 15.910 -0.803 1.00 0.00 O ATOM 328 CB SER A 274 5.457 13.221 -0.571 1.00 0.00 C ATOM 329 OG SER A 274 4.143 13.390 -1.074 1.00 0.00 O ATOM 0 H SER A 274 3.915 13.185 1.388 1.00 0.00 H new ATOM 0 HA SER A 274 6.690 13.900 1.059 1.00 0.00 H new ATOM 0 HB2 SER A 274 6.181 13.501 -1.336 1.00 0.00 H new ATOM 0 HB3 SER A 274 5.629 12.170 -0.340 1.00 0.00 H new ATOM 0 HG SER A 274 3.978 14.341 -1.245 1.00 0.00 H new ATOM 335 N ARG A 275 5.714 16.409 1.349 1.00 0.00 N ATOM 336 CA ARG A 275 5.607 17.851 1.149 1.00 0.00 C ATOM 337 C ARG A 275 6.519 18.311 0.017 1.00 0.00 C ATOM 338 O ARG A 275 6.126 19.126 -0.819 1.00 0.00 O ATOM 339 CB ARG A 275 5.962 18.593 2.439 1.00 0.00 C ATOM 340 CG ARG A 275 5.062 18.239 3.612 1.00 0.00 C ATOM 341 CD ARG A 275 5.440 19.018 4.861 1.00 0.00 C ATOM 342 NE ARG A 275 4.575 18.687 5.990 1.00 0.00 N ATOM 343 CZ ARG A 275 4.688 19.239 7.194 1.00 0.00 C ATOM 344 NH1 ARG A 275 5.626 20.147 7.429 1.00 0.00 N ATOM 345 NH2 ARG A 275 3.862 18.883 8.168 1.00 0.00 N ATOM 0 H ARG A 275 5.928 16.131 2.307 1.00 0.00 H new ATOM 0 HA ARG A 275 4.577 18.080 0.878 1.00 0.00 H new ATOM 0 HB2 ARG A 275 6.995 18.369 2.704 1.00 0.00 H new ATOM 0 HB3 ARG A 275 5.904 19.666 2.259 1.00 0.00 H new ATOM 0 HG2 ARG A 275 4.024 18.449 3.352 1.00 0.00 H new ATOM 0 HG3 ARG A 275 5.130 17.170 3.814 1.00 0.00 H new ATOM 0 HD2 ARG A 275 6.476 18.805 5.123 1.00 0.00 H new ATOM 0 HD3 ARG A 275 5.377 20.087 4.656 1.00 0.00 H new ATOM 0 HE ARG A 275 3.842 17.992 5.847 1.00 0.00 H new ATOM 0 HH11 ARG A 275 6.265 20.425 6.684 1.00 0.00 H new ATOM 0 HH12 ARG A 275 5.708 20.567 8.355 1.00 0.00 H new ATOM 0 HH21 ARG A 275 3.139 18.185 7.994 1.00 0.00 H new ATOM 0 HH22 ARG A 275 3.950 19.307 9.091 1.00 0.00 H new ATOM 359 N ASN A 276 7.738 17.778 -0.005 1.00 0.00 N ATOM 360 CA ASN A 276 8.712 18.126 -1.033 1.00 0.00 C ATOM 361 C ASN A 276 9.953 17.245 -0.921 1.00 0.00 C ATOM 362 O ASN A 276 10.465 17.018 0.176 1.00 0.00 O ATOM 363 CB ASN A 276 9.107 19.601 -0.918 1.00 0.00 C ATOM 364 CG ASN A 276 10.086 20.023 -1.996 1.00 0.00 C ATOM 365 OD1 ASN A 276 9.786 19.945 -3.187 1.00 0.00 O ATOM 366 ND2 ASN A 276 11.265 20.472 -1.582 1.00 0.00 N ATOM 0 H ASN A 276 8.074 17.101 0.680 1.00 0.00 H new ATOM 0 HA ASN A 276 8.252 17.958 -2.007 1.00 0.00 H new ATOM 0 HB2 ASN A 276 8.212 20.220 -0.981 1.00 0.00 H new ATOM 0 HB3 ASN A 276 9.550 19.780 0.062 1.00 0.00 H new ATOM 0 HD21 ASN A 276 11.965 20.769 -2.262 1.00 0.00 H new ATOM 0 HD22 ASN A 276 11.471 20.520 -0.584 1.00 0.00 H new ATOM 373 N SER A 277 10.429 16.750 -2.060 1.00 0.00 N ATOM 374 CA SER A 277 11.608 15.890 -2.093 1.00 0.00 C ATOM 375 C SER A 277 12.204 15.841 -3.494 1.00 0.00 C ATOM 376 O SER A 277 13.420 15.937 -3.664 1.00 0.00 O ATOM 377 CB SER A 277 11.248 14.474 -1.637 1.00 0.00 C ATOM 378 OG SER A 277 10.757 14.472 -0.309 1.00 0.00 O ATOM 0 H SER A 277 10.015 16.930 -2.975 1.00 0.00 H new ATOM 0 HA SER A 277 12.349 16.309 -1.412 1.00 0.00 H new ATOM 0 HB2 SER A 277 10.497 14.054 -2.306 1.00 0.00 H new ATOM 0 HB3 SER A 277 12.127 13.833 -1.703 1.00 0.00 H new ATOM 0 HG SER A 277 10.907 15.352 0.096 1.00 0.00 H new ATOM 384 N ALA A 278 11.342 15.692 -4.494 1.00 0.00 N ATOM 385 CA ALA A 278 11.785 15.631 -5.882 1.00 0.00 C ATOM 386 C ALA A 278 12.489 16.922 -6.289 1.00 0.00 C ATOM 387 O ALA A 278 11.827 17.981 -6.288 1.00 0.00 O ATOM 388 CB ALA A 278 10.603 15.359 -6.801 1.00 0.00 C ATOM 389 OXT ALA A 278 13.696 16.862 -6.604 1.00 0.00 O ATOM 0 H ALA A 278 10.333 15.611 -4.369 1.00 0.00 H new ATOM 0 HA ALA A 278 12.499 14.813 -5.976 1.00 0.00 H new ATOM 0 HB1 ALA A 278 10.948 15.316 -7.834 1.00 0.00 H new ATOM 0 HB2 ALA A 278 10.144 14.408 -6.532 1.00 0.00 H new ATOM 0 HB3 ALA A 278 9.869 16.158 -6.696 1.00 0.00 H new TER 395 ALA A 278 ATOM 396 N MET B 1 14.907 -3.883 2.558 1.00 0.00 N ATOM 397 CA MET B 1 14.434 -2.814 3.476 1.00 0.00 C ATOM 398 C MET B 1 13.022 -3.101 3.982 1.00 0.00 C ATOM 399 O MET B 1 12.133 -3.460 3.208 1.00 0.00 O ATOM 400 CB MET B 1 14.467 -1.480 2.729 1.00 0.00 C ATOM 401 CG MET B 1 13.636 -1.474 1.456 1.00 0.00 C ATOM 402 SD MET B 1 13.674 0.116 0.607 1.00 0.00 S ATOM 403 CE MET B 1 12.641 -0.238 -0.813 1.00 0.00 C ATOM 0 H1 MET B 1 15.825 -3.611 2.152 1.00 0.00 H new ATOM 0 H2 MET B 1 15.012 -4.773 3.086 1.00 0.00 H new ATOM 0 H3 MET B 1 14.215 -4.014 1.792 1.00 0.00 H new ATOM 0 HA MET B 1 15.090 -2.775 4.345 1.00 0.00 H new ATOM 0 HB2 MET B 1 14.107 -0.693 3.392 1.00 0.00 H new ATOM 0 HB3 MET B 1 15.500 -1.238 2.480 1.00 0.00 H new ATOM 0 HG2 MET B 1 14.004 -2.249 0.784 1.00 0.00 H new ATOM 0 HG3 MET B 1 12.604 -1.727 1.700 1.00 0.00 H new ATOM 0 HE1 MET B 1 12.666 0.607 -1.501 1.00 0.00 H new ATOM 0 HE2 MET B 1 13.012 -1.129 -1.319 1.00 0.00 H new ATOM 0 HE3 MET B 1 11.616 -0.408 -0.484 1.00 0.00 H new ATOM 415 N GLN B 2 12.825 -2.941 5.286 1.00 0.00 N ATOM 416 CA GLN B 2 11.524 -3.180 5.903 1.00 0.00 C ATOM 417 C GLN B 2 10.632 -1.944 5.806 1.00 0.00 C ATOM 418 O GLN B 2 11.107 -0.812 5.901 1.00 0.00 O ATOM 419 CB GLN B 2 11.697 -3.591 7.366 1.00 0.00 C ATOM 420 CG GLN B 2 12.470 -2.580 8.196 1.00 0.00 C ATOM 421 CD GLN B 2 12.649 -3.022 9.635 1.00 0.00 C ATOM 422 OE1 GLN B 2 13.231 -4.073 9.906 1.00 0.00 O ATOM 423 NE2 GLN B 2 12.149 -2.220 10.567 1.00 0.00 N ATOM 0 H GLN B 2 13.551 -2.646 5.938 1.00 0.00 H new ATOM 0 HA GLN B 2 11.039 -3.992 5.361 1.00 0.00 H new ATOM 0 HB2 GLN B 2 10.713 -3.738 7.812 1.00 0.00 H new ATOM 0 HB3 GLN B 2 12.212 -4.551 7.406 1.00 0.00 H new ATOM 0 HG2 GLN B 2 13.449 -2.418 7.745 1.00 0.00 H new ATOM 0 HG3 GLN B 2 11.948 -1.624 8.176 1.00 0.00 H new ATOM 0 HE21 GLN B 2 11.674 -1.358 10.297 1.00 0.00 H new ATOM 0 HE22 GLN B 2 12.240 -2.465 11.553 1.00 0.00 H new ATOM 432 N ILE B 3 9.334 -2.174 5.622 1.00 0.00 N ATOM 433 CA ILE B 3 8.364 -1.088 5.518 1.00 0.00 C ATOM 434 C ILE B 3 7.068 -1.452 6.237 1.00 0.00 C ATOM 435 O ILE B 3 6.625 -2.600 6.192 1.00 0.00 O ATOM 436 CB ILE B 3 8.042 -0.744 4.049 1.00 0.00 C ATOM 437 CG1 ILE B 3 7.465 -1.966 3.329 1.00 0.00 C ATOM 438 CG2 ILE B 3 9.289 -0.235 3.339 1.00 0.00 C ATOM 439 CD1 ILE B 3 7.012 -1.681 1.913 1.00 0.00 C ATOM 0 H ILE B 3 8.929 -3.107 5.542 1.00 0.00 H new ATOM 0 HA ILE B 3 8.816 -0.215 5.989 1.00 0.00 H new ATOM 0 HB ILE B 3 7.292 0.047 4.031 1.00 0.00 H new ATOM 0 HG12 ILE B 3 8.218 -2.754 3.308 1.00 0.00 H new ATOM 0 HG13 ILE B 3 6.620 -2.348 3.901 1.00 0.00 H new ATOM 0 HG21 ILE B 3 9.046 0.004 2.304 1.00 0.00 H new ATOM 0 HG22 ILE B 3 9.654 0.661 3.842 1.00 0.00 H new ATOM 0 HG23 ILE B 3 10.061 -1.004 3.363 1.00 0.00 H new ATOM 0 HD11 ILE B 3 6.615 -2.593 1.467 1.00 0.00 H new ATOM 0 HD12 ILE B 3 6.235 -0.916 1.926 1.00 0.00 H new ATOM 0 HD13 ILE B 3 7.859 -1.328 1.324 1.00 0.00 H new ATOM 451 N PHE B 4 6.469 -0.472 6.908 1.00 0.00 N ATOM 452 CA PHE B 4 5.227 -0.700 7.640 1.00 0.00 C ATOM 453 C PHE B 4 4.000 -0.582 6.744 1.00 0.00 C ATOM 454 O PHE B 4 3.889 0.340 5.935 1.00 0.00 O ATOM 455 CB PHE B 4 5.087 0.280 8.806 1.00 0.00 C ATOM 456 CG PHE B 4 5.846 -0.119 10.038 1.00 0.00 C ATOM 457 CD1 PHE B 4 7.178 0.228 10.197 1.00 0.00 C ATOM 458 CD2 PHE B 4 5.215 -0.827 11.050 1.00 0.00 C ATOM 459 CE1 PHE B 4 7.868 -0.128 11.340 1.00 0.00 C ATOM 460 CE2 PHE B 4 5.898 -1.185 12.195 1.00 0.00 C ATOM 461 CZ PHE B 4 7.227 -0.835 12.341 1.00 0.00 C ATOM 0 H PHE B 4 6.822 0.484 6.960 1.00 0.00 H new ATOM 0 HA PHE B 4 5.280 -1.720 8.022 1.00 0.00 H new ATOM 0 HB2 PHE B 4 5.430 1.263 8.483 1.00 0.00 H new ATOM 0 HB3 PHE B 4 4.031 0.378 9.059 1.00 0.00 H new ATOM 0 HD1 PHE B 4 7.682 0.783 9.419 1.00 0.00 H new ATOM 0 HD2 PHE B 4 4.176 -1.102 10.941 1.00 0.00 H new ATOM 0 HE1 PHE B 4 8.907 0.146 11.452 1.00 0.00 H new ATOM 0 HE2 PHE B 4 5.395 -1.737 12.975 1.00 0.00 H new ATOM 0 HZ PHE B 4 7.764 -1.113 13.236 1.00 0.00 H new ATOM 471 N VAL B 5 3.065 -1.509 6.925 1.00 0.00 N ATOM 472 CA VAL B 5 1.819 -1.504 6.172 1.00 0.00 C ATOM 473 C VAL B 5 0.690 -1.007 7.067 1.00 0.00 C ATOM 474 O VAL B 5 0.407 -1.605 8.105 1.00 0.00 O ATOM 475 CB VAL B 5 1.471 -2.909 5.642 1.00 0.00 C ATOM 476 CG1 VAL B 5 0.169 -2.881 4.855 1.00 0.00 C ATOM 477 CG2 VAL B 5 2.606 -3.456 4.790 1.00 0.00 C ATOM 0 H VAL B 5 3.149 -2.277 7.591 1.00 0.00 H new ATOM 0 HA VAL B 5 1.944 -0.841 5.316 1.00 0.00 H new ATOM 0 HB VAL B 5 1.336 -3.573 6.496 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -0.057 -3.883 4.490 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -0.639 -2.539 5.501 1.00 0.00 H new ATOM 0 HG13 VAL B 5 0.270 -2.201 4.009 1.00 0.00 H new ATOM 0 HG21 VAL B 5 2.341 -4.448 4.425 1.00 0.00 H new ATOM 0 HG22 VAL B 5 2.778 -2.792 3.943 1.00 0.00 H new ATOM 0 HG23 VAL B 5 3.513 -3.520 5.390 1.00 0.00 H new ATOM 487 N LYS B 6 0.062 0.098 6.675 1.00 0.00 N ATOM 488 CA LYS B 6 -1.019 0.681 7.464 1.00 0.00 C ATOM 489 C LYS B 6 -2.333 0.709 6.691 1.00 0.00 C ATOM 490 O LYS B 6 -2.374 1.098 5.523 1.00 0.00 O ATOM 491 CB LYS B 6 -0.643 2.101 7.893 1.00 0.00 C ATOM 492 CG LYS B 6 -1.733 2.810 8.681 1.00 0.00 C ATOM 493 CD LYS B 6 -1.332 4.234 9.030 1.00 0.00 C ATOM 494 CE LYS B 6 -2.422 4.939 9.819 1.00 0.00 C ATOM 495 NZ LYS B 6 -2.707 4.248 11.106 1.00 0.00 N ATOM 0 H LYS B 6 0.282 0.606 5.819 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.162 0.054 8.344 1.00 0.00 H new ATOM 0 HB2 LYS B 6 0.263 2.060 8.498 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -0.407 2.689 7.006 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -2.654 2.823 8.099 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -1.942 2.255 9.596 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -0.410 4.222 9.611 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -1.125 4.790 8.116 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -2.120 5.967 10.018 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -3.332 4.984 9.221 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -3.444 4.768 11.624 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -3.036 3.280 10.915 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -1.841 4.212 11.680 1.00 0.00 H new ATOM 509 N THR B 7 -3.410 0.305 7.360 1.00 0.00 N ATOM 510 CA THR B 7 -4.734 0.295 6.749 1.00 0.00 C ATOM 511 C THR B 7 -5.438 1.636 6.963 1.00 0.00 C ATOM 512 O THR B 7 -4.785 2.669 7.115 1.00 0.00 O ATOM 513 CB THR B 7 -5.609 -0.836 7.324 1.00 0.00 C ATOM 514 OG1 THR B 7 -5.790 -0.648 8.732 1.00 0.00 O ATOM 515 CG2 THR B 7 -4.977 -2.196 7.068 1.00 0.00 C ATOM 0 H THR B 7 -3.390 -0.020 8.327 1.00 0.00 H new ATOM 0 HA THR B 7 -4.597 0.123 5.681 1.00 0.00 H new ATOM 0 HB THR B 7 -6.577 -0.803 6.825 1.00 0.00 H new ATOM 0 HG1 THR B 7 -6.348 -1.370 9.089 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.614 -2.977 7.483 1.00 0.00 H new ATOM 0 HG22 THR B 7 -4.867 -2.350 5.995 1.00 0.00 H new ATOM 0 HG23 THR B 7 -3.997 -2.237 7.542 1.00 0.00 H new ATOM 523 N LEU B 8 -6.769 1.614 6.981 1.00 0.00 N ATOM 524 CA LEU B 8 -7.555 2.828 7.186 1.00 0.00 C ATOM 525 C LEU B 8 -7.877 3.030 8.663 1.00 0.00 C ATOM 526 O LEU B 8 -7.833 4.151 9.171 1.00 0.00 O ATOM 527 CB LEU B 8 -8.854 2.780 6.373 1.00 0.00 C ATOM 528 CG LEU B 8 -8.695 2.932 4.856 1.00 0.00 C ATOM 529 CD1 LEU B 8 -8.027 4.257 4.513 1.00 0.00 C ATOM 530 CD2 LEU B 8 -7.909 1.768 4.274 1.00 0.00 C ATOM 0 H LEU B 8 -7.326 0.768 6.856 1.00 0.00 H new ATOM 0 HA LEU B 8 -6.955 3.670 6.842 1.00 0.00 H new ATOM 0 HB2 LEU B 8 -9.352 1.832 6.574 1.00 0.00 H new ATOM 0 HB3 LEU B 8 -9.515 3.569 6.731 1.00 0.00 H new ATOM 0 HG LEU B 8 -9.690 2.926 4.410 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -7.924 4.343 3.431 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -8.637 5.079 4.886 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -7.041 4.298 4.975 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -7.810 1.899 3.196 1.00 0.00 H new ATOM 0 HD22 LEU B 8 -6.919 1.734 4.728 1.00 0.00 H new ATOM 0 HD23 LEU B 8 -8.434 0.835 4.479 1.00 0.00 H new ATOM 542 N THR B 9 -8.216 1.939 9.343 1.00 0.00 N ATOM 543 CA THR B 9 -8.561 1.995 10.759 1.00 0.00 C ATOM 544 C THR B 9 -7.392 2.498 11.601 1.00 0.00 C ATOM 545 O THR B 9 -7.551 3.408 12.415 1.00 0.00 O ATOM 546 CB THR B 9 -8.994 0.611 11.281 1.00 0.00 C ATOM 547 OG1 THR B 9 -10.104 0.126 10.518 1.00 0.00 O ATOM 548 CG2 THR B 9 -9.378 0.677 12.752 1.00 0.00 C ATOM 0 H THR B 9 -8.259 1.005 8.936 1.00 0.00 H new ATOM 0 HA THR B 9 -9.392 2.694 10.852 1.00 0.00 H new ATOM 0 HB THR B 9 -8.150 -0.070 11.174 1.00 0.00 H new ATOM 0 HG1 THR B 9 -10.372 -0.754 10.854 1.00 0.00 H new ATOM 0 HG21 THR B 9 -9.679 -0.313 13.094 1.00 0.00 H new ATOM 0 HG22 THR B 9 -8.523 1.018 13.336 1.00 0.00 H new ATOM 0 HG23 THR B 9 -10.207 1.373 12.881 1.00 0.00 H new ATOM 556 N GLY B 10 -6.220 1.901 11.407 1.00 0.00 N ATOM 557 CA GLY B 10 -5.052 2.309 12.167 1.00 0.00 C ATOM 558 C GLY B 10 -3.991 1.229 12.237 1.00 0.00 C ATOM 559 O GLY B 10 -2.806 1.525 12.394 1.00 0.00 O ATOM 0 H GLY B 10 -6.058 1.146 10.741 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -4.624 3.204 11.715 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -5.358 2.578 13.178 1.00 0.00 H new ATOM 563 N LYS B 11 -4.423 -0.025 12.137 1.00 0.00 N ATOM 564 CA LYS B 11 -3.515 -1.166 12.204 1.00 0.00 C ATOM 565 C LYS B 11 -2.303 -0.969 11.295 1.00 0.00 C ATOM 566 O LYS B 11 -2.429 -0.495 10.164 1.00 0.00 O ATOM 567 CB LYS B 11 -4.252 -2.450 11.817 1.00 0.00 C ATOM 568 CG LYS B 11 -3.439 -3.714 12.053 1.00 0.00 C ATOM 569 CD LYS B 11 -3.156 -3.925 13.531 1.00 0.00 C ATOM 570 CE LYS B 11 -2.285 -5.148 13.765 1.00 0.00 C ATOM 571 NZ LYS B 11 -2.919 -6.394 13.251 1.00 0.00 N ATOM 0 H LYS B 11 -5.403 -0.278 12.008 1.00 0.00 H new ATOM 0 HA LYS B 11 -3.158 -1.248 13.231 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -5.179 -2.513 12.387 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -4.528 -2.397 10.764 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -3.979 -4.575 11.658 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -2.498 -3.650 11.507 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -2.662 -3.042 13.937 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -4.097 -4.039 14.069 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -1.321 -5.005 13.277 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -2.090 -5.255 14.832 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -2.387 -7.220 13.592 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -3.900 -6.450 13.590 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -2.913 -6.383 12.211 1.00 0.00 H new ATOM 585 N THR B 12 -1.130 -1.339 11.804 1.00 0.00 N ATOM 586 CA THR B 12 0.114 -1.210 11.052 1.00 0.00 C ATOM 587 C THR B 12 1.100 -2.302 11.458 1.00 0.00 C ATOM 588 O THR B 12 1.220 -2.624 12.641 1.00 0.00 O ATOM 589 CB THR B 12 0.763 0.169 11.274 1.00 0.00 C ATOM 590 OG1 THR B 12 -0.173 1.207 10.962 1.00 0.00 O ATOM 591 CG2 THR B 12 2.005 0.327 10.410 1.00 0.00 C ATOM 0 H THR B 12 -1.016 -1.732 12.738 1.00 0.00 H new ATOM 0 HA THR B 12 -0.131 -1.314 9.995 1.00 0.00 H new ATOM 0 HB THR B 12 1.054 0.244 12.322 1.00 0.00 H new ATOM 0 HG1 THR B 12 0.247 2.081 11.107 1.00 0.00 H new ATOM 0 HG21 THR B 12 2.446 1.308 10.583 1.00 0.00 H new ATOM 0 HG22 THR B 12 2.728 -0.447 10.667 1.00 0.00 H new ATOM 0 HG23 THR B 12 1.732 0.233 9.359 1.00 0.00 H new ATOM 599 N ILE B 13 1.794 -2.881 10.477 1.00 0.00 N ATOM 600 CA ILE B 13 2.752 -3.953 10.755 1.00 0.00 C ATOM 601 C ILE B 13 3.938 -3.939 9.793 1.00 0.00 C ATOM 602 O ILE B 13 3.786 -3.695 8.597 1.00 0.00 O ATOM 603 CB ILE B 13 2.071 -5.337 10.685 1.00 0.00 C ATOM 604 CG1 ILE B 13 1.085 -5.499 11.842 1.00 0.00 C ATOM 605 CG2 ILE B 13 3.109 -6.453 10.700 1.00 0.00 C ATOM 606 CD1 ILE B 13 0.352 -6.819 11.831 1.00 0.00 C ATOM 0 H ILE B 13 1.713 -2.629 9.492 1.00 0.00 H new ATOM 0 HA ILE B 13 3.124 -3.772 11.764 1.00 0.00 H new ATOM 0 HB ILE B 13 1.520 -5.404 9.747 1.00 0.00 H new ATOM 0 HG12 ILE B 13 1.624 -5.400 12.784 1.00 0.00 H new ATOM 0 HG13 ILE B 13 0.357 -4.688 11.804 1.00 0.00 H new ATOM 0 HG21 ILE B 13 2.606 -7.419 10.650 1.00 0.00 H new ATOM 0 HG22 ILE B 13 3.772 -6.345 9.842 1.00 0.00 H new ATOM 0 HG23 ILE B 13 3.692 -6.395 11.619 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -0.330 -6.864 12.680 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -0.215 -6.913 10.905 1.00 0.00 H new ATOM 0 HD13 ILE B 13 1.071 -7.635 11.900 1.00 0.00 H new ATOM 618 N THR B 14 5.120 -4.221 10.337 1.00 0.00 N ATOM 619 CA THR B 14 6.351 -4.264 9.554 1.00 0.00 C ATOM 620 C THR B 14 6.290 -5.361 8.497 1.00 0.00 C ATOM 621 O THR B 14 5.681 -6.409 8.711 1.00 0.00 O ATOM 622 CB THR B 14 7.577 -4.523 10.454 1.00 0.00 C ATOM 623 OG1 THR B 14 7.631 -3.559 11.508 1.00 0.00 O ATOM 624 CG2 THR B 14 8.867 -4.464 9.649 1.00 0.00 C ATOM 0 H THR B 14 5.250 -4.425 11.328 1.00 0.00 H new ATOM 0 HA THR B 14 6.452 -3.292 9.071 1.00 0.00 H new ATOM 0 HB THR B 14 7.474 -5.521 10.879 1.00 0.00 H new ATOM 0 HG1 THR B 14 7.090 -2.779 11.266 1.00 0.00 H new ATOM 0 HG21 THR B 14 9.716 -4.650 10.307 1.00 0.00 H new ATOM 0 HG22 THR B 14 8.842 -5.222 8.866 1.00 0.00 H new ATOM 0 HG23 THR B 14 8.968 -3.478 9.196 1.00 0.00 H new ATOM 632 N LEU B 15 6.937 -5.119 7.362 1.00 0.00 N ATOM 633 CA LEU B 15 6.968 -6.095 6.280 1.00 0.00 C ATOM 634 C LEU B 15 8.241 -5.916 5.457 1.00 0.00 C ATOM 635 O LEU B 15 8.442 -4.885 4.816 1.00 0.00 O ATOM 636 CB LEU B 15 5.718 -5.944 5.401 1.00 0.00 C ATOM 637 CG LEU B 15 5.389 -7.133 4.485 1.00 0.00 C ATOM 638 CD1 LEU B 15 6.462 -7.327 3.426 1.00 0.00 C ATOM 639 CD2 LEU B 15 5.212 -8.403 5.304 1.00 0.00 C ATOM 0 H LEU B 15 7.446 -4.257 7.168 1.00 0.00 H new ATOM 0 HA LEU B 15 6.969 -7.101 6.700 1.00 0.00 H new ATOM 0 HB2 LEU B 15 4.861 -5.764 6.051 1.00 0.00 H new ATOM 0 HB3 LEU B 15 5.840 -5.056 4.781 1.00 0.00 H new ATOM 0 HG LEU B 15 4.451 -6.913 3.974 1.00 0.00 H new ATOM 0 HD11 LEU B 15 6.200 -8.176 2.794 1.00 0.00 H new ATOM 0 HD12 LEU B 15 6.536 -6.428 2.814 1.00 0.00 H new ATOM 0 HD13 LEU B 15 7.420 -7.517 3.909 1.00 0.00 H new ATOM 0 HD21 LEU B 15 4.979 -9.235 4.639 1.00 0.00 H new ATOM 0 HD22 LEU B 15 6.133 -8.618 5.846 1.00 0.00 H new ATOM 0 HD23 LEU B 15 4.396 -8.267 6.014 1.00 0.00 H new ATOM 651 N GLU B 16 9.105 -6.928 5.496 1.00 0.00 N ATOM 652 CA GLU B 16 10.373 -6.891 4.774 1.00 0.00 C ATOM 653 C GLU B 16 10.165 -6.976 3.266 1.00 0.00 C ATOM 654 O GLU B 16 9.422 -7.828 2.779 1.00 0.00 O ATOM 655 CB GLU B 16 11.275 -8.038 5.237 1.00 0.00 C ATOM 656 CG GLU B 16 12.619 -8.084 4.527 1.00 0.00 C ATOM 657 CD GLU B 16 13.433 -6.821 4.733 1.00 0.00 C ATOM 658 OE1 GLU B 16 13.739 -6.496 5.899 1.00 0.00 O ATOM 659 OE2 GLU B 16 13.764 -6.159 3.728 1.00 0.00 O ATOM 0 H GLU B 16 8.948 -7.787 6.023 1.00 0.00 H new ATOM 0 HA GLU B 16 10.851 -5.937 4.995 1.00 0.00 H new ATOM 0 HB2 GLU B 16 11.444 -7.945 6.310 1.00 0.00 H new ATOM 0 HB3 GLU B 16 10.757 -8.983 5.076 1.00 0.00 H new ATOM 0 HG2 GLU B 16 13.187 -8.941 4.889 1.00 0.00 H new ATOM 0 HG3 GLU B 16 12.457 -8.237 3.460 1.00 0.00 H new ATOM 666 N VAL B 17 10.840 -6.092 2.533 1.00 0.00 N ATOM 667 CA VAL B 17 10.746 -6.065 1.076 1.00 0.00 C ATOM 668 C VAL B 17 12.037 -5.550 0.445 1.00 0.00 C ATOM 669 O VAL B 17 12.506 -4.456 0.761 1.00 0.00 O ATOM 670 CB VAL B 17 9.573 -5.185 0.596 1.00 0.00 C ATOM 671 CG1 VAL B 17 8.242 -5.820 0.962 1.00 0.00 C ATOM 672 CG2 VAL B 17 9.677 -3.785 1.183 1.00 0.00 C ATOM 0 H VAL B 17 11.459 -5.384 2.926 1.00 0.00 H new ATOM 0 HA VAL B 17 10.573 -7.094 0.760 1.00 0.00 H new ATOM 0 HB VAL B 17 9.628 -5.106 -0.490 1.00 0.00 H new ATOM 0 HG11 VAL B 17 7.428 -5.184 0.615 1.00 0.00 H new ATOM 0 HG12 VAL B 17 8.164 -6.799 0.490 1.00 0.00 H new ATOM 0 HG13 VAL B 17 8.178 -5.933 2.044 1.00 0.00 H new ATOM 0 HG21 VAL B 17 8.841 -3.180 0.832 1.00 0.00 H new ATOM 0 HG22 VAL B 17 9.651 -3.844 2.271 1.00 0.00 H new ATOM 0 HG23 VAL B 17 10.614 -3.326 0.867 1.00 0.00 H new ATOM 682 N GLU B 18 12.605 -6.347 -0.454 1.00 0.00 N ATOM 683 CA GLU B 18 13.840 -5.978 -1.138 1.00 0.00 C ATOM 684 C GLU B 18 13.552 -5.056 -2.317 1.00 0.00 C ATOM 685 O GLU B 18 12.509 -5.165 -2.960 1.00 0.00 O ATOM 686 CB GLU B 18 14.577 -7.229 -1.618 1.00 0.00 C ATOM 687 CG GLU B 18 14.970 -8.171 -0.492 1.00 0.00 C ATOM 688 CD GLU B 18 15.888 -7.516 0.522 1.00 0.00 C ATOM 689 OE1 GLU B 18 16.989 -7.076 0.129 1.00 0.00 O ATOM 690 OE2 GLU B 18 15.505 -7.441 1.708 1.00 0.00 O ATOM 0 H GLU B 18 12.229 -7.255 -0.727 1.00 0.00 H new ATOM 0 HA GLU B 18 14.474 -5.444 -0.430 1.00 0.00 H new ATOM 0 HB2 GLU B 18 13.944 -7.765 -2.325 1.00 0.00 H new ATOM 0 HB3 GLU B 18 15.474 -6.927 -2.159 1.00 0.00 H new ATOM 0 HG2 GLU B 18 14.070 -8.524 0.012 1.00 0.00 H new ATOM 0 HG3 GLU B 18 15.464 -9.047 -0.912 1.00 0.00 H new ATOM 697 N SER B 19 14.482 -4.148 -2.597 1.00 0.00 N ATOM 698 CA SER B 19 14.324 -3.209 -3.703 1.00 0.00 C ATOM 699 C SER B 19 13.994 -3.948 -4.998 1.00 0.00 C ATOM 700 O SER B 19 13.113 -3.536 -5.753 1.00 0.00 O ATOM 701 CB SER B 19 15.600 -2.383 -3.884 1.00 0.00 C ATOM 702 OG SER B 19 15.461 -1.456 -4.946 1.00 0.00 O ATOM 0 H SER B 19 15.352 -4.042 -2.074 1.00 0.00 H new ATOM 0 HA SER B 19 13.497 -2.539 -3.466 1.00 0.00 H new ATOM 0 HB2 SER B 19 15.827 -1.851 -2.960 1.00 0.00 H new ATOM 0 HB3 SER B 19 16.441 -3.047 -4.084 1.00 0.00 H new ATOM 0 HG SER B 19 16.289 -0.940 -5.040 1.00 0.00 H new ATOM 708 N SER B 20 14.704 -5.045 -5.242 1.00 0.00 N ATOM 709 CA SER B 20 14.490 -5.852 -6.439 1.00 0.00 C ATOM 710 C SER B 20 13.133 -6.550 -6.391 1.00 0.00 C ATOM 711 O SER B 20 12.494 -6.756 -7.423 1.00 0.00 O ATOM 712 CB SER B 20 15.604 -6.890 -6.585 1.00 0.00 C ATOM 713 OG SER B 20 15.420 -7.676 -7.749 1.00 0.00 O ATOM 0 H SER B 20 15.435 -5.397 -4.624 1.00 0.00 H new ATOM 0 HA SER B 20 14.506 -5.187 -7.302 1.00 0.00 H new ATOM 0 HB2 SER B 20 16.570 -6.387 -6.631 1.00 0.00 H new ATOM 0 HB3 SER B 20 15.622 -7.535 -5.706 1.00 0.00 H new ATOM 0 HG SER B 20 16.146 -8.331 -7.820 1.00 0.00 H new ATOM 719 N ASP B 21 12.707 -6.917 -5.184 1.00 0.00 N ATOM 720 CA ASP B 21 11.431 -7.601 -4.988 1.00 0.00 C ATOM 721 C ASP B 21 10.293 -6.852 -5.680 1.00 0.00 C ATOM 722 O ASP B 21 10.134 -5.643 -5.511 1.00 0.00 O ATOM 723 CB ASP B 21 11.140 -7.744 -3.490 1.00 0.00 C ATOM 724 CG ASP B 21 9.865 -8.511 -3.207 1.00 0.00 C ATOM 725 OD1 ASP B 21 8.781 -8.014 -3.572 1.00 0.00 O ATOM 726 OD2 ASP B 21 9.951 -9.610 -2.619 1.00 0.00 O ATOM 0 H ASP B 21 13.230 -6.751 -4.324 1.00 0.00 H new ATOM 0 HA ASP B 21 11.501 -8.592 -5.435 1.00 0.00 H new ATOM 0 HB2 ASP B 21 11.977 -8.251 -3.009 1.00 0.00 H new ATOM 0 HB3 ASP B 21 11.068 -6.753 -3.043 1.00 0.00 H new ATOM 731 N THR B 22 9.510 -7.585 -6.468 1.00 0.00 N ATOM 732 CA THR B 22 8.387 -7.009 -7.203 1.00 0.00 C ATOM 733 C THR B 22 7.185 -6.769 -6.294 1.00 0.00 C ATOM 734 O THR B 22 6.994 -7.478 -5.308 1.00 0.00 O ATOM 735 CB THR B 22 7.958 -7.923 -8.366 1.00 0.00 C ATOM 736 OG1 THR B 22 7.490 -9.178 -7.857 1.00 0.00 O ATOM 737 CG2 THR B 22 9.116 -8.162 -9.323 1.00 0.00 C ATOM 0 H THR B 22 9.634 -8.587 -6.614 1.00 0.00 H new ATOM 0 HA THR B 22 8.729 -6.053 -7.599 1.00 0.00 H new ATOM 0 HB THR B 22 7.153 -7.427 -8.909 1.00 0.00 H new ATOM 0 HG1 THR B 22 7.218 -9.753 -8.603 1.00 0.00 H new ATOM 0 HG21 THR B 22 8.788 -8.810 -10.136 1.00 0.00 H new ATOM 0 HG22 THR B 22 9.453 -7.209 -9.732 1.00 0.00 H new ATOM 0 HG23 THR B 22 9.938 -8.638 -8.788 1.00 0.00 H new ATOM 745 N ILE B 23 6.372 -5.768 -6.637 1.00 0.00 N ATOM 746 CA ILE B 23 5.183 -5.444 -5.852 1.00 0.00 C ATOM 747 C ILE B 23 4.357 -6.697 -5.581 1.00 0.00 C ATOM 748 O ILE B 23 3.874 -6.905 -4.468 1.00 0.00 O ATOM 749 CB ILE B 23 4.291 -4.405 -6.567 1.00 0.00 C ATOM 750 CG1 ILE B 23 5.060 -3.101 -6.806 1.00 0.00 C ATOM 751 CG2 ILE B 23 3.027 -4.139 -5.759 1.00 0.00 C ATOM 752 CD1 ILE B 23 5.507 -2.409 -5.537 1.00 0.00 C ATOM 0 H ILE B 23 6.516 -5.170 -7.451 1.00 0.00 H new ATOM 0 HA ILE B 23 5.532 -5.020 -4.911 1.00 0.00 H new ATOM 0 HB ILE B 23 4.002 -4.813 -7.536 1.00 0.00 H new ATOM 0 HG12 ILE B 23 5.936 -3.315 -7.419 1.00 0.00 H new ATOM 0 HG13 ILE B 23 4.430 -2.419 -7.377 1.00 0.00 H new ATOM 0 HG21 ILE B 23 2.411 -3.405 -6.278 1.00 0.00 H new ATOM 0 HG22 ILE B 23 2.466 -5.067 -5.644 1.00 0.00 H new ATOM 0 HG23 ILE B 23 3.298 -3.755 -4.776 1.00 0.00 H new ATOM 0 HD11 ILE B 23 6.044 -1.495 -5.791 1.00 0.00 H new ATOM 0 HD12 ILE B 23 4.635 -2.162 -4.931 1.00 0.00 H new ATOM 0 HD13 ILE B 23 6.164 -3.071 -4.974 1.00 0.00 H new ATOM 764 N ASP B 24 4.206 -7.532 -6.607 1.00 0.00 N ATOM 765 CA ASP B 24 3.445 -8.770 -6.480 1.00 0.00 C ATOM 766 C ASP B 24 4.002 -9.624 -5.343 1.00 0.00 C ATOM 767 O ASP B 24 3.251 -10.127 -4.503 1.00 0.00 O ATOM 768 CB ASP B 24 3.484 -9.555 -7.793 1.00 0.00 C ATOM 769 CG ASP B 24 2.622 -10.804 -7.756 1.00 0.00 C ATOM 770 OD1 ASP B 24 1.965 -11.045 -6.721 1.00 0.00 O ATOM 771 OD2 ASP B 24 2.600 -11.539 -8.765 1.00 0.00 O ATOM 0 H ASP B 24 4.601 -7.373 -7.534 1.00 0.00 H new ATOM 0 HA ASP B 24 2.410 -8.516 -6.252 1.00 0.00 H new ATOM 0 HB2 ASP B 24 3.149 -8.911 -8.606 1.00 0.00 H new ATOM 0 HB3 ASP B 24 4.514 -9.836 -8.013 1.00 0.00 H new ATOM 776 N ASN B 25 5.324 -9.773 -5.314 1.00 0.00 N ATOM 777 CA ASN B 25 5.983 -10.552 -4.273 1.00 0.00 C ATOM 778 C ASN B 25 5.668 -9.970 -2.900 1.00 0.00 C ATOM 779 O ASN B 25 5.382 -10.704 -1.951 1.00 0.00 O ATOM 780 CB ASN B 25 7.496 -10.580 -4.503 1.00 0.00 C ATOM 781 CG ASN B 25 7.887 -11.258 -5.806 1.00 0.00 C ATOM 782 OD1 ASN B 25 9.070 -11.355 -6.131 1.00 0.00 O ATOM 783 ND2 ASN B 25 6.900 -11.732 -6.561 1.00 0.00 N ATOM 0 H ASN B 25 5.959 -9.364 -6.000 1.00 0.00 H new ATOM 0 HA ASN B 25 5.608 -11.574 -4.314 1.00 0.00 H new ATOM 0 HB2 ASN B 25 7.877 -9.559 -4.503 1.00 0.00 H new ATOM 0 HB3 ASN B 25 7.975 -11.099 -3.672 1.00 0.00 H new ATOM 0 HD21 ASN B 25 7.111 -12.196 -7.445 1.00 0.00 H new ATOM 0 HD22 ASN B 25 5.932 -11.632 -6.256 1.00 0.00 H new ATOM 790 N VAL B 26 5.709 -8.642 -2.807 1.00 0.00 N ATOM 791 CA VAL B 26 5.412 -7.953 -1.558 1.00 0.00 C ATOM 792 C VAL B 26 4.035 -8.356 -1.048 1.00 0.00 C ATOM 793 O VAL B 26 3.853 -8.631 0.138 1.00 0.00 O ATOM 794 CB VAL B 26 5.453 -6.422 -1.734 1.00 0.00 C ATOM 795 CG1 VAL B 26 5.135 -5.721 -0.422 1.00 0.00 C ATOM 796 CG2 VAL B 26 6.806 -5.981 -2.269 1.00 0.00 C ATOM 0 H VAL B 26 5.945 -8.024 -3.583 1.00 0.00 H new ATOM 0 HA VAL B 26 6.176 -8.243 -0.836 1.00 0.00 H new ATOM 0 HB VAL B 26 4.691 -6.140 -2.461 1.00 0.00 H new ATOM 0 HG11 VAL B 26 5.169 -4.641 -0.569 1.00 0.00 H new ATOM 0 HG12 VAL B 26 4.139 -6.010 -0.087 1.00 0.00 H new ATOM 0 HG13 VAL B 26 5.869 -6.008 0.331 1.00 0.00 H new ATOM 0 HG21 VAL B 26 6.815 -4.897 -2.386 1.00 0.00 H new ATOM 0 HG22 VAL B 26 7.588 -6.277 -1.570 1.00 0.00 H new ATOM 0 HG23 VAL B 26 6.986 -6.452 -3.235 1.00 0.00 H new ATOM 806 N LYS B 27 3.071 -8.397 -1.962 1.00 0.00 N ATOM 807 CA LYS B 27 1.708 -8.777 -1.621 1.00 0.00 C ATOM 808 C LYS B 27 1.670 -10.211 -1.116 1.00 0.00 C ATOM 809 O LYS B 27 0.936 -10.529 -0.181 1.00 0.00 O ATOM 810 CB LYS B 27 0.792 -8.615 -2.834 1.00 0.00 C ATOM 811 CG LYS B 27 0.784 -7.205 -3.401 1.00 0.00 C ATOM 812 CD LYS B 27 0.312 -6.188 -2.373 1.00 0.00 C ATOM 813 CE LYS B 27 0.415 -4.772 -2.916 1.00 0.00 C ATOM 814 NZ LYS B 27 -0.414 -4.584 -4.140 1.00 0.00 N ATOM 0 H LYS B 27 3.211 -8.171 -2.947 1.00 0.00 H new ATOM 0 HA LYS B 27 1.352 -8.120 -0.827 1.00 0.00 H new ATOM 0 HB2 LYS B 27 1.106 -9.310 -3.613 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -0.224 -8.891 -2.552 1.00 0.00 H new ATOM 0 HG2 LYS B 27 1.787 -6.943 -3.739 1.00 0.00 H new ATOM 0 HG3 LYS B 27 0.134 -7.168 -4.275 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -0.720 -6.400 -2.095 1.00 0.00 H new ATOM 0 HD3 LYS B 27 0.911 -6.278 -1.467 1.00 0.00 H new ATOM 0 HE2 LYS B 27 0.096 -4.065 -2.150 1.00 0.00 H new ATOM 0 HE3 LYS B 27 1.456 -4.546 -3.145 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -0.481 -3.570 -4.362 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 0.027 -5.085 -4.938 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -1.367 -4.966 -3.976 1.00 0.00 H new ATOM 828 N SER B 28 2.474 -11.074 -1.733 1.00 0.00 N ATOM 829 CA SER B 28 2.539 -12.472 -1.330 1.00 0.00 C ATOM 830 C SER B 28 2.927 -12.574 0.141 1.00 0.00 C ATOM 831 O SER B 28 2.311 -13.315 0.908 1.00 0.00 O ATOM 832 CB SER B 28 3.547 -13.232 -2.194 1.00 0.00 C ATOM 833 OG SER B 28 3.611 -14.598 -1.822 1.00 0.00 O ATOM 0 H SER B 28 3.087 -10.829 -2.511 1.00 0.00 H new ATOM 0 HA SER B 28 1.555 -12.921 -1.470 1.00 0.00 H new ATOM 0 HB2 SER B 28 3.265 -13.151 -3.244 1.00 0.00 H new ATOM 0 HB3 SER B 28 4.533 -12.778 -2.093 1.00 0.00 H new ATOM 0 HG SER B 28 4.261 -15.062 -2.390 1.00 0.00 H new ATOM 839 N LYS B 29 3.945 -11.808 0.531 1.00 0.00 N ATOM 840 CA LYS B 29 4.405 -11.796 1.914 1.00 0.00 C ATOM 841 C LYS B 29 3.292 -11.310 2.838 1.00 0.00 C ATOM 842 O LYS B 29 3.033 -11.905 3.886 1.00 0.00 O ATOM 843 CB LYS B 29 5.635 -10.897 2.059 1.00 0.00 C ATOM 844 CG LYS B 29 6.808 -11.328 1.194 1.00 0.00 C ATOM 845 CD LYS B 29 8.019 -10.435 1.411 1.00 0.00 C ATOM 846 CE LYS B 29 9.188 -10.862 0.538 1.00 0.00 C ATOM 847 NZ LYS B 29 10.389 -10.009 0.761 1.00 0.00 N ATOM 0 H LYS B 29 4.464 -11.190 -0.092 1.00 0.00 H new ATOM 0 HA LYS B 29 4.678 -12.813 2.196 1.00 0.00 H new ATOM 0 HB2 LYS B 29 5.360 -9.874 1.801 1.00 0.00 H new ATOM 0 HB3 LYS B 29 5.948 -10.889 3.103 1.00 0.00 H new ATOM 0 HG2 LYS B 29 7.070 -12.361 1.424 1.00 0.00 H new ATOM 0 HG3 LYS B 29 6.517 -11.299 0.144 1.00 0.00 H new ATOM 0 HD2 LYS B 29 7.755 -9.401 1.188 1.00 0.00 H new ATOM 0 HD3 LYS B 29 8.315 -10.469 2.460 1.00 0.00 H new ATOM 0 HE2 LYS B 29 9.437 -11.902 0.748 1.00 0.00 H new ATOM 0 HE3 LYS B 29 8.896 -10.810 -0.511 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 10.694 -9.596 -0.143 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 10.154 -9.246 1.428 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 11.158 -10.588 1.154 1.00 0.00 H new ATOM 861 N ILE B 30 2.632 -10.228 2.432 1.00 0.00 N ATOM 862 CA ILE B 30 1.538 -9.661 3.211 1.00 0.00 C ATOM 863 C ILE B 30 0.428 -10.689 3.403 1.00 0.00 C ATOM 864 O ILE B 30 -0.167 -10.783 4.476 1.00 0.00 O ATOM 865 CB ILE B 30 0.959 -8.397 2.538 1.00 0.00 C ATOM 866 CG1 ILE B 30 2.039 -7.316 2.429 1.00 0.00 C ATOM 867 CG2 ILE B 30 -0.241 -7.881 3.323 1.00 0.00 C ATOM 868 CD1 ILE B 30 1.570 -6.049 1.744 1.00 0.00 C ATOM 0 H ILE B 30 2.837 -9.727 1.567 1.00 0.00 H new ATOM 0 HA ILE B 30 1.943 -9.379 4.183 1.00 0.00 H new ATOM 0 HB ILE B 30 0.625 -8.655 1.533 1.00 0.00 H new ATOM 0 HG12 ILE B 30 2.393 -7.067 3.429 1.00 0.00 H new ATOM 0 HG13 ILE B 30 2.890 -7.720 1.881 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -0.638 -6.990 2.837 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -1.012 -8.651 3.356 1.00 0.00 H new ATOM 0 HG23 ILE B 30 0.068 -7.633 4.338 1.00 0.00 H new ATOM 0 HD11 ILE B 30 2.390 -5.332 1.705 1.00 0.00 H new ATOM 0 HD12 ILE B 30 1.244 -6.283 0.731 1.00 0.00 H new ATOM 0 HD13 ILE B 30 0.739 -5.620 2.303 1.00 0.00 H new ATOM 880 N GLN B 31 0.163 -11.463 2.356 1.00 0.00 N ATOM 881 CA GLN B 31 -0.867 -12.493 2.406 1.00 0.00 C ATOM 882 C GLN B 31 -0.519 -13.545 3.451 1.00 0.00 C ATOM 883 O GLN B 31 -1.361 -13.946 4.247 1.00 0.00 O ATOM 884 CB GLN B 31 -1.027 -13.157 1.038 1.00 0.00 C ATOM 885 CG GLN B 31 -2.058 -14.272 1.025 1.00 0.00 C ATOM 886 CD GLN B 31 -2.180 -14.941 -0.330 1.00 0.00 C ATOM 887 OE1 GLN B 31 -2.510 -14.297 -1.325 1.00 0.00 O ATOM 888 NE2 GLN B 31 -1.912 -16.241 -0.373 1.00 0.00 N ATOM 0 H GLN B 31 0.648 -11.396 1.461 1.00 0.00 H new ATOM 0 HA GLN B 31 -1.809 -12.019 2.681 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -1.312 -12.401 0.306 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -0.064 -13.559 0.723 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -1.788 -15.019 1.771 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -3.028 -13.868 1.315 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -1.642 -16.734 0.478 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -1.976 -16.746 -1.257 1.00 0.00 H new ATOM 897 N ASP B 32 0.730 -13.989 3.439 1.00 0.00 N ATOM 898 CA ASP B 32 1.189 -14.996 4.387 1.00 0.00 C ATOM 899 C ASP B 32 1.033 -14.503 5.825 1.00 0.00 C ATOM 900 O ASP B 32 0.674 -15.270 6.718 1.00 0.00 O ATOM 901 CB ASP B 32 2.652 -15.354 4.110 1.00 0.00 C ATOM 902 CG ASP B 32 3.164 -16.464 5.008 1.00 0.00 C ATOM 903 OD1 ASP B 32 3.182 -16.273 6.241 1.00 0.00 O ATOM 904 OD2 ASP B 32 3.547 -17.527 4.475 1.00 0.00 O ATOM 0 H ASP B 32 1.443 -13.669 2.784 1.00 0.00 H new ATOM 0 HA ASP B 32 0.574 -15.887 4.262 1.00 0.00 H new ATOM 0 HB2 ASP B 32 2.756 -15.658 3.068 1.00 0.00 H new ATOM 0 HB3 ASP B 32 3.271 -14.467 4.247 1.00 0.00 H new ATOM 909 N LYS B 33 1.323 -13.222 6.042 1.00 0.00 N ATOM 910 CA LYS B 33 1.235 -12.628 7.375 1.00 0.00 C ATOM 911 C LYS B 33 -0.211 -12.427 7.836 1.00 0.00 C ATOM 912 O LYS B 33 -0.655 -13.055 8.798 1.00 0.00 O ATOM 913 CB LYS B 33 1.974 -11.285 7.397 1.00 0.00 C ATOM 914 CG LYS B 33 3.475 -11.394 7.155 1.00 0.00 C ATOM 915 CD LYS B 33 4.249 -11.681 8.439 1.00 0.00 C ATOM 916 CE LYS B 33 3.944 -13.061 9.001 1.00 0.00 C ATOM 917 NZ LYS B 33 4.694 -13.327 10.260 1.00 0.00 N ATOM 0 H LYS B 33 1.621 -12.575 5.312 1.00 0.00 H new ATOM 0 HA LYS B 33 1.703 -13.327 8.068 1.00 0.00 H new ATOM 0 HB2 LYS B 33 1.541 -10.633 6.639 1.00 0.00 H new ATOM 0 HB3 LYS B 33 1.807 -10.807 8.362 1.00 0.00 H new ATOM 0 HG2 LYS B 33 3.668 -12.187 6.432 1.00 0.00 H new ATOM 0 HG3 LYS B 33 3.838 -10.466 6.714 1.00 0.00 H new ATOM 0 HD2 LYS B 33 5.318 -11.600 8.242 1.00 0.00 H new ATOM 0 HD3 LYS B 33 4.004 -10.925 9.185 1.00 0.00 H new ATOM 0 HE2 LYS B 33 2.874 -13.147 9.191 1.00 0.00 H new ATOM 0 HE3 LYS B 33 4.198 -13.819 8.260 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 4.458 -14.277 10.610 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 5.716 -13.270 10.074 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 4.433 -12.619 10.976 1.00 0.00 H new ATOM 931 N GLU B 34 -0.931 -11.529 7.167 1.00 0.00 N ATOM 932 CA GLU B 34 -2.315 -11.222 7.534 1.00 0.00 C ATOM 933 C GLU B 34 -3.299 -12.282 7.044 1.00 0.00 C ATOM 934 O GLU B 34 -4.209 -12.676 7.773 1.00 0.00 O ATOM 935 CB GLU B 34 -2.715 -9.855 6.978 1.00 0.00 C ATOM 936 CG GLU B 34 -1.778 -8.733 7.397 1.00 0.00 C ATOM 937 CD GLU B 34 -2.197 -7.386 6.842 1.00 0.00 C ATOM 938 OE1 GLU B 34 -2.278 -7.253 5.603 1.00 0.00 O ATOM 939 OE2 GLU B 34 -2.442 -6.463 7.648 1.00 0.00 O ATOM 0 H GLU B 34 -0.581 -11.000 6.368 1.00 0.00 H new ATOM 0 HA GLU B 34 -2.361 -11.211 8.623 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -2.742 -9.908 5.890 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -3.725 -9.617 7.311 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -1.745 -8.679 8.485 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -0.768 -8.963 7.059 1.00 0.00 H new ATOM 946 N GLY B 35 -3.128 -12.725 5.804 1.00 0.00 N ATOM 947 CA GLY B 35 -4.027 -13.717 5.242 1.00 0.00 C ATOM 948 C GLY B 35 -5.156 -13.078 4.459 1.00 0.00 C ATOM 949 O GLY B 35 -6.317 -13.466 4.596 1.00 0.00 O ATOM 0 H GLY B 35 -2.384 -12.416 5.178 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -3.466 -14.387 4.590 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -4.442 -14.327 6.044 1.00 0.00 H new ATOM 953 N ILE B 36 -4.810 -12.090 3.638 1.00 0.00 N ATOM 954 CA ILE B 36 -5.791 -11.380 2.827 1.00 0.00 C ATOM 955 C ILE B 36 -5.474 -11.521 1.337 1.00 0.00 C ATOM 956 O ILE B 36 -4.321 -11.381 0.928 1.00 0.00 O ATOM 957 CB ILE B 36 -5.831 -9.880 3.192 1.00 0.00 C ATOM 958 CG1 ILE B 36 -6.062 -9.697 4.696 1.00 0.00 C ATOM 959 CG2 ILE B 36 -6.908 -9.159 2.392 1.00 0.00 C ATOM 960 CD1 ILE B 36 -7.348 -10.317 5.200 1.00 0.00 C ATOM 0 H ILE B 36 -3.852 -11.763 3.518 1.00 0.00 H new ATOM 0 HA ILE B 36 -6.764 -11.826 3.033 1.00 0.00 H new ATOM 0 HB ILE B 36 -4.866 -9.441 2.937 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -5.223 -10.134 5.238 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -6.070 -8.631 4.925 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -6.919 -8.104 2.665 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -6.697 -9.256 1.327 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -7.880 -9.600 2.611 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -7.439 -10.145 6.272 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -8.196 -9.864 4.687 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -7.336 -11.389 5.004 1.00 0.00 H new ATOM 972 N PRO B 37 -6.494 -11.803 0.501 1.00 0.00 N ATOM 973 CA PRO B 37 -6.309 -11.962 -0.947 1.00 0.00 C ATOM 974 C PRO B 37 -5.601 -10.762 -1.579 1.00 0.00 C ATOM 975 O PRO B 37 -5.903 -9.613 -1.253 1.00 0.00 O ATOM 976 CB PRO B 37 -7.739 -12.079 -1.481 1.00 0.00 C ATOM 977 CG PRO B 37 -8.534 -12.585 -0.328 1.00 0.00 C ATOM 978 CD PRO B 37 -7.903 -11.992 0.900 1.00 0.00 C ATOM 0 HA PRO B 37 -5.681 -12.821 -1.183 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -8.113 -11.115 -1.827 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -7.790 -12.763 -2.328 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -9.579 -12.286 -0.413 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -8.516 -13.674 -0.289 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -8.372 -11.048 1.178 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -7.992 -12.657 1.759 1.00 0.00 H new ATOM 986 N PRO B 38 -4.643 -11.015 -2.492 1.00 0.00 N ATOM 987 CA PRO B 38 -3.887 -9.951 -3.166 1.00 0.00 C ATOM 988 C PRO B 38 -4.783 -9.011 -3.966 1.00 0.00 C ATOM 989 O PRO B 38 -4.616 -7.792 -3.919 1.00 0.00 O ATOM 990 CB PRO B 38 -2.942 -10.710 -4.105 1.00 0.00 C ATOM 991 CG PRO B 38 -2.874 -12.092 -3.552 1.00 0.00 C ATOM 992 CD PRO B 38 -4.218 -12.353 -2.938 1.00 0.00 C ATOM 0 HA PRO B 38 -3.373 -9.312 -2.448 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -3.320 -10.712 -5.127 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -1.956 -10.247 -4.131 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -2.655 -12.817 -4.336 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -2.081 -12.177 -2.809 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -4.916 -12.779 -3.659 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -4.153 -13.054 -2.106 1.00 0.00 H new ATOM 1000 N ASP B 39 -5.727 -9.585 -4.705 1.00 0.00 N ATOM 1001 CA ASP B 39 -6.643 -8.795 -5.522 1.00 0.00 C ATOM 1002 C ASP B 39 -7.409 -7.785 -4.671 1.00 0.00 C ATOM 1003 O ASP B 39 -7.620 -6.646 -5.089 1.00 0.00 O ATOM 1004 CB ASP B 39 -7.613 -9.710 -6.275 1.00 0.00 C ATOM 1005 CG ASP B 39 -8.391 -10.631 -5.354 1.00 0.00 C ATOM 1006 OD1 ASP B 39 -9.202 -10.124 -4.551 1.00 0.00 O ATOM 1007 OD2 ASP B 39 -8.188 -11.861 -5.436 1.00 0.00 O ATOM 0 H ASP B 39 -5.878 -10.592 -4.755 1.00 0.00 H new ATOM 0 HA ASP B 39 -6.052 -8.239 -6.250 1.00 0.00 H new ATOM 0 HB2 ASP B 39 -8.313 -9.099 -6.845 1.00 0.00 H new ATOM 0 HB3 ASP B 39 -7.055 -10.310 -6.994 1.00 0.00 H new ATOM 1012 N GLN B 40 -7.817 -8.202 -3.478 1.00 0.00 N ATOM 1013 CA GLN B 40 -8.553 -7.324 -2.574 1.00 0.00 C ATOM 1014 C GLN B 40 -7.668 -6.185 -2.078 1.00 0.00 C ATOM 1015 O GLN B 40 -8.086 -5.028 -2.050 1.00 0.00 O ATOM 1016 CB GLN B 40 -9.095 -8.115 -1.382 1.00 0.00 C ATOM 1017 CG GLN B 40 -10.077 -9.210 -1.768 1.00 0.00 C ATOM 1018 CD GLN B 40 -10.631 -9.962 -0.569 1.00 0.00 C ATOM 1019 OE1 GLN B 40 -11.432 -10.885 -0.722 1.00 0.00 O ATOM 1020 NE2 GLN B 40 -10.211 -9.575 0.632 1.00 0.00 N ATOM 0 H GLN B 40 -7.651 -9.140 -3.114 1.00 0.00 H new ATOM 0 HA GLN B 40 -9.389 -6.898 -3.129 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -8.259 -8.562 -0.844 1.00 0.00 H new ATOM 0 HB3 GLN B 40 -9.585 -7.427 -0.693 1.00 0.00 H new ATOM 0 HG2 GLN B 40 -10.903 -8.769 -2.326 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -9.582 -9.916 -2.435 1.00 0.00 H new ATOM 0 HE21 GLN B 40 -9.547 -8.806 0.716 1.00 0.00 H new ATOM 0 HE22 GLN B 40 -10.553 -10.047 1.469 1.00 0.00 H new ATOM 1029 N GLN B 41 -6.446 -6.523 -1.678 1.00 0.00 N ATOM 1030 CA GLN B 41 -5.503 -5.531 -1.172 1.00 0.00 C ATOM 1031 C GLN B 41 -5.100 -4.534 -2.254 1.00 0.00 C ATOM 1032 O GLN B 41 -4.698 -4.922 -3.352 1.00 0.00 O ATOM 1033 CB GLN B 41 -4.248 -6.216 -0.629 1.00 0.00 C ATOM 1034 CG GLN B 41 -4.512 -7.156 0.535 1.00 0.00 C ATOM 1035 CD GLN B 41 -3.247 -7.809 1.065 1.00 0.00 C ATOM 1036 OE1 GLN B 41 -3.293 -8.593 2.013 1.00 0.00 O ATOM 1037 NE2 GLN B 41 -2.106 -7.494 0.458 1.00 0.00 N ATOM 0 H GLN B 41 -6.085 -7.477 -1.694 1.00 0.00 H new ATOM 0 HA GLN B 41 -6.004 -4.989 -0.370 1.00 0.00 H new ATOM 0 HB2 GLN B 41 -3.775 -6.776 -1.435 1.00 0.00 H new ATOM 0 HB3 GLN B 41 -3.538 -5.452 -0.312 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -4.994 -6.602 1.341 1.00 0.00 H new ATOM 0 HG3 GLN B 41 -5.210 -7.931 0.219 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -2.108 -6.840 -0.325 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -1.229 -7.907 0.775 1.00 0.00 H new ATOM 1046 N ARG B 42 -5.185 -3.248 -1.925 1.00 0.00 N ATOM 1047 CA ARG B 42 -4.802 -2.192 -2.856 1.00 0.00 C ATOM 1048 C ARG B 42 -3.670 -1.366 -2.254 1.00 0.00 C ATOM 1049 O ARG B 42 -3.866 -0.643 -1.276 1.00 0.00 O ATOM 1050 CB ARG B 42 -6.000 -1.294 -3.179 1.00 0.00 C ATOM 1051 CG ARG B 42 -5.712 -0.245 -4.242 1.00 0.00 C ATOM 1052 CD ARG B 42 -5.324 -0.882 -5.567 1.00 0.00 C ATOM 1053 NE ARG B 42 -5.071 0.115 -6.602 1.00 0.00 N ATOM 1054 CZ ARG B 42 -4.724 -0.188 -7.850 1.00 0.00 C ATOM 1055 NH1 ARG B 42 -4.599 -1.457 -8.216 1.00 0.00 N ATOM 1056 NH2 ARG B 42 -4.504 0.776 -8.732 1.00 0.00 N ATOM 0 H ARG B 42 -5.516 -2.912 -1.020 1.00 0.00 H new ATOM 0 HA ARG B 42 -4.460 -2.649 -3.785 1.00 0.00 H new ATOM 0 HB2 ARG B 42 -6.830 -1.917 -3.512 1.00 0.00 H new ATOM 0 HB3 ARG B 42 -6.324 -0.794 -2.266 1.00 0.00 H new ATOM 0 HG2 ARG B 42 -6.592 0.382 -4.383 1.00 0.00 H new ATOM 0 HG3 ARG B 42 -4.908 0.407 -3.902 1.00 0.00 H new ATOM 0 HD2 ARG B 42 -4.432 -1.493 -5.428 1.00 0.00 H new ATOM 0 HD3 ARG B 42 -6.121 -1.550 -5.895 1.00 0.00 H new ATOM 0 HE ARG B 42 -5.166 1.100 -6.355 1.00 0.00 H new ATOM 0 HH11 ARG B 42 -4.769 -2.202 -7.540 1.00 0.00 H new ATOM 0 HH12 ARG B 42 -4.333 -1.688 -9.173 1.00 0.00 H new ATOM 0 HH21 ARG B 42 -4.601 1.753 -8.455 1.00 0.00 H new ATOM 0 HH22 ARG B 42 -4.238 0.541 -9.688 1.00 0.00 H new ATOM 1070 N LEU B 43 -2.480 -1.496 -2.830 1.00 0.00 N ATOM 1071 CA LEU B 43 -1.308 -0.782 -2.337 1.00 0.00 C ATOM 1072 C LEU B 43 -1.298 0.668 -2.810 1.00 0.00 C ATOM 1073 O LEU B 43 -1.477 0.946 -3.997 1.00 0.00 O ATOM 1074 CB LEU B 43 -0.038 -1.498 -2.797 1.00 0.00 C ATOM 1075 CG LEU B 43 1.227 -1.170 -2.002 1.00 0.00 C ATOM 1076 CD1 LEU B 43 1.052 -1.547 -0.537 1.00 0.00 C ATOM 1077 CD2 LEU B 43 2.430 -1.886 -2.599 1.00 0.00 C ATOM 0 H LEU B 43 -2.301 -2.090 -3.640 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.347 -0.774 -1.248 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -0.209 -2.573 -2.747 1.00 0.00 H new ATOM 0 HB3 LEU B 43 0.138 -1.252 -3.844 1.00 0.00 H new ATOM 0 HG LEU B 43 1.402 -0.096 -2.060 1.00 0.00 H new ATOM 0 HD11 LEU B 43 1.962 -1.306 0.012 1.00 0.00 H new ATOM 0 HD12 LEU B 43 0.216 -0.990 -0.115 1.00 0.00 H new ATOM 0 HD13 LEU B 43 0.853 -2.616 -0.458 1.00 0.00 H new ATOM 0 HD21 LEU B 43 3.322 -1.642 -2.022 1.00 0.00 H new ATOM 0 HD22 LEU B 43 2.263 -2.963 -2.571 1.00 0.00 H new ATOM 0 HD23 LEU B 43 2.568 -1.567 -3.632 1.00 0.00 H new ATOM 1089 N ILE B 44 -1.084 1.588 -1.872 1.00 0.00 N ATOM 1090 CA ILE B 44 -1.050 3.012 -2.187 1.00 0.00 C ATOM 1091 C ILE B 44 0.100 3.709 -1.464 1.00 0.00 C ATOM 1092 O ILE B 44 0.387 3.416 -0.302 1.00 0.00 O ATOM 1093 CB ILE B 44 -2.374 3.707 -1.804 1.00 0.00 C ATOM 1094 CG1 ILE B 44 -3.554 3.026 -2.503 1.00 0.00 C ATOM 1095 CG2 ILE B 44 -2.318 5.186 -2.163 1.00 0.00 C ATOM 1096 CD1 ILE B 44 -4.898 3.632 -2.159 1.00 0.00 C ATOM 0 H ILE B 44 -0.932 1.371 -0.887 1.00 0.00 H new ATOM 0 HA ILE B 44 -0.903 3.092 -3.264 1.00 0.00 H new ATOM 0 HB ILE B 44 -2.516 3.620 -0.727 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -3.406 3.080 -3.582 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -3.563 1.969 -2.235 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -3.258 5.663 -1.887 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -1.498 5.661 -1.623 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -2.157 5.294 -3.236 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -5.685 3.098 -2.691 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -5.068 3.554 -1.085 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -4.910 4.682 -2.452 1.00 0.00 H new ATOM 1108 N PHE B 45 0.754 4.634 -2.163 1.00 0.00 N ATOM 1109 CA PHE B 45 1.875 5.379 -1.598 1.00 0.00 C ATOM 1110 C PHE B 45 2.264 6.540 -2.510 1.00 0.00 C ATOM 1111 O PHE B 45 2.111 6.459 -3.730 1.00 0.00 O ATOM 1112 CB PHE B 45 3.080 4.457 -1.387 1.00 0.00 C ATOM 1113 CG PHE B 45 4.249 5.131 -0.720 1.00 0.00 C ATOM 1114 CD1 PHE B 45 4.088 5.796 0.487 1.00 0.00 C ATOM 1115 CD2 PHE B 45 5.507 5.098 -1.300 1.00 0.00 C ATOM 1116 CE1 PHE B 45 5.161 6.415 1.101 1.00 0.00 C ATOM 1117 CE2 PHE B 45 6.583 5.715 -0.690 1.00 0.00 C ATOM 1118 CZ PHE B 45 6.410 6.374 0.511 1.00 0.00 C ATOM 0 H PHE B 45 0.525 4.886 -3.125 1.00 0.00 H new ATOM 0 HA PHE B 45 1.563 5.780 -0.633 1.00 0.00 H new ATOM 0 HB2 PHE B 45 2.772 3.603 -0.784 1.00 0.00 H new ATOM 0 HB3 PHE B 45 3.400 4.066 -2.353 1.00 0.00 H new ATOM 0 HD1 PHE B 45 3.114 5.830 0.952 1.00 0.00 H new ATOM 0 HD2 PHE B 45 5.648 4.584 -2.239 1.00 0.00 H new ATOM 0 HE1 PHE B 45 5.023 6.930 2.040 1.00 0.00 H new ATOM 0 HE2 PHE B 45 7.558 5.682 -1.152 1.00 0.00 H new ATOM 0 HZ PHE B 45 7.250 6.857 0.989 1.00 0.00 H new ATOM 1128 N ALA B 46 2.764 7.617 -1.908 1.00 0.00 N ATOM 1129 CA ALA B 46 3.179 8.799 -2.658 1.00 0.00 C ATOM 1130 C ALA B 46 2.083 9.266 -3.609 1.00 0.00 C ATOM 1131 O ALA B 46 2.357 9.699 -4.728 1.00 0.00 O ATOM 1132 CB ALA B 46 4.463 8.513 -3.423 1.00 0.00 C ATOM 0 H ALA B 46 2.892 7.695 -0.899 1.00 0.00 H new ATOM 0 HA ALA B 46 3.364 9.603 -1.945 1.00 0.00 H new ATOM 0 HB1 ALA B 46 4.762 9.402 -3.978 1.00 0.00 H new ATOM 0 HB2 ALA B 46 5.252 8.241 -2.721 1.00 0.00 H new ATOM 0 HB3 ALA B 46 4.297 7.690 -4.118 1.00 0.00 H new ATOM 1138 N GLY B 47 0.840 9.179 -3.149 1.00 0.00 N ATOM 1139 CA GLY B 47 -0.287 9.598 -3.959 1.00 0.00 C ATOM 1140 C GLY B 47 -0.435 8.792 -5.237 1.00 0.00 C ATOM 1141 O GLY B 47 -0.800 9.339 -6.278 1.00 0.00 O ATOM 0 H GLY B 47 0.593 8.824 -2.225 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -1.201 9.509 -3.372 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -0.173 10.652 -4.213 1.00 0.00 H new ATOM 1145 N LYS B 48 -0.165 7.490 -5.161 1.00 0.00 N ATOM 1146 CA LYS B 48 -0.291 6.623 -6.330 1.00 0.00 C ATOM 1147 C LYS B 48 -0.298 5.151 -5.938 1.00 0.00 C ATOM 1148 O LYS B 48 0.535 4.701 -5.151 1.00 0.00 O ATOM 1149 CB LYS B 48 0.842 6.881 -7.327 1.00 0.00 C ATOM 1150 CG LYS B 48 2.235 6.680 -6.752 1.00 0.00 C ATOM 1151 CD LYS B 48 3.298 6.803 -7.834 1.00 0.00 C ATOM 1152 CE LYS B 48 4.694 6.565 -7.283 1.00 0.00 C ATOM 1153 NZ LYS B 48 5.088 7.604 -6.293 1.00 0.00 N ATOM 0 H LYS B 48 0.140 7.016 -4.311 1.00 0.00 H new ATOM 0 HA LYS B 48 -1.245 6.860 -6.802 1.00 0.00 H new ATOM 0 HB2 LYS B 48 0.715 6.219 -8.183 1.00 0.00 H new ATOM 0 HB3 LYS B 48 0.758 7.902 -7.699 1.00 0.00 H new ATOM 0 HG2 LYS B 48 2.419 7.418 -5.971 1.00 0.00 H new ATOM 0 HG3 LYS B 48 2.300 5.698 -6.284 1.00 0.00 H new ATOM 0 HD2 LYS B 48 3.093 6.085 -8.628 1.00 0.00 H new ATOM 0 HD3 LYS B 48 3.248 7.796 -8.281 1.00 0.00 H new ATOM 0 HE2 LYS B 48 4.735 5.582 -6.813 1.00 0.00 H new ATOM 0 HE3 LYS B 48 5.411 6.556 -8.104 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 5.878 8.164 -6.673 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 4.279 8.229 -6.105 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 5.384 7.145 -5.408 1.00 0.00 H new ATOM 1167 N GLN B 49 -1.238 4.403 -6.506 1.00 0.00 N ATOM 1168 CA GLN B 49 -1.348 2.978 -6.232 1.00 0.00 C ATOM 1169 C GLN B 49 -0.218 2.223 -6.921 1.00 0.00 C ATOM 1170 O GLN B 49 0.012 2.391 -8.119 1.00 0.00 O ATOM 1171 CB GLN B 49 -2.704 2.436 -6.698 1.00 0.00 C ATOM 1172 CG GLN B 49 -3.898 3.123 -6.050 1.00 0.00 C ATOM 1173 CD GLN B 49 -4.232 4.468 -6.674 1.00 0.00 C ATOM 1174 OE1 GLN B 49 -5.032 5.230 -6.132 1.00 0.00 O ATOM 1175 NE2 GLN B 49 -3.642 4.760 -7.829 1.00 0.00 N ATOM 0 H GLN B 49 -1.934 4.762 -7.159 1.00 0.00 H new ATOM 0 HA GLN B 49 -1.271 2.830 -5.155 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -2.776 2.547 -7.780 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -2.751 1.368 -6.483 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -4.768 2.470 -6.124 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -3.695 3.264 -4.988 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -2.984 4.102 -8.246 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -3.847 5.642 -8.298 1.00 0.00 H new ATOM 1184 N LEU B 50 0.491 1.399 -6.158 1.00 0.00 N ATOM 1185 CA LEU B 50 1.604 0.630 -6.703 1.00 0.00 C ATOM 1186 C LEU B 50 1.109 -0.584 -7.484 1.00 0.00 C ATOM 1187 O LEU B 50 0.362 -1.411 -6.960 1.00 0.00 O ATOM 1188 CB LEU B 50 2.554 0.190 -5.584 1.00 0.00 C ATOM 1189 CG LEU B 50 3.382 1.313 -4.945 1.00 0.00 C ATOM 1190 CD1 LEU B 50 2.484 2.336 -4.264 1.00 0.00 C ATOM 1191 CD2 LEU B 50 4.381 0.737 -3.954 1.00 0.00 C ATOM 0 H LEU B 50 0.316 1.246 -5.165 1.00 0.00 H new ATOM 0 HA LEU B 50 2.148 1.276 -7.392 1.00 0.00 H new ATOM 0 HB2 LEU B 50 1.969 -0.296 -4.804 1.00 0.00 H new ATOM 0 HB3 LEU B 50 3.237 -0.560 -5.984 1.00 0.00 H new ATOM 0 HG LEU B 50 3.930 1.822 -5.738 1.00 0.00 H new ATOM 0 HD11 LEU B 50 3.097 3.120 -3.820 1.00 0.00 H new ATOM 0 HD12 LEU B 50 1.810 2.775 -4.999 1.00 0.00 H new ATOM 0 HD13 LEU B 50 1.901 1.846 -3.484 1.00 0.00 H new ATOM 0 HD21 LEU B 50 4.960 1.546 -3.510 1.00 0.00 H new ATOM 0 HD22 LEU B 50 3.847 0.200 -3.170 1.00 0.00 H new ATOM 0 HD23 LEU B 50 5.052 0.052 -4.471 1.00 0.00 H new ATOM 1203 N GLU B 51 1.536 -0.682 -8.740 1.00 0.00 N ATOM 1204 CA GLU B 51 1.144 -1.793 -9.601 1.00 0.00 C ATOM 1205 C GLU B 51 1.953 -3.046 -9.285 1.00 0.00 C ATOM 1206 O GLU B 51 3.174 -2.990 -9.141 1.00 0.00 O ATOM 1207 CB GLU B 51 1.318 -1.413 -11.067 1.00 0.00 C ATOM 1208 CG GLU B 51 0.352 -0.337 -11.530 1.00 0.00 C ATOM 1209 CD GLU B 51 -1.100 -0.774 -11.458 1.00 0.00 C ATOM 1210 OE1 GLU B 51 -1.586 -1.050 -10.341 1.00 0.00 O ATOM 1211 OE2 GLU B 51 -1.751 -0.842 -12.522 1.00 0.00 O ATOM 0 H GLU B 51 2.155 -0.004 -9.185 1.00 0.00 H new ATOM 0 HA GLU B 51 0.093 -2.010 -9.412 1.00 0.00 H new ATOM 0 HB2 GLU B 51 2.339 -1.067 -11.226 1.00 0.00 H new ATOM 0 HB3 GLU B 51 1.183 -2.302 -11.683 1.00 0.00 H new ATOM 0 HG2 GLU B 51 0.488 0.554 -10.917 1.00 0.00 H new ATOM 0 HG3 GLU B 51 0.592 -0.058 -12.556 1.00 0.00 H new ATOM 1218 N ASP B 52 1.261 -4.175 -9.178 1.00 0.00 N ATOM 1219 CA ASP B 52 1.906 -5.450 -8.878 1.00 0.00 C ATOM 1220 C ASP B 52 2.903 -5.839 -9.968 1.00 0.00 C ATOM 1221 O ASP B 52 2.682 -5.569 -11.149 1.00 0.00 O ATOM 1222 CB ASP B 52 0.852 -6.549 -8.719 1.00 0.00 C ATOM 1223 CG ASP B 52 -0.124 -6.260 -7.594 1.00 0.00 C ATOM 1224 OD1 ASP B 52 0.019 -5.207 -6.937 1.00 0.00 O ATOM 1225 OD2 ASP B 52 -1.034 -7.086 -7.372 1.00 0.00 O ATOM 0 H ASP B 52 0.249 -4.234 -9.295 1.00 0.00 H new ATOM 0 HA ASP B 52 2.454 -5.336 -7.943 1.00 0.00 H new ATOM 0 HB2 ASP B 52 0.302 -6.658 -9.654 1.00 0.00 H new ATOM 0 HB3 ASP B 52 1.349 -7.500 -8.529 1.00 0.00 H new ATOM 1230 N GLY B 53 3.996 -6.481 -9.561 1.00 0.00 N ATOM 1231 CA GLY B 53 5.007 -6.907 -10.514 1.00 0.00 C ATOM 1232 C GLY B 53 6.138 -5.906 -10.675 1.00 0.00 C ATOM 1233 O GLY B 53 7.285 -6.292 -10.897 1.00 0.00 O ATOM 0 H GLY B 53 4.199 -6.713 -8.589 1.00 0.00 H new ATOM 0 HA2 GLY B 53 5.420 -7.863 -10.193 1.00 0.00 H new ATOM 0 HA3 GLY B 53 4.536 -7.073 -11.483 1.00 0.00 H new ATOM 1237 N ARG B 54 5.817 -4.622 -10.574 1.00 0.00 N ATOM 1238 CA ARG B 54 6.821 -3.569 -10.720 1.00 0.00 C ATOM 1239 C ARG B 54 7.853 -3.628 -9.595 1.00 0.00 C ATOM 1240 O ARG B 54 7.506 -3.816 -8.431 1.00 0.00 O ATOM 1241 CB ARG B 54 6.153 -2.192 -10.742 1.00 0.00 C ATOM 1242 CG ARG B 54 5.217 -1.988 -11.921 1.00 0.00 C ATOM 1243 CD ARG B 54 4.616 -0.591 -11.917 1.00 0.00 C ATOM 1244 NE ARG B 54 3.727 -0.369 -13.056 1.00 0.00 N ATOM 1245 CZ ARG B 54 4.132 -0.354 -14.324 1.00 0.00 C ATOM 1246 NH1 ARG B 54 5.412 -0.537 -14.620 1.00 0.00 N ATOM 1247 NH2 ARG B 54 3.256 -0.153 -15.298 1.00 0.00 N ATOM 0 H ARG B 54 4.872 -4.283 -10.392 1.00 0.00 H new ATOM 0 HA ARG B 54 7.336 -3.731 -11.667 1.00 0.00 H new ATOM 0 HB2 ARG B 54 5.593 -2.054 -9.817 1.00 0.00 H new ATOM 0 HB3 ARG B 54 6.925 -1.423 -10.765 1.00 0.00 H new ATOM 0 HG2 ARG B 54 5.761 -2.149 -12.852 1.00 0.00 H new ATOM 0 HG3 ARG B 54 4.419 -2.729 -11.886 1.00 0.00 H new ATOM 0 HD2 ARG B 54 4.062 -0.438 -10.991 1.00 0.00 H new ATOM 0 HD3 ARG B 54 5.417 0.148 -11.934 1.00 0.00 H new ATOM 0 HE ARG B 54 2.736 -0.216 -12.868 1.00 0.00 H new ATOM 0 HH11 ARG B 54 6.091 -0.690 -13.874 1.00 0.00 H new ATOM 0 HH12 ARG B 54 5.717 -0.525 -15.593 1.00 0.00 H new ATOM 0 HH21 ARG B 54 2.271 -0.010 -15.076 1.00 0.00 H new ATOM 0 HH22 ARG B 54 3.567 -0.142 -16.269 1.00 0.00 H new ATOM 1261 N THR B 55 9.125 -3.466 -9.952 1.00 0.00 N ATOM 1262 CA THR B 55 10.207 -3.500 -8.972 1.00 0.00 C ATOM 1263 C THR B 55 10.180 -2.267 -8.071 1.00 0.00 C ATOM 1264 O THR B 55 9.953 -1.150 -8.537 1.00 0.00 O ATOM 1265 CB THR B 55 11.584 -3.592 -9.654 1.00 0.00 C ATOM 1266 OG1 THR B 55 11.783 -2.464 -10.514 1.00 0.00 O ATOM 1267 CG2 THR B 55 11.704 -4.877 -10.459 1.00 0.00 C ATOM 0 H THR B 55 9.431 -3.310 -10.912 1.00 0.00 H new ATOM 0 HA THR B 55 10.050 -4.392 -8.365 1.00 0.00 H new ATOM 0 HB THR B 55 12.349 -3.595 -8.878 1.00 0.00 H new ATOM 0 HG1 THR B 55 12.545 -1.938 -10.193 1.00 0.00 H new ATOM 0 HG21 THR B 55 12.685 -4.920 -10.932 1.00 0.00 H new ATOM 0 HG22 THR B 55 11.583 -5.734 -9.797 1.00 0.00 H new ATOM 0 HG23 THR B 55 10.930 -4.899 -11.226 1.00 0.00 H new ATOM 1275 N LEU B 56 10.419 -2.480 -6.779 1.00 0.00 N ATOM 1276 CA LEU B 56 10.428 -1.390 -5.806 1.00 0.00 C ATOM 1277 C LEU B 56 11.471 -0.337 -6.168 1.00 0.00 C ATOM 1278 O LEU B 56 11.274 0.852 -5.919 1.00 0.00 O ATOM 1279 CB LEU B 56 10.708 -1.930 -4.400 1.00 0.00 C ATOM 1280 CG LEU B 56 9.631 -2.855 -3.827 1.00 0.00 C ATOM 1281 CD1 LEU B 56 10.062 -3.397 -2.472 1.00 0.00 C ATOM 1282 CD2 LEU B 56 8.306 -2.120 -3.704 1.00 0.00 C ATOM 0 H LEU B 56 10.609 -3.400 -6.381 1.00 0.00 H new ATOM 0 HA LEU B 56 9.443 -0.923 -5.823 1.00 0.00 H new ATOM 0 HB2 LEU B 56 11.655 -2.470 -4.418 1.00 0.00 H new ATOM 0 HB3 LEU B 56 10.835 -1.085 -3.723 1.00 0.00 H new ATOM 0 HG LEU B 56 9.499 -3.693 -4.511 1.00 0.00 H new ATOM 0 HD11 LEU B 56 9.285 -4.053 -2.079 1.00 0.00 H new ATOM 0 HD12 LEU B 56 10.989 -3.959 -2.583 1.00 0.00 H new ATOM 0 HD13 LEU B 56 10.221 -2.568 -1.782 1.00 0.00 H new ATOM 0 HD21 LEU B 56 7.553 -2.794 -3.295 1.00 0.00 H new ATOM 0 HD22 LEU B 56 8.425 -1.263 -3.041 1.00 0.00 H new ATOM 0 HD23 LEU B 56 7.988 -1.775 -4.688 1.00 0.00 H new ATOM 1294 N SER B 57 12.581 -0.786 -6.746 1.00 0.00 N ATOM 1295 CA SER B 57 13.667 0.110 -7.135 1.00 0.00 C ATOM 1296 C SER B 57 13.152 1.272 -7.981 1.00 0.00 C ATOM 1297 O SER B 57 13.594 2.410 -7.820 1.00 0.00 O ATOM 1298 CB SER B 57 14.736 -0.661 -7.911 1.00 0.00 C ATOM 1299 OG SER B 57 14.193 -1.252 -9.079 1.00 0.00 O ATOM 0 H SER B 57 12.753 -1.769 -6.956 1.00 0.00 H new ATOM 0 HA SER B 57 14.105 0.518 -6.224 1.00 0.00 H new ATOM 0 HB2 SER B 57 15.548 0.013 -8.185 1.00 0.00 H new ATOM 0 HB3 SER B 57 15.165 -1.435 -7.274 1.00 0.00 H new ATOM 0 HG SER B 57 14.897 -1.737 -9.558 1.00 0.00 H new ATOM 1305 N ASP B 58 12.218 0.978 -8.881 1.00 0.00 N ATOM 1306 CA ASP B 58 11.645 2.001 -9.752 1.00 0.00 C ATOM 1307 C ASP B 58 11.061 3.148 -8.933 1.00 0.00 C ATOM 1308 O ASP B 58 11.338 4.318 -9.198 1.00 0.00 O ATOM 1309 CB ASP B 58 10.558 1.390 -10.641 1.00 0.00 C ATOM 1310 CG ASP B 58 10.002 2.379 -11.650 1.00 0.00 C ATOM 1311 OD1 ASP B 58 10.483 3.532 -11.685 1.00 0.00 O ATOM 1312 OD2 ASP B 58 9.085 1.999 -12.409 1.00 0.00 O ATOM 0 H ASP B 58 11.842 0.041 -9.027 1.00 0.00 H new ATOM 0 HA ASP B 58 12.442 2.397 -10.381 1.00 0.00 H new ATOM 0 HB2 ASP B 58 10.968 0.530 -11.170 1.00 0.00 H new ATOM 0 HB3 ASP B 58 9.746 1.022 -10.014 1.00 0.00 H new ATOM 1317 N TYR B 59 10.250 2.804 -7.937 1.00 0.00 N ATOM 1318 CA TYR B 59 9.625 3.803 -7.078 1.00 0.00 C ATOM 1319 C TYR B 59 10.645 4.440 -6.138 1.00 0.00 C ATOM 1320 O TYR B 59 10.499 5.598 -5.747 1.00 0.00 O ATOM 1321 CB TYR B 59 8.487 3.179 -6.265 1.00 0.00 C ATOM 1322 CG TYR B 59 7.338 2.664 -7.107 1.00 0.00 C ATOM 1323 CD1 TYR B 59 7.517 1.617 -8.003 1.00 0.00 C ATOM 1324 CD2 TYR B 59 6.073 3.229 -7.004 1.00 0.00 C ATOM 1325 CE1 TYR B 59 6.469 1.148 -8.771 1.00 0.00 C ATOM 1326 CE2 TYR B 59 5.020 2.765 -7.768 1.00 0.00 C ATOM 1327 CZ TYR B 59 5.222 1.725 -8.650 1.00 0.00 C ATOM 1328 OH TYR B 59 4.175 1.259 -9.411 1.00 0.00 O ATOM 0 H TYR B 59 10.010 1.840 -7.705 1.00 0.00 H new ATOM 0 HA TYR B 59 9.217 4.582 -7.722 1.00 0.00 H new ATOM 0 HB2 TYR B 59 8.887 2.356 -5.672 1.00 0.00 H new ATOM 0 HB3 TYR B 59 8.106 3.921 -5.564 1.00 0.00 H new ATOM 0 HD1 TYR B 59 8.492 1.162 -8.101 1.00 0.00 H new ATOM 0 HD2 TYR B 59 5.910 4.045 -6.315 1.00 0.00 H new ATOM 0 HE1 TYR B 59 6.625 0.334 -9.463 1.00 0.00 H new ATOM 0 HE2 TYR B 59 4.043 3.215 -7.675 1.00 0.00 H new ATOM 0 HH TYR B 59 3.366 1.773 -9.204 1.00 0.00 H new ATOM 1338 N ASN B 60 11.670 3.671 -5.772 1.00 0.00 N ATOM 1339 CA ASN B 60 12.713 4.153 -4.868 1.00 0.00 C ATOM 1340 C ASN B 60 12.123 4.451 -3.491 1.00 0.00 C ATOM 1341 O ASN B 60 12.267 5.553 -2.960 1.00 0.00 O ATOM 1342 CB ASN B 60 13.392 5.401 -5.445 1.00 0.00 C ATOM 1343 CG ASN B 60 14.665 5.768 -4.706 1.00 0.00 C ATOM 1344 OD1 ASN B 60 14.644 6.065 -3.512 1.00 0.00 O ATOM 1345 ND2 ASN B 60 15.787 5.745 -5.416 1.00 0.00 N ATOM 0 H ASN B 60 11.800 2.710 -6.088 1.00 0.00 H new ATOM 0 HA ASN B 60 13.467 3.373 -4.761 1.00 0.00 H new ATOM 0 HB2 ASN B 60 13.623 5.231 -6.497 1.00 0.00 H new ATOM 0 HB3 ASN B 60 12.697 6.240 -5.403 1.00 0.00 H new ATOM 0 HD21 ASN B 60 16.676 5.979 -4.973 1.00 0.00 H new ATOM 0 HD22 ASN B 60 15.760 5.493 -6.404 1.00 0.00 H new ATOM 1352 N ILE B 61 11.445 3.458 -2.926 1.00 0.00 N ATOM 1353 CA ILE B 61 10.816 3.597 -1.617 1.00 0.00 C ATOM 1354 C ILE B 61 11.856 3.727 -0.507 1.00 0.00 C ATOM 1355 O ILE B 61 12.804 2.946 -0.435 1.00 0.00 O ATOM 1356 CB ILE B 61 9.901 2.395 -1.314 1.00 0.00 C ATOM 1357 CG1 ILE B 61 8.870 2.226 -2.431 1.00 0.00 C ATOM 1358 CG2 ILE B 61 9.213 2.577 0.032 1.00 0.00 C ATOM 1359 CD1 ILE B 61 7.969 1.022 -2.254 1.00 0.00 C ATOM 0 H ILE B 61 11.316 2.543 -3.357 1.00 0.00 H new ATOM 0 HA ILE B 61 10.218 4.508 -1.648 1.00 0.00 H new ATOM 0 HB ILE B 61 10.510 1.492 -1.265 1.00 0.00 H new ATOM 0 HG12 ILE B 61 8.255 3.124 -2.484 1.00 0.00 H new ATOM 0 HG13 ILE B 61 9.392 2.141 -3.384 1.00 0.00 H new ATOM 0 HG21 ILE B 61 8.570 1.719 0.231 1.00 0.00 H new ATOM 0 HG22 ILE B 61 9.965 2.657 0.817 1.00 0.00 H new ATOM 0 HG23 ILE B 61 8.611 3.485 0.013 1.00 0.00 H new ATOM 0 HD11 ILE B 61 7.265 0.969 -3.085 1.00 0.00 H new ATOM 0 HD12 ILE B 61 8.574 0.115 -2.232 1.00 0.00 H new ATOM 0 HD13 ILE B 61 7.419 1.114 -1.318 1.00 0.00 H new ATOM 1371 N GLN B 62 11.664 4.719 0.359 1.00 0.00 N ATOM 1372 CA GLN B 62 12.576 4.959 1.473 1.00 0.00 C ATOM 1373 C GLN B 62 12.357 3.942 2.591 1.00 0.00 C ATOM 1374 O GLN B 62 11.232 3.506 2.833 1.00 0.00 O ATOM 1375 CB GLN B 62 12.391 6.377 2.017 1.00 0.00 C ATOM 1376 CG GLN B 62 12.655 7.465 0.989 1.00 0.00 C ATOM 1377 CD GLN B 62 14.064 7.408 0.431 1.00 0.00 C ATOM 1378 OE1 GLN B 62 15.042 7.521 1.169 1.00 0.00 O ATOM 1379 NE2 GLN B 62 14.173 7.232 -0.880 1.00 0.00 N ATOM 0 H GLN B 62 10.882 5.372 0.310 1.00 0.00 H new ATOM 0 HA GLN B 62 13.595 4.849 1.101 1.00 0.00 H new ATOM 0 HB2 GLN B 62 11.373 6.483 2.392 1.00 0.00 H new ATOM 0 HB3 GLN B 62 13.060 6.521 2.866 1.00 0.00 H new ATOM 0 HG2 GLN B 62 11.940 7.369 0.172 1.00 0.00 H new ATOM 0 HG3 GLN B 62 12.488 8.440 1.446 1.00 0.00 H new ATOM 0 HE21 GLN B 62 13.335 7.143 -1.454 1.00 0.00 H new ATOM 0 HE22 GLN B 62 15.095 7.186 -1.313 1.00 0.00 H new ATOM 1388 N LYS B 63 13.439 3.573 3.270 1.00 0.00 N ATOM 1389 CA LYS B 63 13.375 2.614 4.361 1.00 0.00 C ATOM 1390 C LYS B 63 12.379 3.063 5.430 1.00 0.00 C ATOM 1391 O LYS B 63 12.231 4.259 5.689 1.00 0.00 O ATOM 1392 CB LYS B 63 14.765 2.436 4.973 1.00 0.00 C ATOM 1393 CG LYS B 63 14.811 1.386 6.063 1.00 0.00 C ATOM 1394 CD LYS B 63 16.212 1.206 6.633 1.00 0.00 C ATOM 1395 CE LYS B 63 16.659 2.412 7.451 1.00 0.00 C ATOM 1396 NZ LYS B 63 16.854 3.627 6.611 1.00 0.00 N ATOM 0 H LYS B 63 14.376 3.928 3.080 1.00 0.00 H new ATOM 0 HA LYS B 63 13.031 1.659 3.963 1.00 0.00 H new ATOM 0 HB2 LYS B 63 15.468 2.164 4.186 1.00 0.00 H new ATOM 0 HB3 LYS B 63 15.099 3.389 5.383 1.00 0.00 H new ATOM 0 HG2 LYS B 63 14.128 1.668 6.865 1.00 0.00 H new ATOM 0 HG3 LYS B 63 14.459 0.435 5.664 1.00 0.00 H new ATOM 0 HD2 LYS B 63 16.236 0.315 7.260 1.00 0.00 H new ATOM 0 HD3 LYS B 63 16.916 1.041 5.817 1.00 0.00 H new ATOM 0 HE2 LYS B 63 15.916 2.621 8.221 1.00 0.00 H new ATOM 0 HE3 LYS B 63 17.591 2.175 7.964 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 17.680 4.158 6.955 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 17.011 3.344 5.623 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 16.007 4.228 6.669 1.00 0.00 H new ATOM 1410 N GLU B 64 11.693 2.095 6.039 1.00 0.00 N ATOM 1411 CA GLU B 64 10.701 2.379 7.076 1.00 0.00 C ATOM 1412 C GLU B 64 9.544 3.199 6.513 1.00 0.00 C ATOM 1413 O GLU B 64 9.050 4.124 7.160 1.00 0.00 O ATOM 1414 CB GLU B 64 11.346 3.117 8.254 1.00 0.00 C ATOM 1415 CG GLU B 64 12.441 2.324 8.952 1.00 0.00 C ATOM 1416 CD GLU B 64 11.921 1.069 9.627 1.00 0.00 C ATOM 1417 OE1 GLU B 64 11.375 0.195 8.922 1.00 0.00 O ATOM 1418 OE2 GLU B 64 12.062 0.959 10.863 1.00 0.00 O ATOM 0 H GLU B 64 11.807 1.103 5.830 1.00 0.00 H new ATOM 0 HA GLU B 64 10.308 1.427 7.433 1.00 0.00 H new ATOM 0 HB2 GLU B 64 11.764 4.058 7.896 1.00 0.00 H new ATOM 0 HB3 GLU B 64 10.573 3.368 8.980 1.00 0.00 H new ATOM 0 HG2 GLU B 64 13.204 2.049 8.224 1.00 0.00 H new ATOM 0 HG3 GLU B 64 12.924 2.958 9.696 1.00 0.00 H new ATOM 1425 N SER B 65 9.116 2.851 5.304 1.00 0.00 N ATOM 1426 CA SER B 65 8.016 3.547 4.646 1.00 0.00 C ATOM 1427 C SER B 65 6.669 2.957 5.051 1.00 0.00 C ATOM 1428 O SER B 65 6.544 1.747 5.250 1.00 0.00 O ATOM 1429 CB SER B 65 8.173 3.476 3.128 1.00 0.00 C ATOM 1430 OG SER B 65 7.101 4.133 2.474 1.00 0.00 O ATOM 0 H SER B 65 9.516 2.088 4.758 1.00 0.00 H new ATOM 0 HA SER B 65 8.046 4.589 4.963 1.00 0.00 H new ATOM 0 HB2 SER B 65 9.118 3.934 2.835 1.00 0.00 H new ATOM 0 HB3 SER B 65 8.212 2.434 2.811 1.00 0.00 H new ATOM 0 HG SER B 65 7.455 4.836 1.891 1.00 0.00 H new ATOM 1436 N THR B 66 5.664 3.818 5.167 1.00 0.00 N ATOM 1437 CA THR B 66 4.324 3.382 5.538 1.00 0.00 C ATOM 1438 C THR B 66 3.388 3.407 4.330 1.00 0.00 C ATOM 1439 O THR B 66 2.940 4.472 3.904 1.00 0.00 O ATOM 1440 CB THR B 66 3.737 4.266 6.654 1.00 0.00 C ATOM 1441 OG1 THR B 66 4.591 4.234 7.804 1.00 0.00 O ATOM 1442 CG2 THR B 66 2.343 3.798 7.042 1.00 0.00 C ATOM 0 H THR B 66 5.752 4.822 5.009 1.00 0.00 H new ATOM 0 HA THR B 66 4.409 2.360 5.906 1.00 0.00 H new ATOM 0 HB THR B 66 3.669 5.287 6.278 1.00 0.00 H new ATOM 0 HG1 THR B 66 4.212 4.800 8.509 1.00 0.00 H new ATOM 0 HG21 THR B 66 1.951 4.439 7.832 1.00 0.00 H new ATOM 0 HG22 THR B 66 1.687 3.850 6.173 1.00 0.00 H new ATOM 0 HG23 THR B 66 2.391 2.769 7.399 1.00 0.00 H new ATOM 1450 N LEU B 67 3.096 2.228 3.784 1.00 0.00 N ATOM 1451 CA LEU B 67 2.210 2.117 2.627 1.00 0.00 C ATOM 1452 C LEU B 67 0.767 1.874 3.058 1.00 0.00 C ATOM 1453 O LEU B 67 0.496 1.025 3.907 1.00 0.00 O ATOM 1454 CB LEU B 67 2.668 0.990 1.696 1.00 0.00 C ATOM 1455 CG LEU B 67 3.891 1.307 0.828 1.00 0.00 C ATOM 1456 CD1 LEU B 67 5.127 1.527 1.684 1.00 0.00 C ATOM 1457 CD2 LEU B 67 4.132 0.190 -0.177 1.00 0.00 C ATOM 0 H LEU B 67 3.459 1.337 4.124 1.00 0.00 H new ATOM 0 HA LEU B 67 2.257 3.063 2.088 1.00 0.00 H new ATOM 0 HB2 LEU B 67 2.891 0.111 2.301 1.00 0.00 H new ATOM 0 HB3 LEU B 67 1.838 0.724 1.041 1.00 0.00 H new ATOM 0 HG LEU B 67 3.689 2.230 0.284 1.00 0.00 H new ATOM 0 HD11 LEU B 67 5.979 1.750 1.042 1.00 0.00 H new ATOM 0 HD12 LEU B 67 4.956 2.362 2.363 1.00 0.00 H new ATOM 0 HD13 LEU B 67 5.334 0.626 2.262 1.00 0.00 H new ATOM 0 HD21 LEU B 67 5.004 0.430 -0.786 1.00 0.00 H new ATOM 0 HD22 LEU B 67 4.307 -0.746 0.354 1.00 0.00 H new ATOM 0 HD23 LEU B 67 3.258 0.084 -0.820 1.00 0.00 H new ATOM 1469 N HIS B 68 -0.156 2.623 2.461 1.00 0.00 N ATOM 1470 CA HIS B 68 -1.575 2.491 2.776 1.00 0.00 C ATOM 1471 C HIS B 68 -2.196 1.311 2.034 1.00 0.00 C ATOM 1472 O HIS B 68 -1.873 1.054 0.874 1.00 0.00 O ATOM 1473 CB HIS B 68 -2.318 3.777 2.424 1.00 0.00 C ATOM 1474 CG HIS B 68 -1.827 4.976 3.173 1.00 0.00 C ATOM 1475 ND1 HIS B 68 -1.866 5.075 4.548 1.00 0.00 N ATOM 1476 CD2 HIS B 68 -1.285 6.135 2.730 1.00 0.00 C ATOM 1477 CE1 HIS B 68 -1.371 6.242 4.919 1.00 0.00 C ATOM 1478 NE2 HIS B 68 -1.011 6.904 3.834 1.00 0.00 N ATOM 0 H HIS B 68 0.054 3.329 1.755 1.00 0.00 H new ATOM 0 HA HIS B 68 -1.665 2.308 3.847 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -2.220 3.962 1.354 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -3.380 3.641 2.628 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -1.102 6.404 1.700 1.00 0.00 H new ATOM 0 HE1 HIS B 68 -1.277 6.595 5.935 1.00 0.00 H new ATOM 0 HE2 HIS B 68 -0.596 7.836 3.819 1.00 0.00 H new ATOM 1487 N LEU B 69 -3.088 0.596 2.712 1.00 0.00 N ATOM 1488 CA LEU B 69 -3.755 -0.560 2.121 1.00 0.00 C ATOM 1489 C LEU B 69 -5.273 -0.379 2.112 1.00 0.00 C ATOM 1490 O LEU B 69 -5.872 -0.042 3.132 1.00 0.00 O ATOM 1491 CB LEU B 69 -3.367 -1.831 2.893 1.00 0.00 C ATOM 1492 CG LEU B 69 -4.175 -3.096 2.566 1.00 0.00 C ATOM 1493 CD1 LEU B 69 -3.343 -4.338 2.846 1.00 0.00 C ATOM 1494 CD2 LEU B 69 -5.460 -3.138 3.381 1.00 0.00 C ATOM 0 H LEU B 69 -3.366 0.797 3.673 1.00 0.00 H new ATOM 0 HA LEU B 69 -3.429 -0.656 1.085 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -2.314 -2.039 2.704 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -3.465 -1.628 3.959 1.00 0.00 H new ATOM 0 HG LEU B 69 -4.435 -3.072 1.508 1.00 0.00 H new ATOM 0 HD11 LEU B 69 -3.927 -5.228 2.610 1.00 0.00 H new ATOM 0 HD12 LEU B 69 -2.444 -4.320 2.230 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -3.061 -4.357 3.899 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -6.018 -4.042 3.135 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -5.217 -3.140 4.444 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -6.067 -2.263 3.149 1.00 0.00 H new ATOM 1506 N VAL B 70 -5.890 -0.632 0.958 1.00 0.00 N ATOM 1507 CA VAL B 70 -7.338 -0.524 0.816 1.00 0.00 C ATOM 1508 C VAL B 70 -7.900 -1.838 0.296 1.00 0.00 C ATOM 1509 O VAL B 70 -7.488 -2.323 -0.758 1.00 0.00 O ATOM 1510 CB VAL B 70 -7.744 0.611 -0.150 1.00 0.00 C ATOM 1511 CG1 VAL B 70 -9.260 0.691 -0.287 1.00 0.00 C ATOM 1512 CG2 VAL B 70 -7.180 1.945 0.313 1.00 0.00 C ATOM 0 H VAL B 70 -5.405 -0.914 0.106 1.00 0.00 H new ATOM 0 HA VAL B 70 -7.746 -0.294 1.800 1.00 0.00 H new ATOM 0 HB VAL B 70 -7.323 0.384 -1.129 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -9.521 1.497 -0.972 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -9.640 -0.253 -0.676 1.00 0.00 H new ATOM 0 HG13 VAL B 70 -9.704 0.886 0.689 1.00 0.00 H new ATOM 0 HG21 VAL B 70 -7.480 2.728 -0.383 1.00 0.00 H new ATOM 0 HG22 VAL B 70 -7.563 2.177 1.307 1.00 0.00 H new ATOM 0 HG23 VAL B 70 -6.092 1.888 0.348 1.00 0.00 H new ATOM 1522 N LEU B 71 -8.828 -2.422 1.040 1.00 0.00 N ATOM 1523 CA LEU B 71 -9.422 -3.689 0.644 1.00 0.00 C ATOM 1524 C LEU B 71 -10.736 -3.482 -0.097 1.00 0.00 C ATOM 1525 O LEU B 71 -11.690 -2.924 0.446 1.00 0.00 O ATOM 1526 CB LEU B 71 -9.633 -4.572 1.874 1.00 0.00 C ATOM 1527 CG LEU B 71 -8.355 -4.896 2.651 1.00 0.00 C ATOM 1528 CD1 LEU B 71 -8.675 -5.673 3.916 1.00 0.00 C ATOM 1529 CD2 LEU B 71 -7.384 -5.677 1.778 1.00 0.00 C ATOM 0 H LEU B 71 -9.184 -2.041 1.917 1.00 0.00 H new ATOM 0 HA LEU B 71 -8.735 -4.187 -0.040 1.00 0.00 H new ATOM 0 HB2 LEU B 71 -10.335 -4.077 2.545 1.00 0.00 H new ATOM 0 HB3 LEU B 71 -10.098 -5.506 1.559 1.00 0.00 H new ATOM 0 HG LEU B 71 -7.884 -3.956 2.938 1.00 0.00 H new ATOM 0 HD11 LEU B 71 -7.751 -5.892 4.452 1.00 0.00 H new ATOM 0 HD12 LEU B 71 -9.331 -5.079 4.552 1.00 0.00 H new ATOM 0 HD13 LEU B 71 -9.172 -6.607 3.653 1.00 0.00 H new ATOM 0 HD21 LEU B 71 -6.481 -5.899 2.347 1.00 0.00 H new ATOM 0 HD22 LEU B 71 -7.850 -6.609 1.459 1.00 0.00 H new ATOM 0 HD23 LEU B 71 -7.124 -5.083 0.902 1.00 0.00 H new ATOM 1541 N ARG B 72 -10.772 -3.945 -1.342 1.00 0.00 N ATOM 1542 CA ARG B 72 -11.963 -3.828 -2.175 1.00 0.00 C ATOM 1543 C ARG B 72 -13.148 -4.546 -1.538 1.00 0.00 C ATOM 1544 O ARG B 72 -13.016 -5.669 -1.051 1.00 0.00 O ATOM 1545 CB ARG B 72 -11.700 -4.408 -3.570 1.00 0.00 C ATOM 1546 CG ARG B 72 -10.909 -3.490 -4.492 1.00 0.00 C ATOM 1547 CD ARG B 72 -9.525 -3.177 -3.944 1.00 0.00 C ATOM 1548 NE ARG B 72 -8.781 -2.273 -4.820 1.00 0.00 N ATOM 1549 CZ ARG B 72 -9.170 -1.033 -5.110 1.00 0.00 C ATOM 1550 NH1 ARG B 72 -10.276 -0.534 -4.573 1.00 0.00 N ATOM 1551 NH2 ARG B 72 -8.446 -0.288 -5.933 1.00 0.00 N ATOM 0 H ARG B 72 -9.985 -4.407 -1.798 1.00 0.00 H new ATOM 0 HA ARG B 72 -12.204 -2.769 -2.265 1.00 0.00 H new ATOM 0 HB2 ARG B 72 -11.160 -5.349 -3.463 1.00 0.00 H new ATOM 0 HB3 ARG B 72 -12.656 -4.640 -4.040 1.00 0.00 H new ATOM 0 HG2 ARG B 72 -10.812 -3.958 -5.472 1.00 0.00 H new ATOM 0 HG3 ARG B 72 -11.460 -2.560 -4.636 1.00 0.00 H new ATOM 0 HD2 ARG B 72 -9.620 -2.728 -2.955 1.00 0.00 H new ATOM 0 HD3 ARG B 72 -8.966 -4.104 -3.821 1.00 0.00 H new ATOM 0 HE ARG B 72 -7.913 -2.612 -5.233 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -10.833 -1.101 -3.934 1.00 0.00 H new ATOM 0 HH12 ARG B 72 -10.569 0.417 -4.799 1.00 0.00 H new ATOM 0 HH21 ARG B 72 -7.592 -0.665 -6.344 1.00 0.00 H new ATOM 0 HH22 ARG B 72 -8.743 0.662 -6.156 1.00 0.00 H new ATOM 1565 N LEU B 73 -14.306 -3.893 -1.548 1.00 0.00 N ATOM 1566 CA LEU B 73 -15.515 -4.473 -0.975 1.00 0.00 C ATOM 1567 C LEU B 73 -15.888 -5.761 -1.702 1.00 0.00 C ATOM 1568 O LEU B 73 -15.867 -5.814 -2.932 1.00 0.00 O ATOM 1569 CB LEU B 73 -16.675 -3.476 -1.055 1.00 0.00 C ATOM 1570 CG LEU B 73 -16.435 -2.137 -0.352 1.00 0.00 C ATOM 1571 CD1 LEU B 73 -17.631 -1.217 -0.541 1.00 0.00 C ATOM 1572 CD2 LEU B 73 -16.155 -2.350 1.128 1.00 0.00 C ATOM 0 H LEU B 73 -14.432 -2.963 -1.946 1.00 0.00 H new ATOM 0 HA LEU B 73 -15.319 -4.705 0.072 1.00 0.00 H new ATOM 0 HB2 LEU B 73 -16.895 -3.282 -2.105 1.00 0.00 H new ATOM 0 HB3 LEU B 73 -17.562 -3.940 -0.624 1.00 0.00 H new ATOM 0 HG LEU B 73 -15.561 -1.665 -0.801 1.00 0.00 H new ATOM 0 HD11 LEU B 73 -17.445 -0.270 -0.035 1.00 0.00 H new ATOM 0 HD12 LEU B 73 -17.787 -1.036 -1.605 1.00 0.00 H new ATOM 0 HD13 LEU B 73 -18.520 -1.685 -0.119 1.00 0.00 H new ATOM 0 HD21 LEU B 73 -15.987 -1.386 1.609 1.00 0.00 H new ATOM 0 HD22 LEU B 73 -17.009 -2.844 1.592 1.00 0.00 H new ATOM 0 HD23 LEU B 73 -15.268 -2.973 1.245 1.00 0.00 H new ATOM 1584 N ARG B 74 -16.225 -6.796 -0.932 1.00 0.00 N ATOM 1585 CA ARG B 74 -16.601 -8.093 -1.495 1.00 0.00 C ATOM 1586 C ARG B 74 -15.418 -8.739 -2.215 1.00 0.00 C ATOM 1587 O ARG B 74 -14.718 -8.089 -2.991 1.00 0.00 O ATOM 1588 CB ARG B 74 -17.780 -7.936 -2.460 1.00 0.00 C ATOM 1589 CG ARG B 74 -19.030 -7.364 -1.809 1.00 0.00 C ATOM 1590 CD ARG B 74 -20.139 -7.147 -2.828 1.00 0.00 C ATOM 1591 NE ARG B 74 -21.337 -6.564 -2.226 1.00 0.00 N ATOM 1592 CZ ARG B 74 -22.067 -7.167 -1.290 1.00 0.00 C ATOM 1593 NH1 ARG B 74 -21.727 -8.372 -0.851 1.00 0.00 N ATOM 1594 NH2 ARG B 74 -23.139 -6.565 -0.795 1.00 0.00 N ATOM 0 H ARG B 74 -16.245 -6.761 0.087 1.00 0.00 H new ATOM 0 HA ARG B 74 -16.901 -8.743 -0.673 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -17.480 -7.288 -3.283 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -18.018 -8.909 -2.891 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -19.378 -8.042 -1.029 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -18.789 -6.418 -1.325 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -19.778 -6.492 -3.621 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -20.395 -8.099 -3.292 1.00 0.00 H new ATOM 0 HE ARG B 74 -21.631 -5.640 -2.542 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -20.904 -8.840 -1.231 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -22.289 -8.831 -0.134 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -23.405 -5.639 -1.131 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -23.698 -7.027 -0.078 1.00 0.00 H new ATOM 1608 N GLY B 75 -15.199 -10.025 -1.950 1.00 0.00 N ATOM 1609 CA GLY B 75 -14.099 -10.734 -2.580 1.00 0.00 C ATOM 1610 C GLY B 75 -14.042 -12.195 -2.180 1.00 0.00 C ATOM 1611 O GLY B 75 -13.817 -13.067 -3.020 1.00 0.00 O ATOM 0 H GLY B 75 -15.762 -10.587 -1.312 1.00 0.00 H new ATOM 0 HA2 GLY B 75 -14.198 -10.661 -3.663 1.00 0.00 H new ATOM 0 HA3 GLY B 75 -13.159 -10.251 -2.312 1.00 0.00 H new ATOM 1615 N GLY B 76 -14.246 -12.463 -0.893 1.00 0.00 N ATOM 1616 CA GLY B 76 -14.213 -13.829 -0.404 1.00 0.00 C ATOM 1617 C GLY B 76 -15.248 -14.711 -1.075 1.00 0.00 C ATOM 1618 O GLY B 76 -16.389 -14.242 -1.270 1.00 0.00 O ATOM 1619 OXT GLY B 76 -14.918 -15.869 -1.405 1.00 0.00 O ATOM 0 H GLY B 76 -14.434 -11.758 -0.180 1.00 0.00 H new ATOM 0 HA2 GLY B 76 -13.220 -14.247 -0.571 1.00 0.00 H new ATOM 0 HA3 GLY B 76 -14.382 -13.830 0.673 1.00 0.00 H new TER 1623 GLY B 76