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: B 2 GLN : amide:sc= -4.83! C(o=-9.2!,f=-0.87!) USER MOD Set 1.2: B 63 LYS NZ :NH3+ -174:sc= -4.42! (180deg=-1.74!) USER MOD Set 2.1: B 7 THR OG1 : rot 113:sc= 0.182 USER MOD Set 2.2: B 9 THR OG1 : rot 180:sc= 0.571 USER MOD Single : A 255 TYR OH : rot 180:sc= 0 USER MOD Single : A 265 LYS NZ :NH3+ 147:sc= -0.0274 (180deg=-1.28) USER MOD Single : A 270 SER OG : rot -26:sc= 1.05 USER MOD Single : A 272 LYS NZ :NH3+ -165:sc= -0.0611 (180deg=-0.28) USER MOD Single : A 274 SER OG : rot -28:sc= 1.16 USER MOD Single : A 276 ASN : amide:sc= -0.839 K(o=-0.84,f=-5.3!) USER MOD Single : A 277 SER OG : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -164:sc= 0.894 (180deg=0.227!) USER MOD Single : B 6 LYS NZ :NH3+ 161:sc= -0.0937 (180deg=-0.473) USER MOD Single : B 11 LYS NZ :NH3+ 135:sc= 0.0747 (180deg=-0.192) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot -24:sc= 0.705 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 25 ASN : amide:sc= -2.52! C(o=-2.5!,f=-6.1!) USER MOD Single : B 27 LYS NZ :NH3+ -179:sc= 0.353 (180deg=0.334) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 29 LYS NZ :NH3+ -167:sc= -0.0601 (180deg=-0.364) USER MOD Single : B 31 GLN : amide:sc= -3.42! K(o=-3.4!,f=-1.4) USER MOD Single : B 33 LYS NZ :NH3+ -145:sc= -0.988 (180deg=-3.16!) USER MOD Single : B 40 GLN : amide:sc= -1.13! K(o=-1.1!,f=0) USER MOD Single : B 41 GLN : amide:sc= -6.98! C(o=-7!,f=-9.2!) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 GLN : amide:sc= -6.42! K(o=-6.4!,f=-3.5) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 59 TYR OH : rot -137:sc= 0.361 USER MOD Single : B 60 ASN : amide:sc= -0.745 K(o=-0.75,f=-3.3) USER MOD Single : B 62 GLN : amide:sc= -1.01 K(o=-1,f=-3.3!) USER MOD Single : B 65 SER OG : rot 168:sc= 0.299 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 HIS : no HD1:sc= -3.18 K(o=-3.2,f=-5.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 255 23.129 0.060 2.192 1.00 0.00 N ATOM 2 CA TYR A 255 22.688 -0.687 3.399 1.00 0.00 C ATOM 3 C TYR A 255 21.562 -1.671 3.072 1.00 0.00 C ATOM 4 O TYR A 255 20.720 -1.401 2.217 1.00 0.00 O ATOM 5 CB TYR A 255 22.250 0.321 4.470 1.00 0.00 C ATOM 6 CG TYR A 255 21.329 1.415 3.967 1.00 0.00 C ATOM 7 CD1 TYR A 255 20.064 1.124 3.471 1.00 0.00 C ATOM 8 CD2 TYR A 255 21.727 2.746 4.002 1.00 0.00 C ATOM 9 CE1 TYR A 255 19.225 2.125 3.021 1.00 0.00 C ATOM 10 CE2 TYR A 255 20.893 3.753 3.555 1.00 0.00 C ATOM 11 CZ TYR A 255 19.644 3.438 3.064 1.00 0.00 C ATOM 12 OH TYR A 255 18.811 4.438 2.618 1.00 0.00 O ATOM 0 HA TYR A 255 23.521 -1.281 3.776 1.00 0.00 H new ATOM 0 HB2 TYR A 255 21.748 -0.218 5.274 1.00 0.00 H new ATOM 0 HB3 TYR A 255 23.138 0.782 4.902 1.00 0.00 H new ATOM 0 HD1 TYR A 255 19.731 0.097 3.437 1.00 0.00 H new ATOM 0 HD2 TYR A 255 22.705 2.998 4.385 1.00 0.00 H new ATOM 0 HE1 TYR A 255 18.246 1.880 2.637 1.00 0.00 H new ATOM 0 HE2 TYR A 255 21.218 4.782 3.590 1.00 0.00 H new ATOM 0 HH TYR A 255 19.257 5.305 2.718 1.00 0.00 H new ATOM 24 N PRO A 256 21.551 -2.842 3.742 1.00 0.00 N ATOM 25 CA PRO A 256 20.541 -3.885 3.522 1.00 0.00 C ATOM 26 C PRO A 256 19.182 -3.533 4.127 1.00 0.00 C ATOM 27 O PRO A 256 18.596 -4.333 4.859 1.00 0.00 O ATOM 28 CB PRO A 256 21.128 -5.121 4.225 1.00 0.00 C ATOM 29 CG PRO A 256 22.524 -4.749 4.608 1.00 0.00 C ATOM 30 CD PRO A 256 22.529 -3.257 4.753 1.00 0.00 C ATOM 0 HA PRO A 256 20.350 -4.030 2.459 1.00 0.00 H new ATOM 0 HB2 PRO A 256 20.540 -5.387 5.103 1.00 0.00 H new ATOM 0 HB3 PRO A 256 21.122 -5.987 3.563 1.00 0.00 H new ATOM 0 HG2 PRO A 256 22.815 -5.233 5.541 1.00 0.00 H new ATOM 0 HG3 PRO A 256 23.236 -5.069 3.847 1.00 0.00 H new ATOM 0 HD2 PRO A 256 22.235 -2.945 5.755 1.00 0.00 H new ATOM 0 HD3 PRO A 256 23.515 -2.833 4.563 1.00 0.00 H new ATOM 38 N GLU A 257 18.683 -2.341 3.818 1.00 0.00 N ATOM 39 CA GLU A 257 17.392 -1.895 4.332 1.00 0.00 C ATOM 40 C GLU A 257 16.679 -1.015 3.310 1.00 0.00 C ATOM 41 O GLU A 257 16.143 0.041 3.645 1.00 0.00 O ATOM 42 CB GLU A 257 17.571 -1.125 5.643 1.00 0.00 C ATOM 43 CG GLU A 257 18.180 -1.953 6.764 1.00 0.00 C ATOM 44 CD GLU A 257 18.345 -1.163 8.047 1.00 0.00 C ATOM 45 OE1 GLU A 257 17.324 -0.685 8.585 1.00 0.00 O ATOM 46 OE2 GLU A 257 19.494 -1.023 8.514 1.00 0.00 O ATOM 0 H GLU A 257 19.152 -1.666 3.214 1.00 0.00 H new ATOM 0 HA GLU A 257 16.782 -2.779 4.521 1.00 0.00 H new ATOM 0 HB2 GLU A 257 18.204 -0.257 5.460 1.00 0.00 H new ATOM 0 HB3 GLU A 257 16.601 -0.749 5.968 1.00 0.00 H new ATOM 0 HG2 GLU A 257 17.548 -2.821 6.954 1.00 0.00 H new ATOM 0 HG3 GLU A 257 19.152 -2.330 6.446 1.00 0.00 H new ATOM 53 N ASP A 258 16.681 -1.463 2.060 1.00 0.00 N ATOM 54 CA ASP A 258 16.039 -0.729 0.977 1.00 0.00 C ATOM 55 C ASP A 258 14.533 -0.630 1.196 1.00 0.00 C ATOM 56 O ASP A 258 13.870 0.234 0.626 1.00 0.00 O ATOM 57 CB ASP A 258 16.323 -1.405 -0.366 1.00 0.00 C ATOM 58 CG ASP A 258 17.806 -1.489 -0.672 1.00 0.00 C ATOM 59 OD1 ASP A 258 18.613 -1.020 0.158 1.00 0.00 O ATOM 60 OD2 ASP A 258 18.160 -2.025 -1.743 1.00 0.00 O ATOM 0 H ASP A 258 17.123 -2.336 1.771 1.00 0.00 H new ATOM 0 HA ASP A 258 16.453 0.279 0.967 1.00 0.00 H new ATOM 0 HB2 ASP A 258 15.899 -2.409 -0.360 1.00 0.00 H new ATOM 0 HB3 ASP A 258 15.822 -0.852 -1.161 1.00 0.00 H new ATOM 65 N GLU A 259 13.997 -1.530 2.015 1.00 0.00 N ATOM 66 CA GLU A 259 12.569 -1.555 2.300 1.00 0.00 C ATOM 67 C GLU A 259 12.096 -0.245 2.926 1.00 0.00 C ATOM 68 O GLU A 259 11.102 0.335 2.491 1.00 0.00 O ATOM 69 CB GLU A 259 12.248 -2.726 3.229 1.00 0.00 C ATOM 70 CG GLU A 259 10.791 -2.788 3.651 1.00 0.00 C ATOM 71 CD GLU A 259 9.843 -3.011 2.487 1.00 0.00 C ATOM 72 OE1 GLU A 259 10.324 -3.160 1.343 1.00 0.00 O ATOM 73 OE2 GLU A 259 8.617 -3.038 2.720 1.00 0.00 O ATOM 0 H GLU A 259 14.534 -2.253 2.494 1.00 0.00 H new ATOM 0 HA GLU A 259 12.040 -1.680 1.356 1.00 0.00 H new ATOM 0 HB2 GLU A 259 12.512 -3.658 2.729 1.00 0.00 H new ATOM 0 HB3 GLU A 259 12.872 -2.654 4.120 1.00 0.00 H new ATOM 0 HG2 GLU A 259 10.663 -3.592 4.376 1.00 0.00 H new ATOM 0 HG3 GLU A 259 10.525 -1.859 4.155 1.00 0.00 H new ATOM 80 N GLU A 260 12.807 0.213 3.951 1.00 0.00 N ATOM 81 CA GLU A 260 12.448 1.451 4.634 1.00 0.00 C ATOM 82 C GLU A 260 12.608 2.656 3.713 1.00 0.00 C ATOM 83 O GLU A 260 11.733 3.518 3.647 1.00 0.00 O ATOM 84 CB GLU A 260 13.298 1.636 5.894 1.00 0.00 C ATOM 85 CG GLU A 260 13.018 0.609 6.981 1.00 0.00 C ATOM 86 CD GLU A 260 13.334 -0.809 6.546 1.00 0.00 C ATOM 87 OE1 GLU A 260 14.504 -1.079 6.206 1.00 0.00 O ATOM 88 OE2 GLU A 260 12.410 -1.650 6.547 1.00 0.00 O ATOM 0 H GLU A 260 13.633 -0.253 4.326 1.00 0.00 H new ATOM 0 HA GLU A 260 11.399 1.379 4.922 1.00 0.00 H new ATOM 0 HB2 GLU A 260 14.352 1.584 5.621 1.00 0.00 H new ATOM 0 HB3 GLU A 260 13.122 2.634 6.296 1.00 0.00 H new ATOM 0 HG2 GLU A 260 13.607 0.853 7.865 1.00 0.00 H new ATOM 0 HG3 GLU A 260 11.969 0.670 7.270 1.00 0.00 H new ATOM 95 N GLU A 261 13.731 2.710 3.005 1.00 0.00 N ATOM 96 CA GLU A 261 14.006 3.811 2.088 1.00 0.00 C ATOM 97 C GLU A 261 12.950 3.885 0.990 1.00 0.00 C ATOM 98 O GLU A 261 12.485 4.968 0.635 1.00 0.00 O ATOM 99 CB GLU A 261 15.393 3.645 1.465 1.00 0.00 C ATOM 100 CG GLU A 261 15.790 4.783 0.537 1.00 0.00 C ATOM 101 CD GLU A 261 16.040 6.084 1.276 1.00 0.00 C ATOM 102 OE1 GLU A 261 15.108 6.578 1.943 1.00 0.00 O ATOM 103 OE2 GLU A 261 17.170 6.607 1.188 1.00 0.00 O ATOM 0 H GLU A 261 14.466 2.004 3.048 1.00 0.00 H new ATOM 0 HA GLU A 261 13.976 4.740 2.657 1.00 0.00 H new ATOM 0 HB2 GLU A 261 16.132 3.564 2.262 1.00 0.00 H new ATOM 0 HB3 GLU A 261 15.421 2.708 0.908 1.00 0.00 H new ATOM 0 HG2 GLU A 261 16.690 4.502 -0.010 1.00 0.00 H new ATOM 0 HG3 GLU A 261 15.003 4.935 -0.201 1.00 0.00 H new ATOM 110 N LEU A 262 12.580 2.727 0.452 1.00 0.00 N ATOM 111 CA LEU A 262 11.582 2.657 -0.610 1.00 0.00 C ATOM 112 C LEU A 262 10.222 3.118 -0.093 1.00 0.00 C ATOM 113 O LEU A 262 9.539 3.912 -0.740 1.00 0.00 O ATOM 114 CB LEU A 262 11.496 1.222 -1.154 1.00 0.00 C ATOM 115 CG LEU A 262 10.767 1.051 -2.495 1.00 0.00 C ATOM 116 CD1 LEU A 262 9.282 1.348 -2.360 1.00 0.00 C ATOM 117 CD2 LEU A 262 11.395 1.940 -3.559 1.00 0.00 C ATOM 0 H LEU A 262 12.957 1.822 0.735 1.00 0.00 H new ATOM 0 HA LEU A 262 11.881 3.321 -1.421 1.00 0.00 H new ATOM 0 HB2 LEU A 262 12.509 0.835 -1.262 1.00 0.00 H new ATOM 0 HB3 LEU A 262 10.996 0.602 -0.410 1.00 0.00 H new ATOM 0 HG LEU A 262 10.872 0.010 -2.802 1.00 0.00 H new ATOM 0 HD11 LEU A 262 8.796 1.218 -3.327 1.00 0.00 H new ATOM 0 HD12 LEU A 262 8.839 0.665 -1.636 1.00 0.00 H new ATOM 0 HD13 LEU A 262 9.146 2.375 -2.021 1.00 0.00 H new ATOM 0 HD21 LEU A 262 10.867 1.807 -4.503 1.00 0.00 H new ATOM 0 HD22 LEU A 262 11.326 2.983 -3.249 1.00 0.00 H new ATOM 0 HD23 LEU A 262 12.443 1.668 -3.688 1.00 0.00 H new ATOM 129 N ILE A 263 9.837 2.616 1.077 1.00 0.00 N ATOM 130 CA ILE A 263 8.560 2.976 1.684 1.00 0.00 C ATOM 131 C ILE A 263 8.443 4.486 1.890 1.00 0.00 C ATOM 132 O ILE A 263 7.480 5.104 1.438 1.00 0.00 O ATOM 133 CB ILE A 263 8.360 2.247 3.036 1.00 0.00 C ATOM 134 CG1 ILE A 263 7.684 0.893 2.819 1.00 0.00 C ATOM 135 CG2 ILE A 263 7.556 3.098 4.014 1.00 0.00 C ATOM 136 CD1 ILE A 263 7.503 0.092 4.091 1.00 0.00 C ATOM 0 H ILE A 263 10.392 1.958 1.624 1.00 0.00 H new ATOM 0 HA ILE A 263 7.778 2.660 0.993 1.00 0.00 H new ATOM 0 HB ILE A 263 9.344 2.080 3.474 1.00 0.00 H new ATOM 0 HG12 ILE A 263 6.709 1.053 2.359 1.00 0.00 H new ATOM 0 HG13 ILE A 263 8.277 0.310 2.114 1.00 0.00 H new ATOM 0 HG21 ILE A 263 7.434 2.557 4.952 1.00 0.00 H new ATOM 0 HG22 ILE A 263 8.083 4.034 4.201 1.00 0.00 H new ATOM 0 HG23 ILE A 263 6.576 3.312 3.589 1.00 0.00 H new ATOM 0 HD11 ILE A 263 7.017 -0.856 3.858 1.00 0.00 H new ATOM 0 HD12 ILE A 263 8.477 -0.100 4.541 1.00 0.00 H new ATOM 0 HD13 ILE A 263 6.885 0.655 4.790 1.00 0.00 H new ATOM 148 N ARG A 264 9.420 5.072 2.577 1.00 0.00 N ATOM 149 CA ARG A 264 9.406 6.507 2.844 1.00 0.00 C ATOM 150 C ARG A 264 9.470 7.308 1.550 1.00 0.00 C ATOM 151 O ARG A 264 8.796 8.328 1.413 1.00 0.00 O ATOM 152 CB ARG A 264 10.552 6.894 3.776 1.00 0.00 C ATOM 153 CG ARG A 264 11.937 6.672 3.187 1.00 0.00 C ATOM 154 CD ARG A 264 12.449 7.917 2.477 1.00 0.00 C ATOM 155 NE ARG A 264 12.558 9.055 3.387 1.00 0.00 N ATOM 156 CZ ARG A 264 13.012 10.251 3.025 1.00 0.00 C ATOM 157 NH1 ARG A 264 13.404 10.466 1.775 1.00 0.00 N ATOM 158 NH2 ARG A 264 13.075 11.234 3.914 1.00 0.00 N ATOM 0 H ARG A 264 10.227 4.578 2.957 1.00 0.00 H new ATOM 0 HA ARG A 264 8.465 6.746 3.339 1.00 0.00 H new ATOM 0 HB2 ARG A 264 10.448 7.945 4.044 1.00 0.00 H new ATOM 0 HB3 ARG A 264 10.465 6.319 4.698 1.00 0.00 H new ATOM 0 HG2 ARG A 264 12.630 6.394 3.981 1.00 0.00 H new ATOM 0 HG3 ARG A 264 11.905 5.839 2.485 1.00 0.00 H new ATOM 0 HD2 ARG A 264 13.424 7.709 2.037 1.00 0.00 H new ATOM 0 HD3 ARG A 264 11.777 8.170 1.657 1.00 0.00 H new ATOM 0 HE ARG A 264 12.269 8.924 4.356 1.00 0.00 H new ATOM 0 HH11 ARG A 264 13.357 9.712 1.089 1.00 0.00 H new ATOM 0 HH12 ARG A 264 13.752 11.385 1.500 1.00 0.00 H new ATOM 0 HH21 ARG A 264 12.775 11.072 4.875 1.00 0.00 H new ATOM 0 HH22 ARG A 264 13.423 12.151 3.636 1.00 0.00 H new ATOM 172 N LYS A 265 10.266 6.838 0.595 1.00 0.00 N ATOM 173 CA LYS A 265 10.378 7.519 -0.688 1.00 0.00 C ATOM 174 C LYS A 265 8.991 7.642 -1.294 1.00 0.00 C ATOM 175 O LYS A 265 8.576 8.716 -1.739 1.00 0.00 O ATOM 176 CB LYS A 265 11.296 6.743 -1.631 1.00 0.00 C ATOM 177 CG LYS A 265 11.517 7.434 -2.969 1.00 0.00 C ATOM 178 CD LYS A 265 12.458 6.641 -3.863 1.00 0.00 C ATOM 179 CE LYS A 265 11.873 5.289 -4.238 1.00 0.00 C ATOM 180 NZ LYS A 265 10.579 5.422 -4.962 1.00 0.00 N ATOM 0 H LYS A 265 10.837 5.997 0.684 1.00 0.00 H new ATOM 0 HA LYS A 265 10.809 8.509 -0.538 1.00 0.00 H new ATOM 0 HB2 LYS A 265 12.260 6.593 -1.145 1.00 0.00 H new ATOM 0 HB3 LYS A 265 10.871 5.755 -1.807 1.00 0.00 H new ATOM 0 HG2 LYS A 265 10.560 7.565 -3.474 1.00 0.00 H new ATOM 0 HG3 LYS A 265 11.927 8.430 -2.801 1.00 0.00 H new ATOM 0 HD2 LYS A 265 12.666 7.211 -4.768 1.00 0.00 H new ATOM 0 HD3 LYS A 265 13.410 6.496 -3.352 1.00 0.00 H new ATOM 0 HE2 LYS A 265 12.584 4.747 -4.862 1.00 0.00 H new ATOM 0 HE3 LYS A 265 11.724 4.696 -3.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 10.487 4.650 -5.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 9.794 5.373 -4.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 10.551 6.336 -5.458 1.00 0.00 H new ATOM 194 N ALA A 266 8.265 6.530 -1.267 1.00 0.00 N ATOM 195 CA ALA A 266 6.907 6.490 -1.771 1.00 0.00 C ATOM 196 C ALA A 266 6.020 7.381 -0.914 1.00 0.00 C ATOM 197 O ALA A 266 5.056 7.971 -1.402 1.00 0.00 O ATOM 198 CB ALA A 266 6.388 5.060 -1.785 1.00 0.00 C ATOM 0 H ALA A 266 8.602 5.641 -0.898 1.00 0.00 H new ATOM 0 HA ALA A 266 6.892 6.861 -2.796 1.00 0.00 H new ATOM 0 HB1 ALA A 266 5.367 5.047 -2.166 1.00 0.00 H new ATOM 0 HB2 ALA A 266 7.023 4.449 -2.427 1.00 0.00 H new ATOM 0 HB3 ALA A 266 6.402 4.658 -0.772 1.00 0.00 H new ATOM 204 N ILE A 267 6.364 7.482 0.372 1.00 0.00 N ATOM 205 CA ILE A 267 5.609 8.313 1.299 1.00 0.00 C ATOM 206 C ILE A 267 5.616 9.768 0.842 1.00 0.00 C ATOM 207 O ILE A 267 4.569 10.409 0.770 1.00 0.00 O ATOM 208 CB ILE A 267 6.155 8.217 2.742 1.00 0.00 C ATOM 209 CG1 ILE A 267 5.856 6.830 3.322 1.00 0.00 C ATOM 210 CG2 ILE A 267 5.556 9.312 3.617 1.00 0.00 C ATOM 211 CD1 ILE A 267 6.356 6.633 4.737 1.00 0.00 C ATOM 0 H ILE A 267 7.159 6.998 0.790 1.00 0.00 H new ATOM 0 HA ILE A 267 4.586 7.938 1.302 1.00 0.00 H new ATOM 0 HB ILE A 267 7.235 8.360 2.720 1.00 0.00 H new ATOM 0 HG12 ILE A 267 4.779 6.664 3.302 1.00 0.00 H new ATOM 0 HG13 ILE A 267 6.307 6.074 2.680 1.00 0.00 H new ATOM 0 HG21 ILE A 267 5.953 9.227 4.629 1.00 0.00 H new ATOM 0 HG22 ILE A 267 5.815 10.288 3.206 1.00 0.00 H new ATOM 0 HG23 ILE A 267 4.472 9.205 3.643 1.00 0.00 H new ATOM 0 HD11 ILE A 267 6.105 5.627 5.075 1.00 0.00 H new ATOM 0 HD12 ILE A 267 7.438 6.765 4.762 1.00 0.00 H new ATOM 0 HD13 ILE A 267 5.885 7.364 5.394 1.00 0.00 H new ATOM 223 N GLU A 268 6.799 10.277 0.517 1.00 0.00 N ATOM 224 CA GLU A 268 6.933 11.651 0.050 1.00 0.00 C ATOM 225 C GLU A 268 6.205 11.834 -1.276 1.00 0.00 C ATOM 226 O GLU A 268 5.518 12.834 -1.485 1.00 0.00 O ATOM 227 CB GLU A 268 8.407 12.027 -0.106 1.00 0.00 C ATOM 228 CG GLU A 268 9.184 11.996 1.200 1.00 0.00 C ATOM 229 CD GLU A 268 10.634 12.408 1.028 1.00 0.00 C ATOM 230 OE1 GLU A 268 11.040 12.691 -0.119 1.00 0.00 O ATOM 231 OE2 GLU A 268 11.363 12.447 2.040 1.00 0.00 O ATOM 0 H GLU A 268 7.677 9.760 0.568 1.00 0.00 H new ATOM 0 HA GLU A 268 6.483 12.309 0.794 1.00 0.00 H new ATOM 0 HB2 GLU A 268 8.875 11.343 -0.814 1.00 0.00 H new ATOM 0 HB3 GLU A 268 8.475 13.026 -0.536 1.00 0.00 H new ATOM 0 HG2 GLU A 268 8.705 12.660 1.919 1.00 0.00 H new ATOM 0 HG3 GLU A 268 9.143 10.990 1.619 1.00 0.00 H new ATOM 238 N LEU A 269 6.358 10.857 -2.167 1.00 0.00 N ATOM 239 CA LEU A 269 5.713 10.905 -3.476 1.00 0.00 C ATOM 240 C LEU A 269 4.201 11.070 -3.336 1.00 0.00 C ATOM 241 O LEU A 269 3.594 11.901 -4.011 1.00 0.00 O ATOM 242 CB LEU A 269 6.028 9.635 -4.270 1.00 0.00 C ATOM 243 CG LEU A 269 7.510 9.407 -4.571 1.00 0.00 C ATOM 244 CD1 LEU A 269 7.714 8.063 -5.252 1.00 0.00 C ATOM 245 CD2 LEU A 269 8.059 10.532 -5.438 1.00 0.00 C ATOM 0 H LEU A 269 6.923 10.023 -2.006 1.00 0.00 H new ATOM 0 HA LEU A 269 6.105 11.769 -4.013 1.00 0.00 H new ATOM 0 HB2 LEU A 269 5.650 8.776 -3.716 1.00 0.00 H new ATOM 0 HB3 LEU A 269 5.483 9.671 -5.213 1.00 0.00 H new ATOM 0 HG LEU A 269 8.056 9.402 -3.627 1.00 0.00 H new ATOM 0 HD11 LEU A 269 8.774 7.917 -5.459 1.00 0.00 H new ATOM 0 HD12 LEU A 269 7.359 7.266 -4.598 1.00 0.00 H new ATOM 0 HD13 LEU A 269 7.155 8.041 -6.188 1.00 0.00 H new ATOM 0 HD21 LEU A 269 9.115 10.352 -5.642 1.00 0.00 H new ATOM 0 HD22 LEU A 269 7.509 10.568 -6.378 1.00 0.00 H new ATOM 0 HD23 LEU A 269 7.947 11.482 -4.915 1.00 0.00 H new ATOM 257 N SER A 270 3.601 10.273 -2.455 1.00 0.00 N ATOM 258 CA SER A 270 2.160 10.332 -2.227 1.00 0.00 C ATOM 259 C SER A 270 1.755 11.677 -1.630 1.00 0.00 C ATOM 260 O SER A 270 0.744 12.259 -2.024 1.00 0.00 O ATOM 261 CB SER A 270 1.717 9.191 -1.305 1.00 0.00 C ATOM 262 OG SER A 270 2.391 9.248 -0.061 1.00 0.00 O ATOM 0 H SER A 270 4.090 9.580 -1.888 1.00 0.00 H new ATOM 0 HA SER A 270 1.662 10.221 -3.190 1.00 0.00 H new ATOM 0 HB2 SER A 270 0.641 9.249 -1.142 1.00 0.00 H new ATOM 0 HB3 SER A 270 1.916 8.233 -1.786 1.00 0.00 H new ATOM 0 HG SER A 270 3.252 9.703 -0.176 1.00 0.00 H new ATOM 268 N LEU A 271 2.550 12.167 -0.682 1.00 0.00 N ATOM 269 CA LEU A 271 2.273 13.448 -0.037 1.00 0.00 C ATOM 270 C LEU A 271 2.204 14.569 -1.069 1.00 0.00 C ATOM 271 O LEU A 271 1.382 15.479 -0.958 1.00 0.00 O ATOM 272 CB LEU A 271 3.346 13.768 1.008 1.00 0.00 C ATOM 273 CG LEU A 271 3.429 12.790 2.184 1.00 0.00 C ATOM 274 CD1 LEU A 271 4.560 13.179 3.123 1.00 0.00 C ATOM 275 CD2 LEU A 271 2.106 12.743 2.935 1.00 0.00 C ATOM 0 H LEU A 271 3.390 11.697 -0.344 1.00 0.00 H new ATOM 0 HA LEU A 271 1.307 13.371 0.461 1.00 0.00 H new ATOM 0 HB2 LEU A 271 4.316 13.796 0.511 1.00 0.00 H new ATOM 0 HB3 LEU A 271 3.160 14.768 1.401 1.00 0.00 H new ATOM 0 HG LEU A 271 3.636 11.796 1.789 1.00 0.00 H new ATOM 0 HD11 LEU A 271 4.604 12.473 3.952 1.00 0.00 H new ATOM 0 HD12 LEU A 271 5.505 13.161 2.581 1.00 0.00 H new ATOM 0 HD13 LEU A 271 4.383 14.183 3.510 1.00 0.00 H new ATOM 0 HD21 LEU A 271 2.184 12.043 3.767 1.00 0.00 H new ATOM 0 HD22 LEU A 271 1.869 13.736 3.317 1.00 0.00 H new ATOM 0 HD23 LEU A 271 1.315 12.416 2.259 1.00 0.00 H new ATOM 287 N LYS A 272 3.078 14.499 -2.069 1.00 0.00 N ATOM 288 CA LYS A 272 3.121 15.509 -3.121 1.00 0.00 C ATOM 289 C LYS A 272 1.793 15.580 -3.872 1.00 0.00 C ATOM 290 O LYS A 272 1.285 16.667 -4.149 1.00 0.00 O ATOM 291 CB LYS A 272 4.259 15.205 -4.100 1.00 0.00 C ATOM 292 CG LYS A 272 5.639 15.230 -3.460 1.00 0.00 C ATOM 293 CD LYS A 272 5.997 16.613 -2.933 1.00 0.00 C ATOM 294 CE LYS A 272 6.094 17.634 -4.056 1.00 0.00 C ATOM 295 NZ LYS A 272 7.113 17.246 -5.070 1.00 0.00 N ATOM 0 H LYS A 272 3.766 13.753 -2.173 1.00 0.00 H new ATOM 0 HA LYS A 272 3.300 16.476 -2.651 1.00 0.00 H new ATOM 0 HB2 LYS A 272 4.092 14.224 -4.544 1.00 0.00 H new ATOM 0 HB3 LYS A 272 4.232 15.931 -4.912 1.00 0.00 H new ATOM 0 HG2 LYS A 272 5.673 14.510 -2.642 1.00 0.00 H new ATOM 0 HG3 LYS A 272 6.384 14.916 -4.191 1.00 0.00 H new ATOM 0 HD2 LYS A 272 5.244 16.934 -2.213 1.00 0.00 H new ATOM 0 HD3 LYS A 272 6.947 16.565 -2.401 1.00 0.00 H new ATOM 0 HE2 LYS A 272 5.122 17.737 -4.539 1.00 0.00 H new ATOM 0 HE3 LYS A 272 6.348 18.609 -3.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 272 7.334 18.065 -5.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 272 7.978 16.927 -4.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 272 6.740 16.475 -5.659 1.00 0.00 H new ATOM 309 N GLU A 273 1.239 14.417 -4.202 1.00 0.00 N ATOM 310 CA GLU A 273 -0.028 14.351 -4.924 1.00 0.00 C ATOM 311 C GLU A 273 -1.157 14.973 -4.107 1.00 0.00 C ATOM 312 O GLU A 273 -1.932 15.782 -4.619 1.00 0.00 O ATOM 313 CB GLU A 273 -0.370 12.899 -5.263 1.00 0.00 C ATOM 314 CG GLU A 273 -1.650 12.746 -6.069 1.00 0.00 C ATOM 315 CD GLU A 273 -1.579 13.446 -7.413 1.00 0.00 C ATOM 316 OE1 GLU A 273 -0.701 13.085 -8.224 1.00 0.00 O ATOM 317 OE2 GLU A 273 -2.401 14.355 -7.652 1.00 0.00 O ATOM 0 H GLU A 273 1.647 13.508 -3.981 1.00 0.00 H new ATOM 0 HA GLU A 273 0.081 14.919 -5.848 1.00 0.00 H new ATOM 0 HB2 GLU A 273 0.456 12.461 -5.823 1.00 0.00 H new ATOM 0 HB3 GLU A 273 -0.464 12.331 -4.337 1.00 0.00 H new ATOM 0 HG2 GLU A 273 -1.852 11.686 -6.225 1.00 0.00 H new ATOM 0 HG3 GLU A 273 -2.486 13.149 -5.497 1.00 0.00 H new ATOM 324 N SER A 274 -1.243 14.592 -2.836 1.00 0.00 N ATOM 325 CA SER A 274 -2.276 15.115 -1.948 1.00 0.00 C ATOM 326 C SER A 274 -2.165 16.632 -1.831 1.00 0.00 C ATOM 327 O SER A 274 -3.174 17.337 -1.802 1.00 0.00 O ATOM 328 CB SER A 274 -2.166 14.473 -0.562 1.00 0.00 C ATOM 329 OG SER A 274 -0.928 14.787 0.051 1.00 0.00 O ATOM 0 H SER A 274 -0.610 13.923 -2.398 1.00 0.00 H new ATOM 0 HA SER A 274 -3.249 14.868 -2.374 1.00 0.00 H new ATOM 0 HB2 SER A 274 -2.985 14.819 0.068 1.00 0.00 H new ATOM 0 HB3 SER A 274 -2.267 13.391 -0.650 1.00 0.00 H new ATOM 0 HG SER A 274 -0.251 14.941 -0.640 1.00 0.00 H new ATOM 335 N ARG A 275 -0.927 17.117 -1.770 1.00 0.00 N ATOM 336 CA ARG A 275 -0.650 18.549 -1.661 1.00 0.00 C ATOM 337 C ARG A 275 -1.144 19.117 -0.331 1.00 0.00 C ATOM 338 O ARG A 275 -0.353 19.330 0.588 1.00 0.00 O ATOM 339 CB ARG A 275 -1.289 19.310 -2.828 1.00 0.00 C ATOM 340 CG ARG A 275 -1.067 20.815 -2.775 1.00 0.00 C ATOM 341 CD ARG A 275 0.407 21.172 -2.886 1.00 0.00 C ATOM 342 NE ARG A 275 0.622 22.616 -2.845 1.00 0.00 N ATOM 343 CZ ARG A 275 1.819 23.189 -2.918 1.00 0.00 C ATOM 344 NH1 ARG A 275 2.911 22.444 -3.033 1.00 0.00 N ATOM 345 NH2 ARG A 275 1.926 24.509 -2.874 1.00 0.00 N ATOM 0 H ARG A 275 -0.091 16.533 -1.794 1.00 0.00 H new ATOM 0 HA ARG A 275 0.432 18.678 -1.701 1.00 0.00 H new ATOM 0 HB2 ARG A 275 -0.886 18.925 -3.765 1.00 0.00 H new ATOM 0 HB3 ARG A 275 -2.361 19.110 -2.837 1.00 0.00 H new ATOM 0 HG2 ARG A 275 -1.619 21.293 -3.585 1.00 0.00 H new ATOM 0 HG3 ARG A 275 -1.467 21.209 -1.841 1.00 0.00 H new ATOM 0 HD2 ARG A 275 0.957 20.700 -2.072 1.00 0.00 H new ATOM 0 HD3 ARG A 275 0.809 20.771 -3.817 1.00 0.00 H new ATOM 0 HE ARG A 275 -0.195 23.220 -2.755 1.00 0.00 H new ATOM 0 HH11 ARG A 275 2.834 21.427 -3.066 1.00 0.00 H new ATOM 0 HH12 ARG A 275 3.828 22.888 -3.089 1.00 0.00 H new ATOM 0 HH21 ARG A 275 1.090 25.086 -2.784 1.00 0.00 H new ATOM 0 HH22 ARG A 275 2.845 24.948 -2.930 1.00 0.00 H new ATOM 359 N ASN A 276 -2.448 19.367 -0.238 1.00 0.00 N ATOM 360 CA ASN A 276 -3.038 19.921 0.978 1.00 0.00 C ATOM 361 C ASN A 276 -2.318 21.202 1.390 1.00 0.00 C ATOM 362 O ASN A 276 -1.964 21.381 2.557 1.00 0.00 O ATOM 363 CB ASN A 276 -2.985 18.900 2.119 1.00 0.00 C ATOM 364 CG ASN A 276 -3.781 17.646 1.813 1.00 0.00 C ATOM 365 OD1 ASN A 276 -3.482 16.922 0.865 1.00 0.00 O ATOM 366 ND2 ASN A 276 -4.806 17.386 2.617 1.00 0.00 N ATOM 0 H ASN A 276 -3.116 19.195 -0.990 1.00 0.00 H new ATOM 0 HA ASN A 276 -4.081 20.157 0.769 1.00 0.00 H new ATOM 0 HB2 ASN A 276 -1.947 18.629 2.312 1.00 0.00 H new ATOM 0 HB3 ASN A 276 -3.370 19.358 3.030 1.00 0.00 H new ATOM 0 HD21 ASN A 276 -5.381 16.558 2.459 1.00 0.00 H new ATOM 0 HD22 ASN A 276 -5.018 18.014 3.392 1.00 0.00 H new ATOM 373 N SER A 277 -2.099 22.088 0.420 1.00 0.00 N ATOM 374 CA SER A 277 -1.415 23.353 0.671 1.00 0.00 C ATOM 375 C SER A 277 -0.006 23.111 1.203 1.00 0.00 C ATOM 376 O SER A 277 0.427 23.751 2.163 1.00 0.00 O ATOM 377 CB SER A 277 -2.213 24.208 1.660 1.00 0.00 C ATOM 378 OG SER A 277 -3.494 24.523 1.144 1.00 0.00 O ATOM 0 H SER A 277 -2.387 21.952 -0.549 1.00 0.00 H new ATOM 0 HA SER A 277 -1.339 23.890 -0.275 1.00 0.00 H new ATOM 0 HB2 SER A 277 -2.319 23.674 2.604 1.00 0.00 H new ATOM 0 HB3 SER A 277 -1.667 25.127 1.874 1.00 0.00 H new ATOM 0 HG SER A 277 -3.984 25.068 1.795 1.00 0.00 H new ATOM 384 N ALA A 278 0.705 22.182 0.571 1.00 0.00 N ATOM 385 CA ALA A 278 2.066 21.850 0.975 1.00 0.00 C ATOM 386 C ALA A 278 2.988 23.059 0.848 1.00 0.00 C ATOM 387 O ALA A 278 3.856 23.236 1.728 1.00 0.00 O ATOM 388 CB ALA A 278 2.595 20.691 0.144 1.00 0.00 C ATOM 389 OXT ALA A 278 2.834 23.818 -0.132 1.00 0.00 O ATOM 0 H ALA A 278 0.360 21.645 -0.225 1.00 0.00 H new ATOM 0 HA ALA A 278 2.044 21.552 2.023 1.00 0.00 H new ATOM 0 HB1 ALA A 278 3.612 20.454 0.456 1.00 0.00 H new ATOM 0 HB2 ALA A 278 1.958 19.819 0.289 1.00 0.00 H new ATOM 0 HB3 ALA A 278 2.595 20.969 -0.910 1.00 0.00 H new TER 395 ALA A 278 ATOM 396 N MET B 1 -16.050 -1.335 -1.427 1.00 0.00 N ATOM 397 CA MET B 1 -15.764 -0.872 -2.810 1.00 0.00 C ATOM 398 C MET B 1 -14.470 -1.498 -3.342 1.00 0.00 C ATOM 399 O MET B 1 -14.206 -2.677 -3.108 1.00 0.00 O ATOM 400 CB MET B 1 -15.677 0.661 -2.803 1.00 0.00 C ATOM 401 CG MET B 1 -14.525 1.222 -1.978 1.00 0.00 C ATOM 402 SD MET B 1 -14.692 0.892 -0.213 1.00 0.00 S ATOM 403 CE MET B 1 -13.224 1.698 0.420 1.00 0.00 C ATOM 0 H1 MET B 1 -17.041 -1.126 -1.189 1.00 0.00 H new ATOM 0 H2 MET B 1 -15.887 -2.360 -1.363 1.00 0.00 H new ATOM 0 H3 MET B 1 -15.423 -0.843 -0.759 1.00 0.00 H new ATOM 0 HA MET B 1 -16.567 -1.188 -3.476 1.00 0.00 H new ATOM 0 HB2 MET B 1 -15.577 1.012 -3.830 1.00 0.00 H new ATOM 0 HB3 MET B 1 -16.614 1.064 -2.418 1.00 0.00 H new ATOM 0 HG2 MET B 1 -13.588 0.794 -2.335 1.00 0.00 H new ATOM 0 HG3 MET B 1 -14.464 2.299 -2.136 1.00 0.00 H new ATOM 0 HE1 MET B 1 -13.184 1.582 1.503 1.00 0.00 H new ATOM 0 HE2 MET B 1 -12.339 1.245 -0.027 1.00 0.00 H new ATOM 0 HE3 MET B 1 -13.255 2.758 0.170 1.00 0.00 H new ATOM 415 N GLN B 2 -13.667 -0.711 -4.057 1.00 0.00 N ATOM 416 CA GLN B 2 -12.411 -1.205 -4.612 1.00 0.00 C ATOM 417 C GLN B 2 -11.407 -0.069 -4.775 1.00 0.00 C ATOM 418 O GLN B 2 -11.767 1.043 -5.161 1.00 0.00 O ATOM 419 CB GLN B 2 -12.649 -1.891 -5.962 1.00 0.00 C ATOM 420 CG GLN B 2 -13.173 -0.961 -7.047 1.00 0.00 C ATOM 421 CD GLN B 2 -14.541 -0.391 -6.728 1.00 0.00 C ATOM 422 OE1 GLN B 2 -15.505 -1.131 -6.530 1.00 0.00 O ATOM 423 NE2 GLN B 2 -14.633 0.932 -6.680 1.00 0.00 N ATOM 0 H GLN B 2 -13.864 0.268 -4.264 1.00 0.00 H new ATOM 0 HA GLN B 2 -12.000 -1.935 -3.915 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -11.714 -2.337 -6.301 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -13.359 -2.706 -5.823 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -12.468 -0.142 -7.188 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -13.223 -1.504 -7.991 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -13.808 1.507 -6.851 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -15.529 1.374 -6.472 1.00 0.00 H new ATOM 432 N ILE B 3 -10.147 -0.358 -4.466 1.00 0.00 N ATOM 433 CA ILE B 3 -9.085 0.636 -4.567 1.00 0.00 C ATOM 434 C ILE B 3 -7.968 0.161 -5.493 1.00 0.00 C ATOM 435 O ILE B 3 -7.687 -1.037 -5.579 1.00 0.00 O ATOM 436 CB ILE B 3 -8.489 0.959 -3.181 1.00 0.00 C ATOM 437 CG1 ILE B 3 -7.922 -0.308 -2.534 1.00 0.00 C ATOM 438 CG2 ILE B 3 -9.548 1.592 -2.288 1.00 0.00 C ATOM 439 CD1 ILE B 3 -7.261 -0.067 -1.193 1.00 0.00 C ATOM 0 H ILE B 3 -9.836 -1.274 -4.143 1.00 0.00 H new ATOM 0 HA ILE B 3 -9.534 1.538 -4.983 1.00 0.00 H new ATOM 0 HB ILE B 3 -7.673 1.671 -3.308 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -8.728 -1.031 -2.407 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -7.195 -0.756 -3.211 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -9.115 1.815 -1.313 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -9.906 2.514 -2.746 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -10.381 0.900 -2.165 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -6.884 -1.011 -0.798 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -6.433 0.631 -1.316 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -7.989 0.352 -0.499 1.00 0.00 H new ATOM 451 N PHE B 4 -7.332 1.108 -6.182 1.00 0.00 N ATOM 452 CA PHE B 4 -6.239 0.786 -7.095 1.00 0.00 C ATOM 453 C PHE B 4 -4.918 0.670 -6.347 1.00 0.00 C ATOM 454 O PHE B 4 -4.605 1.489 -5.482 1.00 0.00 O ATOM 455 CB PHE B 4 -6.107 1.842 -8.194 1.00 0.00 C ATOM 456 CG PHE B 4 -6.842 1.501 -9.458 1.00 0.00 C ATOM 457 CD1 PHE B 4 -8.185 1.806 -9.606 1.00 0.00 C ATOM 458 CD2 PHE B 4 -6.181 0.871 -10.501 1.00 0.00 C ATOM 459 CE1 PHE B 4 -8.855 1.490 -10.774 1.00 0.00 C ATOM 460 CE2 PHE B 4 -6.845 0.551 -11.669 1.00 0.00 C ATOM 461 CZ PHE B 4 -8.183 0.862 -11.807 1.00 0.00 C ATOM 0 H PHE B 4 -7.555 2.102 -6.125 1.00 0.00 H new ATOM 0 HA PHE B 4 -6.475 -0.174 -7.553 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -6.478 2.794 -7.815 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -5.051 1.981 -8.426 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -8.714 2.295 -8.802 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -5.134 0.627 -10.399 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -9.902 1.733 -10.879 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -6.318 0.058 -12.473 1.00 0.00 H new ATOM 0 HZ PHE B 4 -8.704 0.615 -12.720 1.00 0.00 H new ATOM 471 N VAL B 5 -4.138 -0.344 -6.696 1.00 0.00 N ATOM 472 CA VAL B 5 -2.843 -0.558 -6.071 1.00 0.00 C ATOM 473 C VAL B 5 -1.726 -0.312 -7.075 1.00 0.00 C ATOM 474 O VAL B 5 -1.544 -1.089 -8.014 1.00 0.00 O ATOM 475 CB VAL B 5 -2.713 -1.990 -5.517 1.00 0.00 C ATOM 476 CG1 VAL B 5 -1.383 -2.172 -4.801 1.00 0.00 C ATOM 477 CG2 VAL B 5 -3.876 -2.312 -4.590 1.00 0.00 C ATOM 0 H VAL B 5 -4.381 -1.031 -7.409 1.00 0.00 H new ATOM 0 HA VAL B 5 -2.761 0.146 -5.243 1.00 0.00 H new ATOM 0 HB VAL B 5 -2.743 -2.686 -6.355 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -1.312 -3.190 -4.418 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -0.566 -1.990 -5.499 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -1.316 -1.467 -3.972 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -3.767 -3.327 -4.209 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -3.882 -1.610 -3.756 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -4.813 -2.230 -5.140 1.00 0.00 H new ATOM 487 N LYS B 6 -0.982 0.772 -6.879 1.00 0.00 N ATOM 488 CA LYS B 6 0.114 1.106 -7.777 1.00 0.00 C ATOM 489 C LYS B 6 1.401 0.430 -7.328 1.00 0.00 C ATOM 490 O LYS B 6 1.844 0.608 -6.193 1.00 0.00 O ATOM 491 CB LYS B 6 0.330 2.618 -7.837 1.00 0.00 C ATOM 492 CG LYS B 6 1.317 3.040 -8.915 1.00 0.00 C ATOM 493 CD LYS B 6 1.694 4.507 -8.789 1.00 0.00 C ATOM 494 CE LYS B 6 2.535 4.759 -7.549 1.00 0.00 C ATOM 495 NZ LYS B 6 3.808 3.987 -7.576 1.00 0.00 N ATOM 0 H LYS B 6 -1.118 1.429 -6.111 1.00 0.00 H new ATOM 0 HA LYS B 6 -0.153 0.747 -8.771 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -0.627 3.108 -8.017 1.00 0.00 H new ATOM 0 HB3 LYS B 6 0.689 2.966 -6.868 1.00 0.00 H new ATOM 0 HG2 LYS B 6 2.215 2.426 -8.846 1.00 0.00 H new ATOM 0 HG3 LYS B 6 0.882 2.859 -9.898 1.00 0.00 H new ATOM 0 HD2 LYS B 6 2.247 4.820 -9.675 1.00 0.00 H new ATOM 0 HD3 LYS B 6 0.790 5.114 -8.747 1.00 0.00 H new ATOM 0 HE2 LYS B 6 2.757 5.823 -7.471 1.00 0.00 H new ATOM 0 HE3 LYS B 6 1.964 4.487 -6.661 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 4.484 4.409 -6.908 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 3.622 3.001 -7.304 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 4.209 4.011 -8.535 1.00 0.00 H new ATOM 509 N THR B 7 2.006 -0.329 -8.229 1.00 0.00 N ATOM 510 CA THR B 7 3.252 -1.012 -7.929 1.00 0.00 C ATOM 511 C THR B 7 4.421 -0.041 -8.019 1.00 0.00 C ATOM 512 O THR B 7 4.418 0.864 -8.853 1.00 0.00 O ATOM 513 CB THR B 7 3.492 -2.199 -8.877 1.00 0.00 C ATOM 514 OG1 THR B 7 3.431 -1.762 -10.240 1.00 0.00 O ATOM 515 CG2 THR B 7 2.462 -3.294 -8.637 1.00 0.00 C ATOM 0 H THR B 7 1.653 -0.487 -9.173 1.00 0.00 H new ATOM 0 HA THR B 7 3.176 -1.399 -6.913 1.00 0.00 H new ATOM 0 HB THR B 7 4.484 -2.604 -8.676 1.00 0.00 H new ATOM 0 HG1 THR B 7 4.317 -1.845 -10.650 1.00 0.00 H new ATOM 0 HG21 THR B 7 2.649 -4.125 -9.317 1.00 0.00 H new ATOM 0 HG22 THR B 7 2.537 -3.644 -7.608 1.00 0.00 H new ATOM 0 HG23 THR B 7 1.462 -2.898 -8.814 1.00 0.00 H new ATOM 523 N LEU B 8 5.413 -0.225 -7.152 1.00 0.00 N ATOM 524 CA LEU B 8 6.585 0.645 -7.134 1.00 0.00 C ATOM 525 C LEU B 8 7.118 0.840 -8.550 1.00 0.00 C ATOM 526 O LEU B 8 7.567 1.928 -8.912 1.00 0.00 O ATOM 527 CB LEU B 8 7.669 0.054 -6.218 1.00 0.00 C ATOM 528 CG LEU B 8 8.849 0.978 -5.877 1.00 0.00 C ATOM 529 CD1 LEU B 8 9.793 1.126 -7.059 1.00 0.00 C ATOM 530 CD2 LEU B 8 8.351 2.343 -5.422 1.00 0.00 C ATOM 0 H LEU B 8 5.429 -0.968 -6.453 1.00 0.00 H new ATOM 0 HA LEU B 8 6.297 1.620 -6.740 1.00 0.00 H new ATOM 0 HB2 LEU B 8 7.197 -0.257 -5.286 1.00 0.00 H new ATOM 0 HB3 LEU B 8 8.064 -0.845 -6.691 1.00 0.00 H new ATOM 0 HG LEU B 8 9.403 0.519 -5.058 1.00 0.00 H new ATOM 0 HD11 LEU B 8 10.617 1.785 -6.786 1.00 0.00 H new ATOM 0 HD12 LEU B 8 10.187 0.148 -7.335 1.00 0.00 H new ATOM 0 HD13 LEU B 8 9.253 1.551 -7.905 1.00 0.00 H new ATOM 0 HD21 LEU B 8 9.203 2.981 -5.186 1.00 0.00 H new ATOM 0 HD22 LEU B 8 7.765 2.801 -6.219 1.00 0.00 H new ATOM 0 HD23 LEU B 8 7.728 2.226 -4.535 1.00 0.00 H new ATOM 542 N THR B 9 7.053 -0.219 -9.350 1.00 0.00 N ATOM 543 CA THR B 9 7.516 -0.163 -10.730 1.00 0.00 C ATOM 544 C THR B 9 6.687 0.821 -11.550 1.00 0.00 C ATOM 545 O THR B 9 7.234 1.615 -12.315 1.00 0.00 O ATOM 546 CB THR B 9 7.462 -1.548 -11.401 1.00 0.00 C ATOM 547 OG1 THR B 9 6.122 -2.054 -11.376 1.00 0.00 O ATOM 548 CG2 THR B 9 8.391 -2.526 -10.698 1.00 0.00 C ATOM 0 H THR B 9 6.684 -1.126 -9.065 1.00 0.00 H new ATOM 0 HA THR B 9 8.552 0.175 -10.700 1.00 0.00 H new ATOM 0 HB THR B 9 7.789 -1.439 -12.435 1.00 0.00 H new ATOM 0 HG1 THR B 9 6.097 -2.934 -11.806 1.00 0.00 H new ATOM 0 HG21 THR B 9 8.336 -3.497 -11.189 1.00 0.00 H new ATOM 0 HG22 THR B 9 9.414 -2.153 -10.744 1.00 0.00 H new ATOM 0 HG23 THR B 9 8.089 -2.629 -9.656 1.00 0.00 H new ATOM 556 N GLY B 10 5.365 0.768 -11.386 1.00 0.00 N ATOM 557 CA GLY B 10 4.497 1.669 -12.124 1.00 0.00 C ATOM 558 C GLY B 10 3.320 0.963 -12.771 1.00 0.00 C ATOM 559 O GLY B 10 3.149 1.027 -13.989 1.00 0.00 O ATOM 0 H GLY B 10 4.884 0.122 -10.760 1.00 0.00 H new ATOM 0 HA2 GLY B 10 4.125 2.440 -11.449 1.00 0.00 H new ATOM 0 HA3 GLY B 10 5.079 2.174 -12.895 1.00 0.00 H new ATOM 563 N LYS B 11 2.503 0.291 -11.964 1.00 0.00 N ATOM 564 CA LYS B 11 1.339 -0.419 -12.485 1.00 0.00 C ATOM 565 C LYS B 11 0.226 -0.495 -11.443 1.00 0.00 C ATOM 566 O LYS B 11 0.357 -1.172 -10.423 1.00 0.00 O ATOM 567 CB LYS B 11 1.734 -1.832 -12.923 1.00 0.00 C ATOM 568 CG LYS B 11 0.611 -2.598 -13.607 1.00 0.00 C ATOM 569 CD LYS B 11 0.204 -1.946 -14.917 1.00 0.00 C ATOM 570 CE LYS B 11 -0.898 -2.729 -15.613 1.00 0.00 C ATOM 571 NZ LYS B 11 -2.133 -2.807 -14.784 1.00 0.00 N ATOM 0 H LYS B 11 2.624 0.223 -10.953 1.00 0.00 H new ATOM 0 HA LYS B 11 0.966 0.136 -13.346 1.00 0.00 H new ATOM 0 HB2 LYS B 11 2.584 -1.768 -13.602 1.00 0.00 H new ATOM 0 HB3 LYS B 11 2.066 -2.394 -12.050 1.00 0.00 H new ATOM 0 HG2 LYS B 11 0.931 -3.623 -13.794 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -0.252 -2.650 -12.943 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -0.136 -0.928 -14.727 1.00 0.00 H new ATOM 0 HD3 LYS B 11 1.071 -1.875 -15.574 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -1.131 -2.257 -16.568 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -0.544 -3.736 -15.833 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -2.963 -2.610 -15.379 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -2.217 -3.760 -14.376 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -2.082 -2.105 -14.018 1.00 0.00 H new ATOM 585 N THR B 12 -0.874 0.201 -11.716 1.00 0.00 N ATOM 586 CA THR B 12 -2.021 0.219 -10.818 1.00 0.00 C ATOM 587 C THR B 12 -2.987 -0.914 -11.144 1.00 0.00 C ATOM 588 O THR B 12 -3.221 -1.222 -12.313 1.00 0.00 O ATOM 589 CB THR B 12 -2.772 1.559 -10.901 1.00 0.00 C ATOM 590 OG1 THR B 12 -3.226 1.787 -12.241 1.00 0.00 O ATOM 591 CG2 THR B 12 -1.879 2.708 -10.462 1.00 0.00 C ATOM 0 H THR B 12 -0.994 0.763 -12.559 1.00 0.00 H new ATOM 0 HA THR B 12 -1.638 0.087 -9.806 1.00 0.00 H new ATOM 0 HB THR B 12 -3.630 1.509 -10.231 1.00 0.00 H new ATOM 0 HG1 THR B 12 -3.704 2.641 -12.283 1.00 0.00 H new ATOM 0 HG21 THR B 12 -2.432 3.645 -10.529 1.00 0.00 H new ATOM 0 HG22 THR B 12 -1.560 2.548 -9.432 1.00 0.00 H new ATOM 0 HG23 THR B 12 -1.003 2.756 -11.109 1.00 0.00 H new ATOM 599 N ILE B 13 -3.548 -1.534 -10.108 1.00 0.00 N ATOM 600 CA ILE B 13 -4.489 -2.633 -10.304 1.00 0.00 C ATOM 601 C ILE B 13 -5.647 -2.566 -9.312 1.00 0.00 C ATOM 602 O ILE B 13 -5.442 -2.416 -8.108 1.00 0.00 O ATOM 603 CB ILE B 13 -3.793 -4.001 -10.169 1.00 0.00 C ATOM 604 CG1 ILE B 13 -2.685 -4.136 -11.218 1.00 0.00 C ATOM 605 CG2 ILE B 13 -4.812 -5.126 -10.306 1.00 0.00 C ATOM 606 CD1 ILE B 13 -1.948 -5.457 -11.165 1.00 0.00 C ATOM 0 H ILE B 13 -3.369 -1.296 -9.132 1.00 0.00 H new ATOM 0 HA ILE B 13 -4.881 -2.527 -11.316 1.00 0.00 H new ATOM 0 HB ILE B 13 -3.338 -4.072 -9.181 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -3.120 -4.014 -12.210 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -1.969 -3.326 -11.082 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -4.308 -6.087 -10.209 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -5.566 -5.031 -9.525 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -5.292 -5.065 -11.283 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -1.180 -5.476 -11.938 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -1.482 -5.575 -10.187 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -2.651 -6.273 -11.332 1.00 0.00 H new ATOM 618 N THR B 14 -6.866 -2.689 -9.831 1.00 0.00 N ATOM 619 CA THR B 14 -8.063 -2.650 -9.000 1.00 0.00 C ATOM 620 C THR B 14 -8.111 -3.836 -8.046 1.00 0.00 C ATOM 621 O THR B 14 -7.807 -4.966 -8.431 1.00 0.00 O ATOM 622 CB THR B 14 -9.344 -2.663 -9.857 1.00 0.00 C ATOM 623 OG1 THR B 14 -9.330 -1.573 -10.783 1.00 0.00 O ATOM 624 CG2 THR B 14 -10.585 -2.568 -8.981 1.00 0.00 C ATOM 0 H THR B 14 -7.050 -2.817 -10.826 1.00 0.00 H new ATOM 0 HA THR B 14 -8.016 -1.722 -8.430 1.00 0.00 H new ATOM 0 HB THR B 14 -9.373 -3.605 -10.405 1.00 0.00 H new ATOM 0 HG1 THR B 14 -8.751 -0.860 -10.441 1.00 0.00 H new ATOM 0 HG21 THR B 14 -11.476 -2.579 -9.609 1.00 0.00 H new ATOM 0 HG22 THR B 14 -10.613 -3.416 -8.297 1.00 0.00 H new ATOM 0 HG23 THR B 14 -10.556 -1.641 -8.409 1.00 0.00 H new ATOM 632 N LEU B 15 -8.505 -3.578 -6.804 1.00 0.00 N ATOM 633 CA LEU B 15 -8.604 -4.634 -5.805 1.00 0.00 C ATOM 634 C LEU B 15 -9.792 -4.371 -4.881 1.00 0.00 C ATOM 635 O LEU B 15 -9.829 -3.367 -4.169 1.00 0.00 O ATOM 636 CB LEU B 15 -7.301 -4.721 -4.999 1.00 0.00 C ATOM 637 CG LEU B 15 -7.047 -6.053 -4.278 1.00 0.00 C ATOM 638 CD1 LEU B 15 -8.100 -6.314 -3.214 1.00 0.00 C ATOM 639 CD2 LEU B 15 -7.006 -7.200 -5.278 1.00 0.00 C ATOM 0 H LEU B 15 -8.760 -2.650 -6.466 1.00 0.00 H new ATOM 0 HA LEU B 15 -8.762 -5.587 -6.309 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -6.466 -4.530 -5.673 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -7.301 -3.923 -4.257 1.00 0.00 H new ATOM 0 HG LEU B 15 -6.079 -5.986 -3.782 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -7.892 -7.264 -2.722 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -8.079 -5.511 -2.477 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -9.085 -6.354 -3.679 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -6.825 -8.136 -4.750 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -7.959 -7.258 -5.804 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -6.205 -7.028 -5.997 1.00 0.00 H new ATOM 651 N GLU B 16 -10.765 -5.279 -4.909 1.00 0.00 N ATOM 652 CA GLU B 16 -11.963 -5.151 -4.086 1.00 0.00 C ATOM 653 C GLU B 16 -11.635 -5.354 -2.612 1.00 0.00 C ATOM 654 O GLU B 16 -10.991 -6.335 -2.239 1.00 0.00 O ATOM 655 CB GLU B 16 -13.023 -6.161 -4.547 1.00 0.00 C ATOM 656 CG GLU B 16 -14.371 -6.030 -3.852 1.00 0.00 C ATOM 657 CD GLU B 16 -14.483 -6.867 -2.588 1.00 0.00 C ATOM 658 OE1 GLU B 16 -13.756 -6.587 -1.614 1.00 0.00 O ATOM 659 OE2 GLU B 16 -15.303 -7.809 -2.576 1.00 0.00 O ATOM 0 H GLU B 16 -10.746 -6.114 -5.495 1.00 0.00 H new ATOM 0 HA GLU B 16 -12.360 -4.143 -4.204 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -13.171 -6.047 -5.621 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -12.641 -7.169 -4.383 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -14.542 -4.983 -3.602 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -15.159 -6.325 -4.545 1.00 0.00 H new ATOM 666 N VAL B 17 -12.093 -4.423 -1.778 1.00 0.00 N ATOM 667 CA VAL B 17 -11.860 -4.494 -0.339 1.00 0.00 C ATOM 668 C VAL B 17 -12.975 -3.795 0.434 1.00 0.00 C ATOM 669 O VAL B 17 -13.293 -2.634 0.175 1.00 0.00 O ATOM 670 CB VAL B 17 -10.508 -3.862 0.057 1.00 0.00 C ATOM 671 CG1 VAL B 17 -9.346 -4.706 -0.440 1.00 0.00 C ATOM 672 CG2 VAL B 17 -10.401 -2.442 -0.477 1.00 0.00 C ATOM 0 H VAL B 17 -12.629 -3.608 -2.076 1.00 0.00 H new ATOM 0 HA VAL B 17 -11.843 -5.553 -0.081 1.00 0.00 H new ATOM 0 HB VAL B 17 -10.461 -3.826 1.145 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -8.406 -4.239 -0.148 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -9.407 -5.703 -0.003 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -9.391 -4.783 -1.526 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -9.441 -2.015 -0.187 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -10.478 -2.455 -1.564 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -11.207 -1.836 -0.063 1.00 0.00 H new ATOM 682 N GLU B 18 -13.561 -4.513 1.385 1.00 0.00 N ATOM 683 CA GLU B 18 -14.638 -3.971 2.203 1.00 0.00 C ATOM 684 C GLU B 18 -14.087 -3.011 3.253 1.00 0.00 C ATOM 685 O GLU B 18 -13.024 -3.252 3.825 1.00 0.00 O ATOM 686 CB GLU B 18 -15.409 -5.105 2.882 1.00 0.00 C ATOM 687 CG GLU B 18 -16.029 -6.097 1.907 1.00 0.00 C ATOM 688 CD GLU B 18 -17.076 -5.466 1.007 1.00 0.00 C ATOM 689 OE1 GLU B 18 -16.721 -4.562 0.222 1.00 0.00 O ATOM 690 OE2 GLU B 18 -18.252 -5.880 1.085 1.00 0.00 O ATOM 0 H GLU B 18 -13.307 -5.475 1.609 1.00 0.00 H new ATOM 0 HA GLU B 18 -15.318 -3.420 1.553 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -14.735 -5.640 3.551 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -16.198 -4.676 3.500 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -15.243 -6.533 1.291 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -16.484 -6.914 2.468 1.00 0.00 H new ATOM 697 N SER B 19 -14.813 -1.925 3.503 1.00 0.00 N ATOM 698 CA SER B 19 -14.389 -0.935 4.488 1.00 0.00 C ATOM 699 C SER B 19 -14.089 -1.601 5.829 1.00 0.00 C ATOM 700 O SER B 19 -13.081 -1.306 6.471 1.00 0.00 O ATOM 701 CB SER B 19 -15.469 0.134 4.665 1.00 0.00 C ATOM 702 OG SER B 19 -15.727 0.805 3.444 1.00 0.00 O ATOM 0 H SER B 19 -15.695 -1.709 3.039 1.00 0.00 H new ATOM 0 HA SER B 19 -13.477 -0.461 4.124 1.00 0.00 H new ATOM 0 HB2 SER B 19 -16.386 -0.328 5.031 1.00 0.00 H new ATOM 0 HB3 SER B 19 -15.152 0.854 5.419 1.00 0.00 H new ATOM 0 HG SER B 19 -16.422 1.482 3.583 1.00 0.00 H new ATOM 708 N SER B 20 -14.971 -2.506 6.240 1.00 0.00 N ATOM 709 CA SER B 20 -14.808 -3.225 7.499 1.00 0.00 C ATOM 710 C SER B 20 -13.640 -4.206 7.421 1.00 0.00 C ATOM 711 O SER B 20 -12.975 -4.473 8.422 1.00 0.00 O ATOM 712 CB SER B 20 -16.094 -3.975 7.851 1.00 0.00 C ATOM 713 OG SER B 20 -17.194 -3.088 7.937 1.00 0.00 O ATOM 0 H SER B 20 -15.809 -2.760 5.717 1.00 0.00 H new ATOM 0 HA SER B 20 -14.594 -2.495 8.279 1.00 0.00 H new ATOM 0 HB2 SER B 20 -16.294 -4.735 7.096 1.00 0.00 H new ATOM 0 HB3 SER B 20 -15.967 -4.495 8.800 1.00 0.00 H new ATOM 0 HG SER B 20 -18.004 -3.592 8.161 1.00 0.00 H new ATOM 719 N ASP B 21 -13.409 -4.748 6.227 1.00 0.00 N ATOM 720 CA ASP B 21 -12.333 -5.713 6.012 1.00 0.00 C ATOM 721 C ASP B 21 -10.995 -5.179 6.521 1.00 0.00 C ATOM 722 O ASP B 21 -10.618 -4.042 6.238 1.00 0.00 O ATOM 723 CB ASP B 21 -12.223 -6.060 4.526 1.00 0.00 C ATOM 724 CG ASP B 21 -11.244 -7.187 4.269 1.00 0.00 C ATOM 725 OD1 ASP B 21 -11.470 -8.296 4.797 1.00 0.00 O ATOM 726 OD2 ASP B 21 -10.255 -6.962 3.541 1.00 0.00 O ATOM 0 H ASP B 21 -13.954 -4.535 5.392 1.00 0.00 H new ATOM 0 HA ASP B 21 -12.576 -6.613 6.576 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -13.206 -6.342 4.147 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -11.909 -5.176 3.971 1.00 0.00 H new ATOM 731 N THR B 22 -10.287 -6.016 7.276 1.00 0.00 N ATOM 732 CA THR B 22 -8.991 -5.648 7.838 1.00 0.00 C ATOM 733 C THR B 22 -7.907 -5.600 6.765 1.00 0.00 C ATOM 734 O THR B 22 -7.988 -6.301 5.756 1.00 0.00 O ATOM 735 CB THR B 22 -8.560 -6.639 8.936 1.00 0.00 C ATOM 736 OG1 THR B 22 -8.389 -7.947 8.378 1.00 0.00 O ATOM 737 CG2 THR B 22 -9.595 -6.692 10.050 1.00 0.00 C ATOM 0 H THR B 22 -10.592 -6.960 7.513 1.00 0.00 H new ATOM 0 HA THR B 22 -9.109 -4.654 8.270 1.00 0.00 H new ATOM 0 HB THR B 22 -7.613 -6.296 9.353 1.00 0.00 H new ATOM 0 HG1 THR B 22 -8.113 -8.570 9.083 1.00 0.00 H new ATOM 0 HG21 THR B 22 -9.271 -7.398 10.815 1.00 0.00 H new ATOM 0 HG22 THR B 22 -9.704 -5.702 10.493 1.00 0.00 H new ATOM 0 HG23 THR B 22 -10.553 -7.014 9.642 1.00 0.00 H new ATOM 745 N ILE B 23 -6.890 -4.771 6.995 1.00 0.00 N ATOM 746 CA ILE B 23 -5.782 -4.635 6.055 1.00 0.00 C ATOM 747 C ILE B 23 -5.161 -5.992 5.747 1.00 0.00 C ATOM 748 O ILE B 23 -4.830 -6.286 4.598 1.00 0.00 O ATOM 749 CB ILE B 23 -4.685 -3.696 6.603 1.00 0.00 C ATOM 750 CG1 ILE B 23 -5.238 -2.281 6.799 1.00 0.00 C ATOM 751 CG2 ILE B 23 -3.479 -3.677 5.671 1.00 0.00 C ATOM 752 CD1 ILE B 23 -5.698 -1.622 5.517 1.00 0.00 C ATOM 0 H ILE B 23 -6.812 -4.184 7.825 1.00 0.00 H new ATOM 0 HA ILE B 23 -6.193 -4.204 5.142 1.00 0.00 H new ATOM 0 HB ILE B 23 -4.361 -4.075 7.572 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -6.075 -2.321 7.496 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -4.469 -1.661 7.260 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -2.718 -3.010 6.075 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -3.070 -4.684 5.584 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -3.786 -3.324 4.686 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -6.076 -0.624 5.737 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -4.859 -1.548 4.825 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -6.490 -2.219 5.065 1.00 0.00 H new ATOM 764 N ASP B 24 -5.005 -6.813 6.781 1.00 0.00 N ATOM 765 CA ASP B 24 -4.422 -8.143 6.622 1.00 0.00 C ATOM 766 C ASP B 24 -5.139 -8.917 5.517 1.00 0.00 C ATOM 767 O ASP B 24 -4.501 -9.475 4.620 1.00 0.00 O ATOM 768 CB ASP B 24 -4.502 -8.917 7.940 1.00 0.00 C ATOM 769 CG ASP B 24 -3.823 -10.272 7.867 1.00 0.00 C ATOM 770 OD1 ASP B 24 -3.248 -10.596 6.806 1.00 0.00 O ATOM 771 OD2 ASP B 24 -3.862 -11.009 8.875 1.00 0.00 O ATOM 0 H ASP B 24 -5.274 -6.582 7.738 1.00 0.00 H new ATOM 0 HA ASP B 24 -3.375 -8.027 6.341 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -4.041 -8.327 8.732 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -5.548 -9.054 8.213 1.00 0.00 H new ATOM 776 N ASN B 25 -6.468 -8.936 5.580 1.00 0.00 N ATOM 777 CA ASN B 25 -7.264 -9.632 4.578 1.00 0.00 C ATOM 778 C ASN B 25 -6.984 -9.059 3.195 1.00 0.00 C ATOM 779 O ASN B 25 -6.862 -9.798 2.219 1.00 0.00 O ATOM 780 CB ASN B 25 -8.754 -9.523 4.901 1.00 0.00 C ATOM 781 CG ASN B 25 -9.614 -10.325 3.943 1.00 0.00 C ATOM 782 OD1 ASN B 25 -9.624 -10.074 2.738 1.00 0.00 O ATOM 783 ND2 ASN B 25 -10.341 -11.300 4.477 1.00 0.00 N ATOM 0 H ASN B 25 -7.013 -8.479 6.312 1.00 0.00 H new ATOM 0 HA ASN B 25 -6.986 -10.686 4.588 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -8.928 -9.870 5.919 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -9.055 -8.476 4.865 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -10.938 -11.875 3.883 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -10.302 -11.473 5.481 1.00 0.00 H new ATOM 790 N VAL B 26 -6.869 -7.734 3.125 1.00 0.00 N ATOM 791 CA VAL B 26 -6.584 -7.062 1.864 1.00 0.00 C ATOM 792 C VAL B 26 -5.318 -7.636 1.244 1.00 0.00 C ATOM 793 O VAL B 26 -5.266 -7.907 0.044 1.00 0.00 O ATOM 794 CB VAL B 26 -6.412 -5.542 2.058 1.00 0.00 C ATOM 795 CG1 VAL B 26 -6.112 -4.861 0.731 1.00 0.00 C ATOM 796 CG2 VAL B 26 -7.651 -4.943 2.705 1.00 0.00 C ATOM 0 H VAL B 26 -6.969 -7.109 3.925 1.00 0.00 H new ATOM 0 HA VAL B 26 -7.433 -7.229 1.201 1.00 0.00 H new ATOM 0 HB VAL B 26 -5.565 -5.374 2.723 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -5.994 -3.789 0.891 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -5.192 -5.269 0.313 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -6.935 -5.036 0.038 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -7.511 -3.870 2.834 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -8.517 -5.122 2.068 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -7.814 -5.407 3.678 1.00 0.00 H new ATOM 806 N LYS B 27 -4.304 -7.837 2.082 1.00 0.00 N ATOM 807 CA LYS B 27 -3.041 -8.401 1.632 1.00 0.00 C ATOM 808 C LYS B 27 -3.257 -9.806 1.086 1.00 0.00 C ATOM 809 O LYS B 27 -2.680 -10.180 0.066 1.00 0.00 O ATOM 810 CB LYS B 27 -2.028 -8.434 2.778 1.00 0.00 C ATOM 811 CG LYS B 27 -1.586 -7.057 3.247 1.00 0.00 C ATOM 812 CD LYS B 27 -0.880 -6.293 2.139 1.00 0.00 C ATOM 813 CE LYS B 27 -0.359 -4.953 2.634 1.00 0.00 C ATOM 814 NZ LYS B 27 0.633 -5.116 3.732 1.00 0.00 N ATOM 0 H LYS B 27 -4.336 -7.616 3.077 1.00 0.00 H new ATOM 0 HA LYS B 27 -2.646 -7.769 0.837 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -2.464 -8.972 3.620 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -1.151 -8.998 2.459 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -2.454 -6.491 3.586 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -0.918 -7.159 4.103 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -0.051 -6.888 1.756 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -1.569 -6.133 1.309 1.00 0.00 H new ATOM 0 HE2 LYS B 27 0.101 -4.414 1.806 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -1.193 -4.346 2.985 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 0.952 -4.180 4.054 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 0.192 -5.623 4.526 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 1.449 -5.659 3.385 1.00 0.00 H new ATOM 828 N SER B 28 -4.100 -10.577 1.771 1.00 0.00 N ATOM 829 CA SER B 28 -4.401 -11.940 1.348 1.00 0.00 C ATOM 830 C SER B 28 -4.932 -11.950 -0.082 1.00 0.00 C ATOM 831 O SER B 28 -4.498 -12.750 -0.912 1.00 0.00 O ATOM 832 CB SER B 28 -5.423 -12.579 2.290 1.00 0.00 C ATOM 833 OG SER B 28 -4.928 -12.640 3.617 1.00 0.00 O ATOM 0 H SER B 28 -4.584 -10.281 2.618 1.00 0.00 H new ATOM 0 HA SER B 28 -3.479 -12.521 1.384 1.00 0.00 H new ATOM 0 HB2 SER B 28 -6.349 -12.004 2.270 1.00 0.00 H new ATOM 0 HB3 SER B 28 -5.664 -13.584 1.942 1.00 0.00 H new ATOM 0 HG SER B 28 -5.601 -13.051 4.199 1.00 0.00 H new ATOM 839 N LYS B 29 -5.868 -11.047 -0.364 1.00 0.00 N ATOM 840 CA LYS B 29 -6.450 -10.944 -1.697 1.00 0.00 C ATOM 841 C LYS B 29 -5.374 -10.604 -2.720 1.00 0.00 C ATOM 842 O LYS B 29 -5.300 -11.218 -3.784 1.00 0.00 O ATOM 843 CB LYS B 29 -7.552 -9.883 -1.722 1.00 0.00 C ATOM 844 CG LYS B 29 -8.730 -10.204 -0.817 1.00 0.00 C ATOM 845 CD LYS B 29 -9.817 -9.149 -0.925 1.00 0.00 C ATOM 846 CE LYS B 29 -11.014 -9.490 -0.052 1.00 0.00 C ATOM 847 NZ LYS B 29 -11.611 -10.805 -0.416 1.00 0.00 N ATOM 0 H LYS B 29 -6.238 -10.378 0.312 1.00 0.00 H new ATOM 0 HA LYS B 29 -6.889 -11.908 -1.955 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -7.128 -8.924 -1.425 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -7.911 -9.769 -2.745 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -9.139 -11.179 -1.083 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -8.389 -10.272 0.216 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -9.415 -8.180 -0.630 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -10.136 -9.059 -1.963 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -10.707 -9.508 0.994 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -11.768 -8.709 -0.150 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -12.540 -10.903 0.040 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -11.725 -10.861 -1.448 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -10.985 -11.571 -0.095 1.00 0.00 H new ATOM 861 N ILE B 30 -4.534 -9.628 -2.384 1.00 0.00 N ATOM 862 CA ILE B 30 -3.452 -9.218 -3.270 1.00 0.00 C ATOM 863 C ILE B 30 -2.529 -10.397 -3.554 1.00 0.00 C ATOM 864 O ILE B 30 -2.027 -10.554 -4.665 1.00 0.00 O ATOM 865 CB ILE B 30 -2.629 -8.058 -2.666 1.00 0.00 C ATOM 866 CG1 ILE B 30 -3.532 -6.851 -2.392 1.00 0.00 C ATOM 867 CG2 ILE B 30 -1.488 -7.674 -3.600 1.00 0.00 C ATOM 868 CD1 ILE B 30 -2.815 -5.687 -1.738 1.00 0.00 C ATOM 0 H ILE B 30 -4.583 -9.109 -1.507 1.00 0.00 H new ATOM 0 HA ILE B 30 -3.904 -8.870 -4.199 1.00 0.00 H new ATOM 0 HB ILE B 30 -2.201 -8.390 -1.720 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -3.969 -6.515 -3.332 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -4.357 -7.164 -1.752 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -0.918 -6.856 -3.160 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -0.834 -8.533 -3.748 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -1.895 -7.358 -4.561 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -3.519 -4.871 -1.576 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -2.402 -6.006 -0.781 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -2.008 -5.346 -2.386 1.00 0.00 H new ATOM 880 N GLN B 31 -2.320 -11.228 -2.539 1.00 0.00 N ATOM 881 CA GLN B 31 -1.468 -12.403 -2.671 1.00 0.00 C ATOM 882 C GLN B 31 -2.061 -13.386 -3.674 1.00 0.00 C ATOM 883 O GLN B 31 -1.345 -13.973 -4.482 1.00 0.00 O ATOM 884 CB GLN B 31 -1.297 -13.090 -1.314 1.00 0.00 C ATOM 885 CG GLN B 31 -0.430 -14.340 -1.368 1.00 0.00 C ATOM 886 CD GLN B 31 -0.402 -15.105 -0.054 1.00 0.00 C ATOM 887 OE1 GLN B 31 0.310 -16.101 0.077 1.00 0.00 O ATOM 888 NE2 GLN B 31 -1.184 -14.655 0.923 1.00 0.00 N ATOM 0 H GLN B 31 -2.731 -11.109 -1.613 1.00 0.00 H new ATOM 0 HA GLN B 31 -0.492 -12.078 -3.032 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -0.857 -12.383 -0.611 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -2.280 -13.356 -0.925 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -0.799 -14.997 -2.156 1.00 0.00 H new ATOM 0 HG3 GLN B 31 0.587 -14.058 -1.639 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -1.759 -13.826 0.775 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -1.208 -15.139 1.821 1.00 0.00 H new ATOM 897 N ASP B 32 -3.374 -13.569 -3.607 1.00 0.00 N ATOM 898 CA ASP B 32 -4.064 -14.490 -4.503 1.00 0.00 C ATOM 899 C ASP B 32 -3.964 -14.035 -5.959 1.00 0.00 C ATOM 900 O ASP B 32 -3.694 -14.841 -6.850 1.00 0.00 O ATOM 901 CB ASP B 32 -5.535 -14.618 -4.095 1.00 0.00 C ATOM 902 CG ASP B 32 -6.293 -15.623 -4.942 1.00 0.00 C ATOM 903 OD1 ASP B 32 -6.412 -15.403 -6.166 1.00 0.00 O ATOM 904 OD2 ASP B 32 -6.767 -16.633 -4.381 1.00 0.00 O ATOM 0 H ASP B 32 -3.983 -13.092 -2.942 1.00 0.00 H new ATOM 0 HA ASP B 32 -3.579 -15.463 -4.420 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -5.593 -14.915 -3.048 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -6.017 -13.644 -4.177 1.00 0.00 H new ATOM 909 N LYS B 33 -4.200 -12.748 -6.198 1.00 0.00 N ATOM 910 CA LYS B 33 -4.154 -12.199 -7.553 1.00 0.00 C ATOM 911 C LYS B 33 -2.719 -12.007 -8.044 1.00 0.00 C ATOM 912 O LYS B 33 -2.314 -12.585 -9.053 1.00 0.00 O ATOM 913 CB LYS B 33 -4.893 -10.859 -7.604 1.00 0.00 C ATOM 914 CG LYS B 33 -5.066 -10.319 -9.014 1.00 0.00 C ATOM 915 CD LYS B 33 -5.796 -8.986 -9.016 1.00 0.00 C ATOM 916 CE LYS B 33 -5.973 -8.455 -10.429 1.00 0.00 C ATOM 917 NZ LYS B 33 -4.666 -8.273 -11.119 1.00 0.00 N ATOM 0 H LYS B 33 -4.425 -12.066 -5.474 1.00 0.00 H new ATOM 0 HA LYS B 33 -4.642 -12.918 -8.211 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -5.875 -10.976 -7.145 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -4.347 -10.128 -7.007 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -4.088 -10.200 -9.481 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -5.621 -11.040 -9.615 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -6.772 -9.103 -8.544 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -5.239 -8.263 -8.421 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -6.593 -9.145 -11.001 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -6.502 -7.503 -10.396 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -4.715 -7.441 -11.741 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -3.916 -8.133 -10.412 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -4.453 -9.118 -11.687 1.00 0.00 H new ATOM 931 N GLU B 34 -1.967 -11.172 -7.337 1.00 0.00 N ATOM 932 CA GLU B 34 -0.585 -10.870 -7.705 1.00 0.00 C ATOM 933 C GLU B 34 0.337 -12.072 -7.520 1.00 0.00 C ATOM 934 O GLU B 34 1.209 -12.328 -8.351 1.00 0.00 O ATOM 935 CB GLU B 34 -0.069 -9.695 -6.874 1.00 0.00 C ATOM 936 CG GLU B 34 -0.940 -8.452 -6.967 1.00 0.00 C ATOM 937 CD GLU B 34 -1.007 -7.878 -8.371 1.00 0.00 C ATOM 938 OE1 GLU B 34 -0.318 -8.408 -9.268 1.00 0.00 O ATOM 939 OE2 GLU B 34 -1.746 -6.892 -8.569 1.00 0.00 O ATOM 0 H GLU B 34 -2.292 -10.688 -6.500 1.00 0.00 H new ATOM 0 HA GLU B 34 -0.581 -10.609 -8.763 1.00 0.00 H new ATOM 0 HB2 GLU B 34 0.000 -10.002 -5.830 1.00 0.00 H new ATOM 0 HB3 GLU B 34 0.941 -9.446 -7.201 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -1.948 -8.696 -6.632 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -0.553 -7.692 -6.288 1.00 0.00 H new ATOM 946 N GLY B 35 0.159 -12.792 -6.419 1.00 0.00 N ATOM 947 CA GLY B 35 1.003 -13.941 -6.142 1.00 0.00 C ATOM 948 C GLY B 35 2.275 -13.541 -5.421 1.00 0.00 C ATOM 949 O GLY B 35 3.374 -13.939 -5.809 1.00 0.00 O ATOM 0 H GLY B 35 -0.553 -12.602 -5.714 1.00 0.00 H new ATOM 0 HA2 GLY B 35 0.452 -14.660 -5.536 1.00 0.00 H new ATOM 0 HA3 GLY B 35 1.256 -14.440 -7.077 1.00 0.00 H new ATOM 953 N ILE B 36 2.119 -12.740 -4.369 1.00 0.00 N ATOM 954 CA ILE B 36 3.251 -12.265 -3.584 1.00 0.00 C ATOM 955 C ILE B 36 2.929 -12.296 -2.091 1.00 0.00 C ATOM 956 O ILE B 36 1.842 -11.890 -1.679 1.00 0.00 O ATOM 957 CB ILE B 36 3.640 -10.826 -3.989 1.00 0.00 C ATOM 958 CG1 ILE B 36 4.026 -10.780 -5.470 1.00 0.00 C ATOM 959 CG2 ILE B 36 4.783 -10.313 -3.121 1.00 0.00 C ATOM 960 CD1 ILE B 36 4.356 -9.390 -5.972 1.00 0.00 C ATOM 0 H ILE B 36 1.213 -12.406 -4.041 1.00 0.00 H new ATOM 0 HA ILE B 36 4.089 -12.932 -3.785 1.00 0.00 H new ATOM 0 HB ILE B 36 2.778 -10.177 -3.833 1.00 0.00 H new ATOM 0 HG12 ILE B 36 4.887 -11.429 -5.632 1.00 0.00 H new ATOM 0 HG13 ILE B 36 3.206 -11.185 -6.063 1.00 0.00 H new ATOM 0 HG21 ILE B 36 5.042 -9.298 -3.423 1.00 0.00 H new ATOM 0 HG22 ILE B 36 4.474 -10.313 -2.076 1.00 0.00 H new ATOM 0 HG23 ILE B 36 5.651 -10.960 -3.243 1.00 0.00 H new ATOM 0 HD11 ILE B 36 4.620 -9.438 -7.029 1.00 0.00 H new ATOM 0 HD12 ILE B 36 3.489 -8.741 -5.843 1.00 0.00 H new ATOM 0 HD13 ILE B 36 5.197 -8.989 -5.406 1.00 0.00 H new ATOM 972 N PRO B 37 3.870 -12.783 -1.256 1.00 0.00 N ATOM 973 CA PRO B 37 3.670 -12.863 0.194 1.00 0.00 C ATOM 974 C PRO B 37 3.145 -11.552 0.776 1.00 0.00 C ATOM 975 O PRO B 37 3.713 -10.488 0.531 1.00 0.00 O ATOM 976 CB PRO B 37 5.073 -13.156 0.726 1.00 0.00 C ATOM 977 CG PRO B 37 5.758 -13.869 -0.387 1.00 0.00 C ATOM 978 CD PRO B 37 5.195 -13.296 -1.660 1.00 0.00 C ATOM 0 HA PRO B 37 2.929 -13.615 0.465 1.00 0.00 H new ATOM 0 HB2 PRO B 37 5.597 -12.237 0.989 1.00 0.00 H new ATOM 0 HB3 PRO B 37 5.035 -13.770 1.626 1.00 0.00 H new ATOM 0 HG2 PRO B 37 6.837 -13.723 -0.338 1.00 0.00 H new ATOM 0 HG3 PRO B 37 5.579 -14.943 -0.330 1.00 0.00 H new ATOM 0 HD2 PRO B 37 5.828 -12.502 -2.056 1.00 0.00 H new ATOM 0 HD3 PRO B 37 5.111 -14.055 -2.438 1.00 0.00 H new ATOM 986 N PRO B 38 2.048 -11.610 1.555 1.00 0.00 N ATOM 987 CA PRO B 38 1.451 -10.416 2.166 1.00 0.00 C ATOM 988 C PRO B 38 2.450 -9.640 3.013 1.00 0.00 C ATOM 989 O PRO B 38 2.529 -8.414 2.927 1.00 0.00 O ATOM 990 CB PRO B 38 0.333 -10.981 3.046 1.00 0.00 C ATOM 991 CG PRO B 38 0.009 -12.306 2.449 1.00 0.00 C ATOM 992 CD PRO B 38 1.302 -12.835 1.896 1.00 0.00 C ATOM 0 HA PRO B 38 1.101 -9.709 1.414 1.00 0.00 H new ATOM 0 HB2 PRO B 38 0.658 -11.083 4.081 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -0.538 -10.325 3.049 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -0.401 -12.983 3.199 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -0.741 -12.208 1.664 1.00 0.00 H new ATOM 0 HD2 PRO B 38 1.836 -13.441 2.629 1.00 0.00 H new ATOM 0 HD3 PRO B 38 1.138 -13.464 1.021 1.00 0.00 H new ATOM 1000 N ASP B 39 3.213 -10.361 3.829 1.00 0.00 N ATOM 1001 CA ASP B 39 4.212 -9.738 4.689 1.00 0.00 C ATOM 1002 C ASP B 39 5.190 -8.918 3.859 1.00 0.00 C ATOM 1003 O ASP B 39 5.510 -7.780 4.200 1.00 0.00 O ATOM 1004 CB ASP B 39 4.969 -10.802 5.486 1.00 0.00 C ATOM 1005 CG ASP B 39 4.054 -11.619 6.376 1.00 0.00 C ATOM 1006 OD1 ASP B 39 3.139 -12.280 5.841 1.00 0.00 O ATOM 1007 OD2 ASP B 39 4.253 -11.600 7.609 1.00 0.00 O ATOM 0 H ASP B 39 3.158 -11.376 3.912 1.00 0.00 H new ATOM 0 HA ASP B 39 3.699 -9.075 5.386 1.00 0.00 H new ATOM 0 HB2 ASP B 39 5.489 -11.467 4.796 1.00 0.00 H new ATOM 0 HB3 ASP B 39 5.731 -10.319 6.098 1.00 0.00 H new ATOM 1012 N GLN B 40 5.655 -9.503 2.762 1.00 0.00 N ATOM 1013 CA GLN B 40 6.590 -8.831 1.871 1.00 0.00 C ATOM 1014 C GLN B 40 5.950 -7.589 1.256 1.00 0.00 C ATOM 1015 O GLN B 40 6.611 -6.571 1.051 1.00 0.00 O ATOM 1016 CB GLN B 40 7.045 -9.790 0.768 1.00 0.00 C ATOM 1017 CG GLN B 40 8.040 -9.177 -0.205 1.00 0.00 C ATOM 1018 CD GLN B 40 8.535 -10.163 -1.251 1.00 0.00 C ATOM 1019 OE1 GLN B 40 9.341 -9.812 -2.112 1.00 0.00 O ATOM 1020 NE2 GLN B 40 8.058 -11.403 -1.185 1.00 0.00 N ATOM 0 H GLN B 40 5.398 -10.445 2.468 1.00 0.00 H new ATOM 0 HA GLN B 40 7.458 -8.519 2.452 1.00 0.00 H new ATOM 0 HB2 GLN B 40 7.495 -10.670 1.227 1.00 0.00 H new ATOM 0 HB3 GLN B 40 6.171 -10.132 0.213 1.00 0.00 H new ATOM 0 HG2 GLN B 40 7.574 -8.328 -0.706 1.00 0.00 H new ATOM 0 HG3 GLN B 40 8.893 -8.789 0.352 1.00 0.00 H new ATOM 0 HE21 GLN B 40 7.391 -11.655 -0.456 1.00 0.00 H new ATOM 0 HE22 GLN B 40 8.359 -12.102 -1.864 1.00 0.00 H new ATOM 1029 N GLN B 41 4.659 -7.690 0.958 1.00 0.00 N ATOM 1030 CA GLN B 41 3.912 -6.588 0.358 1.00 0.00 C ATOM 1031 C GLN B 41 3.637 -5.478 1.369 1.00 0.00 C ATOM 1032 O GLN B 41 3.153 -5.735 2.471 1.00 0.00 O ATOM 1033 CB GLN B 41 2.589 -7.110 -0.202 1.00 0.00 C ATOM 1034 CG GLN B 41 2.765 -8.220 -1.221 1.00 0.00 C ATOM 1035 CD GLN B 41 1.475 -8.960 -1.513 1.00 0.00 C ATOM 1036 OE1 GLN B 41 0.826 -9.483 -0.608 1.00 0.00 O ATOM 1037 NE2 GLN B 41 1.103 -9.017 -2.782 1.00 0.00 N ATOM 0 H GLN B 41 4.104 -8.530 1.123 1.00 0.00 H new ATOM 0 HA GLN B 41 4.519 -6.169 -0.445 1.00 0.00 H new ATOM 0 HB2 GLN B 41 1.973 -7.475 0.620 1.00 0.00 H new ATOM 0 HB3 GLN B 41 2.047 -6.285 -0.664 1.00 0.00 H new ATOM 0 HG2 GLN B 41 3.154 -7.798 -2.148 1.00 0.00 H new ATOM 0 HG3 GLN B 41 3.510 -8.927 -0.856 1.00 0.00 H new ATOM 0 HE21 GLN B 41 1.671 -8.569 -3.501 1.00 0.00 H new ATOM 0 HE22 GLN B 41 0.248 -9.509 -3.041 1.00 0.00 H new ATOM 1046 N ARG B 42 3.934 -4.243 0.976 1.00 0.00 N ATOM 1047 CA ARG B 42 3.703 -3.085 1.836 1.00 0.00 C ATOM 1048 C ARG B 42 2.920 -2.007 1.090 1.00 0.00 C ATOM 1049 O ARG B 42 3.374 -1.494 0.066 1.00 0.00 O ATOM 1050 CB ARG B 42 5.029 -2.502 2.338 1.00 0.00 C ATOM 1051 CG ARG B 42 5.597 -3.189 3.574 1.00 0.00 C ATOM 1052 CD ARG B 42 6.011 -4.626 3.297 1.00 0.00 C ATOM 1053 NE ARG B 42 6.665 -5.242 4.452 1.00 0.00 N ATOM 1054 CZ ARG B 42 6.073 -5.429 5.631 1.00 0.00 C ATOM 1055 NH1 ARG B 42 4.809 -5.071 5.812 1.00 0.00 N ATOM 1056 NH2 ARG B 42 6.747 -5.985 6.629 1.00 0.00 N ATOM 0 H ARG B 42 4.336 -4.017 0.066 1.00 0.00 H new ATOM 0 HA ARG B 42 3.120 -3.421 2.693 1.00 0.00 H new ATOM 0 HB2 ARG B 42 5.764 -2.562 1.535 1.00 0.00 H new ATOM 0 HB3 ARG B 42 4.885 -1.445 2.560 1.00 0.00 H new ATOM 0 HG2 ARG B 42 6.459 -2.628 3.935 1.00 0.00 H new ATOM 0 HG3 ARG B 42 4.852 -3.175 4.369 1.00 0.00 H new ATOM 0 HD2 ARG B 42 5.132 -5.210 3.024 1.00 0.00 H new ATOM 0 HD3 ARG B 42 6.687 -4.650 2.442 1.00 0.00 H new ATOM 0 HE ARG B 42 7.633 -5.547 4.348 1.00 0.00 H new ATOM 0 HH11 ARG B 42 4.284 -4.650 5.046 1.00 0.00 H new ATOM 0 HH12 ARG B 42 4.362 -5.217 6.717 1.00 0.00 H new ATOM 0 HH21 ARG B 42 7.717 -6.269 6.493 1.00 0.00 H new ATOM 0 HH22 ARG B 42 6.295 -6.129 7.532 1.00 0.00 H new ATOM 1070 N LEU B 43 1.746 -1.666 1.613 1.00 0.00 N ATOM 1071 CA LEU B 43 0.900 -0.645 1.002 1.00 0.00 C ATOM 1072 C LEU B 43 1.026 0.684 1.741 1.00 0.00 C ATOM 1073 O LEU B 43 1.118 0.717 2.969 1.00 0.00 O ATOM 1074 CB LEU B 43 -0.562 -1.097 0.990 1.00 0.00 C ATOM 1075 CG LEU B 43 -0.862 -2.320 0.122 1.00 0.00 C ATOM 1076 CD1 LEU B 43 -2.325 -2.714 0.250 1.00 0.00 C ATOM 1077 CD2 LEU B 43 -0.511 -2.042 -1.334 1.00 0.00 C ATOM 0 H LEU B 43 1.358 -2.082 2.460 1.00 0.00 H new ATOM 0 HA LEU B 43 1.237 -0.503 -0.025 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -0.866 -1.316 2.014 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -1.179 -0.267 0.645 1.00 0.00 H new ATOM 0 HG LEU B 43 -0.247 -3.150 0.471 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -2.523 -3.586 -0.374 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -2.548 -2.953 1.290 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -2.955 -1.885 -0.074 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -0.731 -2.924 -1.936 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -1.100 -1.199 -1.696 1.00 0.00 H new ATOM 0 HD23 LEU B 43 0.550 -1.804 -1.414 1.00 0.00 H new ATOM 1089 N ILE B 44 1.030 1.778 0.984 1.00 0.00 N ATOM 1090 CA ILE B 44 1.147 3.111 1.565 1.00 0.00 C ATOM 1091 C ILE B 44 0.114 4.065 0.971 1.00 0.00 C ATOM 1092 O ILE B 44 -0.200 3.993 -0.218 1.00 0.00 O ATOM 1093 CB ILE B 44 2.558 3.695 1.344 1.00 0.00 C ATOM 1094 CG1 ILE B 44 3.617 2.756 1.925 1.00 0.00 C ATOM 1095 CG2 ILE B 44 2.666 5.079 1.972 1.00 0.00 C ATOM 1096 CD1 ILE B 44 5.038 3.221 1.690 1.00 0.00 C ATOM 0 H ILE B 44 0.954 1.767 -0.033 1.00 0.00 H new ATOM 0 HA ILE B 44 0.966 3.008 2.635 1.00 0.00 H new ATOM 0 HB ILE B 44 2.732 3.791 0.272 1.00 0.00 H new ATOM 0 HG12 ILE B 44 3.450 2.654 2.997 1.00 0.00 H new ATOM 0 HG13 ILE B 44 3.491 1.766 1.487 1.00 0.00 H new ATOM 0 HG21 ILE B 44 3.667 5.476 1.807 1.00 0.00 H new ATOM 0 HG22 ILE B 44 1.932 5.744 1.516 1.00 0.00 H new ATOM 0 HG23 ILE B 44 2.476 5.008 3.043 1.00 0.00 H new ATOM 0 HD11 ILE B 44 5.732 2.505 2.130 1.00 0.00 H new ATOM 0 HD12 ILE B 44 5.224 3.296 0.619 1.00 0.00 H new ATOM 0 HD13 ILE B 44 5.182 4.198 2.152 1.00 0.00 H new ATOM 1108 N PHE B 45 -0.407 4.959 1.807 1.00 0.00 N ATOM 1109 CA PHE B 45 -1.403 5.932 1.370 1.00 0.00 C ATOM 1110 C PHE B 45 -1.342 7.191 2.229 1.00 0.00 C ATOM 1111 O PHE B 45 -1.211 7.118 3.453 1.00 0.00 O ATOM 1112 CB PHE B 45 -2.807 5.325 1.430 1.00 0.00 C ATOM 1113 CG PHE B 45 -3.897 6.279 1.023 1.00 0.00 C ATOM 1114 CD1 PHE B 45 -3.809 6.992 -0.163 1.00 0.00 C ATOM 1115 CD2 PHE B 45 -5.011 6.461 1.828 1.00 0.00 C ATOM 1116 CE1 PHE B 45 -4.811 7.868 -0.538 1.00 0.00 C ATOM 1117 CE2 PHE B 45 -6.015 7.335 1.458 1.00 0.00 C ATOM 1118 CZ PHE B 45 -5.915 8.040 0.274 1.00 0.00 C ATOM 0 H PHE B 45 -0.155 5.029 2.793 1.00 0.00 H new ATOM 0 HA PHE B 45 -1.180 6.204 0.338 1.00 0.00 H new ATOM 0 HB2 PHE B 45 -2.842 4.449 0.782 1.00 0.00 H new ATOM 0 HB3 PHE B 45 -3.000 4.978 2.445 1.00 0.00 H new ATOM 0 HD1 PHE B 45 -2.948 6.862 -0.801 1.00 0.00 H new ATOM 0 HD2 PHE B 45 -5.095 5.913 2.755 1.00 0.00 H new ATOM 0 HE1 PHE B 45 -4.730 8.417 -1.465 1.00 0.00 H new ATOM 0 HE2 PHE B 45 -6.878 7.467 2.094 1.00 0.00 H new ATOM 0 HZ PHE B 45 -6.699 8.724 -0.016 1.00 0.00 H new ATOM 1128 N ALA B 46 -1.427 8.347 1.576 1.00 0.00 N ATOM 1129 CA ALA B 46 -1.373 9.625 2.273 1.00 0.00 C ATOM 1130 C ALA B 46 -0.178 9.672 3.216 1.00 0.00 C ATOM 1131 O ALA B 46 -0.256 10.228 4.312 1.00 0.00 O ATOM 1132 CB ALA B 46 -2.666 9.867 3.039 1.00 0.00 C ATOM 0 H ALA B 46 -1.534 8.423 0.564 1.00 0.00 H new ATOM 0 HA ALA B 46 -1.256 10.416 1.532 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -2.610 10.826 3.554 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -3.505 9.878 2.343 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -2.811 9.071 3.769 1.00 0.00 H new ATOM 1138 N GLY B 47 0.929 9.079 2.780 1.00 0.00 N ATOM 1139 CA GLY B 47 2.127 9.057 3.594 1.00 0.00 C ATOM 1140 C GLY B 47 2.080 8.003 4.686 1.00 0.00 C ATOM 1141 O GLY B 47 3.116 7.463 5.074 1.00 0.00 O ATOM 0 H GLY B 47 1.016 8.613 1.877 1.00 0.00 H new ATOM 0 HA2 GLY B 47 2.991 8.873 2.955 1.00 0.00 H new ATOM 0 HA3 GLY B 47 2.270 10.038 4.048 1.00 0.00 H new ATOM 1145 N LYS B 48 0.882 7.716 5.192 1.00 0.00 N ATOM 1146 CA LYS B 48 0.724 6.726 6.255 1.00 0.00 C ATOM 1147 C LYS B 48 0.624 5.310 5.696 1.00 0.00 C ATOM 1148 O LYS B 48 -0.194 5.030 4.819 1.00 0.00 O ATOM 1149 CB LYS B 48 -0.514 7.044 7.097 1.00 0.00 C ATOM 1150 CG LYS B 48 -0.421 8.371 7.837 1.00 0.00 C ATOM 1151 CD LYS B 48 -1.663 8.636 8.676 1.00 0.00 C ATOM 1152 CE LYS B 48 -2.906 8.773 7.812 1.00 0.00 C ATOM 1153 NZ LYS B 48 -4.117 9.069 8.626 1.00 0.00 N ATOM 0 H LYS B 48 0.012 8.152 4.886 1.00 0.00 H new ATOM 0 HA LYS B 48 1.612 6.776 6.885 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -1.390 7.059 6.449 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -0.667 6.243 7.821 1.00 0.00 H new ATOM 0 HG2 LYS B 48 0.459 8.368 8.480 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -0.288 9.180 7.119 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -1.802 7.822 9.387 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -1.522 9.547 9.258 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -2.755 9.569 7.082 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -3.062 7.852 7.251 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -4.943 9.155 8.000 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -4.276 8.298 9.305 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -3.979 9.961 9.142 1.00 0.00 H new ATOM 1167 N GLN B 49 1.459 4.418 6.222 1.00 0.00 N ATOM 1168 CA GLN B 49 1.471 3.022 5.795 1.00 0.00 C ATOM 1169 C GLN B 49 0.295 2.261 6.402 1.00 0.00 C ATOM 1170 O GLN B 49 -0.045 2.458 7.569 1.00 0.00 O ATOM 1171 CB GLN B 49 2.802 2.360 6.179 1.00 0.00 C ATOM 1172 CG GLN B 49 3.103 2.366 7.674 1.00 0.00 C ATOM 1173 CD GLN B 49 2.430 1.233 8.434 1.00 0.00 C ATOM 1174 OE1 GLN B 49 2.486 1.182 9.663 1.00 0.00 O ATOM 1175 NE2 GLN B 49 1.805 0.309 7.712 1.00 0.00 N ATOM 0 H GLN B 49 2.140 4.639 6.949 1.00 0.00 H new ATOM 0 HA GLN B 49 1.369 2.991 4.710 1.00 0.00 H new ATOM 0 HB2 GLN B 49 2.795 1.329 5.827 1.00 0.00 H new ATOM 0 HB3 GLN B 49 3.611 2.870 5.656 1.00 0.00 H new ATOM 0 HG2 GLN B 49 4.181 2.300 7.820 1.00 0.00 H new ATOM 0 HG3 GLN B 49 2.782 3.318 8.097 1.00 0.00 H new ATOM 0 HE21 GLN B 49 1.781 0.387 6.695 1.00 0.00 H new ATOM 0 HE22 GLN B 49 1.350 -0.478 8.175 1.00 0.00 H new ATOM 1184 N LEU B 50 -0.330 1.397 5.605 1.00 0.00 N ATOM 1185 CA LEU B 50 -1.472 0.616 6.075 1.00 0.00 C ATOM 1186 C LEU B 50 -1.042 -0.426 7.103 1.00 0.00 C ATOM 1187 O LEU B 50 -0.165 -1.247 6.836 1.00 0.00 O ATOM 1188 CB LEU B 50 -2.164 -0.088 4.907 1.00 0.00 C ATOM 1189 CG LEU B 50 -2.592 0.810 3.745 1.00 0.00 C ATOM 1190 CD1 LEU B 50 -3.313 -0.013 2.694 1.00 0.00 C ATOM 1191 CD2 LEU B 50 -3.481 1.948 4.228 1.00 0.00 C ATOM 0 H LEU B 50 -0.067 1.220 4.636 1.00 0.00 H new ATOM 0 HA LEU B 50 -2.169 1.310 6.544 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -1.492 -0.854 4.520 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -3.047 -0.601 5.289 1.00 0.00 H new ATOM 0 HG LEU B 50 -1.697 1.249 3.304 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -3.615 0.633 1.870 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -2.647 -0.790 2.320 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -4.196 -0.474 3.136 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -3.769 2.569 3.380 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -4.375 1.537 4.698 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -2.936 2.553 4.953 1.00 0.00 H new ATOM 1203 N GLU B 51 -1.676 -0.399 8.271 1.00 0.00 N ATOM 1204 CA GLU B 51 -1.366 -1.355 9.329 1.00 0.00 C ATOM 1205 C GLU B 51 -2.264 -2.585 9.223 1.00 0.00 C ATOM 1206 O GLU B 51 -3.486 -2.465 9.153 1.00 0.00 O ATOM 1207 CB GLU B 51 -1.531 -0.701 10.702 1.00 0.00 C ATOM 1208 CG GLU B 51 -0.628 0.503 10.916 1.00 0.00 C ATOM 1209 CD GLU B 51 -0.797 1.127 12.288 1.00 0.00 C ATOM 1210 OE1 GLU B 51 -1.618 0.615 13.079 1.00 0.00 O ATOM 1211 OE2 GLU B 51 -0.107 2.128 12.574 1.00 0.00 O ATOM 0 H GLU B 51 -2.406 0.273 8.509 1.00 0.00 H new ATOM 0 HA GLU B 51 -0.329 -1.671 9.211 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -2.569 -0.392 10.826 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -1.324 -1.441 11.475 1.00 0.00 H new ATOM 0 HG2 GLU B 51 0.411 0.200 10.785 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -0.841 1.251 10.153 1.00 0.00 H new ATOM 1218 N ASP B 52 -1.653 -3.766 9.212 1.00 0.00 N ATOM 1219 CA ASP B 52 -2.400 -5.017 9.110 1.00 0.00 C ATOM 1220 C ASP B 52 -3.430 -5.142 10.230 1.00 0.00 C ATOM 1221 O ASP B 52 -3.165 -4.771 11.372 1.00 0.00 O ATOM 1222 CB ASP B 52 -1.443 -6.210 9.150 1.00 0.00 C ATOM 1223 CG ASP B 52 -0.640 -6.265 10.434 1.00 0.00 C ATOM 1224 OD1 ASP B 52 0.104 -5.301 10.711 1.00 0.00 O ATOM 1225 OD2 ASP B 52 -0.754 -7.273 11.163 1.00 0.00 O ATOM 0 H ASP B 52 -0.642 -3.884 9.272 1.00 0.00 H new ATOM 0 HA ASP B 52 -2.931 -5.011 8.158 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -2.013 -7.133 9.041 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -0.762 -6.154 8.301 1.00 0.00 H new ATOM 1230 N GLY B 53 -4.603 -5.674 9.893 1.00 0.00 N ATOM 1231 CA GLY B 53 -5.653 -5.846 10.883 1.00 0.00 C ATOM 1232 C GLY B 53 -6.533 -4.618 11.034 1.00 0.00 C ATOM 1233 O GLY B 53 -7.698 -4.727 11.414 1.00 0.00 O ATOM 0 H GLY B 53 -4.845 -5.989 8.953 1.00 0.00 H new ATOM 0 HA2 GLY B 53 -6.273 -6.698 10.603 1.00 0.00 H new ATOM 0 HA3 GLY B 53 -5.201 -6.083 11.846 1.00 0.00 H new ATOM 1237 N ARG B 54 -5.975 -3.449 10.743 1.00 0.00 N ATOM 1238 CA ARG B 54 -6.718 -2.195 10.855 1.00 0.00 C ATOM 1239 C ARG B 54 -7.845 -2.117 9.830 1.00 0.00 C ATOM 1240 O ARG B 54 -7.697 -2.553 8.688 1.00 0.00 O ATOM 1241 CB ARG B 54 -5.781 -0.996 10.698 1.00 0.00 C ATOM 1242 CG ARG B 54 -5.006 -0.644 11.962 1.00 0.00 C ATOM 1243 CD ARG B 54 -4.184 -1.817 12.478 1.00 0.00 C ATOM 1244 NE ARG B 54 -3.429 -1.465 13.678 1.00 0.00 N ATOM 1245 CZ ARG B 54 -2.661 -2.321 14.347 1.00 0.00 C ATOM 1246 NH1 ARG B 54 -2.557 -3.580 13.944 1.00 0.00 N ATOM 1247 NH2 ARG B 54 -1.999 -1.918 15.423 1.00 0.00 N ATOM 0 H ARG B 54 -5.011 -3.341 10.428 1.00 0.00 H new ATOM 0 HA ARG B 54 -7.164 -2.168 11.849 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -5.073 -1.204 9.896 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -6.366 -0.129 10.390 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -4.345 0.199 11.758 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -5.703 -0.323 12.736 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -4.845 -2.655 12.698 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -3.496 -2.149 11.700 1.00 0.00 H new ATOM 0 HE ARG B 54 -3.494 -0.507 14.023 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -3.067 -3.895 13.119 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -1.967 -4.233 14.459 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -2.078 -0.951 15.738 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -1.410 -2.575 15.935 1.00 0.00 H new ATOM 1261 N THR B 55 -8.974 -1.559 10.255 1.00 0.00 N ATOM 1262 CA THR B 55 -10.143 -1.414 9.392 1.00 0.00 C ATOM 1263 C THR B 55 -9.969 -0.270 8.396 1.00 0.00 C ATOM 1264 O THR B 55 -9.424 0.782 8.731 1.00 0.00 O ATOM 1265 CB THR B 55 -11.421 -1.168 10.215 1.00 0.00 C ATOM 1266 OG1 THR B 55 -11.284 0.031 10.986 1.00 0.00 O ATOM 1267 CG2 THR B 55 -11.702 -2.342 11.141 1.00 0.00 C ATOM 0 H THR B 55 -9.105 -1.197 11.200 1.00 0.00 H new ATOM 0 HA THR B 55 -10.241 -2.351 8.844 1.00 0.00 H new ATOM 0 HB THR B 55 -12.257 -1.062 9.524 1.00 0.00 H new ATOM 0 HG1 THR B 55 -12.101 0.181 11.505 1.00 0.00 H new ATOM 0 HG21 THR B 55 -12.609 -2.146 11.712 1.00 0.00 H new ATOM 0 HG22 THR B 55 -11.834 -3.248 10.550 1.00 0.00 H new ATOM 0 HG23 THR B 55 -10.864 -2.474 11.825 1.00 0.00 H new ATOM 1275 N LEU B 56 -10.443 -0.485 7.173 1.00 0.00 N ATOM 1276 CA LEU B 56 -10.351 0.524 6.121 1.00 0.00 C ATOM 1277 C LEU B 56 -11.193 1.752 6.454 1.00 0.00 C ATOM 1278 O LEU B 56 -10.802 2.881 6.158 1.00 0.00 O ATOM 1279 CB LEU B 56 -10.808 -0.061 4.783 1.00 0.00 C ATOM 1280 CG LEU B 56 -9.946 -1.200 4.238 1.00 0.00 C ATOM 1281 CD1 LEU B 56 -10.550 -1.755 2.960 1.00 0.00 C ATOM 1282 CD2 LEU B 56 -8.527 -0.719 3.987 1.00 0.00 C ATOM 0 H LEU B 56 -10.896 -1.352 6.884 1.00 0.00 H new ATOM 0 HA LEU B 56 -9.308 0.830 6.048 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -11.830 -0.422 4.894 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -10.831 0.740 4.044 1.00 0.00 H new ATOM 0 HG LEU B 56 -9.915 -1.996 4.982 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -9.925 -2.565 2.584 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -11.551 -2.134 3.165 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -10.608 -0.964 2.212 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -7.927 -1.542 3.599 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -8.541 0.093 3.260 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -8.093 -0.362 4.921 1.00 0.00 H new ATOM 1294 N SER B 57 -12.355 1.520 7.057 1.00 0.00 N ATOM 1295 CA SER B 57 -13.266 2.602 7.418 1.00 0.00 C ATOM 1296 C SER B 57 -12.553 3.691 8.214 1.00 0.00 C ATOM 1297 O SER B 57 -12.761 4.880 7.972 1.00 0.00 O ATOM 1298 CB SER B 57 -14.443 2.053 8.226 1.00 0.00 C ATOM 1299 OG SER B 57 -15.338 3.088 8.594 1.00 0.00 O ATOM 0 H SER B 57 -12.689 0.589 7.307 1.00 0.00 H new ATOM 0 HA SER B 57 -13.636 3.047 6.494 1.00 0.00 H new ATOM 0 HB2 SER B 57 -14.972 1.302 7.639 1.00 0.00 H new ATOM 0 HB3 SER B 57 -14.072 1.554 9.121 1.00 0.00 H new ATOM 0 HG SER B 57 -16.082 2.710 9.108 1.00 0.00 H new ATOM 1305 N ASP B 58 -11.714 3.282 9.160 1.00 0.00 N ATOM 1306 CA ASP B 58 -10.973 4.232 9.985 1.00 0.00 C ATOM 1307 C ASP B 58 -10.113 5.145 9.116 1.00 0.00 C ATOM 1308 O ASP B 58 -10.008 6.345 9.371 1.00 0.00 O ATOM 1309 CB ASP B 58 -10.097 3.486 10.996 1.00 0.00 C ATOM 1310 CG ASP B 58 -9.350 4.424 11.927 1.00 0.00 C ATOM 1311 OD1 ASP B 58 -8.531 5.228 11.434 1.00 0.00 O ATOM 1312 OD2 ASP B 58 -9.586 4.354 13.152 1.00 0.00 O ATOM 0 H ASP B 58 -11.530 2.302 9.375 1.00 0.00 H new ATOM 0 HA ASP B 58 -11.690 4.848 10.527 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -10.721 2.815 11.586 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -9.379 2.865 10.460 1.00 0.00 H new ATOM 1317 N TYR B 59 -9.499 4.565 8.090 1.00 0.00 N ATOM 1318 CA TYR B 59 -8.645 5.317 7.177 1.00 0.00 C ATOM 1319 C TYR B 59 -9.472 6.225 6.270 1.00 0.00 C ATOM 1320 O TYR B 59 -9.006 7.284 5.849 1.00 0.00 O ATOM 1321 CB TYR B 59 -7.799 4.362 6.327 1.00 0.00 C ATOM 1322 CG TYR B 59 -6.777 3.566 7.117 1.00 0.00 C ATOM 1323 CD1 TYR B 59 -7.134 2.873 8.268 1.00 0.00 C ATOM 1324 CD2 TYR B 59 -5.450 3.509 6.706 1.00 0.00 C ATOM 1325 CE1 TYR B 59 -6.202 2.149 8.986 1.00 0.00 C ATOM 1326 CE2 TYR B 59 -4.512 2.787 7.419 1.00 0.00 C ATOM 1327 CZ TYR B 59 -4.892 2.109 8.558 1.00 0.00 C ATOM 1328 OH TYR B 59 -3.961 1.388 9.269 1.00 0.00 O ATOM 0 H TYR B 59 -9.577 3.572 7.869 1.00 0.00 H new ATOM 0 HA TYR B 59 -7.984 5.942 7.778 1.00 0.00 H new ATOM 0 HB2 TYR B 59 -8.463 3.669 5.810 1.00 0.00 H new ATOM 0 HB3 TYR B 59 -7.281 4.938 5.560 1.00 0.00 H new ATOM 0 HD1 TYR B 59 -8.159 2.901 8.607 1.00 0.00 H new ATOM 0 HD2 TYR B 59 -5.147 4.038 5.814 1.00 0.00 H new ATOM 0 HE1 TYR B 59 -6.498 1.617 9.878 1.00 0.00 H new ATOM 0 HE2 TYR B 59 -3.485 2.754 7.085 1.00 0.00 H new ATOM 0 HH TYR B 59 -3.132 1.906 9.342 1.00 0.00 H new ATOM 1338 N ASN B 60 -10.696 5.795 5.963 1.00 0.00 N ATOM 1339 CA ASN B 60 -11.587 6.559 5.092 1.00 0.00 C ATOM 1340 C ASN B 60 -10.989 6.688 3.696 1.00 0.00 C ATOM 1341 O ASN B 60 -10.976 7.770 3.108 1.00 0.00 O ATOM 1342 CB ASN B 60 -11.859 7.950 5.675 1.00 0.00 C ATOM 1343 CG ASN B 60 -12.539 7.892 7.028 1.00 0.00 C ATOM 1344 OD1 ASN B 60 -11.984 7.368 7.992 1.00 0.00 O ATOM 1345 ND2 ASN B 60 -13.749 8.433 7.105 1.00 0.00 N ATOM 0 H ASN B 60 -11.093 4.920 6.306 1.00 0.00 H new ATOM 0 HA ASN B 60 -12.532 6.021 5.023 1.00 0.00 H new ATOM 0 HB2 ASN B 60 -10.917 8.491 5.769 1.00 0.00 H new ATOM 0 HB3 ASN B 60 -12.484 8.514 4.983 1.00 0.00 H new ATOM 0 HD21 ASN B 60 -14.256 8.424 7.990 1.00 0.00 H new ATOM 0 HD22 ASN B 60 -14.171 8.857 6.279 1.00 0.00 H new ATOM 1352 N ILE B 61 -10.487 5.574 3.176 1.00 0.00 N ATOM 1353 CA ILE B 61 -9.876 5.552 1.853 1.00 0.00 C ATOM 1354 C ILE B 61 -10.882 5.927 0.769 1.00 0.00 C ATOM 1355 O ILE B 61 -11.993 5.398 0.728 1.00 0.00 O ATOM 1356 CB ILE B 61 -9.286 4.165 1.538 1.00 0.00 C ATOM 1357 CG1 ILE B 61 -8.300 3.751 2.633 1.00 0.00 C ATOM 1358 CG2 ILE B 61 -8.603 4.177 0.177 1.00 0.00 C ATOM 1359 CD1 ILE B 61 -7.766 2.343 2.472 1.00 0.00 C ATOM 0 H ILE B 61 -10.491 4.672 3.652 1.00 0.00 H new ATOM 0 HA ILE B 61 -9.074 6.290 1.861 1.00 0.00 H new ATOM 0 HB ILE B 61 -10.096 3.436 1.508 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -7.463 4.449 2.638 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -8.791 3.835 3.602 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -8.191 3.190 -0.032 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -9.330 4.437 -0.593 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -7.799 4.913 0.180 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -7.074 2.121 3.284 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -8.594 1.635 2.497 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -7.245 2.258 1.518 1.00 0.00 H new ATOM 1371 N GLN B 62 -10.479 6.840 -0.110 1.00 0.00 N ATOM 1372 CA GLN B 62 -11.336 7.288 -1.202 1.00 0.00 C ATOM 1373 C GLN B 62 -11.560 6.167 -2.211 1.00 0.00 C ATOM 1374 O GLN B 62 -10.671 5.351 -2.452 1.00 0.00 O ATOM 1375 CB GLN B 62 -10.721 8.505 -1.896 1.00 0.00 C ATOM 1376 CG GLN B 62 -10.528 9.701 -0.976 1.00 0.00 C ATOM 1377 CD GLN B 62 -11.837 10.233 -0.422 1.00 0.00 C ATOM 1378 OE1 GLN B 62 -12.562 9.528 0.281 1.00 0.00 O ATOM 1379 NE2 GLN B 62 -12.147 11.485 -0.737 1.00 0.00 N ATOM 0 H GLN B 62 -9.561 7.285 -0.087 1.00 0.00 H new ATOM 0 HA GLN B 62 -12.301 7.571 -0.782 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -9.756 8.223 -2.318 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -11.360 8.798 -2.729 1.00 0.00 H new ATOM 0 HG2 GLN B 62 -9.877 9.416 -0.149 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -10.020 10.496 -1.522 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -11.518 12.034 -1.322 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -13.014 11.897 -0.394 1.00 0.00 H new ATOM 1388 N LYS B 63 -12.753 6.129 -2.794 1.00 0.00 N ATOM 1389 CA LYS B 63 -13.097 5.109 -3.771 1.00 0.00 C ATOM 1390 C LYS B 63 -12.096 5.099 -4.926 1.00 0.00 C ATOM 1391 O LYS B 63 -11.759 6.148 -5.476 1.00 0.00 O ATOM 1392 CB LYS B 63 -14.509 5.360 -4.296 1.00 0.00 C ATOM 1393 CG LYS B 63 -15.050 4.226 -5.141 1.00 0.00 C ATOM 1394 CD LYS B 63 -16.465 4.514 -5.616 1.00 0.00 C ATOM 1395 CE LYS B 63 -17.045 3.342 -6.390 1.00 0.00 C ATOM 1396 NZ LYS B 63 -17.127 2.111 -5.555 1.00 0.00 N ATOM 0 H LYS B 63 -13.500 6.797 -2.604 1.00 0.00 H new ATOM 0 HA LYS B 63 -13.060 4.134 -3.286 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -15.178 5.524 -3.451 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -14.511 6.276 -4.887 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -14.400 4.070 -6.002 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -15.040 3.302 -4.562 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -17.100 4.734 -4.758 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -16.464 5.403 -6.247 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -18.040 3.602 -6.752 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -16.428 3.145 -7.267 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -17.431 1.311 -6.145 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -16.193 1.905 -5.147 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -17.814 2.257 -4.788 1.00 0.00 H new ATOM 1410 N GLU B 64 -11.623 3.905 -5.283 1.00 0.00 N ATOM 1411 CA GLU B 64 -10.656 3.747 -6.368 1.00 0.00 C ATOM 1412 C GLU B 64 -9.380 4.540 -6.090 1.00 0.00 C ATOM 1413 O GLU B 64 -8.808 5.151 -6.993 1.00 0.00 O ATOM 1414 CB GLU B 64 -11.267 4.189 -7.701 1.00 0.00 C ATOM 1415 CG GLU B 64 -12.493 3.385 -8.108 1.00 0.00 C ATOM 1416 CD GLU B 64 -13.079 3.838 -9.432 1.00 0.00 C ATOM 1417 OE1 GLU B 64 -12.528 4.784 -10.035 1.00 0.00 O ATOM 1418 OE2 GLU B 64 -14.089 3.247 -9.867 1.00 0.00 O ATOM 0 H GLU B 64 -11.895 3.030 -4.834 1.00 0.00 H new ATOM 0 HA GLU B 64 -10.396 2.690 -6.430 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -11.540 5.242 -7.634 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -10.512 4.104 -8.483 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -12.224 2.331 -8.176 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -13.253 3.471 -7.331 1.00 0.00 H new ATOM 1425 N SER B 65 -8.941 4.524 -4.835 1.00 0.00 N ATOM 1426 CA SER B 65 -7.732 5.239 -4.436 1.00 0.00 C ATOM 1427 C SER B 65 -6.480 4.435 -4.768 1.00 0.00 C ATOM 1428 O SER B 65 -6.470 3.208 -4.655 1.00 0.00 O ATOM 1429 CB SER B 65 -7.766 5.548 -2.938 1.00 0.00 C ATOM 1430 OG SER B 65 -6.606 6.254 -2.537 1.00 0.00 O ATOM 0 H SER B 65 -9.404 4.024 -4.076 1.00 0.00 H new ATOM 0 HA SER B 65 -7.699 6.174 -4.996 1.00 0.00 H new ATOM 0 HB2 SER B 65 -8.653 6.137 -2.705 1.00 0.00 H new ATOM 0 HB3 SER B 65 -7.843 4.619 -2.373 1.00 0.00 H new ATOM 0 HG SER B 65 -6.733 6.605 -1.631 1.00 0.00 H new ATOM 1436 N THR B 66 -5.425 5.135 -5.176 1.00 0.00 N ATOM 1437 CA THR B 66 -4.163 4.499 -5.519 1.00 0.00 C ATOM 1438 C THR B 66 -3.264 4.358 -4.293 1.00 0.00 C ATOM 1439 O THR B 66 -3.099 5.305 -3.523 1.00 0.00 O ATOM 1440 CB THR B 66 -3.419 5.303 -6.595 1.00 0.00 C ATOM 1441 OG1 THR B 66 -3.240 6.657 -6.161 1.00 0.00 O ATOM 1442 CG2 THR B 66 -4.180 5.282 -7.912 1.00 0.00 C ATOM 0 H THR B 66 -5.423 6.150 -5.277 1.00 0.00 H new ATOM 0 HA THR B 66 -4.398 3.507 -5.905 1.00 0.00 H new ATOM 0 HB THR B 66 -2.444 4.841 -6.751 1.00 0.00 H new ATOM 0 HG1 THR B 66 -2.763 7.162 -6.853 1.00 0.00 H new ATOM 0 HG21 THR B 66 -3.633 5.858 -8.658 1.00 0.00 H new ATOM 0 HG22 THR B 66 -4.286 4.253 -8.255 1.00 0.00 H new ATOM 0 HG23 THR B 66 -5.168 5.720 -7.768 1.00 0.00 H new ATOM 1450 N LEU B 67 -2.684 3.173 -4.117 1.00 0.00 N ATOM 1451 CA LEU B 67 -1.799 2.912 -2.983 1.00 0.00 C ATOM 1452 C LEU B 67 -0.421 2.459 -3.461 1.00 0.00 C ATOM 1453 O LEU B 67 -0.311 1.602 -4.337 1.00 0.00 O ATOM 1454 CB LEU B 67 -2.403 1.850 -2.058 1.00 0.00 C ATOM 1455 CG LEU B 67 -3.642 2.285 -1.266 1.00 0.00 C ATOM 1456 CD1 LEU B 67 -4.820 2.547 -2.189 1.00 0.00 C ATOM 1457 CD2 LEU B 67 -4.006 1.230 -0.237 1.00 0.00 C ATOM 0 H LEU B 67 -2.810 2.379 -4.744 1.00 0.00 H new ATOM 0 HA LEU B 67 -1.687 3.843 -2.427 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -2.665 0.979 -2.658 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -1.636 1.531 -1.352 1.00 0.00 H new ATOM 0 HG LEU B 67 -3.403 3.215 -0.751 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -5.684 2.854 -1.599 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -4.562 3.338 -2.893 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -5.061 1.637 -2.739 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -4.887 1.552 0.318 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -4.219 0.288 -0.742 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -3.173 1.092 0.453 1.00 0.00 H new ATOM 1469 N HIS B 68 0.627 3.046 -2.886 1.00 0.00 N ATOM 1470 CA HIS B 68 1.997 2.705 -3.263 1.00 0.00 C ATOM 1471 C HIS B 68 2.408 1.338 -2.717 1.00 0.00 C ATOM 1472 O HIS B 68 2.213 1.042 -1.537 1.00 0.00 O ATOM 1473 CB HIS B 68 2.973 3.778 -2.769 1.00 0.00 C ATOM 1474 CG HIS B 68 2.708 5.149 -3.322 1.00 0.00 C ATOM 1475 ND1 HIS B 68 3.586 6.202 -3.171 1.00 0.00 N ATOM 1476 CD2 HIS B 68 1.656 5.641 -4.023 1.00 0.00 C ATOM 1477 CE1 HIS B 68 3.087 7.278 -3.754 1.00 0.00 C ATOM 1478 NE2 HIS B 68 1.917 6.964 -4.278 1.00 0.00 N ATOM 0 H HIS B 68 0.554 3.758 -2.159 1.00 0.00 H new ATOM 0 HA HIS B 68 2.034 2.660 -4.351 1.00 0.00 H new ATOM 0 HB2 HIS B 68 2.928 3.822 -1.681 1.00 0.00 H new ATOM 0 HB3 HIS B 68 3.988 3.481 -3.034 1.00 0.00 H new ATOM 0 HD2 HIS B 68 0.776 5.093 -4.325 1.00 0.00 H new ATOM 0 HE1 HIS B 68 3.557 8.250 -3.795 1.00 0.00 H new ATOM 0 HE2 HIS B 68 1.306 7.601 -4.789 1.00 0.00 H new ATOM 1487 N LEU B 69 2.982 0.512 -3.589 1.00 0.00 N ATOM 1488 CA LEU B 69 3.433 -0.827 -3.215 1.00 0.00 C ATOM 1489 C LEU B 69 4.910 -0.815 -2.821 1.00 0.00 C ATOM 1490 O LEU B 69 5.703 -0.060 -3.383 1.00 0.00 O ATOM 1491 CB LEU B 69 3.230 -1.797 -4.383 1.00 0.00 C ATOM 1492 CG LEU B 69 3.558 -3.263 -4.086 1.00 0.00 C ATOM 1493 CD1 LEU B 69 2.470 -3.897 -3.235 1.00 0.00 C ATOM 1494 CD2 LEU B 69 3.744 -4.041 -5.380 1.00 0.00 C ATOM 0 H LEU B 69 3.147 0.749 -4.567 1.00 0.00 H new ATOM 0 HA LEU B 69 2.842 -1.154 -2.359 1.00 0.00 H new ATOM 0 HB2 LEU B 69 2.192 -1.734 -4.709 1.00 0.00 H new ATOM 0 HB3 LEU B 69 3.847 -1.467 -5.219 1.00 0.00 H new ATOM 0 HG LEU B 69 4.492 -3.296 -3.526 1.00 0.00 H new ATOM 0 HD11 LEU B 69 2.724 -4.938 -3.036 1.00 0.00 H new ATOM 0 HD12 LEU B 69 2.385 -3.358 -2.292 1.00 0.00 H new ATOM 0 HD13 LEU B 69 1.519 -3.850 -3.766 1.00 0.00 H new ATOM 0 HD21 LEU B 69 3.976 -5.081 -5.149 1.00 0.00 H new ATOM 0 HD22 LEU B 69 2.827 -3.996 -5.967 1.00 0.00 H new ATOM 0 HD23 LEU B 69 4.563 -3.605 -5.952 1.00 0.00 H new ATOM 1506 N VAL B 70 5.278 -1.670 -1.869 1.00 0.00 N ATOM 1507 CA VAL B 70 6.662 -1.772 -1.422 1.00 0.00 C ATOM 1508 C VAL B 70 6.997 -3.224 -1.105 1.00 0.00 C ATOM 1509 O VAL B 70 6.391 -3.830 -0.220 1.00 0.00 O ATOM 1510 CB VAL B 70 6.936 -0.908 -0.172 1.00 0.00 C ATOM 1511 CG1 VAL B 70 8.405 -0.985 0.219 1.00 0.00 C ATOM 1512 CG2 VAL B 70 6.519 0.536 -0.405 1.00 0.00 C ATOM 0 H VAL B 70 4.635 -2.302 -1.393 1.00 0.00 H new ATOM 0 HA VAL B 70 7.291 -1.403 -2.232 1.00 0.00 H new ATOM 0 HB VAL B 70 6.338 -1.303 0.650 1.00 0.00 H new ATOM 0 HG11 VAL B 70 8.579 -0.370 1.102 1.00 0.00 H new ATOM 0 HG12 VAL B 70 8.669 -2.019 0.439 1.00 0.00 H new ATOM 0 HG13 VAL B 70 9.020 -0.621 -0.604 1.00 0.00 H new ATOM 0 HG21 VAL B 70 6.723 1.123 0.491 1.00 0.00 H new ATOM 0 HG22 VAL B 70 7.082 0.946 -1.243 1.00 0.00 H new ATOM 0 HG23 VAL B 70 5.453 0.575 -0.630 1.00 0.00 H new ATOM 1522 N LEU B 71 7.952 -3.781 -1.841 1.00 0.00 N ATOM 1523 CA LEU B 71 8.352 -5.169 -1.643 1.00 0.00 C ATOM 1524 C LEU B 71 9.606 -5.273 -0.783 1.00 0.00 C ATOM 1525 O LEU B 71 10.663 -4.753 -1.141 1.00 0.00 O ATOM 1526 CB LEU B 71 8.593 -5.845 -2.994 1.00 0.00 C ATOM 1527 CG LEU B 71 7.386 -5.865 -3.937 1.00 0.00 C ATOM 1528 CD1 LEU B 71 7.758 -6.510 -5.263 1.00 0.00 C ATOM 1529 CD2 LEU B 71 6.218 -6.602 -3.296 1.00 0.00 C ATOM 0 H LEU B 71 8.462 -3.294 -2.578 1.00 0.00 H new ATOM 0 HA LEU B 71 7.541 -5.677 -1.121 1.00 0.00 H new ATOM 0 HB2 LEU B 71 9.417 -5.337 -3.495 1.00 0.00 H new ATOM 0 HB3 LEU B 71 8.913 -6.872 -2.817 1.00 0.00 H new ATOM 0 HG LEU B 71 7.081 -4.836 -4.126 1.00 0.00 H new ATOM 0 HD11 LEU B 71 6.889 -6.516 -5.921 1.00 0.00 H new ATOM 0 HD12 LEU B 71 8.563 -5.943 -5.730 1.00 0.00 H new ATOM 0 HD13 LEU B 71 8.089 -7.534 -5.089 1.00 0.00 H new ATOM 0 HD21 LEU B 71 5.370 -6.606 -3.981 1.00 0.00 H new ATOM 0 HD22 LEU B 71 6.512 -7.629 -3.077 1.00 0.00 H new ATOM 0 HD23 LEU B 71 5.935 -6.100 -2.371 1.00 0.00 H new ATOM 1541 N ARG B 72 9.480 -5.960 0.346 1.00 0.00 N ATOM 1542 CA ARG B 72 10.606 -6.150 1.256 1.00 0.00 C ATOM 1543 C ARG B 72 11.599 -7.151 0.674 1.00 0.00 C ATOM 1544 O ARG B 72 11.205 -8.187 0.138 1.00 0.00 O ATOM 1545 CB ARG B 72 10.112 -6.631 2.623 1.00 0.00 C ATOM 1546 CG ARG B 72 11.220 -6.772 3.656 1.00 0.00 C ATOM 1547 CD ARG B 72 10.675 -7.244 4.995 1.00 0.00 C ATOM 1548 NE ARG B 72 11.725 -7.367 6.005 1.00 0.00 N ATOM 1549 CZ ARG B 72 12.743 -8.220 5.918 1.00 0.00 C ATOM 1550 NH1 ARG B 72 12.839 -9.045 4.883 1.00 0.00 N ATOM 1551 NH2 ARG B 72 13.663 -8.253 6.872 1.00 0.00 N ATOM 0 H ARG B 72 8.610 -6.395 0.654 1.00 0.00 H new ATOM 0 HA ARG B 72 11.111 -5.192 1.384 1.00 0.00 H new ATOM 0 HB2 ARG B 72 9.365 -5.931 2.997 1.00 0.00 H new ATOM 0 HB3 ARG B 72 9.615 -7.593 2.502 1.00 0.00 H new ATOM 0 HG2 ARG B 72 11.967 -7.479 3.296 1.00 0.00 H new ATOM 0 HG3 ARG B 72 11.724 -5.814 3.784 1.00 0.00 H new ATOM 0 HD2 ARG B 72 9.917 -6.543 5.345 1.00 0.00 H new ATOM 0 HD3 ARG B 72 10.182 -8.208 4.866 1.00 0.00 H new ATOM 0 HE ARG B 72 11.674 -6.763 6.825 1.00 0.00 H new ATOM 0 HH11 ARG B 72 12.131 -9.027 4.149 1.00 0.00 H new ATOM 0 HH12 ARG B 72 13.621 -9.697 4.821 1.00 0.00 H new ATOM 0 HH21 ARG B 72 13.591 -7.625 7.672 1.00 0.00 H new ATOM 0 HH22 ARG B 72 14.443 -8.907 6.806 1.00 0.00 H new ATOM 1565 N LEU B 73 12.887 -6.837 0.778 1.00 0.00 N ATOM 1566 CA LEU B 73 13.930 -7.715 0.255 1.00 0.00 C ATOM 1567 C LEU B 73 13.936 -9.053 0.985 1.00 0.00 C ATOM 1568 O LEU B 73 14.001 -9.102 2.213 1.00 0.00 O ATOM 1569 CB LEU B 73 15.308 -7.053 0.372 1.00 0.00 C ATOM 1570 CG LEU B 73 15.552 -5.861 -0.561 1.00 0.00 C ATOM 1571 CD1 LEU B 73 14.655 -4.687 -0.196 1.00 0.00 C ATOM 1572 CD2 LEU B 73 17.016 -5.449 -0.519 1.00 0.00 C ATOM 0 H LEU B 73 13.233 -5.984 1.218 1.00 0.00 H new ATOM 0 HA LEU B 73 13.713 -7.894 -0.798 1.00 0.00 H new ATOM 0 HB2 LEU B 73 15.445 -6.720 1.401 1.00 0.00 H new ATOM 0 HB3 LEU B 73 16.071 -7.807 0.177 1.00 0.00 H new ATOM 0 HG LEU B 73 15.304 -6.168 -1.577 1.00 0.00 H new ATOM 0 HD11 LEU B 73 14.850 -3.856 -0.874 1.00 0.00 H new ATOM 0 HD12 LEU B 73 13.611 -4.987 -0.280 1.00 0.00 H new ATOM 0 HD13 LEU B 73 14.862 -4.376 0.828 1.00 0.00 H new ATOM 0 HD21 LEU B 73 17.175 -4.602 -1.186 1.00 0.00 H new ATOM 0 HD22 LEU B 73 17.285 -5.165 0.498 1.00 0.00 H new ATOM 0 HD23 LEU B 73 17.638 -6.285 -0.839 1.00 0.00 H new ATOM 1584 N ARG B 74 13.873 -10.137 0.218 1.00 0.00 N ATOM 1585 CA ARG B 74 13.875 -11.480 0.786 1.00 0.00 C ATOM 1586 C ARG B 74 15.279 -11.885 1.222 1.00 0.00 C ATOM 1587 O ARG B 74 15.465 -12.463 2.293 1.00 0.00 O ATOM 1588 CB ARG B 74 13.328 -12.486 -0.228 1.00 0.00 C ATOM 1589 CG ARG B 74 11.899 -12.197 -0.656 1.00 0.00 C ATOM 1590 CD ARG B 74 11.378 -13.256 -1.614 1.00 0.00 C ATOM 1591 NE ARG B 74 12.190 -13.350 -2.824 1.00 0.00 N ATOM 1592 CZ ARG B 74 11.946 -14.209 -3.809 1.00 0.00 C ATOM 1593 NH1 ARG B 74 10.916 -15.041 -3.726 1.00 0.00 N ATOM 1594 NH2 ARG B 74 12.731 -14.236 -4.878 1.00 0.00 N ATOM 0 H ARG B 74 13.820 -10.111 -0.800 1.00 0.00 H new ATOM 0 HA ARG B 74 13.231 -11.477 1.665 1.00 0.00 H new ATOM 0 HB2 ARG B 74 13.970 -12.488 -1.109 1.00 0.00 H new ATOM 0 HB3 ARG B 74 13.375 -13.486 0.202 1.00 0.00 H new ATOM 0 HG2 ARG B 74 11.257 -12.153 0.224 1.00 0.00 H new ATOM 0 HG3 ARG B 74 11.852 -11.218 -1.134 1.00 0.00 H new ATOM 0 HD2 ARG B 74 11.364 -14.223 -1.112 1.00 0.00 H new ATOM 0 HD3 ARG B 74 10.349 -13.023 -1.886 1.00 0.00 H new ATOM 0 HE ARG B 74 12.988 -12.722 -2.919 1.00 0.00 H new ATOM 0 HH11 ARG B 74 10.310 -15.022 -2.906 1.00 0.00 H new ATOM 0 HH12 ARG B 74 10.730 -15.699 -4.482 1.00 0.00 H new ATOM 0 HH21 ARG B 74 13.523 -13.597 -4.945 1.00 0.00 H new ATOM 0 HH22 ARG B 74 12.542 -14.896 -5.633 1.00 0.00 H new ATOM 1608 N GLY B 75 16.265 -11.579 0.383 1.00 0.00 N ATOM 1609 CA GLY B 75 17.640 -11.919 0.698 1.00 0.00 C ATOM 1610 C GLY B 75 18.615 -11.422 -0.351 1.00 0.00 C ATOM 1611 O GLY B 75 19.683 -10.905 -0.020 1.00 0.00 O ATOM 0 H GLY B 75 16.135 -11.102 -0.509 1.00 0.00 H new ATOM 0 HA2 GLY B 75 17.904 -11.493 1.666 1.00 0.00 H new ATOM 0 HA3 GLY B 75 17.731 -13.001 0.791 1.00 0.00 H new ATOM 1615 N GLY B 76 18.249 -11.581 -1.619 1.00 0.00 N ATOM 1616 CA GLY B 76 19.111 -11.141 -2.701 1.00 0.00 C ATOM 1617 C GLY B 76 18.495 -11.375 -4.066 1.00 0.00 C ATOM 1618 O GLY B 76 19.247 -11.378 -5.064 1.00 0.00 O ATOM 1619 OXT GLY B 76 17.261 -11.554 -4.138 1.00 0.00 O ATOM 0 H GLY B 76 17.371 -12.007 -1.917 1.00 0.00 H new ATOM 0 HA2 GLY B 76 19.327 -10.079 -2.581 1.00 0.00 H new ATOM 0 HA3 GLY B 76 20.063 -11.669 -2.640 1.00 0.00 H new TER 1623 GLY B 76