USER MOD reduce.3.24.130724 H: found=0, std=0, add=595, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 164 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 Single : A 10 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00182) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= -0.0414 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= 0.101 K(o=0.1,f=-1.1) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 TYR OH : rot -86:sc= 1.2 USER MOD Single : A 28 THR OG1 : rot 56:sc= 0.258 USER MOD Single : A 29 ASN : amide:sc= 0.0296 K(o=0.03,f=-2.5!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 120:sc= 1.3 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 154:sc= 1 (180deg=-0.743!) USER MOD Single : A 41 SER OG : rot -150:sc= 0.254 USER MOD Single : A 43 THR OG1 : rot 80:sc= 1.26 USER MOD Single : A 44 THR OG1 : rot -84:sc= 1.27 USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 SER OG : rot 180:sc= 0.0325 USER MOD Single : A 50 GLN : amide:sc= -0.0913 K(o=-0.091,f=-3.3!) USER MOD Single : A 52 THR OG1 : rot -100:sc= 0.289 USER MOD Single : A 56 GLN : amide:sc= -2.24! C(o=-2.2!,f=-6!) USER MOD Single : A 57 ASN : amide:sc= -0.206 K(o=-0.21,f=-1) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ -142:sc= 1.22 (180deg=0.484) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot -26:sc= 0.481 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 36 N LYS A 10 -9.287 -7.891 8.503 1.00 10.00 N ATOM 37 CA LYS A 10 -10.474 -7.740 7.677 1.00 10.00 C ATOM 38 C LYS A 10 -10.207 -8.237 6.264 1.00 10.00 C ATOM 39 O LYS A 10 -10.219 -9.445 6.024 1.00 10.00 O ATOM 40 CB LYS A 10 -10.965 -6.292 7.666 1.00 10.00 C ATOM 41 CG LYS A 10 -11.498 -5.800 9.004 1.00 10.00 C ATOM 42 CD LYS A 10 -12.699 -6.616 9.455 1.00 10.00 C ATOM 43 CE LYS A 10 -13.367 -6.000 10.676 1.00 10.00 C ATOM 44 NZ LYS A 10 -14.194 -4.814 10.321 1.00 10.00 N ATOM 0 HA LYS A 10 -11.266 -8.350 8.111 1.00 10.00 H new ATOM 0 HB2 LYS A 10 -10.145 -5.645 7.355 1.00 10.00 H new ATOM 0 HB3 LYS A 10 -11.751 -6.193 6.917 1.00 10.00 H new ATOM 0 HG2 LYS A 10 -10.711 -5.861 9.756 1.00 10.00 H new ATOM 0 HG3 LYS A 10 -11.779 -4.750 8.922 1.00 10.00 H new ATOM 0 HD2 LYS A 10 -13.420 -6.684 8.640 1.00 10.00 H new ATOM 0 HD3 LYS A 10 -12.383 -7.633 9.687 1.00 10.00 H new ATOM 0 HE2 LYS A 10 -13.995 -6.747 11.161 1.00 10.00 H new ATOM 0 HE3 LYS A 10 -12.604 -5.707 11.397 1.00 10.00 H new ATOM 0 HZ1 LYS A 10 -14.644 -4.435 11.179 1.00 10.00 H new ATOM 0 HZ2 LYS A 10 -13.588 -4.083 9.896 1.00 10.00 H new ATOM 0 HZ3 LYS A 10 -14.928 -5.094 9.639 1.00 10.00 H new ATOM 49 N ARG A 11 -9.930 -7.312 5.345 1.00 10.00 N ATOM 50 CA ARG A 11 -9.663 -7.661 3.953 1.00 10.00 C ATOM 51 C ARG A 11 -8.383 -8.490 3.838 1.00 10.00 C ATOM 52 O ARG A 11 -7.459 -8.338 4.635 1.00 10.00 O ATOM 53 CB ARG A 11 -9.549 -6.393 3.097 1.00 10.00 C ATOM 54 CG ARG A 11 -9.626 -6.641 1.597 1.00 10.00 C ATOM 55 CD ARG A 11 -8.548 -5.873 0.849 1.00 10.00 C ATOM 56 NE ARG A 11 -9.086 -4.734 0.101 1.00 10.00 N ATOM 57 CZ ARG A 11 -8.333 -3.883 -0.605 1.00 10.00 C ATOM 58 NH1 ARG A 11 -7.015 -4.057 -0.668 1.00 10.00 N ATOM 59 NH2 ARG A 11 -8.900 -2.864 -1.245 1.00 10.00 N ATOM 0 H ARG A 11 -9.885 -6.312 5.542 1.00 10.00 H new ATOM 0 HA ARG A 11 -10.496 -8.260 3.586 1.00 10.00 H new ATOM 0 HB2 ARG A 11 -10.345 -5.704 3.381 1.00 10.00 H new ATOM 0 HB3 ARG A 11 -8.604 -5.899 3.324 1.00 10.00 H new ATOM 0 HG2 ARG A 11 -9.519 -7.707 1.398 1.00 10.00 H new ATOM 0 HG3 ARG A 11 -10.608 -6.344 1.228 1.00 10.00 H new ATOM 0 HD2 ARG A 11 -7.801 -5.517 1.559 1.00 10.00 H new ATOM 0 HD3 ARG A 11 -8.038 -6.547 0.161 1.00 10.00 H new ATOM 0 HE ARG A 11 -10.094 -4.581 0.120 1.00 10.00 H new ATOM 0 HH11 ARG A 11 -6.580 -4.839 -0.178 1.00 10.00 H new ATOM 0 HH12 ARG A 11 -6.440 -3.409 -1.206 1.00 10.00 H new ATOM 0 HH21 ARG A 11 -9.910 -2.731 -1.198 1.00 10.00 H new ATOM 0 HH22 ARG A 11 -8.325 -2.216 -1.783 1.00 10.00 H new ATOM 66 N VAL A 12 -8.343 -9.376 2.855 1.00 10.00 N ATOM 67 CA VAL A 12 -7.178 -10.221 2.642 1.00 10.00 C ATOM 68 C VAL A 12 -6.231 -9.587 1.628 1.00 10.00 C ATOM 69 O VAL A 12 -6.670 -8.930 0.685 1.00 10.00 O ATOM 70 CB VAL A 12 -7.569 -11.643 2.175 1.00 10.00 C ATOM 71 CG1 VAL A 12 -8.240 -12.409 3.306 1.00 10.00 C ATOM 72 CG2 VAL A 12 -8.473 -11.587 0.952 1.00 10.00 C ATOM 0 H VAL A 12 -9.103 -9.529 2.192 1.00 10.00 H new ATOM 0 HA VAL A 12 -6.671 -10.311 3.603 1.00 10.00 H new ATOM 0 HB VAL A 12 -6.658 -12.171 1.894 1.00 10.00 H new ATOM 0 HG11 VAL A 12 -8.509 -13.407 2.960 1.00 10.00 H new ATOM 0 HG12 VAL A 12 -7.553 -12.489 4.149 1.00 10.00 H new ATOM 0 HG13 VAL A 12 -9.140 -11.880 3.620 1.00 10.00 H new ATOM 0 HG21 VAL A 12 -8.733 -12.600 0.645 1.00 10.00 H new ATOM 0 HG22 VAL A 12 -9.382 -11.038 1.196 1.00 10.00 H new ATOM 0 HG23 VAL A 12 -7.953 -11.083 0.138 1.00 10.00 H new ATOM 74 N PRO A 13 -4.919 -9.755 1.833 1.00 10.00 N ATOM 75 CA PRO A 13 -3.900 -9.211 0.942 1.00 10.00 C ATOM 76 C PRO A 13 -3.541 -10.196 -0.167 1.00 10.00 C ATOM 77 O PRO A 13 -4.181 -11.244 -0.319 1.00 10.00 O ATOM 78 CB PRO A 13 -2.714 -9.035 1.888 1.00 10.00 C ATOM 79 CG PRO A 13 -2.846 -10.160 2.862 1.00 10.00 C ATOM 80 CD PRO A 13 -4.316 -10.483 2.965 1.00 10.00 C ATOM 0 HA PRO A 13 -4.216 -8.300 0.434 1.00 10.00 H new ATOM 0 HB2 PRO A 13 -1.767 -9.083 1.351 1.00 10.00 H new ATOM 0 HB3 PRO A 13 -2.747 -8.068 2.391 1.00 10.00 H new ATOM 0 HG2 PRO A 13 -2.283 -11.030 2.525 1.00 10.00 H new ATOM 0 HG3 PRO A 13 -2.444 -9.877 3.835 1.00 10.00 H new ATOM 0 HD2 PRO A 13 -4.496 -11.556 2.891 1.00 10.00 H new ATOM 0 HD3 PRO A 13 -4.731 -10.155 3.918 1.00 10.00 H new ATOM 81 N TYR A 14 -2.520 -9.855 -0.941 1.00 10.00 N ATOM 82 CA TYR A 14 -2.063 -10.712 -2.029 1.00 10.00 C ATOM 83 C TYR A 14 -1.169 -11.840 -1.508 1.00 10.00 C ATOM 84 O TYR A 14 -1.562 -12.595 -0.615 1.00 10.00 O ATOM 85 CB TYR A 14 -1.336 -9.889 -3.096 1.00 10.00 C ATOM 86 CG TYR A 14 -2.251 -9.195 -4.078 1.00 10.00 C ATOM 87 CD1 TYR A 14 -3.153 -8.227 -3.654 1.00 10.00 C ATOM 88 CD2 TYR A 14 -2.212 -9.505 -5.430 1.00 10.00 C ATOM 89 CE1 TYR A 14 -3.989 -7.589 -4.549 1.00 10.00 C ATOM 90 CE2 TYR A 14 -3.046 -8.872 -6.332 1.00 10.00 C ATOM 91 CZ TYR A 14 -3.931 -7.915 -5.885 1.00 10.00 C ATOM 92 OH TYR A 14 -4.759 -7.280 -6.776 1.00 10.00 O ATOM 0 H TYR A 14 -1.991 -8.989 -0.836 1.00 10.00 H new ATOM 0 HA TYR A 14 -2.940 -11.169 -2.487 1.00 10.00 H new ATOM 0 HB2 TYR A 14 -0.718 -9.140 -2.601 1.00 10.00 H new ATOM 0 HB3 TYR A 14 -0.662 -10.545 -3.647 1.00 10.00 H new ATOM 0 HD1 TYR A 14 -3.201 -7.969 -2.606 1.00 10.00 H new ATOM 0 HD2 TYR A 14 -1.518 -10.254 -5.783 1.00 10.00 H new ATOM 0 HE1 TYR A 14 -4.684 -6.839 -4.203 1.00 10.00 H new ATOM 0 HE2 TYR A 14 -3.004 -9.126 -7.381 1.00 10.00 H new ATOM 0 HH TYR A 14 -4.593 -7.623 -7.679 1.00 10.00 H new ATOM 95 N THR A 15 0.031 -11.955 -2.056 1.00 10.00 N ATOM 96 CA THR A 15 0.955 -12.995 -1.640 1.00 10.00 C ATOM 97 C THR A 15 1.839 -12.509 -0.497 1.00 10.00 C ATOM 98 O THR A 15 2.319 -11.373 -0.507 1.00 10.00 O ATOM 99 CB THR A 15 1.832 -13.470 -2.814 1.00 10.00 C ATOM 100 OG1 THR A 15 2.109 -12.368 -3.688 1.00 10.00 O ATOM 101 CG2 THR A 15 1.130 -14.569 -3.595 1.00 10.00 C ATOM 0 H THR A 15 0.386 -11.341 -2.789 1.00 10.00 H new ATOM 0 HA THR A 15 0.359 -13.839 -1.293 1.00 10.00 H new ATOM 0 HB THR A 15 2.765 -13.864 -2.412 1.00 10.00 H new ATOM 0 HG1 THR A 15 2.668 -12.673 -4.432 1.00 10.00 H new ATOM 0 HG21 THR A 15 1.765 -14.891 -4.420 1.00 10.00 H new ATOM 0 HG22 THR A 15 0.934 -15.415 -2.936 1.00 10.00 H new ATOM 0 HG23 THR A 15 0.187 -14.190 -3.989 1.00 10.00 H new ATOM 104 N LYS A 16 2.053 -13.372 0.489 1.00 10.00 N ATOM 105 CA LYS A 16 2.882 -13.025 1.633 1.00 10.00 C ATOM 106 C LYS A 16 4.329 -12.811 1.202 1.00 10.00 C ATOM 107 O LYS A 16 5.059 -12.037 1.814 1.00 10.00 O ATOM 108 CB LYS A 16 2.782 -14.081 2.741 1.00 10.00 C ATOM 109 CG LYS A 16 3.363 -15.437 2.382 1.00 10.00 C ATOM 110 CD LYS A 16 2.886 -16.516 3.341 1.00 10.00 C ATOM 111 CE LYS A 16 1.423 -16.855 3.106 1.00 10.00 C ATOM 112 NZ LYS A 16 0.867 -17.720 4.179 1.00 10.00 N ATOM 0 H LYS A 16 1.664 -14.315 0.518 1.00 10.00 H new ATOM 0 HA LYS A 16 2.508 -12.088 2.046 1.00 10.00 H new ATOM 0 HB2 LYS A 16 3.292 -13.706 3.628 1.00 10.00 H new ATOM 0 HB3 LYS A 16 1.733 -14.210 3.007 1.00 10.00 H new ATOM 0 HG2 LYS A 16 3.075 -15.700 1.364 1.00 10.00 H new ATOM 0 HG3 LYS A 16 4.452 -15.385 2.402 1.00 10.00 H new ATOM 0 HD2 LYS A 16 3.494 -17.412 3.216 1.00 10.00 H new ATOM 0 HD3 LYS A 16 3.023 -16.179 4.369 1.00 10.00 H new ATOM 0 HE2 LYS A 16 0.843 -15.934 3.048 1.00 10.00 H new ATOM 0 HE3 LYS A 16 1.319 -17.359 2.145 1.00 10.00 H new ATOM 0 HZ1 LYS A 16 -0.132 -17.925 3.977 1.00 10.00 H new ATOM 0 HZ2 LYS A 16 1.402 -18.611 4.219 1.00 10.00 H new ATOM 0 HZ3 LYS A 16 0.942 -17.230 5.093 1.00 10.00 H new ATOM 117 N VAL A 17 4.731 -13.500 0.134 1.00 10.00 N ATOM 118 CA VAL A 17 6.084 -13.373 -0.394 1.00 10.00 C ATOM 119 C VAL A 17 6.295 -11.987 -0.999 1.00 10.00 C ATOM 120 O VAL A 17 7.375 -11.407 -0.895 1.00 10.00 O ATOM 121 CB VAL A 17 6.414 -14.467 -1.438 1.00 10.00 C ATOM 122 CG1 VAL A 17 6.558 -15.816 -0.756 1.00 10.00 C ATOM 123 CG2 VAL A 17 5.352 -14.535 -2.530 1.00 10.00 C ATOM 0 H VAL A 17 4.137 -14.151 -0.380 1.00 10.00 H new ATOM 0 HA VAL A 17 6.767 -13.508 0.445 1.00 10.00 H new ATOM 0 HB VAL A 17 7.360 -14.204 -1.911 1.00 10.00 H new ATOM 0 HG11 VAL A 17 6.790 -16.577 -1.501 1.00 10.00 H new ATOM 0 HG12 VAL A 17 7.363 -15.769 -0.022 1.00 10.00 H new ATOM 0 HG13 VAL A 17 5.625 -16.072 -0.255 1.00 10.00 H new ATOM 0 HG21 VAL A 17 5.616 -15.314 -3.246 1.00 10.00 H new ATOM 0 HG22 VAL A 17 4.385 -14.765 -2.083 1.00 10.00 H new ATOM 0 HG23 VAL A 17 5.295 -13.575 -3.043 1.00 10.00 H new ATOM 125 N GLN A 18 5.241 -11.457 -1.610 1.00 10.00 N ATOM 126 CA GLN A 18 5.286 -10.139 -2.222 1.00 10.00 C ATOM 127 C GLN A 18 5.452 -9.077 -1.149 1.00 10.00 C ATOM 128 O GLN A 18 6.338 -8.227 -1.230 1.00 10.00 O ATOM 129 CB GLN A 18 3.996 -9.882 -3.004 1.00 10.00 C ATOM 130 CG GLN A 18 3.920 -8.515 -3.662 1.00 10.00 C ATOM 131 CD GLN A 18 2.576 -8.255 -4.302 1.00 10.00 C ATOM 132 OE1 GLN A 18 1.552 -8.771 -3.862 1.00 10.00 O ATOM 133 NE2 GLN A 18 2.568 -7.449 -5.350 1.00 10.00 N ATOM 0 H GLN A 18 4.339 -11.926 -1.693 1.00 10.00 H new ATOM 0 HA GLN A 18 6.134 -10.095 -2.906 1.00 10.00 H new ATOM 0 HB2 GLN A 18 3.894 -10.648 -3.773 1.00 10.00 H new ATOM 0 HB3 GLN A 18 3.148 -9.994 -2.328 1.00 10.00 H new ATOM 0 HG2 GLN A 18 4.119 -7.745 -2.917 1.00 10.00 H new ATOM 0 HG3 GLN A 18 4.701 -8.436 -4.419 1.00 10.00 H new ATOM 0 HE21 GLN A 18 3.440 -7.040 -5.685 1.00 10.00 H new ATOM 0 HE22 GLN A 18 1.690 -7.236 -5.823 1.00 10.00 H new ATOM 137 N LEU A 19 4.597 -9.145 -0.138 1.00 10.00 N ATOM 138 CA LEU A 19 4.640 -8.195 0.965 1.00 10.00 C ATOM 139 C LEU A 19 5.965 -8.281 1.713 1.00 10.00 C ATOM 140 O LEU A 19 6.549 -7.262 2.069 1.00 10.00 O ATOM 141 CB LEU A 19 3.466 -8.418 1.926 1.00 10.00 C ATOM 142 CG LEU A 19 2.161 -7.678 1.600 1.00 10.00 C ATOM 143 CD1 LEU A 19 2.394 -6.175 1.511 1.00 10.00 C ATOM 144 CD2 LEU A 19 1.527 -8.208 0.323 1.00 10.00 C ATOM 0 H LEU A 19 3.864 -9.850 -0.059 1.00 10.00 H new ATOM 0 HA LEU A 19 4.553 -7.194 0.543 1.00 10.00 H new ATOM 0 HB2 LEU A 19 3.252 -9.486 1.961 1.00 10.00 H new ATOM 0 HB3 LEU A 19 3.784 -8.124 2.926 1.00 10.00 H new ATOM 0 HG LEU A 19 1.463 -7.864 2.416 1.00 10.00 H new ATOM 0 HD11 LEU A 19 1.454 -5.674 1.279 1.00 10.00 H new ATOM 0 HD12 LEU A 19 2.775 -5.809 2.464 1.00 10.00 H new ATOM 0 HD13 LEU A 19 3.120 -5.965 0.726 1.00 10.00 H new ATOM 0 HD21 LEU A 19 0.605 -7.663 0.121 1.00 10.00 H new ATOM 0 HD22 LEU A 19 2.218 -8.073 -0.509 1.00 10.00 H new ATOM 0 HD23 LEU A 19 1.303 -9.268 0.441 1.00 10.00 H new ATOM 146 N LYS A 20 6.440 -9.507 1.922 1.00 10.00 N ATOM 147 CA LYS A 20 7.698 -9.738 2.622 1.00 10.00 C ATOM 148 C LYS A 20 8.862 -9.070 1.897 1.00 10.00 C ATOM 149 O LYS A 20 9.628 -8.315 2.498 1.00 10.00 O ATOM 150 CB LYS A 20 7.966 -11.239 2.767 1.00 10.00 C ATOM 151 CG LYS A 20 9.174 -11.577 3.625 1.00 10.00 C ATOM 152 CD LYS A 20 9.517 -13.056 3.553 1.00 10.00 C ATOM 153 CE LYS A 20 10.078 -13.432 2.192 1.00 10.00 C ATOM 154 NZ LYS A 20 10.611 -14.819 2.177 1.00 10.00 N ATOM 0 H LYS A 20 5.969 -10.358 1.614 1.00 10.00 H new ATOM 0 HA LYS A 20 7.611 -9.296 3.614 1.00 10.00 H new ATOM 0 HB2 LYS A 20 7.084 -11.714 3.198 1.00 10.00 H new ATOM 0 HB3 LYS A 20 8.107 -11.669 1.775 1.00 10.00 H new ATOM 0 HG2 LYS A 20 10.030 -10.988 3.296 1.00 10.00 H new ATOM 0 HG3 LYS A 20 8.975 -11.299 4.660 1.00 10.00 H new ATOM 0 HD2 LYS A 20 10.244 -13.300 4.327 1.00 10.00 H new ATOM 0 HD3 LYS A 20 8.624 -13.648 3.756 1.00 10.00 H new ATOM 0 HE2 LYS A 20 9.297 -13.335 1.438 1.00 10.00 H new ATOM 0 HE3 LYS A 20 10.871 -12.735 1.921 1.00 10.00 H new ATOM 0 HZ1 LYS A 20 10.984 -15.037 1.231 1.00 10.00 H new ATOM 0 HZ2 LYS A 20 11.374 -14.905 2.879 1.00 10.00 H new ATOM 0 HZ3 LYS A 20 9.848 -15.486 2.411 1.00 10.00 H new ATOM 159 N GLU A 21 8.987 -9.347 0.605 1.00 10.00 N ATOM 160 CA GLU A 21 10.057 -8.767 -0.194 1.00 10.00 C ATOM 161 C GLU A 21 9.892 -7.256 -0.310 1.00 10.00 C ATOM 162 O GLU A 21 10.872 -6.519 -0.375 1.00 10.00 O ATOM 163 CB GLU A 21 10.127 -9.420 -1.575 1.00 10.00 C ATOM 164 CG GLU A 21 10.548 -10.884 -1.541 1.00 10.00 C ATOM 165 CD GLU A 21 11.847 -11.100 -0.791 1.00 10.00 C ATOM 166 OE1 GLU A 21 12.888 -10.564 -1.223 1.00 10.00 O ATOM 167 OE2 GLU A 21 11.840 -11.817 0.231 1.00 10.00 O ATOM 0 H GLU A 21 8.362 -9.968 0.090 1.00 10.00 H new ATOM 0 HA GLU A 21 11.001 -8.963 0.315 1.00 10.00 H new ATOM 0 HB2 GLU A 21 9.150 -9.343 -2.053 1.00 10.00 H new ATOM 0 HB3 GLU A 21 10.830 -8.863 -2.195 1.00 10.00 H new ATOM 0 HG2 GLU A 21 9.760 -11.474 -1.073 1.00 10.00 H new ATOM 0 HG3 GLU A 21 10.657 -11.251 -2.562 1.00 10.00 H new ATOM 169 N LEU A 22 8.644 -6.805 -0.313 1.00 10.00 N ATOM 170 CA LEU A 22 8.342 -5.384 -0.395 1.00 10.00 C ATOM 171 C LEU A 22 8.899 -4.673 0.832 1.00 10.00 C ATOM 172 O LEU A 22 9.537 -3.627 0.724 1.00 10.00 O ATOM 173 CB LEU A 22 6.826 -5.176 -0.480 1.00 10.00 C ATOM 174 CG LEU A 22 6.326 -4.165 -1.517 1.00 10.00 C ATOM 175 CD1 LEU A 22 6.724 -2.748 -1.131 1.00 10.00 C ATOM 176 CD2 LEU A 22 6.838 -4.514 -2.909 1.00 10.00 C ATOM 0 H LEU A 22 7.822 -7.407 -0.259 1.00 10.00 H new ATOM 0 HA LEU A 22 8.804 -4.968 -1.290 1.00 10.00 H new ATOM 0 HB2 LEU A 22 6.362 -6.139 -0.693 1.00 10.00 H new ATOM 0 HB3 LEU A 22 6.470 -4.861 0.501 1.00 10.00 H new ATOM 0 HG LEU A 22 5.237 -4.215 -1.537 1.00 10.00 H new ATOM 0 HD11 LEU A 22 6.357 -2.049 -1.883 1.00 10.00 H new ATOM 0 HD12 LEU A 22 6.290 -2.499 -0.163 1.00 10.00 H new ATOM 0 HD13 LEU A 22 7.810 -2.679 -1.071 1.00 10.00 H new ATOM 0 HD21 LEU A 22 6.469 -3.781 -3.627 1.00 10.00 H new ATOM 0 HD22 LEU A 22 7.928 -4.505 -2.909 1.00 10.00 H new ATOM 0 HD23 LEU A 22 6.484 -5.506 -3.189 1.00 10.00 H new ATOM 178 N GLU A 23 8.665 -5.262 2.002 1.00 10.00 N ATOM 179 CA GLU A 23 9.152 -4.704 3.254 1.00 10.00 C ATOM 180 C GLU A 23 10.673 -4.772 3.307 1.00 10.00 C ATOM 181 O GLU A 23 11.327 -3.894 3.869 1.00 10.00 O ATOM 182 CB GLU A 23 8.557 -5.460 4.443 1.00 10.00 C ATOM 183 CG GLU A 23 7.040 -5.413 4.517 1.00 10.00 C ATOM 184 CD GLU A 23 6.486 -6.182 5.698 1.00 10.00 C ATOM 185 OE1 GLU A 23 6.380 -7.424 5.617 1.00 10.00 O ATOM 186 OE2 GLU A 23 6.148 -5.543 6.717 1.00 10.00 O ATOM 0 H GLU A 23 8.138 -6.129 2.106 1.00 10.00 H new ATOM 0 HA GLU A 23 8.841 -3.661 3.309 1.00 10.00 H new ATOM 0 HB2 GLU A 23 8.875 -6.501 4.392 1.00 10.00 H new ATOM 0 HB3 GLU A 23 8.967 -5.046 5.364 1.00 10.00 H new ATOM 0 HG2 GLU A 23 6.716 -4.374 4.581 1.00 10.00 H new ATOM 0 HG3 GLU A 23 6.623 -5.821 3.596 1.00 10.00 H new ATOM 188 N ARG A 24 11.223 -5.821 2.709 1.00 10.00 N ATOM 189 CA ARG A 24 12.665 -6.027 2.668 1.00 10.00 C ATOM 190 C ARG A 24 13.367 -4.885 1.948 1.00 10.00 C ATOM 191 O ARG A 24 14.232 -4.221 2.523 1.00 10.00 O ATOM 192 CB ARG A 24 12.996 -7.361 1.989 1.00 10.00 C ATOM 193 CG ARG A 24 14.444 -7.810 2.144 1.00 10.00 C ATOM 194 CD ARG A 24 14.837 -7.939 3.608 1.00 10.00 C ATOM 195 NE ARG A 24 13.754 -8.487 4.429 1.00 10.00 N ATOM 196 CZ ARG A 24 13.382 -7.969 5.600 1.00 10.00 C ATOM 197 NH1 ARG A 24 14.034 -6.926 6.107 1.00 10.00 N ATOM 198 NH2 ARG A 24 12.362 -8.490 6.270 1.00 10.00 N ATOM 0 H ARG A 24 10.685 -6.550 2.241 1.00 10.00 H new ATOM 0 HA ARG A 24 13.027 -6.052 3.696 1.00 10.00 H new ATOM 0 HB2 ARG A 24 12.344 -8.133 2.398 1.00 10.00 H new ATOM 0 HB3 ARG A 24 12.766 -7.280 0.927 1.00 10.00 H new ATOM 0 HG2 ARG A 24 14.584 -8.768 1.643 1.00 10.00 H new ATOM 0 HG3 ARG A 24 15.102 -7.094 1.652 1.00 10.00 H new ATOM 0 HD2 ARG A 24 15.714 -8.581 3.691 1.00 10.00 H new ATOM 0 HD3 ARG A 24 15.122 -6.960 3.993 1.00 10.00 H new ATOM 0 HE ARG A 24 13.258 -9.309 4.086 1.00 10.00 H new ATOM 0 HH11 ARG A 24 14.821 -6.521 5.600 1.00 10.00 H new ATOM 0 HH12 ARG A 24 13.747 -6.532 7.003 1.00 10.00 H new ATOM 0 HH21 ARG A 24 11.858 -9.291 5.890 1.00 10.00 H new ATOM 0 HH22 ARG A 24 12.082 -8.089 7.165 1.00 10.00 H new ATOM 205 N GLU A 25 12.982 -4.652 0.698 1.00 10.00 N ATOM 206 CA GLU A 25 13.579 -3.590 -0.103 1.00 10.00 C ATOM 207 C GLU A 25 13.264 -2.220 0.488 1.00 10.00 C ATOM 208 O GLU A 25 14.091 -1.312 0.452 1.00 10.00 O ATOM 209 CB GLU A 25 13.089 -3.672 -1.548 1.00 10.00 C ATOM 210 CG GLU A 25 13.190 -5.063 -2.162 1.00 10.00 C ATOM 211 CD GLU A 25 14.587 -5.428 -2.626 1.00 10.00 C ATOM 212 OE1 GLU A 25 15.572 -4.847 -2.113 1.00 10.00 O ATOM 213 OE2 GLU A 25 14.709 -6.301 -3.513 1.00 10.00 O ATOM 0 H GLU A 25 12.258 -5.185 0.217 1.00 10.00 H new ATOM 0 HA GLU A 25 14.661 -3.724 -0.093 1.00 10.00 H new ATOM 0 HB2 GLU A 25 12.050 -3.344 -1.587 1.00 10.00 H new ATOM 0 HB3 GLU A 25 13.666 -2.976 -2.156 1.00 10.00 H new ATOM 0 HG2 GLU A 25 12.857 -5.798 -1.429 1.00 10.00 H new ATOM 0 HG3 GLU A 25 12.508 -5.126 -3.010 1.00 10.00 H new ATOM 215 N TYR A 26 12.066 -2.091 1.048 1.00 10.00 N ATOM 216 CA TYR A 26 11.629 -0.845 1.662 1.00 10.00 C ATOM 217 C TYR A 26 12.521 -0.496 2.851 1.00 10.00 C ATOM 218 O TYR A 26 12.904 0.659 3.035 1.00 10.00 O ATOM 219 CB TYR A 26 10.174 -0.987 2.119 1.00 10.00 C ATOM 220 CG TYR A 26 9.531 0.270 2.663 1.00 10.00 C ATOM 221 CD1 TYR A 26 9.663 0.622 4.001 1.00 10.00 C ATOM 222 CD2 TYR A 26 8.759 1.083 1.846 1.00 10.00 C ATOM 223 CE1 TYR A 26 9.048 1.750 4.507 1.00 10.00 C ATOM 224 CE2 TYR A 26 8.145 2.218 2.342 1.00 10.00 C ATOM 225 CZ TYR A 26 8.292 2.544 3.675 1.00 10.00 C ATOM 226 OH TYR A 26 7.665 3.658 4.182 1.00 10.00 O ATOM 0 H TYR A 26 11.376 -2.841 1.089 1.00 10.00 H new ATOM 0 HA TYR A 26 11.702 -0.041 0.930 1.00 10.00 H new ATOM 0 HB2 TYR A 26 9.581 -1.341 1.276 1.00 10.00 H new ATOM 0 HB3 TYR A 26 10.128 -1.759 2.888 1.00 10.00 H new ATOM 0 HD1 TYR A 26 10.257 0.002 4.656 1.00 10.00 H new ATOM 0 HD2 TYR A 26 8.636 0.825 0.805 1.00 10.00 H new ATOM 0 HE1 TYR A 26 9.160 2.008 5.550 1.00 10.00 H new ATOM 0 HE2 TYR A 26 7.554 2.845 1.691 1.00 10.00 H new ATOM 0 HH TYR A 26 6.795 3.403 4.554 1.00 10.00 H new ATOM 229 N ALA A 27 12.861 -1.506 3.644 1.00 10.00 N ATOM 230 CA ALA A 27 13.699 -1.313 4.820 1.00 10.00 C ATOM 231 C ALA A 27 15.151 -1.038 4.443 1.00 10.00 C ATOM 232 O ALA A 27 15.914 -0.500 5.245 1.00 10.00 O ATOM 233 CB ALA A 27 13.601 -2.509 5.754 1.00 10.00 C ATOM 0 H ALA A 27 12.567 -2.471 3.492 1.00 10.00 H new ATOM 0 HA ALA A 27 13.327 -0.433 5.344 1.00 10.00 H new ATOM 0 HB1 ALA A 27 14.235 -2.343 6.625 1.00 10.00 H new ATOM 0 HB2 ALA A 27 12.567 -2.635 6.076 1.00 10.00 H new ATOM 0 HB3 ALA A 27 13.931 -3.407 5.231 1.00 10.00 H new ATOM 235 N THR A 28 15.532 -1.407 3.225 1.00 10.00 N ATOM 236 CA THR A 28 16.892 -1.182 2.753 1.00 10.00 C ATOM 237 C THR A 28 17.164 0.317 2.621 1.00 10.00 C ATOM 238 O THR A 28 18.297 0.772 2.792 1.00 10.00 O ATOM 239 CB THR A 28 17.135 -1.878 1.395 1.00 10.00 C ATOM 240 OG1 THR A 28 16.674 -3.232 1.465 1.00 10.00 O ATOM 241 CG2 THR A 28 18.616 -1.881 1.043 1.00 10.00 C ATOM 0 H THR A 28 14.919 -1.862 2.548 1.00 10.00 H new ATOM 0 HA THR A 28 17.576 -1.611 3.486 1.00 10.00 H new ATOM 0 HB THR A 28 16.590 -1.330 0.627 1.00 10.00 H new ATOM 0 HG1 THR A 28 15.733 -3.243 1.737 1.00 10.00 H new ATOM 0 HG21 THR A 28 18.761 -2.376 0.083 1.00 10.00 H new ATOM 0 HG22 THR A 28 18.977 -0.854 0.980 1.00 10.00 H new ATOM 0 HG23 THR A 28 19.172 -2.414 1.814 1.00 10.00 H new ATOM 244 N ASN A 29 16.106 1.075 2.345 1.00 10.00 N ATOM 245 CA ASN A 29 16.202 2.525 2.196 1.00 10.00 C ATOM 246 C ASN A 29 14.815 3.151 2.283 1.00 10.00 C ATOM 247 O ASN A 29 14.467 3.774 3.285 1.00 10.00 O ATOM 248 CB ASN A 29 16.883 2.894 0.866 1.00 10.00 C ATOM 249 CG ASN A 29 16.714 4.356 0.488 1.00 10.00 C ATOM 250 OD1 ASN A 29 15.852 4.706 -0.319 1.00 10.00 O ATOM 251 ND2 ASN A 29 17.528 5.219 1.076 1.00 10.00 N ATOM 0 H ASN A 29 15.164 0.705 2.219 1.00 10.00 H new ATOM 0 HA ASN A 29 16.815 2.918 3.007 1.00 10.00 H new ATOM 0 HB2 ASN A 29 17.946 2.665 0.935 1.00 10.00 H new ATOM 0 HB3 ASN A 29 16.473 2.271 0.071 1.00 10.00 H new ATOM 0 HD21 ASN A 29 17.454 6.214 0.866 1.00 10.00 H new ATOM 0 HD22 ASN A 29 18.229 4.888 1.739 1.00 10.00 H new ATOM 255 N LYS A 30 14.028 2.936 1.237 1.00 10.00 N ATOM 256 CA LYS A 30 12.670 3.456 1.129 1.00 10.00 C ATOM 257 C LYS A 30 12.157 3.112 -0.255 1.00 10.00 C ATOM 258 O LYS A 30 11.057 2.590 -0.425 1.00 10.00 O ATOM 259 CB LYS A 30 12.651 4.978 1.318 1.00 10.00 C ATOM 260 CG LYS A 30 11.258 5.573 1.470 1.00 10.00 C ATOM 261 CD LYS A 30 11.325 7.019 1.935 1.00 10.00 C ATOM 262 CE LYS A 30 11.840 7.937 0.839 1.00 10.00 C ATOM 263 NZ LYS A 30 10.740 8.668 0.157 1.00 10.00 N ATOM 0 H LYS A 30 14.319 2.388 0.428 1.00 10.00 H new ATOM 0 HA LYS A 30 12.042 3.014 1.903 1.00 10.00 H new ATOM 0 HB2 LYS A 30 13.239 5.230 2.200 1.00 10.00 H new ATOM 0 HB3 LYS A 30 13.141 5.445 0.464 1.00 10.00 H new ATOM 0 HG2 LYS A 30 10.731 5.519 0.518 1.00 10.00 H new ATOM 0 HG3 LYS A 30 10.684 4.984 2.186 1.00 10.00 H new ATOM 0 HD2 LYS A 30 10.334 7.347 2.249 1.00 10.00 H new ATOM 0 HD3 LYS A 30 11.976 7.092 2.806 1.00 10.00 H new ATOM 0 HE2 LYS A 30 12.540 8.654 1.267 1.00 10.00 H new ATOM 0 HE3 LYS A 30 12.393 7.350 0.106 1.00 10.00 H new ATOM 0 HZ1 LYS A 30 11.137 9.282 -0.583 1.00 10.00 H new ATOM 0 HZ2 LYS A 30 10.085 7.985 -0.275 1.00 10.00 H new ATOM 0 HZ3 LYS A 30 10.227 9.249 0.850 1.00 10.00 H new ATOM 268 N PHE A 31 12.997 3.393 -1.236 1.00 10.00 N ATOM 269 CA PHE A 31 12.693 3.118 -2.625 1.00 10.00 C ATOM 270 C PHE A 31 13.939 2.562 -3.292 1.00 10.00 C ATOM 271 O PHE A 31 15.045 2.720 -2.772 1.00 10.00 O ATOM 272 CB PHE A 31 12.229 4.390 -3.339 1.00 10.00 C ATOM 273 CG PHE A 31 10.747 4.442 -3.599 1.00 10.00 C ATOM 274 CD1 PHE A 31 9.858 4.740 -2.578 1.00 10.00 C ATOM 275 CD2 PHE A 31 10.243 4.197 -4.866 1.00 10.00 C ATOM 276 CE1 PHE A 31 8.498 4.793 -2.815 1.00 10.00 C ATOM 277 CE2 PHE A 31 8.883 4.249 -5.111 1.00 10.00 C ATOM 278 CZ PHE A 31 8.010 4.547 -4.084 1.00 10.00 C ATOM 0 H PHE A 31 13.912 3.820 -1.089 1.00 10.00 H new ATOM 0 HA PHE A 31 11.884 2.390 -2.684 1.00 10.00 H new ATOM 0 HB2 PHE A 31 12.513 5.255 -2.739 1.00 10.00 H new ATOM 0 HB3 PHE A 31 12.757 4.474 -4.289 1.00 10.00 H new ATOM 0 HD1 PHE A 31 10.234 4.933 -1.584 1.00 10.00 H new ATOM 0 HD2 PHE A 31 10.921 3.962 -5.673 1.00 10.00 H new ATOM 0 HE1 PHE A 31 7.817 5.026 -2.010 1.00 10.00 H new ATOM 0 HE2 PHE A 31 8.505 4.057 -6.104 1.00 10.00 H new ATOM 0 HZ PHE A 31 6.947 4.588 -4.272 1.00 10.00 H new ATOM 280 N ILE A 32 13.768 1.909 -4.423 1.00 10.00 N ATOM 281 CA ILE A 32 14.895 1.327 -5.136 1.00 10.00 C ATOM 282 C ILE A 32 14.853 1.656 -6.624 1.00 10.00 C ATOM 283 O ILE A 32 13.885 2.247 -7.115 1.00 10.00 O ATOM 284 CB ILE A 32 14.997 -0.204 -4.929 1.00 10.00 C ATOM 285 CG1 ILE A 32 13.619 -0.830 -4.684 1.00 10.00 C ATOM 286 CG2 ILE A 32 15.941 -0.529 -3.779 1.00 10.00 C ATOM 287 CD1 ILE A 32 12.762 -0.953 -5.922 1.00 10.00 C ATOM 0 H ILE A 32 12.863 1.766 -4.871 1.00 10.00 H new ATOM 0 HA ILE A 32 15.789 1.780 -4.708 1.00 10.00 H new ATOM 0 HB ILE A 32 15.401 -0.635 -5.845 1.00 10.00 H new ATOM 0 HG12 ILE A 32 13.755 -1.821 -4.251 1.00 10.00 H new ATOM 0 HG13 ILE A 32 13.087 -0.230 -3.946 1.00 10.00 H new ATOM 0 HG21 ILE A 32 15.999 -1.610 -3.650 1.00 10.00 H new ATOM 0 HG22 ILE A 32 16.933 -0.137 -4.001 1.00 10.00 H new ATOM 0 HG23 ILE A 32 15.567 -0.074 -2.862 1.00 10.00 H new ATOM 0 HD11 ILE A 32 11.806 -1.405 -5.659 1.00 10.00 H new ATOM 0 HD12 ILE A 32 12.591 0.037 -6.346 1.00 10.00 H new ATOM 0 HD13 ILE A 32 13.270 -1.579 -6.655 1.00 10.00 H new ATOM 289 N THR A 33 15.905 1.272 -7.332 1.00 10.00 N ATOM 290 CA THR A 33 16.008 1.520 -8.759 1.00 10.00 C ATOM 291 C THR A 33 15.131 0.547 -9.547 1.00 10.00 C ATOM 292 O THR A 33 14.534 -0.373 -8.978 1.00 10.00 O ATOM 293 CB THR A 33 17.468 1.388 -9.222 1.00 10.00 C ATOM 294 OG1 THR A 33 18.134 0.414 -8.403 1.00 10.00 O ATOM 295 CG2 THR A 33 18.189 2.723 -9.106 1.00 10.00 C ATOM 0 H THR A 33 16.707 0.782 -6.934 1.00 10.00 H new ATOM 0 HA THR A 33 15.661 2.536 -8.948 1.00 10.00 H new ATOM 0 HB THR A 33 17.481 1.074 -10.266 1.00 10.00 H new ATOM 0 HG1 THR A 33 18.460 -0.319 -8.966 1.00 10.00 H new ATOM 0 HG21 THR A 33 19.221 2.609 -9.438 1.00 10.00 H new ATOM 0 HG22 THR A 33 17.687 3.463 -9.729 1.00 10.00 H new ATOM 0 HG23 THR A 33 18.177 3.054 -8.068 1.00 10.00 H new ATOM 298 N LYS A 34 15.067 0.742 -10.858 1.00 10.00 N ATOM 299 CA LYS A 34 14.259 -0.110 -11.717 1.00 10.00 C ATOM 300 C LYS A 34 14.828 -1.523 -11.774 1.00 10.00 C ATOM 301 O LYS A 34 14.077 -2.496 -11.847 1.00 10.00 O ATOM 302 CB LYS A 34 14.127 0.489 -13.119 1.00 10.00 C ATOM 303 CG LYS A 34 12.915 1.397 -13.302 1.00 10.00 C ATOM 304 CD LYS A 34 13.035 2.677 -12.488 1.00 10.00 C ATOM 305 CE LYS A 34 11.716 3.437 -12.448 1.00 10.00 C ATOM 306 NZ LYS A 34 11.872 4.789 -11.845 1.00 10.00 N ATOM 0 H LYS A 34 15.566 1.484 -11.349 1.00 10.00 H new ATOM 0 HA LYS A 34 13.260 -0.169 -11.286 1.00 10.00 H new ATOM 0 HB2 LYS A 34 15.029 1.057 -13.345 1.00 10.00 H new ATOM 0 HB3 LYS A 34 14.071 -0.323 -13.844 1.00 10.00 H new ATOM 0 HG2 LYS A 34 12.805 1.647 -14.357 1.00 10.00 H new ATOM 0 HG3 LYS A 34 12.013 0.862 -13.006 1.00 10.00 H new ATOM 0 HD2 LYS A 34 13.348 2.436 -11.472 1.00 10.00 H new ATOM 0 HD3 LYS A 34 13.809 3.312 -12.918 1.00 10.00 H new ATOM 0 HE2 LYS A 34 11.322 3.534 -13.460 1.00 10.00 H new ATOM 0 HE3 LYS A 34 10.985 2.866 -11.875 1.00 10.00 H new ATOM 0 HZ1 LYS A 34 10.952 5.274 -11.836 1.00 10.00 H new ATOM 0 HZ2 LYS A 34 12.224 4.696 -10.871 1.00 10.00 H new ATOM 0 HZ3 LYS A 34 12.550 5.343 -12.406 1.00 10.00 H new ATOM 311 N ASP A 35 16.150 -1.635 -11.715 1.00 10.00 N ATOM 312 CA ASP A 35 16.801 -2.940 -11.745 1.00 10.00 C ATOM 313 C ASP A 35 16.388 -3.773 -10.538 1.00 10.00 C ATOM 314 O ASP A 35 16.239 -4.992 -10.631 1.00 10.00 O ATOM 315 CB ASP A 35 18.329 -2.813 -11.816 1.00 10.00 C ATOM 316 CG ASP A 35 18.955 -2.258 -10.551 1.00 10.00 C ATOM 317 OD1 ASP A 35 19.290 -3.049 -9.646 1.00 10.00 O ATOM 318 OD2 ASP A 35 19.125 -1.024 -10.463 1.00 10.00 O ATOM 0 H ASP A 35 16.789 -0.843 -11.646 1.00 10.00 H new ATOM 0 HA ASP A 35 16.472 -3.449 -12.651 1.00 10.00 H new ATOM 0 HB2 ASP A 35 18.757 -3.794 -12.022 1.00 10.00 H new ATOM 0 HB3 ASP A 35 18.592 -2.168 -12.654 1.00 10.00 H new ATOM 320 N LYS A 36 16.176 -3.100 -9.414 1.00 10.00 N ATOM 321 CA LYS A 36 15.771 -3.770 -8.190 1.00 10.00 C ATOM 322 C LYS A 36 14.283 -4.095 -8.225 1.00 10.00 C ATOM 323 O LYS A 36 13.872 -5.190 -7.837 1.00 10.00 O ATOM 324 CB LYS A 36 16.108 -2.917 -6.966 1.00 10.00 C ATOM 325 CG LYS A 36 17.263 -3.451 -6.129 1.00 10.00 C ATOM 326 CD LYS A 36 16.871 -4.715 -5.378 1.00 10.00 C ATOM 327 CE LYS A 36 17.978 -5.176 -4.439 1.00 10.00 C ATOM 328 NZ LYS A 36 17.490 -6.179 -3.455 1.00 10.00 N ATOM 0 H LYS A 36 16.279 -2.089 -9.327 1.00 10.00 H new ATOM 0 HA LYS A 36 16.326 -4.705 -8.114 1.00 10.00 H new ATOM 0 HB2 LYS A 36 16.351 -1.907 -7.297 1.00 10.00 H new ATOM 0 HB3 LYS A 36 15.222 -2.841 -6.335 1.00 10.00 H new ATOM 0 HG2 LYS A 36 18.115 -3.660 -6.775 1.00 10.00 H new ATOM 0 HG3 LYS A 36 17.581 -2.688 -5.418 1.00 10.00 H new ATOM 0 HD2 LYS A 36 15.961 -4.532 -4.806 1.00 10.00 H new ATOM 0 HD3 LYS A 36 16.645 -5.507 -6.092 1.00 10.00 H new ATOM 0 HE2 LYS A 36 18.793 -5.606 -5.022 1.00 10.00 H new ATOM 0 HE3 LYS A 36 18.385 -4.315 -3.908 1.00 10.00 H new ATOM 0 HZ1 LYS A 36 18.283 -6.778 -3.147 1.00 10.00 H new ATOM 0 HZ2 LYS A 36 17.086 -5.689 -2.631 1.00 10.00 H new ATOM 0 HZ3 LYS A 36 16.759 -6.772 -3.897 1.00 10.00 H new ATOM 333 N ARG A 37 13.475 -3.152 -8.714 1.00 10.00 N ATOM 334 CA ARG A 37 12.030 -3.363 -8.802 1.00 10.00 C ATOM 335 C ARG A 37 11.710 -4.503 -9.766 1.00 10.00 C ATOM 336 O ARG A 37 10.745 -5.242 -9.572 1.00 10.00 O ATOM 337 CB ARG A 37 11.280 -2.082 -9.200 1.00 10.00 C ATOM 338 CG ARG A 37 11.244 -1.810 -10.698 1.00 10.00 C ATOM 339 CD ARG A 37 10.089 -0.903 -11.089 1.00 10.00 C ATOM 340 NE ARG A 37 9.884 -0.899 -12.538 1.00 10.00 N ATOM 341 CZ ARG A 37 9.080 -0.060 -13.191 1.00 10.00 C ATOM 342 NH1 ARG A 37 8.365 0.848 -12.528 1.00 10.00 N ATOM 343 NH2 ARG A 37 8.988 -0.151 -14.512 1.00 10.00 N ATOM 0 H ARG A 37 13.793 -2.244 -9.052 1.00 10.00 H new ATOM 0 HA ARG A 37 11.682 -3.640 -7.807 1.00 10.00 H new ATOM 0 HB2 ARG A 37 10.256 -2.146 -8.831 1.00 10.00 H new ATOM 0 HB3 ARG A 37 11.747 -1.233 -8.701 1.00 10.00 H new ATOM 0 HG2 ARG A 37 12.184 -1.351 -11.005 1.00 10.00 H new ATOM 0 HG3 ARG A 37 11.160 -2.755 -11.235 1.00 10.00 H new ATOM 0 HD2 ARG A 37 9.178 -1.236 -10.591 1.00 10.00 H new ATOM 0 HD3 ARG A 37 10.288 0.112 -10.745 1.00 10.00 H new ATOM 0 HE ARG A 37 10.394 -1.589 -13.089 1.00 10.00 H new ATOM 0 HH11 ARG A 37 8.430 0.906 -11.512 1.00 10.00 H new ATOM 0 HH12 ARG A 37 7.753 1.486 -13.037 1.00 10.00 H new ATOM 0 HH21 ARG A 37 9.528 -0.856 -15.013 1.00 10.00 H new ATOM 0 HH22 ARG A 37 8.377 0.484 -15.026 1.00 10.00 H new ATOM 350 N ARG A 38 12.532 -4.641 -10.806 1.00 10.00 N ATOM 351 CA ARG A 38 12.347 -5.697 -11.791 1.00 10.00 C ATOM 352 C ARG A 38 12.604 -7.054 -11.154 1.00 10.00 C ATOM 353 O ARG A 38 11.950 -8.041 -11.488 1.00 10.00 O ATOM 354 CB ARG A 38 13.266 -5.485 -12.993 1.00 10.00 C ATOM 355 CG ARG A 38 12.825 -6.219 -14.248 1.00 10.00 C ATOM 356 CD ARG A 38 13.434 -5.590 -15.491 1.00 10.00 C ATOM 357 NE ARG A 38 14.418 -6.461 -16.128 1.00 10.00 N ATOM 358 CZ ARG A 38 14.693 -6.439 -17.430 1.00 10.00 C ATOM 359 NH1 ARG A 38 14.064 -5.585 -18.230 1.00 10.00 N ATOM 360 NH2 ARG A 38 15.598 -7.269 -17.928 1.00 10.00 N ATOM 0 H ARG A 38 13.331 -4.033 -10.985 1.00 10.00 H new ATOM 0 HA ARG A 38 11.317 -5.665 -12.145 1.00 10.00 H new ATOM 0 HB2 ARG A 38 13.323 -4.418 -13.210 1.00 10.00 H new ATOM 0 HB3 ARG A 38 14.272 -5.810 -12.729 1.00 10.00 H new ATOM 0 HG2 ARG A 38 13.121 -7.266 -14.184 1.00 10.00 H new ATOM 0 HG3 ARG A 38 11.738 -6.199 -14.322 1.00 10.00 H new ATOM 0 HD2 ARG A 38 12.642 -5.358 -16.203 1.00 10.00 H new ATOM 0 HD3 ARG A 38 13.908 -4.646 -15.223 1.00 10.00 H new ATOM 0 HE ARG A 38 14.924 -7.125 -15.541 1.00 10.00 H new ATOM 0 HH11 ARG A 38 13.369 -4.945 -17.847 1.00 10.00 H new ATOM 0 HH12 ARG A 38 14.276 -5.570 -19.228 1.00 10.00 H new ATOM 0 HH21 ARG A 38 16.083 -7.923 -17.314 1.00 10.00 H new ATOM 0 HH22 ARG A 38 15.810 -7.254 -18.926 1.00 10.00 H new ATOM 367 N ARG A 39 13.550 -7.089 -10.218 1.00 10.00 N ATOM 368 CA ARG A 39 13.881 -8.321 -9.515 1.00 10.00 C ATOM 369 C ARG A 39 12.656 -8.805 -8.742 1.00 10.00 C ATOM 370 O ARG A 39 12.297 -9.986 -8.777 1.00 10.00 O ATOM 371 CB ARG A 39 15.067 -8.094 -8.562 1.00 10.00 C ATOM 372 CG ARG A 39 15.358 -9.259 -7.627 1.00 10.00 C ATOM 373 CD ARG A 39 14.973 -8.929 -6.192 1.00 10.00 C ATOM 374 NE ARG A 39 14.627 -10.130 -5.435 1.00 10.00 N ATOM 375 CZ ARG A 39 14.164 -10.116 -4.186 1.00 10.00 C ATOM 376 NH1 ARG A 39 14.053 -8.975 -3.517 1.00 10.00 N ATOM 377 NH2 ARG A 39 13.819 -11.249 -3.591 1.00 10.00 N ATOM 0 H ARG A 39 14.099 -6.278 -9.931 1.00 10.00 H new ATOM 0 HA ARG A 39 14.172 -9.082 -10.239 1.00 10.00 H new ATOM 0 HB2 ARG A 39 15.959 -7.889 -9.155 1.00 10.00 H new ATOM 0 HB3 ARG A 39 14.870 -7.205 -7.963 1.00 10.00 H new ATOM 0 HG2 ARG A 39 14.809 -10.140 -7.959 1.00 10.00 H new ATOM 0 HG3 ARG A 39 16.418 -9.508 -7.673 1.00 10.00 H new ATOM 0 HD2 ARG A 39 15.801 -8.416 -5.702 1.00 10.00 H new ATOM 0 HD3 ARG A 39 14.127 -8.242 -6.191 1.00 10.00 H new ATOM 0 HE ARG A 39 14.747 -11.034 -5.891 1.00 10.00 H new ATOM 0 HH11 ARG A 39 14.324 -8.096 -3.959 1.00 10.00 H new ATOM 0 HH12 ARG A 39 13.697 -8.977 -2.561 1.00 10.00 H new ATOM 0 HH21 ARG A 39 13.908 -12.134 -4.090 1.00 10.00 H new ATOM 0 HH22 ARG A 39 13.465 -11.235 -2.635 1.00 10.00 H new ATOM 384 N ILE A 40 12.002 -7.873 -8.061 1.00 10.00 N ATOM 385 CA ILE A 40 10.809 -8.179 -7.288 1.00 10.00 C ATOM 386 C ILE A 40 9.666 -8.553 -8.224 1.00 10.00 C ATOM 387 O ILE A 40 8.928 -9.504 -7.970 1.00 10.00 O ATOM 388 CB ILE A 40 10.373 -6.971 -6.431 1.00 10.00 C ATOM 389 CG1 ILE A 40 11.575 -6.369 -5.699 1.00 10.00 C ATOM 390 CG2 ILE A 40 9.294 -7.382 -5.440 1.00 10.00 C ATOM 391 CD1 ILE A 40 11.333 -4.965 -5.193 1.00 10.00 C ATOM 0 H ILE A 40 12.282 -6.893 -8.030 1.00 10.00 H new ATOM 0 HA ILE A 40 11.046 -9.014 -6.628 1.00 10.00 H new ATOM 0 HB ILE A 40 9.959 -6.211 -7.094 1.00 10.00 H new ATOM 0 HG12 ILE A 40 11.836 -7.010 -4.857 1.00 10.00 H new ATOM 0 HG13 ILE A 40 12.433 -6.361 -6.371 1.00 10.00 H new ATOM 0 HG21 ILE A 40 8.999 -6.518 -4.844 1.00 10.00 H new ATOM 0 HG22 ILE A 40 8.428 -7.762 -5.982 1.00 10.00 H new ATOM 0 HG23 ILE A 40 9.681 -8.161 -4.783 1.00 10.00 H new ATOM 0 HD11 ILE A 40 12.227 -4.602 -4.685 1.00 10.00 H new ATOM 0 HD12 ILE A 40 11.102 -4.310 -6.033 1.00 10.00 H new ATOM 0 HD13 ILE A 40 10.496 -4.969 -4.495 1.00 10.00 H new ATOM 393 N SER A 41 9.548 -7.806 -9.316 1.00 10.00 N ATOM 394 CA SER A 41 8.503 -8.036 -10.305 1.00 10.00 C ATOM 395 C SER A 41 8.582 -9.443 -10.885 1.00 10.00 C ATOM 396 O SER A 41 7.578 -10.145 -10.950 1.00 10.00 O ATOM 397 CB SER A 41 8.592 -7.000 -11.429 1.00 10.00 C ATOM 398 OG SER A 41 7.409 -6.990 -12.208 1.00 10.00 O ATOM 0 H SER A 41 10.170 -7.029 -9.539 1.00 10.00 H new ATOM 0 HA SER A 41 7.543 -7.933 -9.799 1.00 10.00 H new ATOM 0 HB2 SER A 41 8.759 -6.011 -11.003 1.00 10.00 H new ATOM 0 HB3 SER A 41 9.448 -7.222 -12.066 1.00 10.00 H new ATOM 0 HG SER A 41 7.625 -6.728 -13.127 1.00 10.00 H new ATOM 401 N ALA A 42 9.777 -9.851 -11.291 1.00 10.00 N ATOM 402 CA ALA A 42 9.983 -11.175 -11.870 1.00 10.00 C ATOM 403 C ALA A 42 9.664 -12.283 -10.872 1.00 10.00 C ATOM 404 O ALA A 42 9.228 -13.370 -11.249 1.00 10.00 O ATOM 405 CB ALA A 42 11.412 -11.315 -12.372 1.00 10.00 C ATOM 0 H ALA A 42 10.622 -9.283 -11.230 1.00 10.00 H new ATOM 0 HA ALA A 42 9.296 -11.278 -12.710 1.00 10.00 H new ATOM 0 HB1 ALA A 42 11.551 -12.307 -12.801 1.00 10.00 H new ATOM 0 HB2 ALA A 42 11.606 -10.560 -13.134 1.00 10.00 H new ATOM 0 HB3 ALA A 42 12.104 -11.179 -11.541 1.00 10.00 H new ATOM 407 N THR A 43 9.865 -12.000 -9.595 1.00 10.00 N ATOM 408 CA THR A 43 9.608 -12.978 -8.554 1.00 10.00 C ATOM 409 C THR A 43 8.121 -13.042 -8.198 1.00 10.00 C ATOM 410 O THR A 43 7.587 -14.113 -7.905 1.00 10.00 O ATOM 411 CB THR A 43 10.434 -12.668 -7.289 1.00 10.00 C ATOM 412 OG1 THR A 43 11.791 -12.380 -7.665 1.00 10.00 O ATOM 413 CG2 THR A 43 10.422 -13.854 -6.336 1.00 10.00 C ATOM 0 H THR A 43 10.205 -11.100 -9.256 1.00 10.00 H new ATOM 0 HA THR A 43 9.910 -13.949 -8.945 1.00 10.00 H new ATOM 0 HB THR A 43 9.992 -11.808 -6.787 1.00 10.00 H new ATOM 0 HG1 THR A 43 11.853 -11.455 -7.983 1.00 10.00 H new ATOM 0 HG21 THR A 43 11.010 -13.615 -5.450 1.00 10.00 H new ATOM 0 HG22 THR A 43 9.396 -14.074 -6.042 1.00 10.00 H new ATOM 0 HG23 THR A 43 10.851 -14.724 -6.833 1.00 10.00 H new ATOM 416 N THR A 44 7.448 -11.895 -8.249 1.00 10.00 N ATOM 417 CA THR A 44 6.032 -11.826 -7.909 1.00 10.00 C ATOM 418 C THR A 44 5.143 -11.966 -9.139 1.00 10.00 C ATOM 419 O THR A 44 3.917 -11.956 -9.027 1.00 10.00 O ATOM 420 CB THR A 44 5.697 -10.514 -7.175 1.00 10.00 C ATOM 421 OG1 THR A 44 6.255 -9.406 -7.896 1.00 10.00 O ATOM 422 CG2 THR A 44 6.276 -10.534 -5.771 1.00 10.00 C ATOM 0 H THR A 44 7.861 -11.003 -8.522 1.00 10.00 H new ATOM 0 HA THR A 44 5.831 -12.666 -7.244 1.00 10.00 H new ATOM 0 HB THR A 44 4.613 -10.412 -7.115 1.00 10.00 H new ATOM 0 HG1 THR A 44 7.194 -9.290 -7.642 1.00 10.00 H new ATOM 0 HG21 THR A 44 6.032 -9.601 -5.263 1.00 10.00 H new ATOM 0 HG22 THR A 44 5.853 -11.371 -5.215 1.00 10.00 H new ATOM 0 HG23 THR A 44 7.359 -10.645 -5.826 1.00 10.00 H new ATOM 425 N ASN A 45 5.771 -12.090 -10.306 1.00 10.00 N ATOM 426 CA ASN A 45 5.055 -12.230 -11.573 1.00 10.00 C ATOM 427 C ASN A 45 4.235 -10.988 -11.883 1.00 10.00 C ATOM 428 O ASN A 45 3.209 -11.059 -12.562 1.00 10.00 O ATOM 429 CB ASN A 45 4.164 -13.477 -11.584 1.00 10.00 C ATOM 430 CG ASN A 45 4.942 -14.742 -11.871 1.00 10.00 C ATOM 431 OD1 ASN A 45 5.396 -15.429 -10.954 1.00 10.00 O ATOM 432 ND2 ASN A 45 5.103 -15.054 -13.145 1.00 10.00 N ATOM 0 H ASN A 45 6.787 -12.096 -10.401 1.00 10.00 H new ATOM 0 HA ASN A 45 5.806 -12.348 -12.354 1.00 10.00 H new ATOM 0 HB2 ASN A 45 3.665 -13.572 -10.619 1.00 10.00 H new ATOM 0 HB3 ASN A 45 3.384 -13.356 -12.336 1.00 10.00 H new ATOM 0 HD21 ASN A 45 5.621 -15.894 -13.403 1.00 10.00 H new ATOM 0 HD22 ASN A 45 4.709 -14.455 -13.870 1.00 10.00 H new ATOM 436 N LEU A 46 4.702 -9.850 -11.394 1.00 10.00 N ATOM 437 CA LEU A 46 4.017 -8.589 -11.607 1.00 10.00 C ATOM 438 C LEU A 46 4.401 -7.964 -12.941 1.00 10.00 C ATOM 439 O LEU A 46 5.173 -8.539 -13.709 1.00 10.00 O ATOM 440 CB LEU A 46 4.298 -7.622 -10.456 1.00 10.00 C ATOM 441 CG LEU A 46 3.151 -7.423 -9.459 1.00 10.00 C ATOM 442 CD1 LEU A 46 2.837 -8.717 -8.725 1.00 10.00 C ATOM 443 CD2 LEU A 46 3.470 -6.310 -8.477 1.00 10.00 C ATOM 0 H LEU A 46 5.558 -9.776 -10.844 1.00 10.00 H new ATOM 0 HA LEU A 46 2.947 -8.794 -11.634 1.00 10.00 H new ATOM 0 HB2 LEU A 46 5.171 -7.980 -9.910 1.00 10.00 H new ATOM 0 HB3 LEU A 46 4.561 -6.652 -10.877 1.00 10.00 H new ATOM 0 HG LEU A 46 2.265 -7.131 -10.023 1.00 10.00 H new ATOM 0 HD11 LEU A 46 2.020 -8.548 -8.024 1.00 10.00 H new ATOM 0 HD12 LEU A 46 2.546 -9.482 -9.445 1.00 10.00 H new ATOM 0 HD13 LEU A 46 3.720 -9.049 -8.180 1.00 10.00 H new ATOM 0 HD21 LEU A 46 2.640 -6.190 -7.781 1.00 10.00 H new ATOM 0 HD22 LEU A 46 4.374 -6.562 -7.923 1.00 10.00 H new ATOM 0 HD23 LEU A 46 3.625 -5.378 -9.021 1.00 10.00 H new ATOM 445 N SER A 47 3.865 -6.783 -13.205 1.00 10.00 N ATOM 446 CA SER A 47 4.125 -6.076 -14.450 1.00 10.00 C ATOM 447 C SER A 47 5.031 -4.859 -14.237 1.00 10.00 C ATOM 448 O SER A 47 4.990 -3.909 -15.025 1.00 10.00 O ATOM 449 CB SER A 47 2.785 -5.619 -15.019 1.00 10.00 C ATOM 450 OG SER A 47 1.957 -5.121 -13.977 1.00 10.00 O ATOM 0 H SER A 47 3.241 -6.289 -12.567 1.00 10.00 H new ATOM 0 HA SER A 47 4.639 -6.748 -15.137 1.00 10.00 H new ATOM 0 HB2 SER A 47 2.945 -4.844 -15.769 1.00 10.00 H new ATOM 0 HB3 SER A 47 2.291 -6.451 -15.520 1.00 10.00 H new ATOM 0 HG SER A 47 1.100 -4.828 -14.352 1.00 10.00 H new ATOM 453 N GLU A 48 5.842 -4.896 -13.174 1.00 10.00 N ATOM 454 CA GLU A 48 6.764 -3.803 -12.833 1.00 10.00 C ATOM 455 C GLU A 48 6.044 -2.555 -12.314 1.00 10.00 C ATOM 456 O GLU A 48 6.357 -2.054 -11.232 1.00 10.00 O ATOM 457 CB GLU A 48 7.698 -3.450 -13.993 1.00 10.00 C ATOM 458 CG GLU A 48 8.928 -4.333 -14.107 1.00 10.00 C ATOM 459 CD GLU A 48 10.013 -3.690 -14.940 1.00 10.00 C ATOM 460 OE1 GLU A 48 10.598 -2.684 -14.483 1.00 10.00 O ATOM 461 OE2 GLU A 48 10.277 -4.172 -16.064 1.00 10.00 O ATOM 0 H GLU A 48 5.879 -5.683 -12.526 1.00 10.00 H new ATOM 0 HA GLU A 48 7.376 -4.183 -12.015 1.00 10.00 H new ATOM 0 HB2 GLU A 48 7.136 -3.510 -14.925 1.00 10.00 H new ATOM 0 HB3 GLU A 48 8.020 -2.415 -13.881 1.00 10.00 H new ATOM 0 HG2 GLU A 48 9.315 -4.546 -13.110 1.00 10.00 H new ATOM 0 HG3 GLU A 48 8.648 -5.288 -14.551 1.00 10.00 H new ATOM 463 N ARG A 49 5.079 -2.074 -13.084 1.00 10.00 N ATOM 464 CA ARG A 49 4.316 -0.881 -12.740 1.00 10.00 C ATOM 465 C ARG A 49 3.678 -1.000 -11.357 1.00 10.00 C ATOM 466 O ARG A 49 3.837 -0.118 -10.514 1.00 10.00 O ATOM 467 CB ARG A 49 3.236 -0.642 -13.797 1.00 10.00 C ATOM 468 CG ARG A 49 2.861 0.817 -14.008 1.00 10.00 C ATOM 469 CD ARG A 49 1.782 1.266 -13.034 1.00 10.00 C ATOM 470 NE ARG A 49 1.061 2.441 -13.518 1.00 10.00 N ATOM 471 CZ ARG A 49 -0.257 2.607 -13.407 1.00 10.00 C ATOM 472 NH1 ARG A 49 -0.995 1.697 -12.779 1.00 10.00 N ATOM 473 NH2 ARG A 49 -0.837 3.687 -13.918 1.00 10.00 N ATOM 0 H ARG A 49 4.802 -2.501 -13.968 1.00 10.00 H new ATOM 0 HA ARG A 49 5.002 -0.034 -12.715 1.00 10.00 H new ATOM 0 HB2 ARG A 49 3.578 -1.055 -14.746 1.00 10.00 H new ATOM 0 HB3 ARG A 49 2.341 -1.195 -13.513 1.00 10.00 H new ATOM 0 HG2 ARG A 49 3.746 1.442 -13.885 1.00 10.00 H new ATOM 0 HG3 ARG A 49 2.511 0.959 -15.030 1.00 10.00 H new ATOM 0 HD2 ARG A 49 1.078 0.450 -12.872 1.00 10.00 H new ATOM 0 HD3 ARG A 49 2.236 1.491 -12.069 1.00 10.00 H new ATOM 0 HE ARG A 49 1.600 3.180 -13.969 1.00 10.00 H new ATOM 0 HH11 ARG A 49 -0.553 0.869 -12.380 1.00 10.00 H new ATOM 0 HH12 ARG A 49 -2.003 1.827 -12.696 1.00 10.00 H new ATOM 0 HH21 ARG A 49 -0.274 4.390 -14.396 1.00 10.00 H new ATOM 0 HH22 ARG A 49 -1.846 3.813 -13.833 1.00 10.00 H new ATOM 480 N GLN A 50 2.973 -2.101 -11.122 1.00 10.00 N ATOM 481 CA GLN A 50 2.303 -2.316 -9.841 1.00 10.00 C ATOM 482 C GLN A 50 3.290 -2.478 -8.685 1.00 10.00 C ATOM 483 O GLN A 50 2.945 -2.244 -7.528 1.00 10.00 O ATOM 484 CB GLN A 50 1.331 -3.496 -9.913 1.00 10.00 C ATOM 485 CG GLN A 50 0.163 -3.279 -10.867 1.00 10.00 C ATOM 486 CD GLN A 50 -0.539 -1.948 -10.657 1.00 10.00 C ATOM 487 OE1 GLN A 50 -0.211 -0.948 -11.306 1.00 10.00 O ATOM 488 NE2 GLN A 50 -1.493 -1.919 -9.744 1.00 10.00 N ATOM 0 H GLN A 50 2.850 -2.856 -11.797 1.00 10.00 H new ATOM 0 HA GLN A 50 1.724 -1.416 -9.635 1.00 10.00 H new ATOM 0 HB2 GLN A 50 1.879 -4.386 -10.222 1.00 10.00 H new ATOM 0 HB3 GLN A 50 0.940 -3.693 -8.915 1.00 10.00 H new ATOM 0 HG2 GLN A 50 0.525 -3.334 -11.894 1.00 10.00 H new ATOM 0 HG3 GLN A 50 -0.557 -4.087 -10.740 1.00 10.00 H new ATOM 0 HE21 GLN A 50 -1.733 -2.767 -9.230 1.00 10.00 H new ATOM 0 HE22 GLN A 50 -1.989 -1.049 -9.553 1.00 10.00 H new ATOM 492 N VAL A 51 4.522 -2.854 -9.003 1.00 10.00 N ATOM 493 CA VAL A 51 5.555 -3.032 -7.982 1.00 10.00 C ATOM 494 C VAL A 51 5.857 -1.694 -7.320 1.00 10.00 C ATOM 495 O VAL A 51 6.031 -1.613 -6.107 1.00 10.00 O ATOM 496 CB VAL A 51 6.862 -3.608 -8.574 1.00 10.00 C ATOM 497 CG1 VAL A 51 7.887 -3.860 -7.479 1.00 10.00 C ATOM 498 CG2 VAL A 51 6.580 -4.889 -9.337 1.00 10.00 C ATOM 0 H VAL A 51 4.833 -3.042 -9.956 1.00 10.00 H new ATOM 0 HA VAL A 51 5.172 -3.743 -7.250 1.00 10.00 H new ATOM 0 HB VAL A 51 7.274 -2.873 -9.266 1.00 10.00 H new ATOM 0 HG11 VAL A 51 8.798 -4.265 -7.920 1.00 10.00 H new ATOM 0 HG12 VAL A 51 8.115 -2.923 -6.971 1.00 10.00 H new ATOM 0 HG13 VAL A 51 7.484 -4.573 -6.760 1.00 10.00 H new ATOM 0 HG21 VAL A 51 7.511 -5.281 -9.747 1.00 10.00 H new ATOM 0 HG22 VAL A 51 6.142 -5.625 -8.663 1.00 10.00 H new ATOM 0 HG23 VAL A 51 5.884 -4.683 -10.150 1.00 10.00 H new ATOM 500 N THR A 52 5.887 -0.647 -8.131 1.00 10.00 N ATOM 501 CA THR A 52 6.156 0.692 -7.636 1.00 10.00 C ATOM 502 C THR A 52 4.955 1.213 -6.845 1.00 10.00 C ATOM 503 O THR A 52 5.108 1.972 -5.884 1.00 10.00 O ATOM 504 CB THR A 52 6.485 1.645 -8.801 1.00 10.00 C ATOM 505 OG1 THR A 52 7.351 0.961 -9.720 1.00 10.00 O ATOM 506 CG2 THR A 52 7.185 2.895 -8.292 1.00 10.00 C ATOM 0 H THR A 52 5.728 -0.701 -9.137 1.00 10.00 H new ATOM 0 HA THR A 52 7.021 0.649 -6.974 1.00 10.00 H new ATOM 0 HB THR A 52 5.559 1.942 -9.293 1.00 10.00 H new ATOM 0 HG1 THR A 52 8.277 1.243 -9.568 1.00 10.00 H new ATOM 0 HG21 THR A 52 7.408 3.554 -9.131 1.00 10.00 H new ATOM 0 HG22 THR A 52 6.536 3.413 -7.586 1.00 10.00 H new ATOM 0 HG23 THR A 52 8.113 2.615 -7.794 1.00 10.00 H new ATOM 509 N ILE A 53 3.763 0.764 -7.234 1.00 10.00 N ATOM 510 CA ILE A 53 2.528 1.163 -6.569 1.00 10.00 C ATOM 511 C ILE A 53 2.489 0.609 -5.146 1.00 10.00 C ATOM 512 O ILE A 53 2.136 1.317 -4.200 1.00 10.00 O ATOM 513 CB ILE A 53 1.286 0.668 -7.347 1.00 10.00 C ATOM 514 CG1 ILE A 53 1.282 1.209 -8.782 1.00 10.00 C ATOM 515 CG2 ILE A 53 0.000 1.041 -6.622 1.00 10.00 C ATOM 516 CD1 ILE A 53 1.317 2.723 -8.882 1.00 10.00 C ATOM 0 H ILE A 53 3.628 0.119 -8.013 1.00 10.00 H new ATOM 0 HA ILE A 53 2.507 2.252 -6.538 1.00 10.00 H new ATOM 0 HB ILE A 53 1.338 -0.420 -7.398 1.00 10.00 H new ATOM 0 HG12 ILE A 53 2.143 0.802 -9.313 1.00 10.00 H new ATOM 0 HG13 ILE A 53 0.391 0.844 -9.292 1.00 10.00 H new ATOM 0 HG21 ILE A 53 -0.857 0.680 -7.192 1.00 10.00 H new ATOM 0 HG22 ILE A 53 -0.005 0.585 -5.632 1.00 10.00 H new ATOM 0 HG23 ILE A 53 -0.060 2.125 -6.523 1.00 10.00 H new ATOM 0 HD11 ILE A 53 1.312 3.019 -9.931 1.00 10.00 H new ATOM 0 HD12 ILE A 53 0.443 3.141 -8.383 1.00 10.00 H new ATOM 0 HD13 ILE A 53 2.222 3.098 -8.404 1.00 10.00 H new ATOM 518 N TRP A 54 2.869 -0.658 -4.996 1.00 10.00 N ATOM 519 CA TRP A 54 2.880 -1.303 -3.687 1.00 10.00 C ATOM 520 C TRP A 54 3.845 -0.604 -2.738 1.00 10.00 C ATOM 521 O TRP A 54 3.622 -0.570 -1.526 1.00 10.00 O ATOM 522 CB TRP A 54 3.223 -2.788 -3.807 1.00 10.00 C ATOM 523 CG TRP A 54 2.045 -3.683 -3.584 1.00 10.00 C ATOM 524 CD1 TRP A 54 1.497 -4.031 -2.382 1.00 10.00 C ATOM 525 CD2 TRP A 54 1.264 -4.344 -4.586 1.00 10.00 C ATOM 526 NE1 TRP A 54 0.427 -4.868 -2.574 1.00 10.00 N ATOM 527 CE2 TRP A 54 0.263 -5.077 -3.920 1.00 10.00 C ATOM 528 CE3 TRP A 54 1.312 -4.391 -5.983 1.00 10.00 C ATOM 529 CZ2 TRP A 54 -0.678 -5.844 -4.603 1.00 10.00 C ATOM 530 CZ3 TRP A 54 0.376 -5.150 -6.658 1.00 10.00 C ATOM 531 CH2 TRP A 54 -0.606 -5.868 -5.968 1.00 10.00 C ATOM 0 H TRP A 54 3.173 -1.257 -5.764 1.00 10.00 H new ATOM 0 HA TRP A 54 1.876 -1.220 -3.271 1.00 10.00 H new ATOM 0 HB2 TRP A 54 3.635 -2.980 -4.797 1.00 10.00 H new ATOM 0 HB3 TRP A 54 4.001 -3.035 -3.084 1.00 10.00 H new ATOM 0 HD1 TRP A 54 1.854 -3.696 -1.420 1.00 10.00 H new ATOM 0 HE1 TRP A 54 -0.152 -5.269 -1.836 1.00 10.00 H new ATOM 0 HE3 TRP A 54 2.068 -3.843 -6.525 1.00 10.00 H new ATOM 0 HZ2 TRP A 54 -1.437 -6.400 -4.073 1.00 10.00 H new ATOM 0 HZ3 TRP A 54 0.403 -5.190 -7.737 1.00 10.00 H new ATOM 0 HH2 TRP A 54 -1.322 -6.454 -6.525 1.00 10.00 H new ATOM 534 N PHE A 55 4.911 -0.038 -3.292 1.00 10.00 N ATOM 535 CA PHE A 55 5.894 0.679 -2.486 1.00 10.00 C ATOM 536 C PHE A 55 5.255 1.911 -1.857 1.00 10.00 C ATOM 537 O PHE A 55 5.455 2.194 -0.675 1.00 10.00 O ATOM 538 CB PHE A 55 7.117 1.066 -3.318 1.00 10.00 C ATOM 539 CG PHE A 55 8.278 0.133 -3.142 1.00 10.00 C ATOM 540 CD1 PHE A 55 9.135 0.270 -2.064 1.00 10.00 C ATOM 541 CD2 PHE A 55 8.510 -0.886 -4.052 1.00 10.00 C ATOM 542 CE1 PHE A 55 10.202 -0.590 -1.895 1.00 10.00 C ATOM 543 CE2 PHE A 55 9.576 -1.749 -3.891 1.00 10.00 C ATOM 544 CZ PHE A 55 10.421 -1.602 -2.811 1.00 10.00 C ATOM 0 H PHE A 55 5.117 -0.061 -4.291 1.00 10.00 H new ATOM 0 HA PHE A 55 6.235 0.016 -1.691 1.00 10.00 H new ATOM 0 HB2 PHE A 55 6.837 1.091 -4.371 1.00 10.00 H new ATOM 0 HB3 PHE A 55 7.427 2.075 -3.046 1.00 10.00 H new ATOM 0 HD1 PHE A 55 8.967 1.059 -1.346 1.00 10.00 H new ATOM 0 HD2 PHE A 55 7.849 -1.007 -4.898 1.00 10.00 H new ATOM 0 HE1 PHE A 55 10.864 -0.472 -1.050 1.00 10.00 H new ATOM 0 HE2 PHE A 55 9.748 -2.537 -4.609 1.00 10.00 H new ATOM 0 HZ PHE A 55 11.254 -2.277 -2.681 1.00 10.00 H new ATOM 546 N GLN A 56 4.467 2.626 -2.652 1.00 10.00 N ATOM 547 CA GLN A 56 3.773 3.814 -2.175 1.00 10.00 C ATOM 548 C GLN A 56 2.719 3.399 -1.156 1.00 10.00 C ATOM 549 O GLN A 56 2.507 4.069 -0.147 1.00 10.00 O ATOM 550 CB GLN A 56 3.098 4.539 -3.342 1.00 10.00 C ATOM 551 CG GLN A 56 4.054 5.029 -4.419 1.00 10.00 C ATOM 552 CD GLN A 56 3.405 5.081 -5.787 1.00 10.00 C ATOM 553 OE1 GLN A 56 2.532 4.278 -6.101 1.00 10.00 O ATOM 554 NE2 GLN A 56 3.822 6.030 -6.607 1.00 10.00 N ATOM 0 H GLN A 56 4.293 2.402 -3.632 1.00 10.00 H new ATOM 0 HA GLN A 56 4.493 4.489 -1.713 1.00 10.00 H new ATOM 0 HB2 GLN A 56 2.370 3.868 -3.798 1.00 10.00 H new ATOM 0 HB3 GLN A 56 2.543 5.392 -2.951 1.00 10.00 H new ATOM 0 HG2 GLN A 56 4.417 6.022 -4.154 1.00 10.00 H new ATOM 0 HG3 GLN A 56 4.923 4.371 -4.457 1.00 10.00 H new ATOM 0 HE21 GLN A 56 4.550 6.678 -6.308 1.00 10.00 H new ATOM 0 HE22 GLN A 56 3.415 6.114 -7.539 1.00 10.00 H new ATOM 558 N ASN A 57 2.083 2.266 -1.428 1.00 10.00 N ATOM 559 CA ASN A 57 1.050 1.720 -0.556 1.00 10.00 C ATOM 560 C ASN A 57 1.605 1.396 0.823 1.00 10.00 C ATOM 561 O ASN A 57 0.908 1.508 1.828 1.00 10.00 O ATOM 562 CB ASN A 57 0.452 0.458 -1.176 1.00 10.00 C ATOM 563 CG ASN A 57 -0.849 0.732 -1.889 1.00 10.00 C ATOM 564 OD1 ASN A 57 -1.656 1.541 -1.435 1.00 10.00 O ATOM 565 ND2 ASN A 57 -1.068 0.062 -3.006 1.00 10.00 N ATOM 0 H ASN A 57 2.268 1.701 -2.257 1.00 10.00 H new ATOM 0 HA ASN A 57 0.273 2.477 -0.445 1.00 10.00 H new ATOM 0 HB2 ASN A 57 1.165 0.028 -1.879 1.00 10.00 H new ATOM 0 HB3 ASN A 57 0.287 -0.284 -0.395 1.00 10.00 H new ATOM 0 HD21 ASN A 57 -1.933 0.207 -3.526 1.00 10.00 H new ATOM 0 HD22 ASN A 57 -0.372 -0.600 -3.348 1.00 10.00 H new ATOM 569 N ARG A 58 2.870 1.000 0.869 1.00 10.00 N ATOM 570 CA ARG A 58 3.513 0.665 2.132 1.00 10.00 C ATOM 571 C ARG A 58 3.623 1.889 3.038 1.00 10.00 C ATOM 572 O ARG A 58 3.629 1.763 4.259 1.00 10.00 O ATOM 573 CB ARG A 58 4.887 0.040 1.901 1.00 10.00 C ATOM 574 CG ARG A 58 5.026 -1.357 2.480 1.00 10.00 C ATOM 575 CD ARG A 58 6.282 -1.488 3.325 1.00 10.00 C ATOM 576 NE ARG A 58 6.285 -0.559 4.459 1.00 10.00 N ATOM 577 CZ ARG A 58 6.689 -0.882 5.689 1.00 10.00 C ATOM 578 NH1 ARG A 58 7.073 -2.126 5.962 1.00 10.00 N ATOM 579 NH2 ARG A 58 6.705 0.042 6.641 1.00 10.00 N ATOM 0 H ARG A 58 3.469 0.903 0.049 1.00 10.00 H new ATOM 0 HA ARG A 58 2.886 -0.071 2.635 1.00 10.00 H new ATOM 0 HB2 ARG A 58 5.083 0.001 0.830 1.00 10.00 H new ATOM 0 HB3 ARG A 58 5.648 0.684 2.341 1.00 10.00 H new ATOM 0 HG2 ARG A 58 4.152 -1.588 3.088 1.00 10.00 H new ATOM 0 HG3 ARG A 58 5.053 -2.086 1.670 1.00 10.00 H new ATOM 0 HD2 ARG A 58 6.364 -2.510 3.694 1.00 10.00 H new ATOM 0 HD3 ARG A 58 7.158 -1.302 2.703 1.00 10.00 H new ATOM 0 HE ARG A 58 5.958 0.394 4.298 1.00 10.00 H new ATOM 0 HH11 ARG A 58 7.059 -2.836 5.230 1.00 10.00 H new ATOM 0 HH12 ARG A 58 7.381 -2.370 6.903 1.00 10.00 H new ATOM 0 HH21 ARG A 58 6.409 0.995 6.431 1.00 10.00 H new ATOM 0 HH22 ARG A 58 7.013 -0.201 7.582 1.00 10.00 H new ATOM 586 N ARG A 59 3.687 3.069 2.427 1.00 10.00 N ATOM 587 CA ARG A 59 3.786 4.316 3.175 1.00 10.00 C ATOM 588 C ARG A 59 2.495 4.595 3.942 1.00 10.00 C ATOM 589 O ARG A 59 2.521 5.108 5.060 1.00 10.00 O ATOM 590 CB ARG A 59 4.127 5.483 2.245 1.00 10.00 C ATOM 591 CG ARG A 59 5.607 5.588 1.899 1.00 10.00 C ATOM 592 CD ARG A 59 6.312 6.617 2.772 1.00 10.00 C ATOM 593 NE ARG A 59 6.262 6.283 4.199 1.00 10.00 N ATOM 594 CZ ARG A 59 5.581 6.986 5.109 1.00 10.00 C ATOM 595 NH1 ARG A 59 4.866 8.044 4.737 1.00 10.00 N ATOM 596 NH2 ARG A 59 5.605 6.624 6.386 1.00 10.00 N ATOM 0 H ARG A 59 3.672 3.186 1.414 1.00 10.00 H new ATOM 0 HA ARG A 59 4.594 4.211 3.899 1.00 10.00 H new ATOM 0 HB2 ARG A 59 3.555 5.378 1.323 1.00 10.00 H new ATOM 0 HB3 ARG A 59 3.807 6.413 2.714 1.00 10.00 H new ATOM 0 HG2 ARG A 59 6.081 4.615 2.026 1.00 10.00 H new ATOM 0 HG3 ARG A 59 5.718 5.862 0.850 1.00 10.00 H new ATOM 0 HD2 ARG A 59 7.353 6.700 2.459 1.00 10.00 H new ATOM 0 HD3 ARG A 59 5.854 7.594 2.616 1.00 10.00 H new ATOM 0 HE ARG A 59 6.779 5.463 4.517 1.00 10.00 H new ATOM 0 HH11 ARG A 59 4.837 8.320 3.756 1.00 10.00 H new ATOM 0 HH12 ARG A 59 4.347 8.579 5.433 1.00 10.00 H new ATOM 0 HH21 ARG A 59 6.144 5.808 6.675 1.00 10.00 H new ATOM 0 HH22 ARG A 59 5.084 7.162 7.079 1.00 10.00 H new ATOM 603 N VAL A 60 1.362 4.234 3.351 1.00 10.00 N ATOM 604 CA VAL A 60 0.079 4.445 4.005 1.00 10.00 C ATOM 605 C VAL A 60 -0.229 3.292 4.965 1.00 10.00 C ATOM 606 O VAL A 60 -1.034 3.428 5.886 1.00 10.00 O ATOM 607 CB VAL A 60 -1.074 4.657 2.993 1.00 10.00 C ATOM 608 CG1 VAL A 60 -1.540 3.346 2.376 1.00 10.00 C ATOM 609 CG2 VAL A 60 -2.230 5.407 3.639 1.00 10.00 C ATOM 0 H VAL A 60 1.306 3.799 2.430 1.00 10.00 H new ATOM 0 HA VAL A 60 0.157 5.367 4.582 1.00 10.00 H new ATOM 0 HB VAL A 60 -0.685 5.269 2.179 1.00 10.00 H new ATOM 0 HG11 VAL A 60 -2.349 3.542 1.673 1.00 10.00 H new ATOM 0 HG12 VAL A 60 -0.709 2.875 1.851 1.00 10.00 H new ATOM 0 HG13 VAL A 60 -1.896 2.680 3.162 1.00 10.00 H new ATOM 0 HG21 VAL A 60 -3.028 5.544 2.909 1.00 10.00 H new ATOM 0 HG22 VAL A 60 -2.607 4.834 4.486 1.00 10.00 H new ATOM 0 HG23 VAL A 60 -1.884 6.381 3.985 1.00 10.00 H new ATOM 611 N LYS A 61 0.439 2.165 4.744 1.00 10.00 N ATOM 612 CA LYS A 61 0.265 0.985 5.585 1.00 10.00 C ATOM 613 C LYS A 61 0.710 1.275 7.012 1.00 10.00 C ATOM 614 O LYS A 61 -0.013 0.993 7.968 1.00 10.00 O ATOM 615 CB LYS A 61 1.073 -0.191 5.027 1.00 10.00 C ATOM 616 CG LYS A 61 0.382 -0.951 3.910 1.00 10.00 C ATOM 617 CD LYS A 61 -0.439 -2.110 4.453 1.00 10.00 C ATOM 618 CE LYS A 61 -0.811 -3.082 3.348 1.00 10.00 C ATOM 619 NZ LYS A 61 -1.338 -4.368 3.875 1.00 10.00 N ATOM 0 H LYS A 61 1.110 2.043 3.985 1.00 10.00 H new ATOM 0 HA LYS A 61 -0.793 0.724 5.589 1.00 10.00 H new ATOM 0 HB2 LYS A 61 2.029 0.182 4.659 1.00 10.00 H new ATOM 0 HB3 LYS A 61 1.293 -0.883 5.840 1.00 10.00 H new ATOM 0 HG2 LYS A 61 -0.266 -0.274 3.353 1.00 10.00 H new ATOM 0 HG3 LYS A 61 1.127 -1.328 3.209 1.00 10.00 H new ATOM 0 HD2 LYS A 61 0.128 -2.631 5.224 1.00 10.00 H new ATOM 0 HD3 LYS A 61 -1.344 -1.728 4.926 1.00 10.00 H new ATOM 0 HE2 LYS A 61 -1.560 -2.624 2.702 1.00 10.00 H new ATOM 0 HE3 LYS A 61 0.066 -3.278 2.731 1.00 10.00 H new ATOM 0 HZ1 LYS A 61 -1.577 -4.996 3.082 1.00 10.00 H new ATOM 0 HZ2 LYS A 61 -0.616 -4.821 4.470 1.00 10.00 H new ATOM 0 HZ3 LYS A 61 -2.191 -4.187 4.443 1.00 10.00 H new ATOM 624 N GLU A 62 1.903 1.845 7.144 1.00 10.00 N ATOM 625 CA GLU A 62 2.450 2.179 8.452 1.00 10.00 C ATOM 626 C GLU A 62 1.610 3.247 9.144 1.00 10.00 C ATOM 627 O GLU A 62 1.461 3.236 10.367 1.00 10.00 O ATOM 628 CB GLU A 62 3.921 2.596 8.347 1.00 10.00 C ATOM 629 CG GLU A 62 4.236 3.510 7.174 1.00 10.00 C ATOM 630 CD GLU A 62 5.679 3.401 6.725 1.00 10.00 C ATOM 631 OE1 GLU A 62 5.994 2.488 5.939 1.00 10.00 O ATOM 632 OE2 GLU A 62 6.512 4.228 7.160 1.00 10.00 O ATOM 0 H GLU A 62 2.509 2.085 6.360 1.00 10.00 H new ATOM 0 HA GLU A 62 2.410 1.282 9.071 1.00 10.00 H new ATOM 0 HB2 GLU A 62 4.210 3.098 9.270 1.00 10.00 H new ATOM 0 HB3 GLU A 62 4.535 1.699 8.267 1.00 10.00 H new ATOM 0 HG2 GLU A 62 3.580 3.264 6.339 1.00 10.00 H new ATOM 0 HG3 GLU A 62 4.023 4.542 7.454 1.00 10.00 H new ATOM 634 N LYS A 63 1.040 4.151 8.350 1.00 10.00 N ATOM 635 CA LYS A 63 0.194 5.219 8.879 1.00 10.00 C ATOM 636 C LYS A 63 -1.048 4.619 9.531 1.00 10.00 C ATOM 637 O LYS A 63 -1.501 5.077 10.580 1.00 10.00 O ATOM 638 CB LYS A 63 -0.209 6.192 7.762 1.00 10.00 C ATOM 639 CG LYS A 63 -1.005 7.402 8.235 1.00 10.00 C ATOM 640 CD LYS A 63 -1.490 8.246 7.062 1.00 10.00 C ATOM 641 CE LYS A 63 -2.327 9.428 7.534 1.00 10.00 C ATOM 642 NZ LYS A 63 -2.843 10.238 6.395 1.00 10.00 N ATOM 0 H LYS A 63 1.149 4.165 7.336 1.00 10.00 H new ATOM 0 HA LYS A 63 0.758 5.774 9.629 1.00 10.00 H new ATOM 0 HB2 LYS A 63 0.693 6.540 7.258 1.00 10.00 H new ATOM 0 HB3 LYS A 63 -0.799 5.651 7.022 1.00 10.00 H new ATOM 0 HG2 LYS A 63 -1.860 7.069 8.823 1.00 10.00 H new ATOM 0 HG3 LYS A 63 -0.385 8.012 8.892 1.00 10.00 H new ATOM 0 HD2 LYS A 63 -0.633 8.609 6.495 1.00 10.00 H new ATOM 0 HD3 LYS A 63 -2.081 7.627 6.387 1.00 10.00 H new ATOM 0 HE2 LYS A 63 -3.165 9.064 8.129 1.00 10.00 H new ATOM 0 HE3 LYS A 63 -1.725 10.061 8.186 1.00 10.00 H new ATOM 0 HZ1 LYS A 63 -3.407 11.032 6.761 1.00 10.00 H new ATOM 0 HZ2 LYS A 63 -2.044 10.607 5.841 1.00 10.00 H new ATOM 0 HZ3 LYS A 63 -3.439 9.641 5.787 1.00 10.00 H new ATOM 647 N LYS A 64 -1.574 3.573 8.902 1.00 10.00 N ATOM 648 CA LYS A 64 -2.753 2.881 9.401 1.00 10.00 C ATOM 649 C LYS A 64 -2.465 2.215 10.746 1.00 10.00 C ATOM 650 O LYS A 64 -3.314 2.198 11.640 1.00 10.00 O ATOM 651 CB LYS A 64 -3.217 1.842 8.372 1.00 10.00 C ATOM 652 CG LYS A 64 -4.209 0.819 8.898 1.00 10.00 C ATOM 653 CD LYS A 64 -3.707 -0.596 8.658 1.00 10.00 C ATOM 654 CE LYS A 64 -4.562 -1.615 9.389 1.00 10.00 C ATOM 655 NZ LYS A 64 -4.137 -3.008 9.096 1.00 10.00 N ATOM 0 H LYS A 64 -1.197 3.184 8.038 1.00 10.00 H new ATOM 0 HA LYS A 64 -3.549 3.610 9.554 1.00 10.00 H new ATOM 0 HB2 LYS A 64 -3.669 2.364 7.529 1.00 10.00 H new ATOM 0 HB3 LYS A 64 -2.343 1.315 7.990 1.00 10.00 H new ATOM 0 HG2 LYS A 64 -4.369 0.976 9.965 1.00 10.00 H new ATOM 0 HG3 LYS A 64 -5.173 0.955 8.408 1.00 10.00 H new ATOM 0 HD2 LYS A 64 -3.715 -0.811 7.589 1.00 10.00 H new ATOM 0 HD3 LYS A 64 -2.673 -0.679 8.992 1.00 10.00 H new ATOM 0 HE2 LYS A 64 -4.502 -1.436 10.462 1.00 10.00 H new ATOM 0 HE3 LYS A 64 -5.606 -1.486 9.102 1.00 10.00 H new ATOM 0 HZ1 LYS A 64 -4.746 -3.673 9.614 1.00 10.00 H new ATOM 0 HZ2 LYS A 64 -4.218 -3.188 8.075 1.00 10.00 H new ATOM 0 HZ3 LYS A 64 -3.149 -3.139 9.393 1.00 10.00 H new ATOM 660 N VAL A 65 -1.259 1.681 10.891 1.00 10.00 N ATOM 661 CA VAL A 65 -0.861 1.015 12.128 1.00 10.00 C ATOM 662 C VAL A 65 -0.784 2.015 13.281 1.00 10.00 C ATOM 663 O VAL A 65 -1.263 1.745 14.385 1.00 10.00 O ATOM 664 CB VAL A 65 0.494 0.291 11.978 1.00 10.00 C ATOM 665 CG1 VAL A 65 0.855 -0.461 13.253 1.00 10.00 C ATOM 666 CG2 VAL A 65 0.468 -0.655 10.788 1.00 10.00 C ATOM 0 H VAL A 65 -0.539 1.695 10.169 1.00 10.00 H new ATOM 0 HA VAL A 65 -1.624 0.269 12.349 1.00 10.00 H new ATOM 0 HB VAL A 65 1.261 1.045 11.802 1.00 10.00 H new ATOM 0 HG11 VAL A 65 1.814 -0.962 13.121 1.00 10.00 H new ATOM 0 HG12 VAL A 65 0.925 0.242 14.083 1.00 10.00 H new ATOM 0 HG13 VAL A 65 0.085 -1.202 13.469 1.00 10.00 H new ATOM 0 HG21 VAL A 65 1.432 -1.155 10.700 1.00 10.00 H new ATOM 0 HG22 VAL A 65 -0.315 -1.399 10.932 1.00 10.00 H new ATOM 0 HG23 VAL A 65 0.268 -0.089 9.878 1.00 10.00 H new ATOM 668 N ILE A 66 -0.195 3.175 13.014 1.00 10.00 N ATOM 669 CA ILE A 66 -0.055 4.223 14.025 1.00 10.00 C ATOM 670 C ILE A 66 -1.426 4.742 14.457 1.00 10.00 C ATOM 671 O ILE A 66 -1.635 5.096 15.621 1.00 10.00 O ATOM 672 CB ILE A 66 0.807 5.396 13.510 1.00 10.00 C ATOM 673 CG1 ILE A 66 2.156 4.880 13.007 1.00 10.00 C ATOM 674 CG2 ILE A 66 1.013 6.436 14.603 1.00 10.00 C ATOM 675 CD1 ILE A 66 2.986 5.926 12.294 1.00 10.00 C ATOM 0 H ILE A 66 0.195 3.417 12.103 1.00 10.00 H new ATOM 0 HA ILE A 66 0.448 3.780 14.884 1.00 10.00 H new ATOM 0 HB ILE A 66 0.281 5.871 12.682 1.00 10.00 H new ATOM 0 HG12 ILE A 66 2.725 4.494 13.853 1.00 10.00 H new ATOM 0 HG13 ILE A 66 1.984 4.043 12.330 1.00 10.00 H new ATOM 0 HG21 ILE A 66 1.623 7.253 14.218 1.00 10.00 H new ATOM 0 HG22 ILE A 66 0.046 6.825 14.922 1.00 10.00 H new ATOM 0 HG23 ILE A 66 1.518 5.976 15.453 1.00 10.00 H new ATOM 0 HD11 ILE A 66 3.927 5.483 11.968 1.00 10.00 H new ATOM 0 HD12 ILE A 66 2.439 6.296 11.427 1.00 10.00 H new ATOM 0 HD13 ILE A 66 3.191 6.753 12.974 1.00 10.00 H new ATOM 677 N ASN A 67 -2.355 4.775 13.510 1.00 10.00 N ATOM 678 CA ASN A 67 -3.711 5.238 13.774 1.00 10.00 C ATOM 679 C ASN A 67 -4.465 4.227 14.638 1.00 10.00 C ATOM 680 O ASN A 67 -5.287 4.596 15.477 1.00 10.00 O ATOM 681 CB ASN A 67 -4.459 5.469 12.454 1.00 10.00 C ATOM 682 CG ASN A 67 -5.832 6.095 12.648 1.00 10.00 C ATOM 683 OD1 ASN A 67 -6.051 6.883 13.570 1.00 10.00 O ATOM 684 ND2 ASN A 67 -6.767 5.761 11.769 1.00 10.00 N ATOM 0 H ASN A 67 -2.192 4.484 12.546 1.00 10.00 H new ATOM 0 HA ASN A 67 -3.654 6.182 14.316 1.00 10.00 H new ATOM 0 HB2 ASN A 67 -3.860 6.114 11.812 1.00 10.00 H new ATOM 0 HB3 ASN A 67 -4.570 4.517 11.935 1.00 10.00 H new ATOM 0 HD21 ASN A 67 -7.703 6.160 11.844 1.00 10.00 H new ATOM 0 HD22 ASN A 67 -6.550 5.105 11.018 1.00 10.00 H new ATOM 688 N LYS A 68 -4.176 2.947 14.431 1.00 10.00 N ATOM 689 CA LYS A 68 -4.820 1.888 15.195 1.00 10.00 C ATOM 690 C LYS A 68 -4.249 1.817 16.606 1.00 10.00 C ATOM 691 O LYS A 68 -4.959 1.493 17.562 1.00 10.00 O ATOM 692 CB LYS A 68 -4.668 0.537 14.493 1.00 10.00 C ATOM 693 CG LYS A 68 -5.974 -0.229 14.344 1.00 10.00 C ATOM 694 CD LYS A 68 -6.963 0.541 13.483 1.00 10.00 C ATOM 695 CE LYS A 68 -8.357 -0.054 13.567 1.00 10.00 C ATOM 696 NZ LYS A 68 -9.254 0.509 12.527 1.00 10.00 N ATOM 0 H LYS A 68 -3.500 2.619 13.741 1.00 10.00 H new ATOM 0 HA LYS A 68 -5.882 2.122 15.262 1.00 10.00 H new ATOM 0 HB2 LYS A 68 -4.238 0.698 13.505 1.00 10.00 H new ATOM 0 HB3 LYS A 68 -3.961 -0.075 15.053 1.00 10.00 H new ATOM 0 HG2 LYS A 68 -5.779 -1.204 13.897 1.00 10.00 H new ATOM 0 HG3 LYS A 68 -6.407 -0.411 15.328 1.00 10.00 H new ATOM 0 HD2 LYS A 68 -6.991 1.583 13.803 1.00 10.00 H new ATOM 0 HD3 LYS A 68 -6.626 0.535 12.446 1.00 10.00 H new ATOM 0 HE2 LYS A 68 -8.299 -1.136 13.451 1.00 10.00 H new ATOM 0 HE3 LYS A 68 -8.777 0.139 14.554 1.00 10.00 H new ATOM 0 HZ1 LYS A 68 -10.198 0.081 12.614 1.00 10.00 H new ATOM 0 HZ2 LYS A 68 -9.328 1.539 12.653 1.00 10.00 H new ATOM 0 HZ3 LYS A 68 -8.865 0.303 11.585 1.00 10.00 H new ATOM 701 N LEU A 69 -2.964 2.133 16.732 1.00 10.00 N ATOM 702 CA LEU A 69 -2.292 2.121 18.021 1.00 10.00 C ATOM 703 C LEU A 69 -2.663 3.369 18.817 1.00 10.00 C ATOM 704 O LEU A 69 -1.829 4.239 19.076 1.00 10.00 O ATOM 705 CB LEU A 69 -0.775 2.042 17.829 1.00 10.00 C ATOM 706 CG LEU A 69 0.043 1.627 19.055 1.00 10.00 C ATOM 707 CD1 LEU A 69 -0.229 0.175 19.416 1.00 10.00 C ATOM 708 CD2 LEU A 69 1.523 1.854 18.806 1.00 10.00 C ATOM 0 H LEU A 69 -2.367 2.402 15.950 1.00 10.00 H new ATOM 0 HA LEU A 69 -2.616 1.242 18.578 1.00 10.00 H new ATOM 0 HB2 LEU A 69 -0.568 1.336 17.025 1.00 10.00 H new ATOM 0 HB3 LEU A 69 -0.421 3.018 17.496 1.00 10.00 H new ATOM 0 HG LEU A 69 -0.261 2.247 19.899 1.00 10.00 H new ATOM 0 HD11 LEU A 69 0.362 -0.100 20.290 1.00 10.00 H new ATOM 0 HD12 LEU A 69 -1.288 0.048 19.640 1.00 10.00 H new ATOM 0 HD13 LEU A 69 0.044 -0.466 18.577 1.00 10.00 H new ATOM 0 HD21 LEU A 69 2.090 1.554 19.687 1.00 10.00 H new ATOM 0 HD22 LEU A 69 1.843 1.261 17.949 1.00 10.00 H new ATOM 0 HD23 LEU A 69 1.700 2.910 18.603 1.00 10.00 H new ATOM 710 N LYS A 70 -3.938 3.455 19.171 1.00 10.00 N ATOM 711 CA LYS A 70 -4.464 4.582 19.928 1.00 10.00 C ATOM 712 C LYS A 70 -5.504 4.095 20.929 1.00 10.00 C ATOM 713 O LYS A 70 -5.569 4.582 22.060 1.00 10.00 O ATOM 714 CB LYS A 70 -5.111 5.607 18.986 1.00 10.00 C ATOM 715 CG LYS A 70 -4.136 6.338 18.076 1.00 10.00 C ATOM 716 CD LYS A 70 -3.335 7.377 18.839 1.00 10.00 C ATOM 717 CE LYS A 70 -2.186 7.916 18.002 1.00 10.00 C ATOM 718 NZ LYS A 70 -1.130 6.890 17.781 1.00 10.00 N ATOM 0 H LYS A 70 -4.635 2.747 18.942 1.00 10.00 H new ATOM 0 HA LYS A 70 -3.638 5.056 20.458 1.00 10.00 H new ATOM 0 HB2 LYS A 70 -5.850 5.097 18.369 1.00 10.00 H new ATOM 0 HB3 LYS A 70 -5.649 6.342 19.585 1.00 10.00 H new ATOM 0 HG2 LYS A 70 -3.457 5.620 17.616 1.00 10.00 H new ATOM 0 HG3 LYS A 70 -4.684 6.821 17.267 1.00 10.00 H new ATOM 0 HD2 LYS A 70 -3.989 8.198 19.134 1.00 10.00 H new ATOM 0 HD3 LYS A 70 -2.944 6.936 19.756 1.00 10.00 H new ATOM 0 HE2 LYS A 70 -2.567 8.258 17.040 1.00 10.00 H new ATOM 0 HE3 LYS A 70 -1.751 8.783 18.499 1.00 10.00 H new ATOM 0 HZ1 LYS A 70 -0.194 7.341 17.820 1.00 10.00 H new ATOM 0 HZ2 LYS A 70 -1.194 6.161 18.520 1.00 10.00 H new ATOM 0 HZ3 LYS A 70 -1.264 6.450 16.848 1.00 10.00 H new ATOM 723 N THR A 71 -6.318 3.132 20.494 1.00 10.00 N ATOM 724 CA THR A 71 -7.372 2.560 21.330 1.00 10.00 C ATOM 725 C THR A 71 -8.319 3.649 21.841 1.00 10.00 C ATOM 726 O THR A 71 -8.673 3.688 23.019 1.00 10.00 O ATOM 727 CB THR A 71 -6.789 1.754 22.511 1.00 10.00 C ATOM 728 OG1 THR A 71 -5.570 1.118 22.094 1.00 10.00 O ATOM 729 CG2 THR A 71 -7.776 0.684 22.953 1.00 10.00 C ATOM 0 H THR A 71 -6.265 2.729 19.558 1.00 10.00 H new ATOM 0 HA THR A 71 -7.941 1.872 20.705 1.00 10.00 H new ATOM 0 HB THR A 71 -6.596 2.432 23.342 1.00 10.00 H new ATOM 0 HG1 THR A 71 -5.196 0.607 22.841 1.00 10.00 H new ATOM 0 HG21 THR A 71 -7.354 0.122 23.786 1.00 10.00 H new ATOM 0 HG22 THR A 71 -8.707 1.155 23.268 1.00 10.00 H new ATOM 0 HG23 THR A 71 -7.975 0.007 22.122 1.00 10.00 H new ATOM 732 N THR A 72 -8.711 4.542 20.942 1.00 10.00 N ATOM 733 CA THR A 72 -9.605 5.634 21.292 1.00 10.00 C ATOM 734 C THR A 72 -11.054 5.269 20.981 1.00 10.00 C ATOM 735 O THR A 72 -11.975 6.024 21.284 1.00 10.00 O ATOM 736 CB THR A 72 -9.211 6.941 20.558 1.00 10.00 C ATOM 737 OG1 THR A 72 -10.016 8.034 21.021 1.00 10.00 O ATOM 738 CG2 THR A 72 -9.357 6.791 19.050 1.00 10.00 C ATOM 0 H THR A 72 -8.423 4.530 19.964 1.00 10.00 H new ATOM 0 HA THR A 72 -9.511 5.806 22.364 1.00 10.00 H new ATOM 0 HB THR A 72 -8.164 7.147 20.781 1.00 10.00 H new ATOM 0 HG1 THR A 72 -10.872 7.692 21.354 1.00 10.00 H new ATOM 0 HG21 THR A 72 -9.074 7.724 18.562 1.00 10.00 H new ATOM 0 HG22 THR A 72 -8.709 5.987 18.700 1.00 10.00 H new ATOM 0 HG23 THR A 72 -10.393 6.555 18.806 1.00 10.00 H new ATOM 741 N SER A 73 -11.247 4.097 20.393 1.00 10.00 N ATOM 742 CA SER A 73 -12.572 3.630 20.035 1.00 10.00 C ATOM 743 C SER A 73 -12.895 2.343 20.781 1.00 10.00 C ATOM 744 O SER A 73 -13.825 2.350 21.611 1.00 10.00 O ATOM 745 CB SER A 73 -12.658 3.409 18.524 1.00 10.00 C ATOM 746 OG SER A 73 -12.169 4.544 17.824 1.00 10.00 O ATOM 747 OXT SER A 73 -12.204 1.331 20.546 1.00 10.00 O ATOM 0 H SER A 73 -10.495 3.451 20.154 1.00 10.00 H new ATOM 0 HA SER A 73 -13.303 4.387 20.319 1.00 10.00 H new ATOM 0 HB2 SER A 73 -12.080 2.527 18.247 1.00 10.00 H new ATOM 0 HB3 SER A 73 -13.692 3.216 18.238 1.00 10.00 H new ATOM 0 HG SER A 73 -12.230 4.384 16.859 1.00 10.00 H new