USER MOD reduce.3.24.130724 H: found=0, std=0, add=706, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 702 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 1 GLY N :NH3+ 160:sc= -0.616 (180deg=-0.906) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -7:sc= 1.09 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 ASN : amide:sc= -4.87! C(o=-4.9!,f=-6.9!) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 TYR OH : rot 0:sc= -2.87! USER MOD Single : A 27 ASN : amide:sc= -0.0016 K(o=-0.0016,f=-0.74) USER MOD Single : A 34 TYR OH : rot 180:sc=-0.00659 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 180:sc=-0.00584 USER MOD Single : A 47 THR OG1 : rot -111:sc= 1.2 USER MOD Single : A 57 ASN : amide:sc= -0.65 K(o=-0.65,f=-2.2) USER MOD Single : A 59 ASN : amide:sc= -5.74! C(o=-5.7!,f=-14!) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 TYR OH : rot 165:sc= 1.32 USER MOD Single : A 64 HIS : no HD1:sc= -0.124 X(o=-0.12,f=-0.12) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 HIS : no HD1:sc= 0 X(o=0,f=-0.00052) USER MOD Single : A 78 MET CE :methyl 135:sc= -1.69 (180deg=-2.82!) USER MOD Single : A 82 ASN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 83 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.140 13.515 -11.304 1.00 0.00 N ATOM 2 CA GLY A 1 0.780 13.863 -10.927 1.00 0.00 C ATOM 3 C GLY A 1 -0.103 14.042 -12.163 1.00 0.00 C ATOM 4 O GLY A 1 0.120 14.951 -12.962 1.00 0.00 O ATOM 0 H1 GLY A 1 2.784 13.726 -10.515 1.00 0.00 H new ATOM 0 H2 GLY A 1 2.189 12.501 -11.529 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.421 14.068 -12.138 1.00 0.00 H new ATOM 0 HA2 GLY A 1 0.365 13.083 -10.289 1.00 0.00 H new ATOM 0 HA3 GLY A 1 0.785 14.783 -10.343 1.00 0.00 H new ATOM 8 N SER A 2 -1.085 13.162 -12.282 1.00 0.00 N ATOM 9 CA SER A 2 -2.003 13.213 -13.408 1.00 0.00 C ATOM 10 C SER A 2 -1.220 13.195 -14.723 1.00 0.00 C ATOM 11 O SER A 2 -0.876 14.248 -15.258 1.00 0.00 O ATOM 12 CB SER A 2 -2.894 14.454 -13.338 1.00 0.00 C ATOM 13 OG SER A 2 -3.865 14.357 -12.298 1.00 0.00 O ATOM 0 H SER A 2 -1.266 12.409 -11.618 1.00 0.00 H new ATOM 0 HA SER A 2 -2.647 12.335 -13.363 1.00 0.00 H new ATOM 0 HB2 SER A 2 -2.275 15.336 -13.175 1.00 0.00 H new ATOM 0 HB3 SER A 2 -3.399 14.592 -14.294 1.00 0.00 H new ATOM 0 HG SER A 2 -4.413 15.169 -12.285 1.00 0.00 H new ATOM 19 N SER A 3 -0.960 11.988 -15.204 1.00 0.00 N ATOM 20 CA SER A 3 -0.224 11.820 -16.445 1.00 0.00 C ATOM 21 C SER A 3 1.183 12.402 -16.302 1.00 0.00 C ATOM 22 O SER A 3 1.382 13.605 -16.471 1.00 0.00 O ATOM 23 CB SER A 3 -0.957 12.482 -17.614 1.00 0.00 C ATOM 24 OG SER A 3 -2.272 11.961 -17.784 1.00 0.00 O ATOM 0 H SER A 3 -1.246 11.117 -14.756 1.00 0.00 H new ATOM 0 HA SER A 3 -0.149 10.753 -16.656 1.00 0.00 H new ATOM 0 HB2 SER A 3 -1.012 13.557 -17.445 1.00 0.00 H new ATOM 0 HB3 SER A 3 -0.387 12.333 -18.531 1.00 0.00 H new ATOM 0 HG SER A 3 -2.707 12.410 -18.539 1.00 0.00 H new ATOM 30 N GLY A 4 2.125 11.523 -15.992 1.00 0.00 N ATOM 31 CA GLY A 4 3.508 11.935 -15.824 1.00 0.00 C ATOM 32 C GLY A 4 4.193 11.119 -14.727 1.00 0.00 C ATOM 33 O GLY A 4 5.023 10.257 -15.015 1.00 0.00 O ATOM 0 H GLY A 4 1.957 10.527 -15.853 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.045 11.810 -16.764 1.00 0.00 H new ATOM 0 HA3 GLY A 4 3.548 12.995 -15.572 1.00 0.00 H new ATOM 37 N SER A 5 3.823 11.420 -13.491 1.00 0.00 N ATOM 38 CA SER A 5 4.392 10.725 -12.348 1.00 0.00 C ATOM 39 C SER A 5 3.321 9.872 -11.668 1.00 0.00 C ATOM 40 O SER A 5 2.135 10.005 -11.966 1.00 0.00 O ATOM 41 CB SER A 5 4.997 11.713 -11.349 1.00 0.00 C ATOM 42 OG SER A 5 6.376 11.965 -11.614 1.00 0.00 O ATOM 0 H SER A 5 3.136 12.136 -13.256 1.00 0.00 H new ATOM 0 HA SER A 5 5.191 10.076 -12.705 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.443 12.651 -11.387 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.888 11.319 -10.339 1.00 0.00 H new ATOM 0 HG SER A 5 6.725 12.602 -10.956 1.00 0.00 H new ATOM 48 N SER A 6 3.777 9.013 -10.769 1.00 0.00 N ATOM 49 CA SER A 6 2.872 8.137 -10.044 1.00 0.00 C ATOM 50 C SER A 6 3.565 7.585 -8.797 1.00 0.00 C ATOM 51 O SER A 6 4.230 6.552 -8.858 1.00 0.00 O ATOM 52 CB SER A 6 2.386 6.991 -10.932 1.00 0.00 C ATOM 53 OG SER A 6 1.540 7.451 -11.983 1.00 0.00 O ATOM 0 H SER A 6 4.762 8.905 -10.526 1.00 0.00 H new ATOM 0 HA SER A 6 2.002 8.720 -9.741 1.00 0.00 H new ATOM 0 HB2 SER A 6 3.245 6.474 -11.359 1.00 0.00 H new ATOM 0 HB3 SER A 6 1.846 6.265 -10.324 1.00 0.00 H new ATOM 0 HG SER A 6 1.353 8.405 -11.859 1.00 0.00 H new ATOM 59 N GLY A 7 3.386 8.297 -7.694 1.00 0.00 N ATOM 60 CA GLY A 7 3.985 7.892 -6.434 1.00 0.00 C ATOM 61 C GLY A 7 2.958 7.200 -5.536 1.00 0.00 C ATOM 62 O GLY A 7 3.206 6.105 -5.032 1.00 0.00 O ATOM 0 H GLY A 7 2.834 9.153 -7.647 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.820 7.218 -6.624 1.00 0.00 H new ATOM 0 HA3 GLY A 7 4.391 8.765 -5.923 1.00 0.00 H new ATOM 66 N LEU A 8 1.827 7.867 -5.363 1.00 0.00 N ATOM 67 CA LEU A 8 0.761 7.330 -4.533 1.00 0.00 C ATOM 68 C LEU A 8 0.643 5.823 -4.775 1.00 0.00 C ATOM 69 O LEU A 8 0.670 5.035 -3.831 1.00 0.00 O ATOM 70 CB LEU A 8 -0.541 8.095 -4.773 1.00 0.00 C ATOM 71 CG LEU A 8 -0.865 9.200 -3.766 1.00 0.00 C ATOM 72 CD1 LEU A 8 -2.077 10.017 -4.219 1.00 0.00 C ATOM 73 CD2 LEU A 8 -1.056 8.623 -2.362 1.00 0.00 C ATOM 0 H LEU A 8 1.625 8.774 -5.783 1.00 0.00 H new ATOM 0 HA LEU A 8 0.994 7.467 -3.477 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -0.501 8.538 -5.768 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -1.364 7.380 -4.775 1.00 0.00 H new ATOM 0 HG LEU A 8 -0.015 9.881 -3.722 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -2.286 10.796 -3.485 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.866 10.476 -5.185 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -2.944 9.362 -4.310 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -1.285 9.429 -1.665 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -1.878 7.907 -2.372 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -0.141 8.121 -2.047 1.00 0.00 H new ATOM 85 N ARG A 9 0.515 5.468 -6.045 1.00 0.00 N ATOM 86 CA ARG A 9 0.393 4.070 -6.422 1.00 0.00 C ATOM 87 C ARG A 9 1.442 3.229 -5.694 1.00 0.00 C ATOM 88 O ARG A 9 1.103 2.389 -4.862 1.00 0.00 O ATOM 89 CB ARG A 9 0.563 3.891 -7.933 1.00 0.00 C ATOM 90 CG ARG A 9 -0.147 2.625 -8.419 1.00 0.00 C ATOM 91 CD ARG A 9 -0.382 2.675 -9.930 1.00 0.00 C ATOM 92 NE ARG A 9 0.879 2.382 -10.648 1.00 0.00 N ATOM 93 CZ ARG A 9 1.015 2.436 -11.980 1.00 0.00 C ATOM 94 NH1 ARG A 9 -0.032 2.773 -12.746 1.00 0.00 N ATOM 95 NH2 ARG A 9 2.196 2.155 -12.545 1.00 0.00 N ATOM 0 H ARG A 9 0.493 6.124 -6.826 1.00 0.00 H new ATOM 0 HA ARG A 9 -0.605 3.736 -6.137 1.00 0.00 H new ATOM 0 HB2 ARG A 9 0.161 4.760 -8.453 1.00 0.00 H new ATOM 0 HB3 ARG A 9 1.623 3.835 -8.179 1.00 0.00 H new ATOM 0 HG2 ARG A 9 0.452 1.749 -8.169 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -1.101 2.517 -7.902 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -1.147 1.951 -10.212 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -0.753 3.659 -10.216 1.00 0.00 H new ATOM 0 HE ARG A 9 1.695 2.123 -10.094 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -0.931 2.988 -12.315 1.00 0.00 H new ATOM 0 HH12 ARG A 9 0.070 2.814 -13.760 1.00 0.00 H new ATOM 0 HH21 ARG A 9 2.993 1.900 -11.961 1.00 0.00 H new ATOM 0 HH22 ARG A 9 2.299 2.196 -13.559 1.00 0.00 H new ATOM 109 N GLU A 10 2.698 3.485 -6.032 1.00 0.00 N ATOM 110 CA GLU A 10 3.800 2.763 -5.421 1.00 0.00 C ATOM 111 C GLU A 10 3.645 2.748 -3.898 1.00 0.00 C ATOM 112 O GLU A 10 3.733 1.693 -3.272 1.00 0.00 O ATOM 113 CB GLU A 10 5.145 3.365 -5.829 1.00 0.00 C ATOM 114 CG GLU A 10 5.738 2.622 -7.027 1.00 0.00 C ATOM 115 CD GLU A 10 7.211 2.283 -6.789 1.00 0.00 C ATOM 116 OE1 GLU A 10 7.998 3.243 -6.642 1.00 0.00 O ATOM 117 OE2 GLU A 10 7.516 1.071 -6.756 1.00 0.00 O ATOM 0 H GLU A 10 2.976 4.183 -6.722 1.00 0.00 H new ATOM 0 HA GLU A 10 3.777 1.734 -5.780 1.00 0.00 H new ATOM 0 HB2 GLU A 10 5.015 4.418 -6.078 1.00 0.00 H new ATOM 0 HB3 GLU A 10 5.838 3.319 -4.989 1.00 0.00 H new ATOM 0 HG2 GLU A 10 5.175 1.706 -7.206 1.00 0.00 H new ATOM 0 HG3 GLU A 10 5.643 3.235 -7.923 1.00 0.00 H new ATOM 124 N GLN A 11 3.415 3.932 -3.348 1.00 0.00 N ATOM 125 CA GLN A 11 3.248 4.068 -1.911 1.00 0.00 C ATOM 126 C GLN A 11 2.310 2.981 -1.380 1.00 0.00 C ATOM 127 O GLN A 11 2.639 2.288 -0.418 1.00 0.00 O ATOM 128 CB GLN A 11 2.732 5.462 -1.549 1.00 0.00 C ATOM 129 CG GLN A 11 3.715 6.544 -1.997 1.00 0.00 C ATOM 130 CD GLN A 11 3.710 7.726 -1.025 1.00 0.00 C ATOM 131 OE1 GLN A 11 4.408 7.744 -0.025 1.00 0.00 O ATOM 132 NE2 GLN A 11 2.885 8.709 -1.373 1.00 0.00 N ATOM 0 H GLN A 11 3.341 4.804 -3.871 1.00 0.00 H new ATOM 0 HA GLN A 11 4.222 3.943 -1.438 1.00 0.00 H new ATOM 0 HB2 GLN A 11 1.763 5.629 -2.020 1.00 0.00 H new ATOM 0 HB3 GLN A 11 2.579 5.528 -0.472 1.00 0.00 H new ATOM 0 HG2 GLN A 11 4.719 6.125 -2.060 1.00 0.00 H new ATOM 0 HG3 GLN A 11 3.451 6.889 -2.996 1.00 0.00 H new ATOM 0 HE21 GLN A 11 2.328 8.630 -2.224 1.00 0.00 H new ATOM 0 HE22 GLN A 11 2.809 9.542 -0.789 1.00 0.00 H new ATOM 141 N VAL A 12 1.162 2.866 -2.030 1.00 0.00 N ATOM 142 CA VAL A 12 0.175 1.876 -1.636 1.00 0.00 C ATOM 143 C VAL A 12 0.712 0.476 -1.942 1.00 0.00 C ATOM 144 O VAL A 12 0.501 -0.456 -1.168 1.00 0.00 O ATOM 145 CB VAL A 12 -1.162 2.167 -2.322 1.00 0.00 C ATOM 146 CG1 VAL A 12 -2.120 0.982 -2.180 1.00 0.00 C ATOM 147 CG2 VAL A 12 -1.791 3.450 -1.776 1.00 0.00 C ATOM 0 H VAL A 12 0.893 3.442 -2.827 1.00 0.00 H new ATOM 0 HA VAL A 12 -0.008 1.926 -0.563 1.00 0.00 H new ATOM 0 HB VAL A 12 -0.968 2.316 -3.384 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -3.062 1.215 -2.676 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -1.677 0.099 -2.639 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -2.304 0.788 -1.123 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -2.740 3.633 -2.280 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -1.964 3.343 -0.705 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -1.118 4.289 -1.953 1.00 0.00 H new ATOM 157 N LYS A 13 1.395 0.374 -3.073 1.00 0.00 N ATOM 158 CA LYS A 13 1.964 -0.895 -3.491 1.00 0.00 C ATOM 159 C LYS A 13 2.805 -1.473 -2.351 1.00 0.00 C ATOM 160 O LYS A 13 2.559 -2.588 -1.896 1.00 0.00 O ATOM 161 CB LYS A 13 2.735 -0.731 -4.802 1.00 0.00 C ATOM 162 CG LYS A 13 1.801 -0.315 -5.940 1.00 0.00 C ATOM 163 CD LYS A 13 2.135 -1.067 -7.229 1.00 0.00 C ATOM 164 CE LYS A 13 1.096 -2.153 -7.515 1.00 0.00 C ATOM 165 NZ LYS A 13 1.587 -3.079 -8.560 1.00 0.00 N ATOM 0 H LYS A 13 1.567 1.150 -3.712 1.00 0.00 H new ATOM 0 HA LYS A 13 1.174 -1.616 -3.701 1.00 0.00 H new ATOM 0 HB2 LYS A 13 3.517 0.018 -4.677 1.00 0.00 H new ATOM 0 HB3 LYS A 13 3.229 -1.668 -5.057 1.00 0.00 H new ATOM 0 HG2 LYS A 13 0.767 -0.513 -5.657 1.00 0.00 H new ATOM 0 HG3 LYS A 13 1.885 0.758 -6.109 1.00 0.00 H new ATOM 0 HD2 LYS A 13 2.173 -0.367 -8.063 1.00 0.00 H new ATOM 0 HD3 LYS A 13 3.124 -1.518 -7.145 1.00 0.00 H new ATOM 0 HE2 LYS A 13 0.880 -2.708 -6.602 1.00 0.00 H new ATOM 0 HE3 LYS A 13 0.161 -1.694 -7.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 0.869 -3.810 -8.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 1.770 -2.549 -9.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 2.467 -3.530 -8.238 1.00 0.00 H new ATOM 179 N GLU A 14 3.782 -0.687 -1.922 1.00 0.00 N ATOM 180 CA GLU A 14 4.662 -1.106 -0.844 1.00 0.00 C ATOM 181 C GLU A 14 3.851 -1.385 0.423 1.00 0.00 C ATOM 182 O GLU A 14 4.190 -2.279 1.198 1.00 0.00 O ATOM 183 CB GLU A 14 5.746 -0.059 -0.582 1.00 0.00 C ATOM 184 CG GLU A 14 7.008 -0.363 -1.392 1.00 0.00 C ATOM 185 CD GLU A 14 8.254 -0.311 -0.506 1.00 0.00 C ATOM 186 OE1 GLU A 14 8.760 0.814 -0.303 1.00 0.00 O ATOM 187 OE2 GLU A 14 8.672 -1.396 -0.051 1.00 0.00 O ATOM 0 H GLU A 14 3.984 0.238 -2.302 1.00 0.00 H new ATOM 0 HA GLU A 14 5.160 -2.028 -1.144 1.00 0.00 H new ATOM 0 HB2 GLU A 14 5.371 0.931 -0.843 1.00 0.00 H new ATOM 0 HB3 GLU A 14 5.988 -0.038 0.481 1.00 0.00 H new ATOM 0 HG2 GLU A 14 6.923 -1.349 -1.848 1.00 0.00 H new ATOM 0 HG3 GLU A 14 7.105 0.357 -2.205 1.00 0.00 H new ATOM 194 N LEU A 15 2.796 -0.603 0.597 1.00 0.00 N ATOM 195 CA LEU A 15 1.934 -0.754 1.757 1.00 0.00 C ATOM 196 C LEU A 15 1.374 -2.177 1.788 1.00 0.00 C ATOM 197 O LEU A 15 1.760 -2.983 2.634 1.00 0.00 O ATOM 198 CB LEU A 15 0.856 0.332 1.770 1.00 0.00 C ATOM 199 CG LEU A 15 -0.443 -0.022 2.497 1.00 0.00 C ATOM 200 CD1 LEU A 15 -0.229 -0.070 4.010 1.00 0.00 C ATOM 201 CD2 LEU A 15 -1.568 0.940 2.107 1.00 0.00 C ATOM 0 H LEU A 15 2.518 0.138 -0.047 1.00 0.00 H new ATOM 0 HA LEU A 15 2.504 -0.615 2.676 1.00 0.00 H new ATOM 0 HB2 LEU A 15 1.275 1.227 2.231 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.614 0.588 0.739 1.00 0.00 H new ATOM 0 HG LEU A 15 -0.749 -1.020 2.184 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -1.168 -0.324 4.502 1.00 0.00 H new ATOM 0 HD12 LEU A 15 0.521 -0.825 4.248 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.113 0.904 4.360 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -2.480 0.667 2.637 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -1.285 1.958 2.373 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -1.741 0.881 1.032 1.00 0.00 H new ATOM 213 N PHE A 16 0.470 -2.445 0.856 1.00 0.00 N ATOM 214 CA PHE A 16 -0.148 -3.757 0.766 1.00 0.00 C ATOM 215 C PHE A 16 0.908 -4.864 0.821 1.00 0.00 C ATOM 216 O PHE A 16 0.697 -5.896 1.456 1.00 0.00 O ATOM 217 CB PHE A 16 -0.867 -3.821 -0.582 1.00 0.00 C ATOM 218 CG PHE A 16 -2.226 -3.118 -0.595 1.00 0.00 C ATOM 219 CD1 PHE A 16 -3.134 -3.375 0.384 1.00 0.00 C ATOM 220 CD2 PHE A 16 -2.526 -2.235 -1.585 1.00 0.00 C ATOM 221 CE1 PHE A 16 -4.396 -2.723 0.372 1.00 0.00 C ATOM 222 CE2 PHE A 16 -3.788 -1.583 -1.597 1.00 0.00 C ATOM 223 CZ PHE A 16 -4.696 -1.841 -0.618 1.00 0.00 C ATOM 0 H PHE A 16 0.151 -1.775 0.156 1.00 0.00 H new ATOM 0 HA PHE A 16 -0.834 -3.904 1.600 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -0.230 -3.372 -1.344 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -1.007 -4.866 -0.859 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -2.896 -4.075 1.171 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -1.805 -2.030 -2.362 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -5.117 -2.928 1.149 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -4.026 -0.882 -2.384 1.00 0.00 H new ATOM 0 HZ PHE A 16 -5.655 -1.345 -0.627 1.00 0.00 H new ATOM 233 N ASN A 17 2.019 -4.612 0.146 1.00 0.00 N ATOM 234 CA ASN A 17 3.107 -5.574 0.108 1.00 0.00 C ATOM 235 C ASN A 17 3.716 -5.703 1.506 1.00 0.00 C ATOM 236 O ASN A 17 4.022 -6.807 1.954 1.00 0.00 O ATOM 237 CB ASN A 17 4.212 -5.122 -0.849 1.00 0.00 C ATOM 238 CG ASN A 17 3.690 -5.032 -2.284 1.00 0.00 C ATOM 239 OD1 ASN A 17 2.504 -4.892 -2.534 1.00 0.00 O ATOM 240 ND2 ASN A 17 4.641 -5.122 -3.211 1.00 0.00 N ATOM 0 H ASN A 17 2.190 -3.755 -0.380 1.00 0.00 H new ATOM 0 HA ASN A 17 2.702 -6.526 -0.235 1.00 0.00 H new ATOM 0 HB2 ASN A 17 4.595 -4.151 -0.536 1.00 0.00 H new ATOM 0 HB3 ASN A 17 5.046 -5.823 -0.805 1.00 0.00 H new ATOM 0 HD21 ASN A 17 4.395 -5.074 -4.200 1.00 0.00 H new ATOM 0 HD22 ASN A 17 5.615 -5.238 -2.932 1.00 0.00 H new ATOM 247 N GLU A 18 3.873 -4.559 2.156 1.00 0.00 N ATOM 248 CA GLU A 18 4.441 -4.530 3.493 1.00 0.00 C ATOM 249 C GLU A 18 3.586 -5.363 4.450 1.00 0.00 C ATOM 250 O GLU A 18 4.112 -6.173 5.212 1.00 0.00 O ATOM 251 CB GLU A 18 4.584 -3.092 3.997 1.00 0.00 C ATOM 252 CG GLU A 18 5.729 -2.372 3.281 1.00 0.00 C ATOM 253 CD GLU A 18 6.965 -2.279 4.177 1.00 0.00 C ATOM 254 OE1 GLU A 18 7.147 -3.212 4.991 1.00 0.00 O ATOM 255 OE2 GLU A 18 7.700 -1.279 4.030 1.00 0.00 O ATOM 0 H GLU A 18 3.617 -3.646 1.782 1.00 0.00 H new ATOM 0 HA GLU A 18 5.439 -4.967 3.453 1.00 0.00 H new ATOM 0 HB2 GLU A 18 3.652 -2.551 3.835 1.00 0.00 H new ATOM 0 HB3 GLU A 18 4.767 -3.096 5.071 1.00 0.00 H new ATOM 0 HG2 GLU A 18 5.980 -2.904 2.363 1.00 0.00 H new ATOM 0 HG3 GLU A 18 5.409 -1.371 2.992 1.00 0.00 H new ATOM 262 N LYS A 19 2.282 -5.136 4.379 1.00 0.00 N ATOM 263 CA LYS A 19 1.350 -5.856 5.231 1.00 0.00 C ATOM 264 C LYS A 19 1.529 -7.360 5.017 1.00 0.00 C ATOM 265 O LYS A 19 1.738 -8.106 5.973 1.00 0.00 O ATOM 266 CB LYS A 19 -0.080 -5.367 4.992 1.00 0.00 C ATOM 267 CG LYS A 19 -0.232 -3.898 5.392 1.00 0.00 C ATOM 268 CD LYS A 19 -0.271 -3.746 6.914 1.00 0.00 C ATOM 269 CE LYS A 19 0.122 -2.329 7.335 1.00 0.00 C ATOM 270 NZ LYS A 19 0.824 -2.350 8.638 1.00 0.00 N ATOM 0 H LYS A 19 1.849 -4.464 3.745 1.00 0.00 H new ATOM 0 HA LYS A 19 1.560 -5.656 6.282 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -0.339 -5.490 3.940 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -0.777 -5.978 5.565 1.00 0.00 H new ATOM 0 HG2 LYS A 19 0.598 -3.319 4.986 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -1.146 -3.492 4.959 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -1.272 -3.973 7.280 1.00 0.00 H new ATOM 0 HD3 LYS A 19 0.407 -4.466 7.372 1.00 0.00 H new ATOM 0 HE2 LYS A 19 0.765 -1.883 6.576 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -0.768 -1.704 7.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 1.083 -1.380 8.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 0.198 -2.756 9.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 1.684 -2.929 8.560 1.00 0.00 H new ATOM 284 N TYR A 20 1.441 -7.762 3.758 1.00 0.00 N ATOM 285 CA TYR A 20 1.591 -9.164 3.407 1.00 0.00 C ATOM 286 C TYR A 20 2.800 -9.780 4.113 1.00 0.00 C ATOM 287 O TYR A 20 2.690 -10.837 4.732 1.00 0.00 O ATOM 288 CB TYR A 20 1.826 -9.198 1.896 1.00 0.00 C ATOM 289 CG TYR A 20 1.432 -10.520 1.234 1.00 0.00 C ATOM 290 CD1 TYR A 20 0.188 -11.068 1.474 1.00 0.00 C ATOM 291 CD2 TYR A 20 2.321 -11.165 0.398 1.00 0.00 C ATOM 292 CE1 TYR A 20 -0.182 -12.312 0.851 1.00 0.00 C ATOM 293 CE2 TYR A 20 1.951 -12.409 -0.224 1.00 0.00 C ATOM 294 CZ TYR A 20 0.717 -12.922 0.032 1.00 0.00 C ATOM 295 OH TYR A 20 0.367 -14.097 -0.556 1.00 0.00 O ATOM 0 H TYR A 20 1.268 -7.141 2.968 1.00 0.00 H new ATOM 0 HA TYR A 20 0.709 -9.730 3.706 1.00 0.00 H new ATOM 0 HB2 TYR A 20 1.261 -8.389 1.433 1.00 0.00 H new ATOM 0 HB3 TYR A 20 2.880 -9.005 1.698 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -0.507 -10.564 2.129 1.00 0.00 H new ATOM 0 HD2 TYR A 20 3.294 -10.736 0.211 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -1.152 -12.751 1.030 1.00 0.00 H new ATOM 0 HE2 TYR A 20 2.638 -12.924 -0.880 1.00 0.00 H new ATOM 0 HH TYR A 20 -0.541 -14.343 -0.281 1.00 0.00 H new ATOM 305 N GLY A 21 3.927 -9.091 3.998 1.00 0.00 N ATOM 306 CA GLY A 21 5.155 -9.557 4.617 1.00 0.00 C ATOM 307 C GLY A 21 4.947 -9.833 6.108 1.00 0.00 C ATOM 308 O GLY A 21 5.201 -10.941 6.579 1.00 0.00 O ATOM 0 H GLY A 21 4.014 -8.214 3.485 1.00 0.00 H new ATOM 0 HA2 GLY A 21 5.495 -10.465 4.119 1.00 0.00 H new ATOM 0 HA3 GLY A 21 5.938 -8.810 4.488 1.00 0.00 H new ATOM 312 N GLU A 22 4.487 -8.807 6.809 1.00 0.00 N ATOM 313 CA GLU A 22 4.243 -8.924 8.235 1.00 0.00 C ATOM 314 C GLU A 22 3.246 -10.052 8.511 1.00 0.00 C ATOM 315 O GLU A 22 3.471 -10.882 9.392 1.00 0.00 O ATOM 316 CB GLU A 22 3.746 -7.599 8.817 1.00 0.00 C ATOM 317 CG GLU A 22 4.682 -6.450 8.440 1.00 0.00 C ATOM 318 CD GLU A 22 4.860 -5.481 9.612 1.00 0.00 C ATOM 319 OE1 GLU A 22 5.433 -5.922 10.631 1.00 0.00 O ATOM 320 OE2 GLU A 22 4.418 -4.322 9.461 1.00 0.00 O ATOM 0 H GLU A 22 4.277 -7.890 6.415 1.00 0.00 H new ATOM 0 HA GLU A 22 5.185 -9.168 8.727 1.00 0.00 H new ATOM 0 HB2 GLU A 22 2.741 -7.390 8.449 1.00 0.00 H new ATOM 0 HB3 GLU A 22 3.678 -7.677 9.902 1.00 0.00 H new ATOM 0 HG2 GLU A 22 5.652 -6.849 8.143 1.00 0.00 H new ATOM 0 HG3 GLU A 22 4.280 -5.916 7.579 1.00 0.00 H new ATOM 327 N ALA A 23 2.167 -10.047 7.744 1.00 0.00 N ATOM 328 CA ALA A 23 1.136 -11.059 7.895 1.00 0.00 C ATOM 329 C ALA A 23 1.747 -12.442 7.664 1.00 0.00 C ATOM 330 O ALA A 23 1.378 -13.407 8.333 1.00 0.00 O ATOM 331 CB ALA A 23 -0.016 -10.764 6.931 1.00 0.00 C ATOM 0 H ALA A 23 1.984 -9.357 7.015 1.00 0.00 H new ATOM 0 HA ALA A 23 0.728 -11.042 8.906 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -0.789 -11.524 7.045 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -0.435 -9.783 7.155 1.00 0.00 H new ATOM 0 HB3 ALA A 23 0.355 -10.775 5.906 1.00 0.00 H new ATOM 337 N LEU A 24 2.671 -12.496 6.716 1.00 0.00 N ATOM 338 CA LEU A 24 3.337 -13.744 6.389 1.00 0.00 C ATOM 339 C LEU A 24 4.269 -14.136 7.538 1.00 0.00 C ATOM 340 O LEU A 24 4.823 -15.235 7.546 1.00 0.00 O ATOM 341 CB LEU A 24 4.041 -13.638 5.036 1.00 0.00 C ATOM 342 CG LEU A 24 3.168 -13.893 3.804 1.00 0.00 C ATOM 343 CD1 LEU A 24 3.825 -13.330 2.542 1.00 0.00 C ATOM 344 CD2 LEU A 24 2.839 -15.381 3.665 1.00 0.00 C ATOM 0 H LEU A 24 2.974 -11.694 6.163 1.00 0.00 H new ATOM 0 HA LEU A 24 2.608 -14.547 6.280 1.00 0.00 H new ATOM 0 HB2 LEU A 24 4.473 -12.641 4.951 1.00 0.00 H new ATOM 0 HB3 LEU A 24 4.869 -14.347 5.023 1.00 0.00 H new ATOM 0 HG LEU A 24 2.223 -13.366 3.938 1.00 0.00 H new ATOM 0 HD11 LEU A 24 3.185 -13.524 1.681 1.00 0.00 H new ATOM 0 HD12 LEU A 24 3.966 -12.255 2.654 1.00 0.00 H new ATOM 0 HD13 LEU A 24 4.792 -13.809 2.391 1.00 0.00 H new ATOM 0 HD21 LEU A 24 2.218 -15.535 2.783 1.00 0.00 H new ATOM 0 HD22 LEU A 24 3.763 -15.950 3.563 1.00 0.00 H new ATOM 0 HD23 LEU A 24 2.301 -15.719 4.551 1.00 0.00 H new ATOM 356 N GLY A 25 4.414 -13.216 8.480 1.00 0.00 N ATOM 357 CA GLY A 25 5.270 -13.451 9.630 1.00 0.00 C ATOM 358 C GLY A 25 6.744 -13.277 9.262 1.00 0.00 C ATOM 359 O GLY A 25 7.621 -13.858 9.901 1.00 0.00 O ATOM 0 H GLY A 25 3.953 -12.306 8.470 1.00 0.00 H new ATOM 0 HA2 GLY A 25 5.007 -12.759 10.430 1.00 0.00 H new ATOM 0 HA3 GLY A 25 5.103 -14.458 10.012 1.00 0.00 H new ATOM 363 N LEU A 26 6.974 -12.474 8.233 1.00 0.00 N ATOM 364 CA LEU A 26 8.327 -12.216 7.772 1.00 0.00 C ATOM 365 C LEU A 26 8.767 -10.829 8.243 1.00 0.00 C ATOM 366 O LEU A 26 8.068 -10.186 9.025 1.00 0.00 O ATOM 367 CB LEU A 26 8.423 -12.410 6.257 1.00 0.00 C ATOM 368 CG LEU A 26 7.705 -13.637 5.690 1.00 0.00 C ATOM 369 CD1 LEU A 26 8.059 -13.847 4.216 1.00 0.00 C ATOM 370 CD2 LEU A 26 7.998 -14.880 6.533 1.00 0.00 C ATOM 0 H LEU A 26 6.245 -11.993 7.706 1.00 0.00 H new ATOM 0 HA LEU A 26 9.021 -12.935 8.207 1.00 0.00 H new ATOM 0 HB2 LEU A 26 8.020 -11.521 5.771 1.00 0.00 H new ATOM 0 HB3 LEU A 26 9.477 -12.472 5.985 1.00 0.00 H new ATOM 0 HG LEU A 26 6.631 -13.459 5.740 1.00 0.00 H new ATOM 0 HD11 LEU A 26 7.536 -14.725 3.838 1.00 0.00 H new ATOM 0 HD12 LEU A 26 7.759 -12.971 3.641 1.00 0.00 H new ATOM 0 HD13 LEU A 26 9.134 -13.995 4.118 1.00 0.00 H new ATOM 0 HD21 LEU A 26 7.476 -15.738 6.109 1.00 0.00 H new ATOM 0 HD22 LEU A 26 9.071 -15.073 6.536 1.00 0.00 H new ATOM 0 HD23 LEU A 26 7.656 -14.716 7.555 1.00 0.00 H new ATOM 382 N ASN A 27 9.922 -10.409 7.748 1.00 0.00 N ATOM 383 CA ASN A 27 10.462 -9.110 8.110 1.00 0.00 C ATOM 384 C ASN A 27 10.756 -8.313 6.837 1.00 0.00 C ATOM 385 O ASN A 27 11.556 -7.378 6.857 1.00 0.00 O ATOM 386 CB ASN A 27 11.772 -9.256 8.889 1.00 0.00 C ATOM 387 CG ASN A 27 11.502 -9.554 10.364 1.00 0.00 C ATOM 388 OD1 ASN A 27 10.814 -10.499 10.718 1.00 0.00 O ATOM 389 ND2 ASN A 27 12.080 -8.699 11.204 1.00 0.00 N ATOM 0 H ASN A 27 10.498 -10.945 7.100 1.00 0.00 H new ATOM 0 HA ASN A 27 9.727 -8.600 8.732 1.00 0.00 H new ATOM 0 HB2 ASN A 27 12.369 -10.058 8.456 1.00 0.00 H new ATOM 0 HB3 ASN A 27 12.356 -8.340 8.800 1.00 0.00 H new ATOM 0 HD21 ASN A 27 11.960 -8.813 12.210 1.00 0.00 H new ATOM 0 HD22 ASN A 27 12.643 -7.930 10.841 1.00 0.00 H new ATOM 396 N ARG A 28 10.092 -8.711 5.762 1.00 0.00 N ATOM 397 CA ARG A 28 10.271 -8.045 4.483 1.00 0.00 C ATOM 398 C ARG A 28 8.934 -7.945 3.746 1.00 0.00 C ATOM 399 O ARG A 28 8.053 -8.782 3.933 1.00 0.00 O ATOM 400 CB ARG A 28 11.274 -8.797 3.607 1.00 0.00 C ATOM 401 CG ARG A 28 10.995 -10.301 3.619 1.00 0.00 C ATOM 402 CD ARG A 28 10.920 -10.858 2.196 1.00 0.00 C ATOM 403 NE ARG A 28 10.996 -12.335 2.226 1.00 0.00 N ATOM 404 CZ ARG A 28 12.111 -13.025 2.502 1.00 0.00 C ATOM 405 NH1 ARG A 28 13.251 -12.376 2.774 1.00 0.00 N ATOM 406 NH2 ARG A 28 12.086 -14.365 2.507 1.00 0.00 N ATOM 0 H ARG A 28 9.429 -9.486 5.750 1.00 0.00 H new ATOM 0 HA ARG A 28 10.657 -7.045 4.680 1.00 0.00 H new ATOM 0 HB2 ARG A 28 11.222 -8.422 2.585 1.00 0.00 H new ATOM 0 HB3 ARG A 28 12.287 -8.609 3.964 1.00 0.00 H new ATOM 0 HG2 ARG A 28 11.780 -10.815 4.173 1.00 0.00 H new ATOM 0 HG3 ARG A 28 10.057 -10.496 4.139 1.00 0.00 H new ATOM 0 HD2 ARG A 28 9.990 -10.543 1.722 1.00 0.00 H new ATOM 0 HD3 ARG A 28 11.736 -10.456 1.596 1.00 0.00 H new ATOM 0 HE ARG A 28 10.146 -12.861 2.024 1.00 0.00 H new ATOM 0 HH11 ARG A 28 13.270 -11.356 2.771 1.00 0.00 H new ATOM 0 HH12 ARG A 28 14.099 -12.902 2.984 1.00 0.00 H new ATOM 0 HH21 ARG A 28 11.218 -14.860 2.301 1.00 0.00 H new ATOM 0 HH22 ARG A 28 12.935 -14.890 2.717 1.00 0.00 H new ATOM 420 N PRO A 29 8.823 -6.885 2.900 1.00 0.00 N ATOM 421 CA PRO A 29 7.609 -6.663 2.134 1.00 0.00 C ATOM 422 C PRO A 29 7.510 -7.649 0.967 1.00 0.00 C ATOM 423 O PRO A 29 8.469 -7.828 0.219 1.00 0.00 O ATOM 424 CB PRO A 29 7.686 -5.215 1.682 1.00 0.00 C ATOM 425 CG PRO A 29 9.147 -4.815 1.815 1.00 0.00 C ATOM 426 CD PRO A 29 9.846 -5.873 2.654 1.00 0.00 C ATOM 0 HA PRO A 29 6.706 -6.835 2.719 1.00 0.00 H new ATOM 0 HB2 PRO A 29 7.344 -5.108 0.653 1.00 0.00 H new ATOM 0 HB3 PRO A 29 7.049 -4.579 2.297 1.00 0.00 H new ATOM 0 HG2 PRO A 29 9.613 -4.738 0.832 1.00 0.00 H new ATOM 0 HG3 PRO A 29 9.233 -3.836 2.286 1.00 0.00 H new ATOM 0 HD2 PRO A 29 10.702 -6.295 2.127 1.00 0.00 H new ATOM 0 HD3 PRO A 29 10.221 -5.454 3.588 1.00 0.00 H new ATOM 434 N VAL A 30 6.341 -8.261 0.848 1.00 0.00 N ATOM 435 CA VAL A 30 6.104 -9.223 -0.214 1.00 0.00 C ATOM 436 C VAL A 30 4.861 -8.808 -1.004 1.00 0.00 C ATOM 437 O VAL A 30 3.902 -8.292 -0.432 1.00 0.00 O ATOM 438 CB VAL A 30 5.999 -10.633 0.370 1.00 0.00 C ATOM 439 CG1 VAL A 30 5.616 -11.647 -0.710 1.00 0.00 C ATOM 440 CG2 VAL A 30 7.301 -11.037 1.064 1.00 0.00 C ATOM 0 H VAL A 30 5.547 -8.109 1.470 1.00 0.00 H new ATOM 0 HA VAL A 30 6.942 -9.237 -0.911 1.00 0.00 H new ATOM 0 HB VAL A 30 5.208 -10.627 1.119 1.00 0.00 H new ATOM 0 HG11 VAL A 30 5.548 -12.641 -0.268 1.00 0.00 H new ATOM 0 HG12 VAL A 30 4.652 -11.374 -1.140 1.00 0.00 H new ATOM 0 HG13 VAL A 30 6.375 -11.649 -1.493 1.00 0.00 H new ATOM 0 HG21 VAL A 30 7.200 -12.043 1.470 1.00 0.00 H new ATOM 0 HG22 VAL A 30 8.119 -11.017 0.343 1.00 0.00 H new ATOM 0 HG23 VAL A 30 7.514 -10.339 1.873 1.00 0.00 H new ATOM 450 N LEU A 31 4.917 -9.052 -2.305 1.00 0.00 N ATOM 451 CA LEU A 31 3.807 -8.710 -3.179 1.00 0.00 C ATOM 452 C LEU A 31 2.560 -9.477 -2.735 1.00 0.00 C ATOM 453 O LEU A 31 2.665 -10.536 -2.117 1.00 0.00 O ATOM 454 CB LEU A 31 4.185 -8.946 -4.643 1.00 0.00 C ATOM 455 CG LEU A 31 4.880 -7.782 -5.351 1.00 0.00 C ATOM 456 CD1 LEU A 31 5.711 -8.279 -6.537 1.00 0.00 C ATOM 457 CD2 LEU A 31 3.871 -6.711 -5.767 1.00 0.00 C ATOM 0 H LEU A 31 5.713 -9.482 -2.775 1.00 0.00 H new ATOM 0 HA LEU A 31 3.574 -7.648 -3.101 1.00 0.00 H new ATOM 0 HB2 LEU A 31 4.837 -9.818 -4.693 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.279 -9.193 -5.196 1.00 0.00 H new ATOM 0 HG LEU A 31 5.570 -7.317 -4.647 1.00 0.00 H new ATOM 0 HD11 LEU A 31 6.195 -7.432 -7.023 1.00 0.00 H new ATOM 0 HD12 LEU A 31 6.470 -8.976 -6.183 1.00 0.00 H new ATOM 0 HD13 LEU A 31 5.060 -8.784 -7.251 1.00 0.00 H new ATOM 0 HD21 LEU A 31 4.392 -5.895 -6.268 1.00 0.00 H new ATOM 0 HD22 LEU A 31 3.139 -7.146 -6.447 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.362 -6.328 -4.883 1.00 0.00 H new ATOM 469 N VAL A 32 1.408 -8.913 -3.067 1.00 0.00 N ATOM 470 CA VAL A 32 0.142 -9.530 -2.710 1.00 0.00 C ATOM 471 C VAL A 32 -0.437 -10.241 -3.935 1.00 0.00 C ATOM 472 O VAL A 32 -0.703 -9.608 -4.956 1.00 0.00 O ATOM 473 CB VAL A 32 -0.805 -8.481 -2.123 1.00 0.00 C ATOM 474 CG1 VAL A 32 -2.214 -9.052 -1.945 1.00 0.00 C ATOM 475 CG2 VAL A 32 -0.264 -7.932 -0.802 1.00 0.00 C ATOM 0 H VAL A 32 1.325 -8.035 -3.580 1.00 0.00 H new ATOM 0 HA VAL A 32 0.289 -10.284 -1.936 1.00 0.00 H new ATOM 0 HB VAL A 32 -0.867 -7.653 -2.829 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -2.867 -8.286 -1.526 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -2.602 -9.371 -2.912 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -2.178 -9.907 -1.269 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -0.956 -7.189 -0.406 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.158 -8.747 -0.086 1.00 0.00 H new ATOM 0 HG23 VAL A 32 0.708 -7.469 -0.971 1.00 0.00 H new ATOM 485 N PRO A 33 -0.621 -11.580 -3.789 1.00 0.00 N ATOM 486 CA PRO A 33 -1.164 -12.383 -4.872 1.00 0.00 C ATOM 487 C PRO A 33 -2.669 -12.158 -5.019 1.00 0.00 C ATOM 488 O PRO A 33 -3.458 -13.090 -4.866 1.00 0.00 O ATOM 489 CB PRO A 33 -0.809 -13.818 -4.513 1.00 0.00 C ATOM 490 CG PRO A 33 -0.494 -13.809 -3.027 1.00 0.00 C ATOM 491 CD PRO A 33 -0.317 -12.363 -2.595 1.00 0.00 C ATOM 0 HA PRO A 33 -0.749 -12.115 -5.844 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -1.637 -14.492 -4.733 1.00 0.00 H new ATOM 0 HB3 PRO A 33 0.047 -14.165 -5.092 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -1.300 -14.279 -2.464 1.00 0.00 H new ATOM 0 HG3 PRO A 33 0.412 -14.381 -2.826 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -0.988 -12.110 -1.774 1.00 0.00 H new ATOM 0 HD3 PRO A 33 0.698 -12.175 -2.246 1.00 0.00 H new ATOM 499 N TYR A 34 -3.024 -10.916 -5.315 1.00 0.00 N ATOM 500 CA TYR A 34 -4.421 -10.557 -5.486 1.00 0.00 C ATOM 501 C TYR A 34 -5.156 -11.597 -6.335 1.00 0.00 C ATOM 502 O TYR A 34 -6.251 -12.031 -5.981 1.00 0.00 O ATOM 503 CB TYR A 34 -4.426 -9.217 -6.224 1.00 0.00 C ATOM 504 CG TYR A 34 -3.569 -8.137 -5.559 1.00 0.00 C ATOM 505 CD1 TYR A 34 -4.075 -7.411 -4.500 1.00 0.00 C ATOM 506 CD2 TYR A 34 -2.292 -7.890 -6.018 1.00 0.00 C ATOM 507 CE1 TYR A 34 -3.270 -6.394 -3.875 1.00 0.00 C ATOM 508 CE2 TYR A 34 -1.485 -6.874 -5.393 1.00 0.00 C ATOM 509 CZ TYR A 34 -2.015 -6.175 -4.352 1.00 0.00 C ATOM 510 OH TYR A 34 -1.254 -5.216 -3.761 1.00 0.00 O ATOM 0 H TYR A 34 -2.367 -10.146 -5.441 1.00 0.00 H new ATOM 0 HA TYR A 34 -4.923 -10.504 -4.520 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -4.070 -9.373 -7.242 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -5.453 -8.858 -6.297 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -5.075 -7.606 -4.140 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -1.897 -8.459 -6.847 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -3.654 -5.818 -3.046 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -0.483 -6.671 -5.742 1.00 0.00 H new ATOM 0 HH TYR A 34 -0.382 -5.171 -4.205 1.00 0.00 H new ATOM 520 N LYS A 35 -4.522 -11.966 -7.438 1.00 0.00 N ATOM 521 CA LYS A 35 -5.102 -12.947 -8.341 1.00 0.00 C ATOM 522 C LYS A 35 -5.656 -14.118 -7.527 1.00 0.00 C ATOM 523 O LYS A 35 -6.801 -14.525 -7.720 1.00 0.00 O ATOM 524 CB LYS A 35 -4.083 -13.364 -9.403 1.00 0.00 C ATOM 525 CG LYS A 35 -4.625 -13.113 -10.812 1.00 0.00 C ATOM 526 CD LYS A 35 -3.713 -13.736 -11.870 1.00 0.00 C ATOM 527 CE LYS A 35 -4.388 -13.738 -13.243 1.00 0.00 C ATOM 528 NZ LYS A 35 -3.905 -14.876 -14.057 1.00 0.00 N ATOM 0 H LYS A 35 -3.613 -11.604 -7.727 1.00 0.00 H new ATOM 0 HA LYS A 35 -5.940 -12.514 -8.888 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -3.157 -12.807 -9.261 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -3.841 -14.420 -9.285 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -5.628 -13.531 -10.899 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -4.711 -12.041 -10.987 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -2.777 -13.180 -11.922 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -3.461 -14.757 -11.583 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -5.469 -13.802 -13.123 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -4.180 -12.800 -13.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -4.373 -14.862 -14.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -2.876 -14.798 -14.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -4.126 -15.769 -13.571 1.00 0.00 H new ATOM 542 N LEU A 36 -4.818 -14.625 -6.634 1.00 0.00 N ATOM 543 CA LEU A 36 -5.211 -15.741 -5.791 1.00 0.00 C ATOM 544 C LEU A 36 -6.349 -15.302 -4.868 1.00 0.00 C ATOM 545 O LEU A 36 -7.471 -15.792 -4.984 1.00 0.00 O ATOM 546 CB LEU A 36 -3.998 -16.303 -5.046 1.00 0.00 C ATOM 547 CG LEU A 36 -2.971 -17.048 -5.902 1.00 0.00 C ATOM 548 CD1 LEU A 36 -1.710 -17.361 -5.096 1.00 0.00 C ATOM 549 CD2 LEU A 36 -3.583 -18.306 -6.522 1.00 0.00 C ATOM 0 H LEU A 36 -3.870 -14.284 -6.476 1.00 0.00 H new ATOM 0 HA LEU A 36 -5.592 -16.562 -6.399 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -3.492 -15.479 -4.542 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -4.355 -16.980 -4.270 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.674 -16.396 -6.724 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.997 -17.890 -5.728 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.263 -16.431 -4.744 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.970 -17.985 -4.241 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.832 -18.817 -7.125 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -3.926 -18.972 -5.730 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -4.427 -18.027 -7.153 1.00 0.00 H new ATOM 561 N ILE A 37 -6.021 -14.382 -3.973 1.00 0.00 N ATOM 562 CA ILE A 37 -7.002 -13.871 -3.031 1.00 0.00 C ATOM 563 C ILE A 37 -8.322 -13.615 -3.763 1.00 0.00 C ATOM 564 O ILE A 37 -9.395 -13.735 -3.176 1.00 0.00 O ATOM 565 CB ILE A 37 -6.455 -12.642 -2.302 1.00 0.00 C ATOM 566 CG1 ILE A 37 -5.209 -12.997 -1.489 1.00 0.00 C ATOM 567 CG2 ILE A 37 -7.537 -11.992 -1.437 1.00 0.00 C ATOM 568 CD1 ILE A 37 -4.151 -11.898 -1.601 1.00 0.00 C ATOM 0 H ILE A 37 -5.089 -13.977 -3.880 1.00 0.00 H new ATOM 0 HA ILE A 37 -7.205 -14.609 -2.255 1.00 0.00 H new ATOM 0 HB ILE A 37 -6.154 -11.907 -3.049 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -5.481 -13.140 -0.443 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -4.796 -13.942 -1.843 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -7.123 -11.121 -0.930 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -8.370 -11.682 -2.068 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -7.890 -12.709 -0.696 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -3.275 -12.175 -1.014 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.864 -11.775 -2.645 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -4.559 -10.960 -1.224 1.00 0.00 H new ATOM 580 N ARG A 38 -8.196 -13.267 -5.035 1.00 0.00 N ATOM 581 CA ARG A 38 -9.365 -12.993 -5.855 1.00 0.00 C ATOM 582 C ARG A 38 -10.226 -14.251 -5.990 1.00 0.00 C ATOM 583 O ARG A 38 -11.402 -14.244 -5.630 1.00 0.00 O ATOM 584 CB ARG A 38 -8.960 -12.508 -7.247 1.00 0.00 C ATOM 585 CG ARG A 38 -10.118 -11.778 -7.932 1.00 0.00 C ATOM 586 CD ARG A 38 -9.857 -10.272 -7.992 1.00 0.00 C ATOM 587 NE ARG A 38 -10.401 -9.714 -9.250 1.00 0.00 N ATOM 588 CZ ARG A 38 -10.235 -8.443 -9.642 1.00 0.00 C ATOM 589 NH1 ARG A 38 -9.540 -7.591 -8.876 1.00 0.00 N ATOM 590 NH2 ARG A 38 -10.763 -8.024 -10.799 1.00 0.00 N ATOM 0 H ARG A 38 -7.303 -13.168 -5.518 1.00 0.00 H new ATOM 0 HA ARG A 38 -9.939 -12.208 -5.362 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -8.101 -11.842 -7.168 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -8.650 -13.357 -7.856 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -10.253 -12.168 -8.941 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -11.044 -11.969 -7.390 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -10.319 -9.780 -7.136 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -8.786 -10.077 -7.931 1.00 0.00 H new ATOM 0 HE ARG A 38 -10.936 -10.335 -9.857 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -9.137 -7.910 -7.995 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -9.414 -6.624 -9.174 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -11.292 -8.672 -11.383 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -10.636 -7.057 -11.097 1.00 0.00 H new ATOM 604 N ASP A 39 -9.606 -15.301 -6.508 1.00 0.00 N ATOM 605 CA ASP A 39 -10.300 -16.563 -6.695 1.00 0.00 C ATOM 606 C ASP A 39 -10.568 -17.200 -5.330 1.00 0.00 C ATOM 607 O ASP A 39 -11.619 -17.802 -5.118 1.00 0.00 O ATOM 608 CB ASP A 39 -9.454 -17.540 -7.515 1.00 0.00 C ATOM 609 CG ASP A 39 -10.187 -18.803 -7.972 1.00 0.00 C ATOM 610 OD1 ASP A 39 -10.402 -19.679 -7.107 1.00 0.00 O ATOM 611 OD2 ASP A 39 -10.517 -18.864 -9.176 1.00 0.00 O ATOM 0 H ASP A 39 -8.630 -15.303 -6.804 1.00 0.00 H new ATOM 0 HA ASP A 39 -11.232 -16.361 -7.223 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -9.075 -17.020 -8.395 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -8.589 -17.835 -6.921 1.00 0.00 H new ATOM 616 N SER A 40 -9.598 -17.046 -4.440 1.00 0.00 N ATOM 617 CA SER A 40 -9.716 -17.598 -3.103 1.00 0.00 C ATOM 618 C SER A 40 -9.877 -16.470 -2.082 1.00 0.00 C ATOM 619 O SER A 40 -8.898 -15.844 -1.683 1.00 0.00 O ATOM 620 CB SER A 40 -8.500 -18.458 -2.753 1.00 0.00 C ATOM 621 OG SER A 40 -8.630 -19.073 -1.474 1.00 0.00 O ATOM 0 H SER A 40 -8.727 -16.546 -4.620 1.00 0.00 H new ATOM 0 HA SER A 40 -10.600 -18.235 -3.074 1.00 0.00 H new ATOM 0 HB2 SER A 40 -8.370 -19.228 -3.514 1.00 0.00 H new ATOM 0 HB3 SER A 40 -7.602 -17.840 -2.768 1.00 0.00 H new ATOM 0 HG SER A 40 -7.834 -19.614 -1.289 1.00 0.00 H new ATOM 627 N PRO A 41 -11.156 -16.238 -1.680 1.00 0.00 N ATOM 628 CA PRO A 41 -11.460 -15.196 -0.714 1.00 0.00 C ATOM 629 C PRO A 41 -11.055 -15.622 0.698 1.00 0.00 C ATOM 630 O PRO A 41 -10.934 -14.786 1.593 1.00 0.00 O ATOM 631 CB PRO A 41 -12.953 -14.950 -0.857 1.00 0.00 C ATOM 632 CG PRO A 41 -13.512 -16.177 -1.558 1.00 0.00 C ATOM 633 CD PRO A 41 -12.342 -16.960 -2.132 1.00 0.00 C ATOM 0 HA PRO A 41 -10.900 -14.278 -0.895 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -13.421 -14.810 0.117 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -13.146 -14.047 -1.436 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -14.076 -16.793 -0.858 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -14.200 -15.883 -2.351 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -12.340 -17.989 -1.773 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -12.389 -17.002 -3.220 1.00 0.00 H new ATOM 641 N ASP A 42 -10.857 -16.923 0.855 1.00 0.00 N ATOM 642 CA ASP A 42 -10.469 -17.471 2.143 1.00 0.00 C ATOM 643 C ASP A 42 -8.974 -17.794 2.127 1.00 0.00 C ATOM 644 O ASP A 42 -8.559 -18.854 2.592 1.00 0.00 O ATOM 645 CB ASP A 42 -11.229 -18.764 2.444 1.00 0.00 C ATOM 646 CG ASP A 42 -12.618 -18.571 3.055 1.00 0.00 C ATOM 647 OD1 ASP A 42 -12.742 -17.668 3.910 1.00 0.00 O ATOM 648 OD2 ASP A 42 -13.525 -19.332 2.654 1.00 0.00 O ATOM 0 H ASP A 42 -10.958 -17.613 0.111 1.00 0.00 H new ATOM 0 HA ASP A 42 -10.702 -16.730 2.907 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -11.331 -19.331 1.519 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -10.630 -19.369 3.125 1.00 0.00 H new ATOM 653 N ALA A 43 -8.206 -16.860 1.584 1.00 0.00 N ATOM 654 CA ALA A 43 -6.765 -17.033 1.500 1.00 0.00 C ATOM 655 C ALA A 43 -6.083 -16.073 2.477 1.00 0.00 C ATOM 656 O ALA A 43 -5.294 -16.496 3.321 1.00 0.00 O ATOM 657 CB ALA A 43 -6.309 -16.817 0.057 1.00 0.00 C ATOM 0 H ALA A 43 -8.554 -15.982 1.198 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.483 -18.047 1.783 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.229 -16.947 -0.006 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -6.800 -17.542 -0.592 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -6.573 -15.808 -0.261 1.00 0.00 H new ATOM 663 N VAL A 44 -6.412 -14.798 2.332 1.00 0.00 N ATOM 664 CA VAL A 44 -5.841 -13.774 3.190 1.00 0.00 C ATOM 665 C VAL A 44 -6.918 -12.742 3.532 1.00 0.00 C ATOM 666 O VAL A 44 -7.735 -12.388 2.684 1.00 0.00 O ATOM 667 CB VAL A 44 -4.611 -13.156 2.522 1.00 0.00 C ATOM 668 CG1 VAL A 44 -4.226 -11.836 3.195 1.00 0.00 C ATOM 669 CG2 VAL A 44 -3.437 -14.135 2.523 1.00 0.00 C ATOM 0 H VAL A 44 -7.068 -14.450 1.632 1.00 0.00 H new ATOM 0 HA VAL A 44 -5.499 -14.210 4.129 1.00 0.00 H new ATOM 0 HB VAL A 44 -4.866 -12.941 1.484 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -3.349 -11.418 2.701 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -5.055 -11.133 3.118 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -3.999 -12.016 4.246 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -2.576 -13.671 2.042 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -3.182 -14.397 3.550 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -3.715 -15.037 1.977 1.00 0.00 H new ATOM 679 N GLU A 45 -6.884 -12.289 4.776 1.00 0.00 N ATOM 680 CA GLU A 45 -7.847 -11.304 5.241 1.00 0.00 C ATOM 681 C GLU A 45 -7.224 -9.907 5.232 1.00 0.00 C ATOM 682 O GLU A 45 -6.105 -9.719 5.709 1.00 0.00 O ATOM 683 CB GLU A 45 -8.369 -11.663 6.633 1.00 0.00 C ATOM 684 CG GLU A 45 -9.065 -10.466 7.284 1.00 0.00 C ATOM 685 CD GLU A 45 -8.311 -10.007 8.534 1.00 0.00 C ATOM 686 OE1 GLU A 45 -8.558 -10.614 9.599 1.00 0.00 O ATOM 687 OE2 GLU A 45 -7.507 -9.060 8.397 1.00 0.00 O ATOM 0 H GLU A 45 -6.205 -12.585 5.477 1.00 0.00 H new ATOM 0 HA GLU A 45 -8.697 -11.305 4.559 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -9.066 -12.498 6.560 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -7.542 -11.993 7.261 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -9.127 -9.645 6.570 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -10.087 -10.735 7.550 1.00 0.00 H new ATOM 694 N VAL A 46 -7.975 -8.963 4.685 1.00 0.00 N ATOM 695 CA VAL A 46 -7.511 -7.588 4.609 1.00 0.00 C ATOM 696 C VAL A 46 -8.479 -6.684 5.375 1.00 0.00 C ATOM 697 O VAL A 46 -9.689 -6.743 5.164 1.00 0.00 O ATOM 698 CB VAL A 46 -7.338 -7.175 3.145 1.00 0.00 C ATOM 699 CG1 VAL A 46 -7.218 -5.655 3.015 1.00 0.00 C ATOM 700 CG2 VAL A 46 -6.132 -7.876 2.517 1.00 0.00 C ATOM 0 H VAL A 46 -8.902 -9.123 4.290 1.00 0.00 H new ATOM 0 HA VAL A 46 -6.533 -7.488 5.079 1.00 0.00 H new ATOM 0 HB VAL A 46 -8.229 -7.488 2.600 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -7.096 -5.388 1.965 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -8.120 -5.184 3.407 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -6.353 -5.309 3.580 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.031 -7.565 1.477 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -5.229 -7.607 3.065 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -6.275 -8.956 2.561 1.00 0.00 H new ATOM 710 N THR A 47 -7.909 -5.867 6.249 1.00 0.00 N ATOM 711 CA THR A 47 -8.706 -4.951 7.048 1.00 0.00 C ATOM 712 C THR A 47 -7.935 -3.653 7.298 1.00 0.00 C ATOM 713 O THR A 47 -6.769 -3.538 6.927 1.00 0.00 O ATOM 714 CB THR A 47 -9.112 -5.675 8.333 1.00 0.00 C ATOM 715 OG1 THR A 47 -7.956 -6.433 8.684 1.00 0.00 O ATOM 716 CG2 THR A 47 -10.191 -6.732 8.094 1.00 0.00 C ATOM 0 H THR A 47 -6.905 -5.820 6.421 1.00 0.00 H new ATOM 0 HA THR A 47 -9.615 -4.656 6.524 1.00 0.00 H new ATOM 0 HB THR A 47 -9.471 -4.948 9.061 1.00 0.00 H new ATOM 0 HG1 THR A 47 -8.140 -7.387 8.558 1.00 0.00 H new ATOM 0 HG21 THR A 47 -10.442 -7.215 9.038 1.00 0.00 H new ATOM 0 HG22 THR A 47 -11.081 -6.257 7.682 1.00 0.00 H new ATOM 0 HG23 THR A 47 -9.820 -7.478 7.392 1.00 0.00 H new ATOM 724 N GLY A 48 -8.620 -2.708 7.927 1.00 0.00 N ATOM 725 CA GLY A 48 -8.015 -1.423 8.230 1.00 0.00 C ATOM 726 C GLY A 48 -8.272 -0.416 7.108 1.00 0.00 C ATOM 727 O GLY A 48 -8.349 0.786 7.353 1.00 0.00 O ATOM 0 H GLY A 48 -9.587 -2.807 8.234 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.419 -1.039 9.167 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -6.942 -1.547 8.373 1.00 0.00 H new ATOM 731 N LEU A 49 -8.398 -0.945 5.900 1.00 0.00 N ATOM 732 CA LEU A 49 -8.645 -0.108 4.738 1.00 0.00 C ATOM 733 C LEU A 49 -9.729 0.919 5.076 1.00 0.00 C ATOM 734 O LEU A 49 -10.460 0.756 6.051 1.00 0.00 O ATOM 735 CB LEU A 49 -8.973 -0.969 3.517 1.00 0.00 C ATOM 736 CG LEU A 49 -7.776 -1.457 2.700 1.00 0.00 C ATOM 737 CD1 LEU A 49 -8.222 -2.412 1.590 1.00 0.00 C ATOM 738 CD2 LEU A 49 -6.968 -0.279 2.152 1.00 0.00 C ATOM 0 H LEU A 49 -8.334 -1.943 5.701 1.00 0.00 H new ATOM 0 HA LEU A 49 -7.747 0.450 4.473 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -9.538 -1.839 3.852 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -9.628 -0.397 2.859 1.00 0.00 H new ATOM 0 HG LEU A 49 -7.117 -2.018 3.363 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -7.352 -2.744 1.024 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -8.719 -3.276 2.031 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -8.913 -1.897 0.923 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -6.123 -0.655 1.575 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -7.604 0.331 1.510 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -6.601 0.327 2.980 1.00 0.00 H new ATOM 750 N PRO A 50 -9.799 1.980 4.229 1.00 0.00 N ATOM 751 CA PRO A 50 -10.780 3.033 4.427 1.00 0.00 C ATOM 752 C PRO A 50 -12.178 2.565 4.013 1.00 0.00 C ATOM 753 O PRO A 50 -12.325 1.812 3.053 1.00 0.00 O ATOM 754 CB PRO A 50 -10.276 4.202 3.598 1.00 0.00 C ATOM 755 CG PRO A 50 -9.288 3.614 2.604 1.00 0.00 C ATOM 756 CD PRO A 50 -8.949 2.205 3.062 1.00 0.00 C ATOM 0 HA PRO A 50 -10.883 3.320 5.474 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -11.098 4.699 3.083 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -9.796 4.950 4.229 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -9.718 3.597 1.603 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -8.387 4.226 2.553 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -9.151 1.475 2.278 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -7.893 2.115 3.318 1.00 0.00 H new ATOM 764 N ASP A 51 -13.168 3.032 4.759 1.00 0.00 N ATOM 765 CA ASP A 51 -14.547 2.671 4.482 1.00 0.00 C ATOM 766 C ASP A 51 -14.916 3.129 3.069 1.00 0.00 C ATOM 767 O ASP A 51 -14.392 4.128 2.581 1.00 0.00 O ATOM 768 CB ASP A 51 -15.503 3.352 5.464 1.00 0.00 C ATOM 769 CG ASP A 51 -14.996 3.439 6.905 1.00 0.00 C ATOM 770 OD1 ASP A 51 -14.829 2.360 7.514 1.00 0.00 O ATOM 771 OD2 ASP A 51 -14.787 4.582 7.365 1.00 0.00 O ATOM 0 H ASP A 51 -13.042 3.657 5.555 1.00 0.00 H new ATOM 0 HA ASP A 51 -14.638 1.589 4.581 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -15.710 4.361 5.106 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -16.450 2.812 5.460 1.00 0.00 H new ATOM 776 N ASP A 52 -15.814 2.375 2.454 1.00 0.00 N ATOM 777 CA ASP A 52 -16.259 2.690 1.106 1.00 0.00 C ATOM 778 C ASP A 52 -15.126 2.402 0.119 1.00 0.00 C ATOM 779 O ASP A 52 -15.025 3.050 -0.922 1.00 0.00 O ATOM 780 CB ASP A 52 -16.630 4.170 0.981 1.00 0.00 C ATOM 781 CG ASP A 52 -17.931 4.448 0.228 1.00 0.00 C ATOM 782 OD1 ASP A 52 -18.169 3.741 -0.776 1.00 0.00 O ATOM 783 OD2 ASP A 52 -18.660 5.362 0.671 1.00 0.00 O ATOM 0 H ASP A 52 -16.246 1.547 2.863 1.00 0.00 H new ATOM 0 HA ASP A 52 -17.134 2.078 0.888 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -16.709 4.595 1.982 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -15.817 4.692 0.476 1.00 0.00 H new ATOM 788 N ILE A 53 -14.303 1.429 0.480 1.00 0.00 N ATOM 789 CA ILE A 53 -13.182 1.047 -0.360 1.00 0.00 C ATOM 790 C ILE A 53 -12.807 -0.409 -0.073 1.00 0.00 C ATOM 791 O ILE A 53 -12.421 -0.745 1.046 1.00 0.00 O ATOM 792 CB ILE A 53 -12.020 2.027 -0.183 1.00 0.00 C ATOM 793 CG1 ILE A 53 -12.446 3.452 -0.542 1.00 0.00 C ATOM 794 CG2 ILE A 53 -10.795 1.576 -0.981 1.00 0.00 C ATOM 795 CD1 ILE A 53 -11.246 4.402 -0.529 1.00 0.00 C ATOM 0 H ILE A 53 -14.391 0.893 1.344 1.00 0.00 H new ATOM 0 HA ILE A 53 -13.459 1.104 -1.413 1.00 0.00 H new ATOM 0 HB ILE A 53 -11.734 2.032 0.869 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -12.910 3.459 -1.528 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -13.198 3.800 0.166 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -9.984 2.290 -0.837 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -10.478 0.592 -0.635 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -11.049 1.524 -2.040 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -11.576 5.408 -0.787 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -10.800 4.411 0.465 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -10.507 4.065 -1.256 1.00 0.00 H new ATOM 807 N PRO A 54 -12.938 -1.255 -1.129 1.00 0.00 N ATOM 808 CA PRO A 54 -12.618 -2.667 -1.001 1.00 0.00 C ATOM 809 C PRO A 54 -11.103 -2.885 -0.969 1.00 0.00 C ATOM 810 O PRO A 54 -10.343 -1.949 -0.726 1.00 0.00 O ATOM 811 CB PRO A 54 -13.288 -3.332 -2.191 1.00 0.00 C ATOM 812 CG PRO A 54 -13.565 -2.220 -3.189 1.00 0.00 C ATOM 813 CD PRO A 54 -13.392 -0.893 -2.468 1.00 0.00 C ATOM 0 HA PRO A 54 -12.979 -3.097 -0.067 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -12.643 -4.095 -2.626 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -14.212 -3.828 -1.892 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -12.881 -2.287 -4.035 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -14.575 -2.309 -3.589 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -12.665 -0.259 -2.975 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -14.329 -0.337 -2.432 1.00 0.00 H new ATOM 821 N PHE A 55 -10.711 -4.126 -1.219 1.00 0.00 N ATOM 822 CA PHE A 55 -9.301 -4.478 -1.222 1.00 0.00 C ATOM 823 C PHE A 55 -8.915 -5.182 -2.524 1.00 0.00 C ATOM 824 O PHE A 55 -9.100 -6.391 -2.659 1.00 0.00 O ATOM 825 CB PHE A 55 -9.078 -5.439 -0.052 1.00 0.00 C ATOM 826 CG PHE A 55 -7.907 -6.404 -0.253 1.00 0.00 C ATOM 827 CD1 PHE A 55 -6.630 -5.937 -0.228 1.00 0.00 C ATOM 828 CD2 PHE A 55 -8.144 -7.727 -0.457 1.00 0.00 C ATOM 829 CE1 PHE A 55 -5.544 -6.831 -0.415 1.00 0.00 C ATOM 830 CE2 PHE A 55 -7.057 -8.622 -0.644 1.00 0.00 C ATOM 831 CZ PHE A 55 -5.779 -8.155 -0.619 1.00 0.00 C ATOM 0 H PHE A 55 -11.345 -4.899 -1.421 1.00 0.00 H new ATOM 0 HA PHE A 55 -8.692 -3.578 -1.132 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -8.905 -4.858 0.854 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -9.988 -6.017 0.109 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -6.442 -4.886 -0.066 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -9.158 -8.097 -0.477 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -4.530 -6.460 -0.395 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -7.245 -9.673 -0.806 1.00 0.00 H new ATOM 0 HZ PHE A 55 -4.952 -8.835 -0.761 1.00 0.00 H new ATOM 841 N ARG A 56 -8.385 -4.395 -3.450 1.00 0.00 N ATOM 842 CA ARG A 56 -7.972 -4.927 -4.737 1.00 0.00 C ATOM 843 C ARG A 56 -6.670 -4.264 -5.192 1.00 0.00 C ATOM 844 O ARG A 56 -6.156 -3.371 -4.519 1.00 0.00 O ATOM 845 CB ARG A 56 -9.049 -4.701 -5.799 1.00 0.00 C ATOM 846 CG ARG A 56 -10.412 -5.198 -5.312 1.00 0.00 C ATOM 847 CD ARG A 56 -11.093 -6.060 -6.377 1.00 0.00 C ATOM 848 NE ARG A 56 -12.260 -5.342 -6.938 1.00 0.00 N ATOM 849 CZ ARG A 56 -12.981 -5.779 -7.979 1.00 0.00 C ATOM 850 NH1 ARG A 56 -12.661 -6.933 -8.580 1.00 0.00 N ATOM 851 NH2 ARG A 56 -14.024 -5.062 -8.420 1.00 0.00 N ATOM 0 H ARG A 56 -8.232 -3.393 -3.334 1.00 0.00 H new ATOM 0 HA ARG A 56 -7.816 -5.999 -4.617 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -9.110 -3.640 -6.040 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -8.775 -5.221 -6.717 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -10.287 -5.776 -4.397 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -11.047 -4.347 -5.067 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -10.386 -6.298 -7.171 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -11.413 -7.006 -5.941 1.00 0.00 H new ATOM 0 HE ARG A 56 -12.532 -4.460 -6.505 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -11.868 -7.480 -8.245 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -13.211 -7.265 -9.373 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -14.269 -4.184 -7.963 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -14.573 -5.395 -9.213 1.00 0.00 H new ATOM 865 N ASN A 57 -6.174 -4.727 -6.329 1.00 0.00 N ATOM 866 CA ASN A 57 -4.942 -4.190 -6.881 1.00 0.00 C ATOM 867 C ASN A 57 -4.911 -2.675 -6.668 1.00 0.00 C ATOM 868 O ASN A 57 -5.895 -1.987 -6.930 1.00 0.00 O ATOM 869 CB ASN A 57 -4.848 -4.458 -8.385 1.00 0.00 C ATOM 870 CG ASN A 57 -3.390 -4.532 -8.840 1.00 0.00 C ATOM 871 OD1 ASN A 57 -2.948 -3.802 -9.712 1.00 0.00 O ATOM 872 ND2 ASN A 57 -2.670 -5.450 -8.202 1.00 0.00 N ATOM 0 H ASN A 57 -6.603 -5.468 -6.883 1.00 0.00 H new ATOM 0 HA ASN A 57 -4.107 -4.675 -6.376 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -5.355 -5.393 -8.623 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -5.363 -3.668 -8.931 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -1.685 -5.576 -8.433 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -3.103 -6.028 -7.482 1.00 0.00 H new ATOM 879 N PRO A 58 -3.737 -2.187 -6.183 1.00 0.00 N ATOM 880 CA PRO A 58 -3.564 -0.767 -5.933 1.00 0.00 C ATOM 881 C PRO A 58 -3.383 0.004 -7.243 1.00 0.00 C ATOM 882 O PRO A 58 -3.377 1.234 -7.248 1.00 0.00 O ATOM 883 CB PRO A 58 -2.355 -0.673 -5.017 1.00 0.00 C ATOM 884 CG PRO A 58 -1.619 -1.994 -5.162 1.00 0.00 C ATOM 885 CD PRO A 58 -2.549 -2.972 -5.862 1.00 0.00 C ATOM 0 HA PRO A 58 -4.438 -0.314 -5.465 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -1.715 0.163 -5.299 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -2.660 -0.507 -3.984 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -0.703 -1.859 -5.738 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -1.327 -2.378 -4.184 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -2.089 -3.381 -6.762 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -2.794 -3.816 -5.217 1.00 0.00 H new ATOM 893 N ASN A 59 -3.239 -0.752 -8.321 1.00 0.00 N ATOM 894 CA ASN A 59 -3.058 -0.157 -9.633 1.00 0.00 C ATOM 895 C ASN A 59 -4.417 -0.024 -10.321 1.00 0.00 C ATOM 896 O ASN A 59 -4.693 -0.718 -11.300 1.00 0.00 O ATOM 897 CB ASN A 59 -2.164 -1.030 -10.516 1.00 0.00 C ATOM 898 CG ASN A 59 -1.393 -0.179 -11.528 1.00 0.00 C ATOM 899 OD1 ASN A 59 -0.275 0.248 -11.293 1.00 0.00 O ATOM 900 ND2 ASN A 59 -2.051 0.041 -12.663 1.00 0.00 N ATOM 0 H ASN A 59 -3.244 -1.772 -8.312 1.00 0.00 H new ATOM 0 HA ASN A 59 -2.590 0.818 -9.498 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -1.463 -1.585 -9.893 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -2.773 -1.765 -11.043 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -1.621 0.597 -13.402 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -2.985 -0.347 -12.794 1.00 0.00 H new ATOM 907 N THR A 60 -5.233 0.870 -9.782 1.00 0.00 N ATOM 908 CA THR A 60 -6.558 1.101 -10.332 1.00 0.00 C ATOM 909 C THR A 60 -7.300 2.157 -9.509 1.00 0.00 C ATOM 910 O THR A 60 -8.056 2.959 -10.056 1.00 0.00 O ATOM 911 CB THR A 60 -7.286 -0.242 -10.394 1.00 0.00 C ATOM 912 OG1 THR A 60 -8.659 0.112 -10.543 1.00 0.00 O ATOM 913 CG2 THR A 60 -7.239 -0.996 -9.063 1.00 0.00 C ATOM 0 H THR A 60 -5.002 1.443 -8.970 1.00 0.00 H new ATOM 0 HA THR A 60 -6.501 1.503 -11.344 1.00 0.00 H new ATOM 0 HB THR A 60 -6.843 -0.858 -11.177 1.00 0.00 H new ATOM 0 HG1 THR A 60 -9.203 -0.702 -10.593 1.00 0.00 H new ATOM 0 HG21 THR A 60 -7.771 -1.942 -9.162 1.00 0.00 H new ATOM 0 HG22 THR A 60 -6.201 -1.189 -8.791 1.00 0.00 H new ATOM 0 HG23 THR A 60 -7.712 -0.394 -8.287 1.00 0.00 H new ATOM 921 N TYR A 61 -7.059 2.123 -8.207 1.00 0.00 N ATOM 922 CA TYR A 61 -7.694 3.066 -7.303 1.00 0.00 C ATOM 923 C TYR A 61 -7.559 4.499 -7.822 1.00 0.00 C ATOM 924 O TYR A 61 -6.895 4.739 -8.829 1.00 0.00 O ATOM 925 CB TYR A 61 -6.946 2.946 -5.974 1.00 0.00 C ATOM 926 CG TYR A 61 -7.217 1.640 -5.223 1.00 0.00 C ATOM 927 CD1 TYR A 61 -8.514 1.197 -5.056 1.00 0.00 C ATOM 928 CD2 TYR A 61 -6.166 0.906 -4.714 1.00 0.00 C ATOM 929 CE1 TYR A 61 -8.769 -0.032 -4.350 1.00 0.00 C ATOM 930 CE2 TYR A 61 -6.421 -0.323 -4.008 1.00 0.00 C ATOM 931 CZ TYR A 61 -7.710 -0.731 -3.861 1.00 0.00 C ATOM 932 OH TYR A 61 -7.950 -1.891 -3.194 1.00 0.00 O ATOM 0 H TYR A 61 -6.432 1.457 -7.756 1.00 0.00 H new ATOM 0 HA TYR A 61 -8.757 2.847 -7.206 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -5.876 3.029 -6.162 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -7.224 3.785 -5.336 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -9.337 1.772 -5.455 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -5.152 1.253 -4.845 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -9.778 -0.390 -4.212 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -5.607 -0.907 -3.605 1.00 0.00 H new ATOM 0 HH TYR A 61 -7.116 -2.400 -3.112 1.00 0.00 H new ATOM 942 N ASP A 62 -8.201 5.415 -7.111 1.00 0.00 N ATOM 943 CA ASP A 62 -8.161 6.818 -7.488 1.00 0.00 C ATOM 944 C ASP A 62 -7.436 7.612 -6.399 1.00 0.00 C ATOM 945 O ASP A 62 -7.187 7.097 -5.311 1.00 0.00 O ATOM 946 CB ASP A 62 -9.573 7.390 -7.631 1.00 0.00 C ATOM 947 CG ASP A 62 -10.532 6.541 -8.467 1.00 0.00 C ATOM 948 OD1 ASP A 62 -10.023 5.686 -9.223 1.00 0.00 O ATOM 949 OD2 ASP A 62 -11.755 6.765 -8.330 1.00 0.00 O ATOM 0 H ASP A 62 -8.751 5.213 -6.276 1.00 0.00 H new ATOM 0 HA ASP A 62 -7.642 6.897 -8.443 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -9.999 7.519 -6.636 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -9.504 8.381 -8.079 1.00 0.00 H new ATOM 954 N ILE A 63 -7.120 8.856 -6.731 1.00 0.00 N ATOM 955 CA ILE A 63 -6.430 9.727 -5.795 1.00 0.00 C ATOM 956 C ILE A 63 -6.977 9.492 -4.387 1.00 0.00 C ATOM 957 O ILE A 63 -6.287 8.937 -3.533 1.00 0.00 O ATOM 958 CB ILE A 63 -6.519 11.184 -6.254 1.00 0.00 C ATOM 959 CG1 ILE A 63 -5.330 11.553 -7.144 1.00 0.00 C ATOM 960 CG2 ILE A 63 -6.655 12.129 -5.058 1.00 0.00 C ATOM 961 CD1 ILE A 63 -5.534 11.044 -8.572 1.00 0.00 C ATOM 0 H ILE A 63 -7.329 9.281 -7.635 1.00 0.00 H new ATOM 0 HA ILE A 63 -5.367 9.490 -5.767 1.00 0.00 H new ATOM 0 HB ILE A 63 -7.420 11.297 -6.857 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -5.202 12.635 -7.155 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -4.416 11.128 -6.730 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -6.716 13.158 -5.412 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -7.559 11.883 -4.501 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -5.787 12.020 -4.408 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -4.674 11.320 -9.183 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -5.637 9.959 -8.560 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -6.436 11.490 -8.992 1.00 0.00 H new ATOM 973 N HIS A 64 -8.214 9.926 -4.186 1.00 0.00 N ATOM 974 CA HIS A 64 -8.861 9.768 -2.895 1.00 0.00 C ATOM 975 C HIS A 64 -8.500 8.406 -2.302 1.00 0.00 C ATOM 976 O HIS A 64 -7.727 8.325 -1.348 1.00 0.00 O ATOM 977 CB HIS A 64 -10.372 9.981 -3.016 1.00 0.00 C ATOM 978 CG HIS A 64 -10.757 11.263 -3.717 1.00 0.00 C ATOM 979 ND1 HIS A 64 -11.678 11.305 -4.749 1.00 0.00 N ATOM 980 CD2 HIS A 64 -10.339 12.546 -3.521 1.00 0.00 C ATOM 981 CE1 HIS A 64 -11.800 12.562 -5.150 1.00 0.00 C ATOM 982 NE2 HIS A 64 -10.968 13.329 -4.388 1.00 0.00 N ATOM 0 H HIS A 64 -8.784 10.386 -4.896 1.00 0.00 H new ATOM 0 HA HIS A 64 -8.498 10.531 -2.207 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -10.805 9.139 -3.556 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -10.810 9.979 -2.018 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -9.618 12.870 -2.785 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -12.444 12.917 -5.941 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -10.849 14.339 -4.471 1.00 0.00 H new ATOM 990 N ARG A 65 -9.076 7.368 -2.890 1.00 0.00 N ATOM 991 CA ARG A 65 -8.825 6.013 -2.433 1.00 0.00 C ATOM 992 C ARG A 65 -7.338 5.825 -2.122 1.00 0.00 C ATOM 993 O ARG A 65 -6.974 5.484 -0.997 1.00 0.00 O ATOM 994 CB ARG A 65 -9.253 4.987 -3.483 1.00 0.00 C ATOM 995 CG ARG A 65 -10.711 5.199 -3.896 1.00 0.00 C ATOM 996 CD ARG A 65 -11.478 3.875 -3.903 1.00 0.00 C ATOM 997 NE ARG A 65 -12.869 4.098 -4.351 1.00 0.00 N ATOM 998 CZ ARG A 65 -13.213 4.407 -5.610 1.00 0.00 C ATOM 999 NH1 ARG A 65 -12.268 4.529 -6.551 1.00 0.00 N ATOM 1000 NH2 ARG A 65 -14.503 4.591 -5.925 1.00 0.00 N ATOM 0 H ARG A 65 -9.717 7.439 -3.680 1.00 0.00 H new ATOM 0 HA ARG A 65 -9.413 5.855 -1.529 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -8.608 5.067 -4.358 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -9.127 3.980 -3.085 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -11.189 5.897 -3.209 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -10.750 5.651 -4.887 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -10.984 3.163 -4.564 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -11.475 3.438 -2.904 1.00 0.00 H new ATOM 0 HE ARG A 65 -13.614 4.011 -3.659 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -11.287 4.387 -6.310 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -12.529 4.764 -7.509 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -15.222 4.496 -5.208 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -14.766 4.826 -6.882 1.00 0.00 H new ATOM 1014 N LEU A 66 -6.521 6.055 -3.138 1.00 0.00 N ATOM 1015 CA LEU A 66 -5.083 5.915 -2.988 1.00 0.00 C ATOM 1016 C LEU A 66 -4.638 6.617 -1.703 1.00 0.00 C ATOM 1017 O LEU A 66 -3.838 6.075 -0.940 1.00 0.00 O ATOM 1018 CB LEU A 66 -4.362 6.414 -4.242 1.00 0.00 C ATOM 1019 CG LEU A 66 -4.383 5.471 -5.448 1.00 0.00 C ATOM 1020 CD1 LEU A 66 -3.626 6.078 -6.631 1.00 0.00 C ATOM 1021 CD2 LEU A 66 -3.846 4.088 -5.071 1.00 0.00 C ATOM 0 H LEU A 66 -6.827 6.338 -4.069 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.811 4.864 -2.889 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.808 7.363 -4.540 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.323 6.617 -3.983 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.418 5.339 -5.762 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -3.656 5.388 -7.475 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.093 7.021 -6.916 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.589 6.258 -6.346 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -3.872 3.437 -5.945 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.819 4.180 -4.717 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -4.464 3.660 -4.282 1.00 0.00 H new ATOM 1033 N GLU A 67 -5.174 7.812 -1.504 1.00 0.00 N ATOM 1034 CA GLU A 67 -4.842 8.593 -0.324 1.00 0.00 C ATOM 1035 C GLU A 67 -5.436 7.943 0.927 1.00 0.00 C ATOM 1036 O GLU A 67 -4.737 7.744 1.920 1.00 0.00 O ATOM 1037 CB GLU A 67 -5.321 10.038 -0.471 1.00 0.00 C ATOM 1038 CG GLU A 67 -4.352 10.853 -1.330 1.00 0.00 C ATOM 1039 CD GLU A 67 -3.679 11.952 -0.504 1.00 0.00 C ATOM 1040 OE1 GLU A 67 -4.352 12.977 -0.269 1.00 0.00 O ATOM 1041 OE2 GLU A 67 -2.505 11.740 -0.128 1.00 0.00 O ATOM 0 H GLU A 67 -5.835 8.258 -2.139 1.00 0.00 H new ATOM 0 HA GLU A 67 -3.757 8.613 -0.219 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -6.313 10.052 -0.923 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -5.413 10.496 0.514 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -3.593 10.195 -1.753 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -4.889 11.299 -2.167 1.00 0.00 H new ATOM 1048 N LYS A 68 -6.720 7.630 0.840 1.00 0.00 N ATOM 1049 CA LYS A 68 -7.416 7.007 1.953 1.00 0.00 C ATOM 1050 C LYS A 68 -6.599 5.817 2.458 1.00 0.00 C ATOM 1051 O LYS A 68 -6.319 5.712 3.651 1.00 0.00 O ATOM 1052 CB LYS A 68 -8.848 6.645 1.554 1.00 0.00 C ATOM 1053 CG LYS A 68 -9.595 7.869 1.018 1.00 0.00 C ATOM 1054 CD LYS A 68 -10.804 8.202 1.895 1.00 0.00 C ATOM 1055 CE LYS A 68 -11.382 9.572 1.535 1.00 0.00 C ATOM 1056 NZ LYS A 68 -11.028 10.572 2.567 1.00 0.00 N ATOM 0 H LYS A 68 -7.297 7.796 0.016 1.00 0.00 H new ATOM 0 HA LYS A 68 -7.508 7.706 2.784 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -8.831 5.864 0.794 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -9.378 6.240 2.416 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -8.920 8.724 0.983 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -9.924 7.680 -0.004 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -11.570 7.436 1.771 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -10.510 8.192 2.945 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -11.000 9.891 0.565 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -12.466 9.503 1.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -11.428 11.496 2.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -11.413 10.274 3.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -9.993 10.650 2.635 1.00 0.00 H new ATOM 1070 N ILE A 69 -6.240 4.948 1.524 1.00 0.00 N ATOM 1071 CA ILE A 69 -5.460 3.768 1.860 1.00 0.00 C ATOM 1072 C ILE A 69 -4.191 4.195 2.598 1.00 0.00 C ATOM 1073 O ILE A 69 -3.883 3.670 3.667 1.00 0.00 O ATOM 1074 CB ILE A 69 -5.191 2.931 0.608 1.00 0.00 C ATOM 1075 CG1 ILE A 69 -6.455 2.193 0.160 1.00 0.00 C ATOM 1076 CG2 ILE A 69 -4.018 1.974 0.830 1.00 0.00 C ATOM 1077 CD1 ILE A 69 -6.776 2.493 -1.305 1.00 0.00 C ATOM 0 H ILE A 69 -6.475 5.037 0.535 1.00 0.00 H new ATOM 0 HA ILE A 69 -6.019 3.120 2.535 1.00 0.00 H new ATOM 0 HB ILE A 69 -4.908 3.606 -0.200 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.320 1.120 0.294 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -7.295 2.489 0.788 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -3.848 1.391 -0.075 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -3.121 2.546 1.067 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -4.248 1.302 1.657 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.678 1.956 -1.597 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -6.934 3.564 -1.431 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -5.944 2.173 -1.933 1.00 0.00 H new ATOM 1089 N LEU A 70 -3.486 5.144 1.999 1.00 0.00 N ATOM 1090 CA LEU A 70 -2.256 5.647 2.586 1.00 0.00 C ATOM 1091 C LEU A 70 -2.551 6.201 3.982 1.00 0.00 C ATOM 1092 O LEU A 70 -1.791 5.968 4.920 1.00 0.00 O ATOM 1093 CB LEU A 70 -1.590 6.659 1.651 1.00 0.00 C ATOM 1094 CG LEU A 70 -0.734 6.072 0.527 1.00 0.00 C ATOM 1095 CD1 LEU A 70 0.165 7.142 -0.095 1.00 0.00 C ATOM 1096 CD2 LEU A 70 0.069 4.867 1.023 1.00 0.00 C ATOM 0 H LEU A 70 -3.744 5.578 1.113 1.00 0.00 H new ATOM 0 HA LEU A 70 -1.535 4.839 2.709 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -2.368 7.277 1.203 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -0.964 7.320 2.250 1.00 0.00 H new ATOM 0 HG LEU A 70 -1.400 5.715 -0.259 1.00 0.00 H new ATOM 0 HD11 LEU A 70 0.762 6.697 -0.891 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -0.452 7.941 -0.507 1.00 0.00 H new ATOM 0 HD13 LEU A 70 0.826 7.551 0.669 1.00 0.00 H new ATOM 0 HD21 LEU A 70 0.669 4.468 0.205 1.00 0.00 H new ATOM 0 HD22 LEU A 70 0.725 5.177 1.837 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -0.614 4.097 1.381 1.00 0.00 H new ATOM 1108 N LYS A 71 -3.658 6.924 4.074 1.00 0.00 N ATOM 1109 CA LYS A 71 -4.063 7.513 5.339 1.00 0.00 C ATOM 1110 C LYS A 71 -4.406 6.398 6.329 1.00 0.00 C ATOM 1111 O LYS A 71 -4.383 6.610 7.540 1.00 0.00 O ATOM 1112 CB LYS A 71 -5.200 8.514 5.124 1.00 0.00 C ATOM 1113 CG LYS A 71 -4.686 9.953 5.204 1.00 0.00 C ATOM 1114 CD LYS A 71 -4.079 10.394 3.869 1.00 0.00 C ATOM 1115 CE LYS A 71 -4.258 11.898 3.657 1.00 0.00 C ATOM 1116 NZ LYS A 71 -2.968 12.529 3.300 1.00 0.00 N ATOM 0 H LYS A 71 -4.286 7.115 3.294 1.00 0.00 H new ATOM 0 HA LYS A 71 -3.243 8.085 5.773 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -5.661 8.342 4.151 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -5.974 8.358 5.876 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -5.504 10.621 5.474 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -3.937 10.032 5.992 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -3.018 10.144 3.847 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -4.552 9.849 3.052 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -4.987 12.075 2.867 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -4.654 12.354 4.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -3.108 13.550 3.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -2.283 12.376 4.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -2.606 12.105 2.422 1.00 0.00 H new ATOM 1130 N ALA A 72 -4.715 5.234 5.777 1.00 0.00 N ATOM 1131 CA ALA A 72 -5.061 4.085 6.597 1.00 0.00 C ATOM 1132 C ALA A 72 -3.959 3.031 6.482 1.00 0.00 C ATOM 1133 O ALA A 72 -4.214 1.839 6.654 1.00 0.00 O ATOM 1134 CB ALA A 72 -6.429 3.547 6.171 1.00 0.00 C ATOM 0 H ALA A 72 -4.733 5.062 4.772 1.00 0.00 H new ATOM 0 HA ALA A 72 -5.135 4.371 7.646 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -6.689 2.685 6.786 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -7.182 4.325 6.300 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -6.392 3.247 5.124 1.00 0.00 H new ATOM 1140 N ARG A 73 -2.757 3.506 6.190 1.00 0.00 N ATOM 1141 CA ARG A 73 -1.615 2.620 6.050 1.00 0.00 C ATOM 1142 C ARG A 73 -1.279 1.970 7.393 1.00 0.00 C ATOM 1143 O ARG A 73 -0.857 0.816 7.441 1.00 0.00 O ATOM 1144 CB ARG A 73 -0.388 3.378 5.537 1.00 0.00 C ATOM 1145 CG ARG A 73 0.059 4.441 6.541 1.00 0.00 C ATOM 1146 CD ARG A 73 1.321 5.157 6.055 1.00 0.00 C ATOM 1147 NE ARG A 73 1.680 6.242 6.995 1.00 0.00 N ATOM 1148 CZ ARG A 73 1.153 7.474 6.959 1.00 0.00 C ATOM 1149 NH1 ARG A 73 0.239 7.784 6.029 1.00 0.00 N ATOM 1150 NH2 ARG A 73 1.538 8.395 7.852 1.00 0.00 N ATOM 0 H ARG A 73 -2.550 4.494 6.046 1.00 0.00 H new ATOM 0 HA ARG A 73 -1.881 1.850 5.326 1.00 0.00 H new ATOM 0 HB2 ARG A 73 0.427 2.677 5.357 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -0.620 3.849 4.582 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -0.741 5.166 6.689 1.00 0.00 H new ATOM 0 HG3 ARG A 73 0.250 3.976 7.508 1.00 0.00 H new ATOM 0 HD2 ARG A 73 2.144 4.447 5.975 1.00 0.00 H new ATOM 0 HD3 ARG A 73 1.156 5.567 5.059 1.00 0.00 H new ATOM 0 HE ARG A 73 2.372 6.040 7.716 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -0.055 7.083 5.349 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -0.162 8.721 6.001 1.00 0.00 H new ATOM 0 HH21 ARG A 73 2.233 8.159 8.560 1.00 0.00 H new ATOM 0 HH22 ARG A 73 1.136 9.332 7.824 1.00 0.00 H new ATOM 1164 N GLU A 74 -1.478 2.741 8.453 1.00 0.00 N ATOM 1165 CA GLU A 74 -1.201 2.255 9.794 1.00 0.00 C ATOM 1166 C GLU A 74 -2.366 1.401 10.301 1.00 0.00 C ATOM 1167 O GLU A 74 -2.199 0.598 11.216 1.00 0.00 O ATOM 1168 CB GLU A 74 -0.916 3.415 10.750 1.00 0.00 C ATOM 1169 CG GLU A 74 0.454 4.034 10.467 1.00 0.00 C ATOM 1170 CD GLU A 74 1.381 3.891 11.675 1.00 0.00 C ATOM 1171 OE1 GLU A 74 1.032 4.463 12.730 1.00 0.00 O ATOM 1172 OE2 GLU A 74 2.418 3.211 11.518 1.00 0.00 O ATOM 0 H GLU A 74 -1.828 3.698 8.410 1.00 0.00 H new ATOM 0 HA GLU A 74 -0.308 1.631 9.755 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -1.691 4.175 10.647 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -0.953 3.060 11.780 1.00 0.00 H new ATOM 0 HG2 GLU A 74 0.904 3.550 9.600 1.00 0.00 H new ATOM 0 HG3 GLU A 74 0.336 5.089 10.218 1.00 0.00 H new ATOM 1179 N HIS A 75 -3.520 1.606 9.682 1.00 0.00 N ATOM 1180 CA HIS A 75 -4.712 0.866 10.059 1.00 0.00 C ATOM 1181 C HIS A 75 -4.779 -0.440 9.264 1.00 0.00 C ATOM 1182 O HIS A 75 -5.137 -1.484 9.806 1.00 0.00 O ATOM 1183 CB HIS A 75 -5.964 1.728 9.887 1.00 0.00 C ATOM 1184 CG HIS A 75 -6.063 2.870 10.871 1.00 0.00 C ATOM 1185 ND1 HIS A 75 -6.828 2.804 12.022 1.00 0.00 N ATOM 1186 CD2 HIS A 75 -5.484 4.105 10.863 1.00 0.00 C ATOM 1187 CE1 HIS A 75 -6.709 3.954 12.670 1.00 0.00 C ATOM 1188 NE2 HIS A 75 -5.876 4.759 11.949 1.00 0.00 N ATOM 0 H HIS A 75 -3.654 2.274 8.923 1.00 0.00 H new ATOM 0 HA HIS A 75 -4.663 0.606 11.116 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -5.978 2.132 8.875 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -6.845 1.095 9.990 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -4.819 4.486 10.102 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -7.187 4.209 13.604 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -5.600 5.708 12.203 1.00 0.00 H new ATOM 1196 N VAL A 76 -4.426 -0.338 7.991 1.00 0.00 N ATOM 1197 CA VAL A 76 -4.440 -1.498 7.115 1.00 0.00 C ATOM 1198 C VAL A 76 -3.732 -2.664 7.808 1.00 0.00 C ATOM 1199 O VAL A 76 -2.613 -2.513 8.295 1.00 0.00 O ATOM 1200 CB VAL A 76 -3.821 -1.141 5.763 1.00 0.00 C ATOM 1201 CG1 VAL A 76 -3.588 -2.395 4.918 1.00 0.00 C ATOM 1202 CG2 VAL A 76 -4.689 -0.128 5.013 1.00 0.00 C ATOM 0 H VAL A 76 -4.129 0.530 7.545 1.00 0.00 H new ATOM 0 HA VAL A 76 -5.464 -1.813 6.915 1.00 0.00 H new ATOM 0 HB VAL A 76 -2.852 -0.679 5.950 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -3.147 -2.113 3.962 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -2.912 -3.068 5.445 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -4.539 -2.899 4.744 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -4.226 0.109 4.055 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -5.679 -0.552 4.843 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -4.781 0.782 5.606 1.00 0.00 H new ATOM 1212 N ARG A 77 -4.414 -3.800 7.830 1.00 0.00 N ATOM 1213 CA ARG A 77 -3.863 -4.990 8.456 1.00 0.00 C ATOM 1214 C ARG A 77 -4.258 -6.237 7.662 1.00 0.00 C ATOM 1215 O ARG A 77 -5.388 -6.346 7.191 1.00 0.00 O ATOM 1216 CB ARG A 77 -4.357 -5.134 9.897 1.00 0.00 C ATOM 1217 CG ARG A 77 -3.450 -6.073 10.696 1.00 0.00 C ATOM 1218 CD ARG A 77 -4.201 -7.342 11.105 1.00 0.00 C ATOM 1219 NE ARG A 77 -4.202 -7.476 12.579 1.00 0.00 N ATOM 1220 CZ ARG A 77 -3.173 -7.955 13.291 1.00 0.00 C ATOM 1221 NH1 ARG A 77 -2.052 -8.348 12.667 1.00 0.00 N ATOM 1222 NH2 ARG A 77 -3.262 -8.041 14.625 1.00 0.00 N ATOM 0 H ARG A 77 -5.342 -3.921 7.425 1.00 0.00 H new ATOM 0 HA ARG A 77 -2.778 -4.888 8.465 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -4.385 -4.155 10.375 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -5.377 -5.519 9.899 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -2.578 -6.339 10.098 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -3.083 -5.561 11.585 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -5.225 -7.304 10.734 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -3.731 -8.215 10.652 1.00 0.00 H new ATOM 0 HE ARG A 77 -5.039 -7.185 13.085 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -1.984 -8.282 11.651 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -1.268 -8.713 13.208 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -4.114 -7.742 15.100 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -2.478 -8.406 15.166 1.00 0.00 H new ATOM 1236 N MET A 78 -3.303 -7.147 7.539 1.00 0.00 N ATOM 1237 CA MET A 78 -3.536 -8.383 6.810 1.00 0.00 C ATOM 1238 C MET A 78 -3.456 -9.593 7.743 1.00 0.00 C ATOM 1239 O MET A 78 -2.591 -9.653 8.615 1.00 0.00 O ATOM 1240 CB MET A 78 -2.496 -8.524 5.699 1.00 0.00 C ATOM 1241 CG MET A 78 -2.816 -7.596 4.526 1.00 0.00 C ATOM 1242 SD MET A 78 -1.530 -7.702 3.293 1.00 0.00 S ATOM 1243 CE MET A 78 -2.241 -6.681 2.013 1.00 0.00 C ATOM 0 H MET A 78 -2.366 -7.054 7.932 1.00 0.00 H new ATOM 0 HA MET A 78 -4.537 -8.346 6.379 1.00 0.00 H new ATOM 0 HB2 MET A 78 -1.506 -8.292 6.091 1.00 0.00 H new ATOM 0 HB3 MET A 78 -2.467 -9.557 5.352 1.00 0.00 H new ATOM 0 HG2 MET A 78 -3.775 -7.870 4.087 1.00 0.00 H new ATOM 0 HG3 MET A 78 -2.908 -6.569 4.879 1.00 0.00 H new ATOM 0 HE1 MET A 78 -1.480 -6.006 1.621 1.00 0.00 H new ATOM 0 HE2 MET A 78 -2.614 -7.314 1.208 1.00 0.00 H new ATOM 0 HE3 MET A 78 -3.064 -6.099 2.427 1.00 0.00 H new ATOM 1253 N VAL A 79 -4.369 -10.528 7.527 1.00 0.00 N ATOM 1254 CA VAL A 79 -4.412 -11.734 8.338 1.00 0.00 C ATOM 1255 C VAL A 79 -4.511 -12.955 7.421 1.00 0.00 C ATOM 1256 O VAL A 79 -5.454 -13.075 6.641 1.00 0.00 O ATOM 1257 CB VAL A 79 -5.560 -11.647 9.344 1.00 0.00 C ATOM 1258 CG1 VAL A 79 -5.650 -12.922 10.184 1.00 0.00 C ATOM 1259 CG2 VAL A 79 -5.414 -10.412 10.236 1.00 0.00 C ATOM 0 H VAL A 79 -5.085 -10.475 6.802 1.00 0.00 H new ATOM 0 HA VAL A 79 -3.496 -11.837 8.920 1.00 0.00 H new ATOM 0 HB VAL A 79 -6.490 -11.548 8.784 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -6.475 -12.834 10.892 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -5.822 -13.777 9.530 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -4.717 -13.065 10.730 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -6.243 -10.373 10.943 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -4.473 -10.468 10.783 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.422 -9.514 9.618 1.00 0.00 H new ATOM 1269 N ILE A 80 -3.525 -13.831 7.547 1.00 0.00 N ATOM 1270 CA ILE A 80 -3.490 -15.039 6.740 1.00 0.00 C ATOM 1271 C ILE A 80 -4.595 -15.990 7.205 1.00 0.00 C ATOM 1272 O ILE A 80 -4.483 -16.607 8.264 1.00 0.00 O ATOM 1273 CB ILE A 80 -2.092 -15.660 6.767 1.00 0.00 C ATOM 1274 CG1 ILE A 80 -1.022 -14.618 6.438 1.00 0.00 C ATOM 1275 CG2 ILE A 80 -2.013 -16.875 5.839 1.00 0.00 C ATOM 1276 CD1 ILE A 80 -1.069 -14.232 4.958 1.00 0.00 C ATOM 0 H ILE A 80 -2.744 -13.728 8.196 1.00 0.00 H new ATOM 0 HA ILE A 80 -3.690 -14.805 5.694 1.00 0.00 H new ATOM 0 HB ILE A 80 -1.896 -16.014 7.779 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -1.172 -13.731 7.054 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -0.036 -15.014 6.683 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -1.009 -17.297 5.877 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -2.735 -17.626 6.160 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -2.239 -16.568 4.818 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -0.298 -13.490 4.751 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -0.895 -15.117 4.346 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -2.048 -13.814 4.722 1.00 0.00 H new ATOM 1288 N ILE A 81 -5.636 -16.079 6.390 1.00 0.00 N ATOM 1289 CA ILE A 81 -6.761 -16.944 6.705 1.00 0.00 C ATOM 1290 C ILE A 81 -6.350 -18.404 6.494 1.00 0.00 C ATOM 1291 O ILE A 81 -6.572 -19.246 7.362 1.00 0.00 O ATOM 1292 CB ILE A 81 -7.996 -16.531 5.903 1.00 0.00 C ATOM 1293 CG1 ILE A 81 -8.427 -15.105 6.255 1.00 0.00 C ATOM 1294 CG2 ILE A 81 -9.134 -17.537 6.091 1.00 0.00 C ATOM 1295 CD1 ILE A 81 -8.703 -14.971 7.754 1.00 0.00 C ATOM 0 H ILE A 81 -5.724 -15.567 5.512 1.00 0.00 H new ATOM 0 HA ILE A 81 -7.041 -16.839 7.753 1.00 0.00 H new ATOM 0 HB ILE A 81 -7.734 -16.536 4.845 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -7.647 -14.402 5.961 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -9.322 -14.842 5.692 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -10.000 -17.220 5.510 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -8.810 -18.521 5.751 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -9.404 -17.588 7.146 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -9.007 -13.949 7.978 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -9.500 -15.658 8.040 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -7.799 -15.211 8.313 1.00 0.00 H new ATOM 1307 N ASN A 82 -5.759 -18.656 5.335 1.00 0.00 N ATOM 1308 CA ASN A 82 -5.316 -19.999 5.000 1.00 0.00 C ATOM 1309 C ASN A 82 -3.809 -19.982 4.732 1.00 0.00 C ATOM 1310 O ASN A 82 -3.367 -19.531 3.676 1.00 0.00 O ATOM 1311 CB ASN A 82 -6.014 -20.510 3.738 1.00 0.00 C ATOM 1312 CG ASN A 82 -5.877 -22.029 3.612 1.00 0.00 C ATOM 1313 OD1 ASN A 82 -4.874 -22.552 3.156 1.00 0.00 O ATOM 1314 ND2 ASN A 82 -6.938 -22.706 4.041 1.00 0.00 N ATOM 0 H ASN A 82 -5.577 -17.954 4.617 1.00 0.00 H new ATOM 0 HA ASN A 82 -5.559 -20.653 5.837 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -7.069 -20.238 3.766 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -5.584 -20.028 2.860 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -6.944 -23.725 3.999 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -7.746 -22.206 4.412 1.00 0.00 H new ATOM 1321 N GLN A 83 -3.062 -20.478 5.707 1.00 0.00 N ATOM 1322 CA GLN A 83 -1.614 -20.526 5.590 1.00 0.00 C ATOM 1323 C GLN A 83 -1.183 -21.793 4.848 1.00 0.00 C ATOM 1324 O GLN A 83 -1.955 -22.744 4.737 1.00 0.00 O ATOM 1325 CB GLN A 83 -0.950 -20.443 6.966 1.00 0.00 C ATOM 1326 CG GLN A 83 0.394 -19.718 6.883 1.00 0.00 C ATOM 1327 CD GLN A 83 1.005 -19.533 8.275 1.00 0.00 C ATOM 1328 OE1 GLN A 83 1.689 -20.397 8.799 1.00 0.00 O ATOM 1329 NE2 GLN A 83 0.719 -18.365 8.840 1.00 0.00 N ATOM 0 H GLN A 83 -3.432 -20.850 6.582 1.00 0.00 H new ATOM 0 HA GLN A 83 -1.287 -19.662 5.012 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -1.607 -19.919 7.660 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -0.802 -21.447 7.363 1.00 0.00 H new ATOM 0 HG2 GLN A 83 1.079 -20.286 6.254 1.00 0.00 H new ATOM 0 HG3 GLN A 83 0.258 -18.746 6.410 1.00 0.00 H new ATOM 0 HE21 GLN A 83 0.140 -17.687 8.345 1.00 0.00 H new ATOM 0 HE22 GLN A 83 1.078 -18.146 9.769 1.00 0.00 H new ATOM 1338 N SER A 84 0.048 -21.764 4.359 1.00 0.00 N ATOM 1339 CA SER A 84 0.591 -22.897 3.631 1.00 0.00 C ATOM 1340 C SER A 84 -0.160 -23.080 2.310 1.00 0.00 C ATOM 1341 O SER A 84 -1.376 -22.902 2.254 1.00 0.00 O ATOM 1342 CB SER A 84 0.513 -24.177 4.467 1.00 0.00 C ATOM 1343 OG SER A 84 1.796 -24.770 4.654 1.00 0.00 O ATOM 0 H SER A 84 0.685 -20.973 4.453 1.00 0.00 H new ATOM 0 HA SER A 84 1.641 -22.696 3.420 1.00 0.00 H new ATOM 0 HB2 SER A 84 0.073 -23.950 5.438 1.00 0.00 H new ATOM 0 HB3 SER A 84 -0.149 -24.891 3.977 1.00 0.00 H new ATOM 0 HG SER A 84 1.705 -25.583 5.193 1.00 0.00 H new ATOM 1349 N GLY A 85 0.595 -23.432 1.281 1.00 0.00 N ATOM 1350 CA GLY A 85 0.016 -23.640 -0.036 1.00 0.00 C ATOM 1351 C GLY A 85 1.062 -23.431 -1.134 1.00 0.00 C ATOM 1352 O GLY A 85 2.116 -24.063 -1.119 1.00 0.00 O ATOM 0 H GLY A 85 1.603 -23.579 1.332 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -0.390 -24.649 -0.103 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -0.815 -22.951 -0.185 1.00 0.00 H new ATOM 1356 N PRO A 86 0.722 -22.519 -2.084 1.00 0.00 N ATOM 1357 CA PRO A 86 1.619 -22.219 -3.187 1.00 0.00 C ATOM 1358 C PRO A 86 2.790 -21.351 -2.721 1.00 0.00 C ATOM 1359 O PRO A 86 2.606 -20.181 -2.389 1.00 0.00 O ATOM 1360 CB PRO A 86 0.748 -21.534 -4.227 1.00 0.00 C ATOM 1361 CG PRO A 86 -0.491 -21.059 -3.486 1.00 0.00 C ATOM 1362 CD PRO A 86 -0.519 -21.752 -2.133 1.00 0.00 C ATOM 0 HA PRO A 86 2.086 -23.111 -3.604 1.00 0.00 H new ATOM 0 HB2 PRO A 86 1.273 -20.697 -4.686 1.00 0.00 H new ATOM 0 HB3 PRO A 86 0.483 -22.223 -5.029 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -0.469 -19.977 -3.360 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -1.390 -21.296 -4.055 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -0.570 -21.029 -1.319 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -1.390 -22.401 -2.038 1.00 0.00 H new ATOM 1370 N SER A 87 3.968 -21.957 -2.713 1.00 0.00 N ATOM 1371 CA SER A 87 5.168 -21.255 -2.294 1.00 0.00 C ATOM 1372 C SER A 87 6.410 -22.044 -2.711 1.00 0.00 C ATOM 1373 O SER A 87 6.319 -23.229 -3.026 1.00 0.00 O ATOM 1374 CB SER A 87 5.171 -21.022 -0.782 1.00 0.00 C ATOM 1375 OG SER A 87 5.774 -19.779 -0.433 1.00 0.00 O ATOM 0 H SER A 87 4.117 -22.927 -2.990 1.00 0.00 H new ATOM 0 HA SER A 87 5.182 -20.282 -2.785 1.00 0.00 H new ATOM 0 HB2 SER A 87 4.147 -21.045 -0.410 1.00 0.00 H new ATOM 0 HB3 SER A 87 5.706 -21.835 -0.291 1.00 0.00 H new ATOM 0 HG SER A 87 5.754 -19.668 0.540 1.00 0.00 H new ATOM 1381 N SER A 88 7.542 -21.355 -2.701 1.00 0.00 N ATOM 1382 CA SER A 88 8.801 -21.977 -3.075 1.00 0.00 C ATOM 1383 C SER A 88 9.053 -23.210 -2.206 1.00 0.00 C ATOM 1384 O SER A 88 9.077 -23.114 -0.980 1.00 0.00 O ATOM 1385 CB SER A 88 9.962 -20.990 -2.948 1.00 0.00 C ATOM 1386 OG SER A 88 9.873 -19.934 -3.902 1.00 0.00 O ATOM 0 H SER A 88 7.613 -20.372 -2.440 1.00 0.00 H new ATOM 0 HA SER A 88 8.735 -22.284 -4.119 1.00 0.00 H new ATOM 0 HB2 SER A 88 9.972 -20.570 -1.942 1.00 0.00 H new ATOM 0 HB3 SER A 88 10.905 -21.520 -3.081 1.00 0.00 H new ATOM 0 HG SER A 88 10.632 -19.324 -3.787 1.00 0.00 H new ATOM 1392 N GLY A 89 9.237 -24.339 -2.874 1.00 0.00 N ATOM 1393 CA GLY A 89 9.488 -25.589 -2.177 1.00 0.00 C ATOM 1394 C GLY A 89 9.653 -26.744 -3.166 1.00 0.00 C ATOM 1395 O GLY A 89 8.788 -26.972 -4.011 1.00 0.00 O ATOM 0 H GLY A 89 9.217 -24.414 -3.891 1.00 0.00 H new ATOM 0 HA2 GLY A 89 10.387 -25.496 -1.568 1.00 0.00 H new ATOM 0 HA3 GLY A 89 8.663 -25.803 -1.497 1.00 0.00 H new TER 1399 GLY A 89