USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 846 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 66 MET CE :methyl -113:sc= -1.22 (180deg=-2.49!) USER MOD Set 1.2: A 90 MET CE :methyl 145:sc= -0.953 (180deg=-5.86!) USER MOD Single : A 2 SER OG : rot 25:sc= 0.393 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot -85:sc= 1.21 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= -0.0785 X(o=-0.078,f=-0.0059) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=-0.068) USER MOD Single : A 28 HIS :FLIP no HD1:sc= -4.66! C(o=-6.3!,f=-4.7!) USER MOD Single : A 30 TYR OH : rot 180:sc= -1.37 USER MOD Single : A 31 LYS NZ :NH3+ 157:sc= 0.0344 (180deg=-0.0198) USER MOD Single : A 35 THR OG1 : rot 171:sc= -1.03 USER MOD Single : A 36 GLN : amide:sc= -0.0206 X(o=-0.021,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= -0.615 K(o=-0.61,f=-6.4!) USER MOD Single : A 46 MET CE :methyl -147:sc= 0 (180deg=-0.512) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= -0.136 K(o=-0.14,f=-0.77) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= -0.325 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc=-0.00357 USER MOD Single : A 71 MET CE :methyl 154:sc= -3.53 (180deg=-5.85!) USER MOD Single : A 76 THR OG1 : rot -87:sc= 1.25 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl -165:sc=-0.00203 (180deg=-0.21) USER MOD Single : A 87 GLN : amide:sc= -0.173 K(o=-0.17,f=-0.81) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.587 X(o=-0.59,f=-0.39) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 18 N SER A 2 1.136 -1.765 -1.879 1.00 0.00 N ATOM 19 CA SER A 2 0.579 -2.855 -2.671 1.00 0.00 C ATOM 20 C SER A 2 -0.856 -3.156 -2.249 1.00 0.00 C ATOM 21 O SER A 2 -1.201 -3.063 -1.070 1.00 0.00 O ATOM 22 CB SER A 2 1.439 -4.112 -2.524 1.00 0.00 C ATOM 23 OG SER A 2 2.818 -3.787 -2.513 1.00 0.00 O ATOM 0 HA SER A 2 0.575 -2.546 -3.716 1.00 0.00 H new ATOM 0 HB2 SER A 2 1.177 -4.630 -1.602 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.230 -4.798 -3.345 1.00 0.00 H new ATOM 0 HG SER A 2 2.934 -2.863 -2.207 1.00 0.00 H new ATOM 29 N LEU A 3 -1.689 -3.516 -3.219 1.00 0.00 N ATOM 30 CA LEU A 3 -3.088 -3.830 -2.950 1.00 0.00 C ATOM 31 C LEU A 3 -3.374 -5.305 -3.212 1.00 0.00 C ATOM 32 O LEU A 3 -2.831 -5.899 -4.143 1.00 0.00 O ATOM 33 CB LEU A 3 -4.002 -2.960 -3.814 1.00 0.00 C ATOM 34 CG LEU A 3 -4.218 -1.526 -3.329 1.00 0.00 C ATOM 35 CD1 LEU A 3 -4.409 -0.587 -4.510 1.00 0.00 C ATOM 36 CD2 LEU A 3 -5.413 -1.454 -2.390 1.00 0.00 C ATOM 0 H LEU A 3 -1.420 -3.598 -4.199 1.00 0.00 H new ATOM 0 HA LEU A 3 -3.286 -3.621 -1.899 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -3.589 -2.923 -4.822 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -4.974 -3.448 -3.886 1.00 0.00 H new ATOM 0 HG LEU A 3 -3.331 -1.211 -2.780 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -4.561 0.429 -4.146 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -3.523 -0.616 -5.145 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -5.279 -0.900 -5.087 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -5.551 -0.426 -2.055 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -6.308 -1.788 -2.914 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -5.237 -2.096 -1.527 1.00 0.00 H new ATOM 48 N LYS A 4 -4.234 -5.892 -2.385 1.00 0.00 N ATOM 49 CA LYS A 4 -4.597 -7.296 -2.528 1.00 0.00 C ATOM 50 C LYS A 4 -5.245 -7.555 -3.884 1.00 0.00 C ATOM 51 O LYS A 4 -5.025 -8.599 -4.498 1.00 0.00 O ATOM 52 CB LYS A 4 -5.550 -7.715 -1.406 1.00 0.00 C ATOM 53 CG LYS A 4 -4.982 -7.501 -0.014 1.00 0.00 C ATOM 54 CD LYS A 4 -4.435 -8.792 0.570 1.00 0.00 C ATOM 55 CE LYS A 4 -2.914 -8.798 0.583 1.00 0.00 C ATOM 56 NZ LYS A 4 -2.369 -10.020 1.237 1.00 0.00 N ATOM 0 H LYS A 4 -4.692 -5.416 -1.608 1.00 0.00 H new ATOM 0 HA LYS A 4 -3.685 -7.890 -2.462 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -6.479 -7.153 -1.501 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -5.801 -8.768 -1.529 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -4.189 -6.754 -0.055 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -5.759 -7.105 0.640 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -4.809 -8.920 1.586 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -4.798 -9.639 -0.013 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -2.542 -8.737 -0.440 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -2.552 -7.914 1.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -1.330 -9.986 1.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -2.703 -10.066 2.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -2.693 -10.863 0.722 1.00 0.00 H new ATOM 70 N SER A 5 -6.044 -6.599 -4.345 1.00 0.00 N ATOM 71 CA SER A 5 -6.727 -6.725 -5.628 1.00 0.00 C ATOM 72 C SER A 5 -5.728 -6.990 -6.750 1.00 0.00 C ATOM 73 O SER A 5 -6.077 -7.562 -7.783 1.00 0.00 O ATOM 74 CB SER A 5 -7.526 -5.456 -5.931 1.00 0.00 C ATOM 75 OG SER A 5 -6.744 -4.295 -5.711 1.00 0.00 O ATOM 0 H SER A 5 -6.235 -5.728 -3.850 1.00 0.00 H new ATOM 0 HA SER A 5 -7.412 -7.571 -5.566 1.00 0.00 H new ATOM 0 HB2 SER A 5 -7.868 -5.477 -6.966 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.415 -5.424 -5.302 1.00 0.00 H new ATOM 0 HG SER A 5 -6.789 -4.045 -4.765 1.00 0.00 H new ATOM 81 N ASP A 6 -4.486 -6.571 -6.540 1.00 0.00 N ATOM 82 CA ASP A 6 -3.435 -6.763 -7.532 1.00 0.00 C ATOM 83 C ASP A 6 -3.317 -8.234 -7.921 1.00 0.00 C ATOM 84 O ASP A 6 -3.133 -8.563 -9.092 1.00 0.00 O ATOM 85 CB ASP A 6 -2.096 -6.256 -6.994 1.00 0.00 C ATOM 86 CG ASP A 6 -1.178 -5.764 -8.096 1.00 0.00 C ATOM 87 OD1 ASP A 6 -1.436 -4.669 -8.638 1.00 0.00 O ATOM 88 OD2 ASP A 6 -0.201 -6.473 -8.415 1.00 0.00 O ATOM 0 H ASP A 6 -4.182 -6.095 -5.691 1.00 0.00 H new ATOM 0 HA ASP A 6 -3.700 -6.190 -8.421 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -2.275 -5.447 -6.286 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -1.602 -7.057 -6.444 1.00 0.00 H new ATOM 93 N GLU A 7 -3.424 -9.113 -6.929 1.00 0.00 N ATOM 94 CA GLU A 7 -3.327 -10.548 -7.168 1.00 0.00 C ATOM 95 C GLU A 7 -4.420 -11.015 -8.125 1.00 0.00 C ATOM 96 O GLU A 7 -4.146 -11.693 -9.115 1.00 0.00 O ATOM 97 CB GLU A 7 -3.428 -11.315 -5.848 1.00 0.00 C ATOM 98 CG GLU A 7 -2.086 -11.781 -5.310 1.00 0.00 C ATOM 99 CD GLU A 7 -2.208 -12.989 -4.403 1.00 0.00 C ATOM 100 OE1 GLU A 7 -2.922 -13.943 -4.778 1.00 0.00 O ATOM 101 OE2 GLU A 7 -1.591 -12.982 -3.317 1.00 0.00 O ATOM 0 H GLU A 7 -3.578 -8.857 -5.954 1.00 0.00 H new ATOM 0 HA GLU A 7 -2.358 -10.750 -7.624 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -3.907 -10.679 -5.104 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -4.074 -12.182 -5.990 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -1.429 -12.023 -6.145 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -1.616 -10.965 -4.761 1.00 0.00 H new ATOM 108 N VAL A 8 -5.661 -10.647 -7.822 1.00 0.00 N ATOM 109 CA VAL A 8 -6.796 -11.027 -8.655 1.00 0.00 C ATOM 110 C VAL A 8 -6.654 -10.469 -10.066 1.00 0.00 C ATOM 111 O VAL A 8 -6.836 -11.185 -11.051 1.00 0.00 O ATOM 112 CB VAL A 8 -8.125 -10.535 -8.051 1.00 0.00 C ATOM 113 CG1 VAL A 8 -9.290 -10.892 -8.961 1.00 0.00 C ATOM 114 CG2 VAL A 8 -8.326 -11.117 -6.660 1.00 0.00 C ATOM 0 H VAL A 8 -5.906 -10.086 -7.006 1.00 0.00 H new ATOM 0 HA VAL A 8 -6.806 -12.116 -8.698 1.00 0.00 H new ATOM 0 HB VAL A 8 -8.084 -9.449 -7.963 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -10.220 -10.536 -8.518 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -9.149 -10.422 -9.934 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.337 -11.974 -9.084 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -9.270 -10.759 -6.249 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -8.346 -12.205 -6.720 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -7.506 -10.805 -6.013 1.00 0.00 H new ATOM 124 N PHE A 9 -6.326 -9.184 -10.158 1.00 0.00 N ATOM 125 CA PHE A 9 -6.159 -8.528 -11.450 1.00 0.00 C ATOM 126 C PHE A 9 -5.014 -9.158 -12.236 1.00 0.00 C ATOM 127 O PHE A 9 -5.038 -9.196 -13.466 1.00 0.00 O ATOM 128 CB PHE A 9 -5.898 -7.033 -11.256 1.00 0.00 C ATOM 129 CG PHE A 9 -7.152 -6.212 -11.159 1.00 0.00 C ATOM 130 CD1 PHE A 9 -8.146 -6.547 -10.254 1.00 0.00 C ATOM 131 CD2 PHE A 9 -7.336 -5.106 -11.973 1.00 0.00 C ATOM 132 CE1 PHE A 9 -9.302 -5.794 -10.164 1.00 0.00 C ATOM 133 CE2 PHE A 9 -8.490 -4.349 -11.887 1.00 0.00 C ATOM 134 CZ PHE A 9 -9.473 -4.693 -10.980 1.00 0.00 C ATOM 0 H PHE A 9 -6.171 -8.577 -9.353 1.00 0.00 H new ATOM 0 HA PHE A 9 -7.080 -8.658 -12.018 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -5.309 -6.890 -10.350 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -5.297 -6.666 -12.088 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -8.016 -7.406 -9.612 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -6.569 -4.832 -12.683 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -10.071 -6.067 -9.456 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -8.622 -3.490 -12.528 1.00 0.00 H new ATOM 0 HZ PHE A 9 -10.374 -4.102 -10.909 1.00 0.00 H new ATOM 144 N ALA A 10 -4.011 -9.652 -11.517 1.00 0.00 N ATOM 145 CA ALA A 10 -2.857 -10.282 -12.146 1.00 0.00 C ATOM 146 C ALA A 10 -3.233 -11.627 -12.760 1.00 0.00 C ATOM 147 O ALA A 10 -2.872 -11.924 -13.899 1.00 0.00 O ATOM 148 CB ALA A 10 -1.735 -10.457 -11.134 1.00 0.00 C ATOM 0 H ALA A 10 -3.975 -9.628 -10.498 1.00 0.00 H new ATOM 0 HA ALA A 10 -2.510 -9.630 -12.948 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -0.879 -10.929 -11.617 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -1.440 -9.482 -10.745 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -2.080 -11.086 -10.313 1.00 0.00 H new ATOM 154 N LYS A 11 -3.959 -12.437 -11.997 1.00 0.00 N ATOM 155 CA LYS A 11 -4.385 -13.751 -12.466 1.00 0.00 C ATOM 156 C LYS A 11 -5.361 -13.623 -13.630 1.00 0.00 C ATOM 157 O LYS A 11 -5.304 -14.396 -14.587 1.00 0.00 O ATOM 158 CB LYS A 11 -5.036 -14.536 -11.324 1.00 0.00 C ATOM 159 CG LYS A 11 -4.247 -14.490 -10.027 1.00 0.00 C ATOM 160 CD LYS A 11 -5.162 -14.345 -8.823 1.00 0.00 C ATOM 161 CE LYS A 11 -5.422 -15.687 -8.156 1.00 0.00 C ATOM 162 NZ LYS A 11 -6.296 -15.551 -6.958 1.00 0.00 N ATOM 0 H LYS A 11 -4.265 -12.207 -11.051 1.00 0.00 H new ATOM 0 HA LYS A 11 -3.503 -14.289 -12.813 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -6.036 -14.140 -11.146 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -5.155 -15.575 -11.630 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -3.655 -15.400 -9.928 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -3.547 -13.655 -10.056 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -4.712 -13.661 -8.103 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -6.108 -13.903 -9.135 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -5.889 -16.364 -8.871 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -4.473 -16.137 -7.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -6.449 -16.487 -6.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -5.839 -14.926 -6.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -7.211 -15.145 -7.240 1.00 0.00 H new ATOM 176 N ILE A 12 -6.254 -12.643 -13.543 1.00 0.00 N ATOM 177 CA ILE A 12 -7.240 -12.414 -14.592 1.00 0.00 C ATOM 178 C ILE A 12 -6.565 -12.096 -15.921 1.00 0.00 C ATOM 179 O ILE A 12 -6.866 -12.710 -16.945 1.00 0.00 O ATOM 180 CB ILE A 12 -8.195 -11.262 -14.225 1.00 0.00 C ATOM 181 CG1 ILE A 12 -9.038 -11.639 -13.005 1.00 0.00 C ATOM 182 CG2 ILE A 12 -9.088 -10.917 -15.407 1.00 0.00 C ATOM 183 CD1 ILE A 12 -9.570 -10.444 -12.246 1.00 0.00 C ATOM 0 H ILE A 12 -6.315 -11.995 -12.757 1.00 0.00 H new ATOM 0 HA ILE A 12 -7.815 -13.335 -14.691 1.00 0.00 H new ATOM 0 HB ILE A 12 -7.601 -10.383 -13.975 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -9.876 -12.256 -13.329 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -8.436 -12.248 -12.331 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -9.757 -10.102 -15.132 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -8.471 -10.611 -16.252 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -9.677 -11.791 -15.685 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -10.158 -10.786 -11.394 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -8.736 -9.838 -11.891 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -10.199 -9.846 -12.905 1.00 0.00 H new ATOM 195 N ALA A 13 -5.650 -11.133 -15.898 1.00 0.00 N ATOM 196 CA ALA A 13 -4.929 -10.735 -17.101 1.00 0.00 C ATOM 197 C ALA A 13 -4.296 -11.942 -17.786 1.00 0.00 C ATOM 198 O ALA A 13 -4.412 -12.112 -18.999 1.00 0.00 O ATOM 199 CB ALA A 13 -3.866 -9.700 -16.762 1.00 0.00 C ATOM 0 H ALA A 13 -5.390 -10.614 -15.059 1.00 0.00 H new ATOM 0 HA ALA A 13 -5.644 -10.291 -17.793 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -3.336 -9.412 -17.670 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -4.340 -8.821 -16.325 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -3.160 -10.124 -16.048 1.00 0.00 H new ATOM 205 N LYS A 14 -3.624 -12.777 -17.000 1.00 0.00 N ATOM 206 CA LYS A 14 -2.972 -13.969 -17.529 1.00 0.00 C ATOM 207 C LYS A 14 -3.972 -14.854 -18.266 1.00 0.00 C ATOM 208 O LYS A 14 -3.619 -15.540 -19.226 1.00 0.00 O ATOM 209 CB LYS A 14 -2.312 -14.759 -16.398 1.00 0.00 C ATOM 210 CG LYS A 14 -1.244 -15.728 -16.875 1.00 0.00 C ATOM 211 CD LYS A 14 0.066 -15.525 -16.131 1.00 0.00 C ATOM 212 CE LYS A 14 -0.060 -15.912 -14.666 1.00 0.00 C ATOM 213 NZ LYS A 14 0.572 -14.904 -13.770 1.00 0.00 N ATOM 0 H LYS A 14 -3.517 -12.650 -15.994 1.00 0.00 H new ATOM 0 HA LYS A 14 -2.206 -13.650 -18.236 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -1.866 -14.060 -15.690 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -3.079 -15.314 -15.858 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -1.590 -16.752 -16.732 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -1.081 -15.593 -17.944 1.00 0.00 H new ATOM 0 HD2 LYS A 14 0.848 -16.122 -16.600 1.00 0.00 H new ATOM 0 HD3 LYS A 14 0.372 -14.482 -16.208 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -1.114 -16.018 -14.408 1.00 0.00 H new ATOM 0 HE3 LYS A 14 0.407 -16.884 -14.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 0.465 -15.204 -12.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 1.583 -14.821 -13.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 0.110 -13.982 -13.904 1.00 0.00 H new ATOM 227 N ARG A 15 -5.221 -14.834 -17.811 1.00 0.00 N ATOM 228 CA ARG A 15 -6.272 -15.635 -18.427 1.00 0.00 C ATOM 229 C ARG A 15 -6.710 -15.027 -19.756 1.00 0.00 C ATOM 230 O ARG A 15 -7.143 -15.738 -20.664 1.00 0.00 O ATOM 231 CB ARG A 15 -7.472 -15.750 -17.486 1.00 0.00 C ATOM 232 CG ARG A 15 -7.148 -16.430 -16.166 1.00 0.00 C ATOM 233 CD ARG A 15 -7.434 -17.923 -16.223 1.00 0.00 C ATOM 234 NE ARG A 15 -8.085 -18.402 -15.007 1.00 0.00 N ATOM 235 CZ ARG A 15 -8.164 -19.685 -14.673 1.00 0.00 C ATOM 236 NH1 ARG A 15 -7.635 -20.612 -15.459 1.00 0.00 N ATOM 237 NH2 ARG A 15 -8.772 -20.043 -13.549 1.00 0.00 N ATOM 0 H ARG A 15 -5.529 -14.272 -17.018 1.00 0.00 H new ATOM 0 HA ARG A 15 -5.872 -16.631 -18.617 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -7.862 -14.752 -17.285 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -8.264 -16.307 -17.987 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -6.098 -16.269 -15.920 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -7.735 -15.976 -15.368 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -8.069 -18.138 -17.083 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -6.500 -18.466 -16.372 1.00 0.00 H new ATOM 0 HE ARG A 15 -8.502 -17.714 -14.380 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -7.166 -20.341 -16.323 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -7.697 -21.597 -15.200 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -9.179 -19.333 -12.941 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -8.832 -21.029 -13.293 1.00 0.00 H new ATOM 251 N LEU A 16 -6.595 -13.708 -19.864 1.00 0.00 N ATOM 252 CA LEU A 16 -6.979 -13.004 -21.082 1.00 0.00 C ATOM 253 C LEU A 16 -6.031 -13.340 -22.229 1.00 0.00 C ATOM 254 O LEU A 16 -6.373 -13.172 -23.399 1.00 0.00 O ATOM 255 CB LEU A 16 -6.989 -11.493 -20.840 1.00 0.00 C ATOM 256 CG LEU A 16 -7.731 -11.018 -19.590 1.00 0.00 C ATOM 257 CD1 LEU A 16 -7.845 -9.502 -19.582 1.00 0.00 C ATOM 258 CD2 LEU A 16 -9.108 -11.660 -19.512 1.00 0.00 C ATOM 0 H LEU A 16 -6.239 -13.105 -19.123 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.982 -13.329 -21.358 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.957 -11.148 -20.778 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -7.435 -11.009 -21.709 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.160 -11.323 -18.713 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.376 -9.182 -18.685 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -6.848 -9.062 -19.590 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.393 -9.174 -20.465 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -9.622 -11.311 -18.616 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.688 -11.386 -20.393 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -9.002 -12.744 -19.470 1.00 0.00 H new ATOM 270 N GLU A 17 -4.840 -13.819 -21.884 1.00 0.00 N ATOM 271 CA GLU A 17 -3.844 -14.181 -22.885 1.00 0.00 C ATOM 272 C GLU A 17 -4.207 -15.499 -23.563 1.00 0.00 C ATOM 273 O GLU A 17 -3.631 -15.861 -24.589 1.00 0.00 O ATOM 274 CB GLU A 17 -2.459 -14.291 -22.242 1.00 0.00 C ATOM 275 CG GLU A 17 -1.936 -12.974 -21.695 1.00 0.00 C ATOM 276 CD GLU A 17 -0.447 -12.799 -21.919 1.00 0.00 C ATOM 277 OE1 GLU A 17 0.339 -13.549 -21.302 1.00 0.00 O ATOM 278 OE2 GLU A 17 -0.067 -11.912 -22.712 1.00 0.00 O ATOM 0 H GLU A 17 -4.542 -13.965 -20.920 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.825 -13.396 -23.641 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -2.500 -15.020 -21.433 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -1.754 -14.674 -22.980 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -2.470 -12.150 -22.169 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -2.148 -12.919 -20.627 1.00 0.00 H new ATOM 285 N SER A 18 -5.168 -16.211 -22.982 1.00 0.00 N ATOM 286 CA SER A 18 -5.606 -17.491 -23.527 1.00 0.00 C ATOM 287 C SER A 18 -6.826 -17.309 -24.425 1.00 0.00 C ATOM 288 O SER A 18 -7.265 -18.248 -25.090 1.00 0.00 O ATOM 289 CB SER A 18 -5.932 -18.466 -22.394 1.00 0.00 C ATOM 290 OG SER A 18 -4.995 -19.529 -22.351 1.00 0.00 O ATOM 0 H SER A 18 -5.658 -15.923 -22.135 1.00 0.00 H new ATOM 0 HA SER A 18 -4.793 -17.901 -24.127 1.00 0.00 H new ATOM 0 HB2 SER A 18 -5.929 -17.936 -21.442 1.00 0.00 H new ATOM 0 HB3 SER A 18 -6.936 -18.867 -22.533 1.00 0.00 H new ATOM 0 HG SER A 18 -5.224 -20.137 -21.618 1.00 0.00 H new ATOM 296 N ILE A 19 -7.369 -16.097 -24.437 1.00 0.00 N ATOM 297 CA ILE A 19 -8.537 -15.791 -25.253 1.00 0.00 C ATOM 298 C ILE A 19 -8.254 -16.035 -26.731 1.00 0.00 C ATOM 299 O ILE A 19 -7.152 -15.777 -27.214 1.00 0.00 O ATOM 300 CB ILE A 19 -8.991 -14.332 -25.063 1.00 0.00 C ATOM 301 CG1 ILE A 19 -9.250 -14.044 -23.582 1.00 0.00 C ATOM 302 CG2 ILE A 19 -10.239 -14.053 -25.888 1.00 0.00 C ATOM 303 CD1 ILE A 19 -9.540 -12.589 -23.291 1.00 0.00 C ATOM 0 H ILE A 19 -7.019 -15.310 -23.890 1.00 0.00 H new ATOM 0 HA ILE A 19 -9.335 -16.457 -24.923 1.00 0.00 H new ATOM 0 HB ILE A 19 -8.195 -13.672 -25.409 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -10.092 -14.648 -23.245 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.381 -14.356 -23.002 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -10.547 -13.018 -25.743 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -10.023 -14.223 -26.943 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -11.042 -14.718 -25.570 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -9.714 -12.459 -22.223 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -8.689 -11.980 -23.597 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -10.427 -12.277 -23.843 1.00 0.00 H new ATOM 315 N ASP A 20 -9.258 -16.533 -27.446 1.00 0.00 N ATOM 316 CA ASP A 20 -9.118 -16.809 -28.871 1.00 0.00 C ATOM 317 C ASP A 20 -10.141 -16.018 -29.680 1.00 0.00 C ATOM 318 O ASP A 20 -11.218 -15.669 -29.195 1.00 0.00 O ATOM 319 CB ASP A 20 -9.283 -18.305 -29.141 1.00 0.00 C ATOM 320 CG ASP A 20 -8.048 -18.920 -29.770 1.00 0.00 C ATOM 321 OD1 ASP A 20 -6.932 -18.448 -29.468 1.00 0.00 O ATOM 322 OD2 ASP A 20 -8.198 -19.872 -30.564 1.00 0.00 O ATOM 0 H ASP A 20 -10.177 -16.753 -27.062 1.00 0.00 H new ATOM 0 HA ASP A 20 -8.119 -16.500 -29.180 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -9.504 -18.818 -28.205 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -10.138 -18.460 -29.799 1.00 0.00 H new ATOM 327 N PRO A 21 -9.798 -15.726 -30.944 1.00 0.00 N ATOM 328 CA PRO A 21 -10.673 -14.972 -31.847 1.00 0.00 C ATOM 329 C PRO A 21 -11.904 -15.770 -32.262 1.00 0.00 C ATOM 330 O PRO A 21 -12.958 -15.201 -32.544 1.00 0.00 O ATOM 331 CB PRO A 21 -9.780 -14.699 -33.060 1.00 0.00 C ATOM 332 CG PRO A 21 -8.768 -15.792 -33.039 1.00 0.00 C ATOM 333 CD PRO A 21 -8.531 -16.110 -31.588 1.00 0.00 C ATOM 0 HA PRO A 21 -11.064 -14.070 -31.376 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -10.355 -14.710 -33.986 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -9.307 -13.720 -32.991 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -9.129 -16.669 -33.577 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -7.845 -15.478 -33.526 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.309 -17.167 -31.439 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -7.689 -15.547 -31.186 1.00 0.00 H new ATOM 341 N ALA A 22 -11.763 -17.091 -32.296 1.00 0.00 N ATOM 342 CA ALA A 22 -12.865 -17.968 -32.674 1.00 0.00 C ATOM 343 C ALA A 22 -14.007 -17.879 -31.667 1.00 0.00 C ATOM 344 O ALA A 22 -15.150 -17.608 -32.033 1.00 0.00 O ATOM 345 CB ALA A 22 -12.379 -19.404 -32.799 1.00 0.00 C ATOM 0 H ALA A 22 -10.896 -17.578 -32.066 1.00 0.00 H new ATOM 0 HA ALA A 22 -13.242 -17.639 -33.642 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -13.213 -20.047 -33.082 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -11.602 -19.460 -33.562 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -11.973 -19.735 -31.843 1.00 0.00 H new ATOM 351 N ASN A 23 -13.689 -18.110 -30.398 1.00 0.00 N ATOM 352 CA ASN A 23 -14.690 -18.058 -29.338 1.00 0.00 C ATOM 353 C ASN A 23 -14.764 -16.661 -28.729 1.00 0.00 C ATOM 354 O ASN A 23 -13.777 -16.150 -28.200 1.00 0.00 O ATOM 355 CB ASN A 23 -14.365 -19.084 -28.250 1.00 0.00 C ATOM 356 CG ASN A 23 -15.501 -20.062 -28.021 1.00 0.00 C ATOM 357 OD1 ASN A 23 -15.963 -20.240 -26.894 1.00 0.00 O ATOM 358 ND2 ASN A 23 -15.956 -20.702 -29.091 1.00 0.00 N ATOM 0 H ASN A 23 -12.747 -18.335 -30.078 1.00 0.00 H new ATOM 0 HA ASN A 23 -15.659 -18.297 -29.775 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -13.466 -19.634 -28.530 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -14.143 -18.564 -27.318 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -16.719 -21.373 -28.998 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -15.543 -20.523 -30.006 1.00 0.00 H new ATOM 365 N ARG A 24 -15.942 -16.050 -28.806 1.00 0.00 N ATOM 366 CA ARG A 24 -16.145 -14.712 -28.263 1.00 0.00 C ATOM 367 C ARG A 24 -17.589 -14.259 -28.461 1.00 0.00 C ATOM 368 O ARG A 24 -18.192 -14.515 -29.503 1.00 0.00 O ATOM 369 CB ARG A 24 -15.192 -13.718 -28.929 1.00 0.00 C ATOM 370 CG ARG A 24 -14.126 -13.175 -27.992 1.00 0.00 C ATOM 371 CD ARG A 24 -12.940 -12.615 -28.762 1.00 0.00 C ATOM 372 NE ARG A 24 -12.145 -11.697 -27.950 1.00 0.00 N ATOM 373 CZ ARG A 24 -11.256 -10.851 -28.457 1.00 0.00 C ATOM 374 NH1 ARG A 24 -11.049 -10.805 -29.766 1.00 0.00 N ATOM 375 NH2 ARG A 24 -10.571 -10.046 -27.654 1.00 0.00 N ATOM 0 H ARG A 24 -16.770 -16.460 -29.239 1.00 0.00 H new ATOM 0 HA ARG A 24 -15.935 -14.745 -27.194 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -14.706 -14.204 -29.775 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -15.770 -12.885 -29.329 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -14.555 -12.394 -27.364 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -13.787 -13.969 -27.326 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -12.309 -13.436 -29.104 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -13.297 -12.096 -29.651 1.00 0.00 H new ATOM 0 HE ARG A 24 -12.280 -11.706 -26.939 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -11.574 -11.421 -30.387 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -10.365 -10.154 -30.152 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -10.727 -10.077 -26.647 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -9.888 -9.396 -28.044 1.00 0.00 H new ATOM 389 N GLN A 25 -18.136 -13.587 -27.453 1.00 0.00 N ATOM 390 CA GLN A 25 -19.509 -13.100 -27.516 1.00 0.00 C ATOM 391 C GLN A 25 -19.545 -11.575 -27.543 1.00 0.00 C ATOM 392 O GLN A 25 -20.197 -10.975 -28.397 1.00 0.00 O ATOM 393 CB GLN A 25 -20.312 -13.620 -26.323 1.00 0.00 C ATOM 394 CG GLN A 25 -21.351 -14.665 -26.697 1.00 0.00 C ATOM 395 CD GLN A 25 -22.360 -14.907 -25.593 1.00 0.00 C ATOM 396 OE1 GLN A 25 -22.997 -13.973 -25.103 1.00 0.00 O ATOM 397 NE2 GLN A 25 -22.513 -16.164 -25.194 1.00 0.00 N ATOM 0 H GLN A 25 -17.650 -13.368 -26.584 1.00 0.00 H new ATOM 0 HA GLN A 25 -19.958 -13.472 -28.437 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -19.625 -14.048 -25.592 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -20.811 -12.781 -25.838 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -21.874 -14.345 -27.598 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -20.848 -15.602 -26.936 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -21.965 -16.907 -25.627 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -23.179 -16.387 -24.454 1.00 0.00 H new ATOM 406 N VAL A 26 -18.841 -10.955 -26.601 1.00 0.00 N ATOM 407 CA VAL A 26 -18.792 -9.500 -26.517 1.00 0.00 C ATOM 408 C VAL A 26 -17.643 -9.039 -25.628 1.00 0.00 C ATOM 409 O VAL A 26 -17.405 -9.606 -24.562 1.00 0.00 O ATOM 410 CB VAL A 26 -20.112 -8.925 -25.970 1.00 0.00 C ATOM 411 CG1 VAL A 26 -20.278 -9.275 -24.499 1.00 0.00 C ATOM 412 CG2 VAL A 26 -20.163 -7.419 -26.178 1.00 0.00 C ATOM 0 H VAL A 26 -18.297 -11.437 -25.886 1.00 0.00 H new ATOM 0 HA VAL A 26 -18.635 -9.130 -27.530 1.00 0.00 H new ATOM 0 HB VAL A 26 -20.939 -9.373 -26.520 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -21.216 -8.860 -24.130 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -20.289 -10.359 -24.382 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -19.448 -8.857 -23.930 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -21.102 -7.029 -25.786 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -19.329 -6.951 -25.655 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -20.094 -7.196 -27.243 1.00 0.00 H new ATOM 422 N GLU A 27 -16.933 -8.008 -26.075 1.00 0.00 N ATOM 423 CA GLU A 27 -15.808 -7.471 -25.319 1.00 0.00 C ATOM 424 C GLU A 27 -15.799 -5.946 -25.365 1.00 0.00 C ATOM 425 O GLU A 27 -15.718 -5.346 -26.438 1.00 0.00 O ATOM 426 CB GLU A 27 -14.489 -8.016 -25.870 1.00 0.00 C ATOM 427 CG GLU A 27 -14.058 -9.327 -25.232 1.00 0.00 C ATOM 428 CD GLU A 27 -13.777 -9.189 -23.749 1.00 0.00 C ATOM 429 OE1 GLU A 27 -12.622 -8.873 -23.391 1.00 0.00 O ATOM 430 OE2 GLU A 27 -14.710 -9.396 -22.945 1.00 0.00 O ATOM 0 H GLU A 27 -17.117 -7.528 -26.956 1.00 0.00 H new ATOM 0 HA GLU A 27 -15.918 -7.785 -24.281 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -14.586 -8.160 -26.946 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -13.706 -7.273 -25.717 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -14.838 -10.074 -25.382 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -13.164 -9.695 -25.735 1.00 0.00 H new ATOM 437 N HIS A 28 -15.884 -5.324 -24.194 1.00 0.00 N ATOM 438 CA HIS A 28 -15.886 -3.868 -24.099 1.00 0.00 C ATOM 439 C HIS A 28 -14.941 -3.393 -23.000 1.00 0.00 C ATOM 440 O HIS A 28 -14.742 -4.081 -21.998 1.00 0.00 O ATOM 441 CB HIS A 28 -17.301 -3.355 -23.828 1.00 0.00 C ATOM 442 CG HIS A 28 -18.126 -4.287 -22.995 1.00 0.00 C ATOM 443 ND1 HIS A 28 -18.785 -5.422 -23.326 1.00 0.00 N flip ATOM 444 CD2 HIS A 28 -18.349 -4.095 -21.648 1.00 0.00 C flip ATOM 445 CE1 HIS A 28 -19.387 -5.891 -22.184 1.00 0.00 C flip ATOM 446 NE2 HIS A 28 -19.108 -5.073 -21.186 1.00 0.00 N flip ATOM 0 H HIS A 28 -15.952 -5.805 -23.297 1.00 0.00 H new ATOM 0 HA HIS A 28 -15.538 -3.467 -25.051 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -17.239 -2.390 -23.325 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -17.806 -3.187 -24.779 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -17.964 -3.274 -21.062 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -19.991 -6.784 -22.114 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -19.425 -5.178 -20.222 1.00 0.00 H new ATOM 454 N VAL A 29 -14.359 -2.214 -23.194 1.00 0.00 N ATOM 455 CA VAL A 29 -13.434 -1.648 -22.220 1.00 0.00 C ATOM 456 C VAL A 29 -14.127 -1.401 -20.884 1.00 0.00 C ATOM 457 O VAL A 29 -15.234 -0.863 -20.837 1.00 0.00 O ATOM 458 CB VAL A 29 -12.829 -0.324 -22.724 1.00 0.00 C ATOM 459 CG1 VAL A 29 -11.720 0.144 -21.794 1.00 0.00 C ATOM 460 CG2 VAL A 29 -12.312 -0.483 -24.145 1.00 0.00 C ATOM 0 H VAL A 29 -14.512 -1.632 -24.018 1.00 0.00 H new ATOM 0 HA VAL A 29 -12.634 -2.376 -22.083 1.00 0.00 H new ATOM 0 HB VAL A 29 -13.611 0.435 -22.729 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -11.304 1.081 -22.166 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -12.125 0.298 -20.794 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -10.935 -0.611 -21.755 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -11.888 0.462 -24.486 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -11.543 -1.255 -24.168 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -13.134 -0.769 -24.801 1.00 0.00 H new ATOM 470 N TYR A 30 -13.468 -1.797 -19.801 1.00 0.00 N ATOM 471 CA TYR A 30 -14.022 -1.620 -18.463 1.00 0.00 C ATOM 472 C TYR A 30 -13.021 -0.923 -17.547 1.00 0.00 C ATOM 473 O TYR A 30 -11.812 -1.137 -17.650 1.00 0.00 O ATOM 474 CB TYR A 30 -14.416 -2.973 -17.869 1.00 0.00 C ATOM 475 CG TYR A 30 -15.656 -2.917 -17.005 1.00 0.00 C ATOM 476 CD1 TYR A 30 -16.871 -2.491 -17.525 1.00 0.00 C ATOM 477 CD2 TYR A 30 -15.611 -3.290 -15.667 1.00 0.00 C ATOM 478 CE1 TYR A 30 -18.006 -2.438 -16.739 1.00 0.00 C ATOM 479 CE2 TYR A 30 -16.741 -3.241 -14.873 1.00 0.00 C ATOM 480 CZ TYR A 30 -17.935 -2.813 -15.414 1.00 0.00 C ATOM 481 OH TYR A 30 -19.064 -2.762 -14.627 1.00 0.00 O ATOM 0 H TYR A 30 -12.551 -2.242 -19.823 1.00 0.00 H new ATOM 0 HA TYR A 30 -14.910 -0.993 -18.545 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -14.580 -3.682 -18.680 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -13.586 -3.355 -17.275 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -16.930 -2.196 -18.562 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -14.677 -3.624 -15.240 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -18.943 -2.105 -17.160 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -16.689 -3.536 -13.835 1.00 0.00 H new ATOM 0 HH TYR A 30 -18.844 -3.060 -13.720 1.00 0.00 H new ATOM 491 N LYS A 31 -13.532 -0.086 -16.650 1.00 0.00 N ATOM 492 CA LYS A 31 -12.686 0.643 -15.713 1.00 0.00 C ATOM 493 C LYS A 31 -12.807 0.064 -14.307 1.00 0.00 C ATOM 494 O LYS A 31 -13.897 -0.301 -13.867 1.00 0.00 O ATOM 495 CB LYS A 31 -13.064 2.126 -15.700 1.00 0.00 C ATOM 496 CG LYS A 31 -12.189 2.985 -16.596 1.00 0.00 C ATOM 497 CD LYS A 31 -11.535 4.115 -15.819 1.00 0.00 C ATOM 498 CE LYS A 31 -12.526 5.229 -15.517 1.00 0.00 C ATOM 499 NZ LYS A 31 -11.982 6.568 -15.879 1.00 0.00 N ATOM 0 H LYS A 31 -14.529 0.104 -16.552 1.00 0.00 H new ATOM 0 HA LYS A 31 -11.652 0.541 -16.041 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -14.103 2.230 -16.013 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -13.000 2.500 -14.678 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -11.419 2.366 -17.056 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -12.791 3.399 -17.405 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -11.126 3.728 -14.886 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -10.699 4.516 -16.392 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -13.450 5.052 -16.067 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -12.778 5.214 -14.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -12.768 7.231 -16.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -11.380 6.919 -15.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -11.418 6.490 -16.749 1.00 0.00 H new ATOM 513 N PHE A 32 -11.681 -0.015 -13.606 1.00 0.00 N ATOM 514 CA PHE A 32 -11.661 -0.549 -12.249 1.00 0.00 C ATOM 515 C PHE A 32 -11.063 0.462 -11.275 1.00 0.00 C ATOM 516 O PHE A 32 -9.900 0.846 -11.400 1.00 0.00 O ATOM 517 CB PHE A 32 -10.863 -1.853 -12.203 1.00 0.00 C ATOM 518 CG PHE A 32 -11.488 -2.967 -12.992 1.00 0.00 C ATOM 519 CD1 PHE A 32 -12.462 -3.774 -12.426 1.00 0.00 C ATOM 520 CD2 PHE A 32 -11.102 -3.209 -14.301 1.00 0.00 C ATOM 521 CE1 PHE A 32 -13.040 -4.800 -13.149 1.00 0.00 C ATOM 522 CE2 PHE A 32 -11.676 -4.233 -15.029 1.00 0.00 C ATOM 523 CZ PHE A 32 -12.645 -5.030 -14.453 1.00 0.00 C ATOM 0 H PHE A 32 -10.770 0.284 -13.955 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.690 -0.750 -11.949 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -9.858 -1.668 -12.584 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -10.758 -2.169 -11.165 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -12.773 -3.599 -11.407 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -10.344 -2.590 -14.757 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -13.799 -5.421 -12.696 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -11.367 -4.410 -16.049 1.00 0.00 H new ATOM 0 HZ PHE A 32 -13.094 -5.832 -15.021 1.00 0.00 H new ATOM 533 N ARG A 33 -11.866 0.889 -10.306 1.00 0.00 N ATOM 534 CA ARG A 33 -11.417 1.856 -9.313 1.00 0.00 C ATOM 535 C ARG A 33 -11.110 1.170 -7.985 1.00 0.00 C ATOM 536 O ARG A 33 -11.990 0.568 -7.368 1.00 0.00 O ATOM 537 CB ARG A 33 -12.480 2.937 -9.106 1.00 0.00 C ATOM 538 CG ARG A 33 -12.272 4.169 -9.972 1.00 0.00 C ATOM 539 CD ARG A 33 -13.180 5.311 -9.543 1.00 0.00 C ATOM 540 NE ARG A 33 -12.603 6.616 -9.854 1.00 0.00 N ATOM 541 CZ ARG A 33 -13.224 7.768 -9.625 1.00 0.00 C ATOM 542 NH1 ARG A 33 -14.434 7.776 -9.084 1.00 0.00 N ATOM 543 NH2 ARG A 33 -12.633 8.915 -9.935 1.00 0.00 N ATOM 0 H ARG A 33 -12.831 0.580 -10.188 1.00 0.00 H new ATOM 0 HA ARG A 33 -10.503 2.320 -9.683 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -13.462 2.515 -9.319 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -12.483 3.236 -8.058 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -11.231 4.487 -9.910 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -12.467 3.919 -11.015 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -14.145 5.213 -10.041 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -13.366 5.243 -8.471 1.00 0.00 H new ATOM 0 HE ARG A 33 -11.672 6.645 -10.270 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -14.890 6.896 -8.842 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -14.909 8.662 -8.909 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -11.701 8.913 -10.350 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -13.111 9.799 -9.759 1.00 0.00 H new ATOM 557 N ILE A 34 -9.857 1.263 -7.553 1.00 0.00 N ATOM 558 CA ILE A 34 -9.435 0.651 -6.299 1.00 0.00 C ATOM 559 C ILE A 34 -9.457 1.663 -5.158 1.00 0.00 C ATOM 560 O ILE A 34 -8.693 2.629 -5.155 1.00 0.00 O ATOM 561 CB ILE A 34 -8.020 0.054 -6.412 1.00 0.00 C ATOM 562 CG1 ILE A 34 -7.975 -1.001 -7.520 1.00 0.00 C ATOM 563 CG2 ILE A 34 -7.591 -0.548 -5.083 1.00 0.00 C ATOM 564 CD1 ILE A 34 -8.884 -2.183 -7.265 1.00 0.00 C ATOM 0 H ILE A 34 -9.117 1.756 -8.052 1.00 0.00 H new ATOM 0 HA ILE A 34 -10.143 -0.150 -6.085 1.00 0.00 H new ATOM 0 HB ILE A 34 -7.324 0.853 -6.668 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.254 -0.536 -8.465 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -6.951 -1.357 -7.630 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -6.589 -0.966 -5.179 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -7.589 0.227 -4.316 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -8.287 -1.337 -4.799 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.801 -2.890 -8.090 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -8.592 -2.673 -6.336 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -9.915 -1.838 -7.185 1.00 0.00 H new ATOM 576 N THR A 35 -10.338 1.435 -4.189 1.00 0.00 N ATOM 577 CA THR A 35 -10.460 2.326 -3.042 1.00 0.00 C ATOM 578 C THR A 35 -10.025 1.631 -1.757 1.00 0.00 C ATOM 579 O THR A 35 -10.200 0.422 -1.606 1.00 0.00 O ATOM 580 CB THR A 35 -11.905 2.832 -2.875 1.00 0.00 C ATOM 581 OG1 THR A 35 -12.731 1.789 -2.346 1.00 0.00 O ATOM 582 CG2 THR A 35 -12.470 3.307 -4.205 1.00 0.00 C ATOM 0 H THR A 35 -10.978 0.641 -4.176 1.00 0.00 H new ATOM 0 HA THR A 35 -9.805 3.176 -3.231 1.00 0.00 H new ATOM 0 HB THR A 35 -11.894 3.673 -2.182 1.00 0.00 H new ATOM 0 HG1 THR A 35 -13.608 2.156 -2.107 1.00 0.00 H new ATOM 0 HG21 THR A 35 -13.491 3.660 -4.061 1.00 0.00 H new ATOM 0 HG22 THR A 35 -11.856 4.121 -4.591 1.00 0.00 H new ATOM 0 HG23 THR A 35 -12.468 2.482 -4.917 1.00 0.00 H new ATOM 590 N GLN A 36 -9.459 2.402 -0.835 1.00 0.00 N ATOM 591 CA GLN A 36 -9.000 1.859 0.438 1.00 0.00 C ATOM 592 C GLN A 36 -10.043 2.074 1.530 1.00 0.00 C ATOM 593 O GLN A 36 -10.148 3.161 2.096 1.00 0.00 O ATOM 594 CB GLN A 36 -7.676 2.508 0.845 1.00 0.00 C ATOM 595 CG GLN A 36 -6.621 1.509 1.293 1.00 0.00 C ATOM 596 CD GLN A 36 -5.228 2.105 1.322 1.00 0.00 C ATOM 597 OE1 GLN A 36 -4.629 2.262 2.386 1.00 0.00 O ATOM 598 NE2 GLN A 36 -4.703 2.442 0.150 1.00 0.00 N ATOM 0 H GLN A 36 -9.307 3.405 -0.945 1.00 0.00 H new ATOM 0 HA GLN A 36 -8.848 0.787 0.313 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -7.288 3.081 0.003 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -7.861 3.215 1.653 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -6.875 1.140 2.287 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -6.631 0.650 0.622 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -5.234 2.295 -0.708 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -3.768 2.848 0.108 1.00 0.00 H new ATOM 607 N GLY A 37 -10.813 1.029 1.820 1.00 0.00 N ATOM 608 CA GLY A 37 -11.838 1.125 2.843 1.00 0.00 C ATOM 609 C GLY A 37 -13.070 1.864 2.362 1.00 0.00 C ATOM 610 O GLY A 37 -14.180 1.600 2.821 1.00 0.00 O ATOM 0 H GLY A 37 -10.745 0.119 1.365 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -12.122 0.123 3.164 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -11.430 1.635 3.715 1.00 0.00 H new ATOM 614 N GLY A 38 -12.874 2.797 1.434 1.00 0.00 N ATOM 615 CA GLY A 38 -13.988 3.564 0.907 1.00 0.00 C ATOM 616 C GLY A 38 -13.535 4.796 0.148 1.00 0.00 C ATOM 617 O GLY A 38 -14.351 5.505 -0.442 1.00 0.00 O ATOM 0 H GLY A 38 -11.964 3.035 1.038 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -14.581 2.931 0.246 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -14.639 3.865 1.728 1.00 0.00 H new ATOM 621 N LYS A 39 -12.232 5.052 0.163 1.00 0.00 N ATOM 622 CA LYS A 39 -11.671 6.207 -0.528 1.00 0.00 C ATOM 623 C LYS A 39 -10.778 5.768 -1.685 1.00 0.00 C ATOM 624 O LYS A 39 -9.834 5.001 -1.497 1.00 0.00 O ATOM 625 CB LYS A 39 -10.871 7.072 0.448 1.00 0.00 C ATOM 626 CG LYS A 39 -10.143 6.272 1.515 1.00 0.00 C ATOM 627 CD LYS A 39 -8.952 7.036 2.069 1.00 0.00 C ATOM 628 CE LYS A 39 -8.478 6.446 3.389 1.00 0.00 C ATOM 629 NZ LYS A 39 -8.690 7.386 4.524 1.00 0.00 N ATOM 0 H LYS A 39 -11.544 4.475 0.646 1.00 0.00 H new ATOM 0 HA LYS A 39 -12.496 6.794 -0.931 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -10.144 7.660 -0.113 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -11.546 7.778 0.932 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -10.832 6.033 2.325 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -9.805 5.325 1.094 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -8.137 7.015 1.346 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -9.224 8.082 2.213 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -9.012 5.516 3.583 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -7.419 6.197 3.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -8.354 6.947 5.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -8.161 8.264 4.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -9.703 7.604 4.610 1.00 0.00 H new ATOM 643 N VAL A 40 -11.083 6.261 -2.881 1.00 0.00 N ATOM 644 CA VAL A 40 -10.306 5.921 -4.068 1.00 0.00 C ATOM 645 C VAL A 40 -8.819 6.171 -3.841 1.00 0.00 C ATOM 646 O VAL A 40 -8.425 7.220 -3.331 1.00 0.00 O ATOM 647 CB VAL A 40 -10.771 6.731 -5.293 1.00 0.00 C ATOM 648 CG1 VAL A 40 -9.738 6.653 -6.407 1.00 0.00 C ATOM 649 CG2 VAL A 40 -12.126 6.235 -5.775 1.00 0.00 C ATOM 0 H VAL A 40 -11.862 6.897 -3.054 1.00 0.00 H new ATOM 0 HA VAL A 40 -10.468 4.860 -4.260 1.00 0.00 H new ATOM 0 HB VAL A 40 -10.875 7.776 -4.999 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -10.083 7.231 -7.264 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.790 7.059 -6.053 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.599 5.613 -6.703 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -12.440 6.818 -6.641 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -12.051 5.184 -6.053 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -12.860 6.347 -4.977 1.00 0.00 H new ATOM 659 N VAL A 41 -7.996 5.200 -4.225 1.00 0.00 N ATOM 660 CA VAL A 41 -6.552 5.315 -4.066 1.00 0.00 C ATOM 661 C VAL A 41 -5.839 5.185 -5.407 1.00 0.00 C ATOM 662 O VAL A 41 -4.676 5.564 -5.545 1.00 0.00 O ATOM 663 CB VAL A 41 -6.006 4.245 -3.101 1.00 0.00 C ATOM 664 CG1 VAL A 41 -6.292 2.850 -3.635 1.00 0.00 C ATOM 665 CG2 VAL A 41 -4.515 4.443 -2.875 1.00 0.00 C ATOM 0 H VAL A 41 -8.305 4.325 -4.648 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.358 6.303 -3.649 1.00 0.00 H new ATOM 0 HB VAL A 41 -6.513 4.352 -2.142 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.899 2.107 -2.941 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -7.368 2.715 -3.741 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -5.814 2.727 -4.607 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -4.146 3.679 -2.191 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -3.989 4.363 -3.826 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.340 5.429 -2.445 1.00 0.00 H new ATOM 675 N LYS A 42 -6.544 4.646 -6.396 1.00 0.00 N ATOM 676 CA LYS A 42 -5.981 4.467 -7.729 1.00 0.00 C ATOM 677 C LYS A 42 -7.032 3.930 -8.696 1.00 0.00 C ATOM 678 O LYS A 42 -8.034 3.351 -8.279 1.00 0.00 O ATOM 679 CB LYS A 42 -4.787 3.512 -7.676 1.00 0.00 C ATOM 680 CG LYS A 42 -3.526 4.078 -8.306 1.00 0.00 C ATOM 681 CD LYS A 42 -2.360 3.112 -8.188 1.00 0.00 C ATOM 682 CE LYS A 42 -1.212 3.718 -7.395 1.00 0.00 C ATOM 683 NZ LYS A 42 -0.387 4.636 -8.229 1.00 0.00 N ATOM 0 H LYS A 42 -7.507 4.325 -6.299 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.645 5.440 -8.088 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -4.581 3.259 -6.636 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -5.052 2.584 -8.184 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -3.711 4.299 -9.357 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.269 5.021 -7.823 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -2.694 2.195 -7.703 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -2.011 2.838 -9.184 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -1.610 4.263 -6.539 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -0.582 2.921 -7.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 0.385 5.029 -7.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 0.013 4.110 -9.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -0.982 5.411 -8.585 1.00 0.00 H new ATOM 697 N ASN A 43 -6.795 4.126 -9.989 1.00 0.00 N ATOM 698 CA ASN A 43 -7.721 3.660 -11.015 1.00 0.00 C ATOM 699 C ASN A 43 -6.982 2.890 -12.105 1.00 0.00 C ATOM 700 O ASN A 43 -5.965 3.350 -12.624 1.00 0.00 O ATOM 701 CB ASN A 43 -8.470 4.844 -11.630 1.00 0.00 C ATOM 702 CG ASN A 43 -8.616 6.002 -10.661 1.00 0.00 C ATOM 703 OD1 ASN A 43 -9.582 6.071 -9.900 1.00 0.00 O ATOM 704 ND2 ASN A 43 -7.656 6.918 -10.686 1.00 0.00 N ATOM 0 H ASN A 43 -5.970 4.604 -10.351 1.00 0.00 H new ATOM 0 HA ASN A 43 -8.439 2.989 -10.544 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -7.940 5.183 -12.520 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -9.458 4.517 -11.953 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -7.700 7.720 -10.058 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -6.874 6.820 -11.334 1.00 0.00 H new ATOM 711 N TRP A 44 -7.502 1.717 -12.448 1.00 0.00 N ATOM 712 CA TRP A 44 -6.892 0.883 -13.477 1.00 0.00 C ATOM 713 C TRP A 44 -7.729 0.892 -14.752 1.00 0.00 C ATOM 714 O TRP A 44 -8.939 1.119 -14.710 1.00 0.00 O ATOM 715 CB TRP A 44 -6.729 -0.551 -12.970 1.00 0.00 C ATOM 716 CG TRP A 44 -5.541 -0.733 -12.075 1.00 0.00 C ATOM 717 CD1 TRP A 44 -5.488 -0.512 -10.728 1.00 0.00 C ATOM 718 CD2 TRP A 44 -4.234 -1.171 -12.463 1.00 0.00 C ATOM 719 NE1 TRP A 44 -4.228 -0.786 -10.255 1.00 0.00 N ATOM 720 CE2 TRP A 44 -3.440 -1.194 -11.300 1.00 0.00 C ATOM 721 CE3 TRP A 44 -3.659 -1.549 -13.679 1.00 0.00 C ATOM 722 CZ2 TRP A 44 -2.102 -1.577 -11.320 1.00 0.00 C ATOM 723 CZ3 TRP A 44 -2.331 -1.930 -13.697 1.00 0.00 C ATOM 724 CH2 TRP A 44 -1.564 -1.942 -12.524 1.00 0.00 C ATOM 0 H TRP A 44 -8.344 1.322 -12.029 1.00 0.00 H new ATOM 0 HA TRP A 44 -5.909 1.294 -13.707 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -7.630 -0.842 -12.430 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -6.638 -1.222 -13.824 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -6.316 -0.172 -10.123 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -3.927 -0.700 -9.284 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -4.242 -1.543 -14.588 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -1.509 -1.586 -10.417 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -1.876 -2.224 -14.631 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -0.528 -2.245 -12.571 1.00 0.00 H new ATOM 735 N VAL A 45 -7.078 0.644 -15.884 1.00 0.00 N ATOM 736 CA VAL A 45 -7.764 0.623 -17.171 1.00 0.00 C ATOM 737 C VAL A 45 -7.528 -0.697 -17.897 1.00 0.00 C ATOM 738 O VAL A 45 -6.402 -1.190 -17.959 1.00 0.00 O ATOM 739 CB VAL A 45 -7.300 1.782 -18.072 1.00 0.00 C ATOM 740 CG1 VAL A 45 -7.893 1.644 -19.467 1.00 0.00 C ATOM 741 CG2 VAL A 45 -7.677 3.120 -17.454 1.00 0.00 C ATOM 0 H VAL A 45 -6.077 0.455 -15.936 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.828 0.736 -16.965 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.214 1.740 -18.159 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -7.554 2.472 -20.090 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -7.569 0.701 -19.908 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -8.981 1.660 -19.403 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -7.342 3.928 -18.104 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.759 3.174 -17.336 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -7.201 3.217 -16.478 1.00 0.00 H new ATOM 751 N MET A 46 -8.597 -1.263 -18.446 1.00 0.00 N ATOM 752 CA MET A 46 -8.506 -2.525 -19.171 1.00 0.00 C ATOM 753 C MET A 46 -8.639 -2.300 -20.673 1.00 0.00 C ATOM 754 O MET A 46 -9.647 -1.773 -21.145 1.00 0.00 O ATOM 755 CB MET A 46 -9.589 -3.493 -18.690 1.00 0.00 C ATOM 756 CG MET A 46 -9.798 -4.680 -19.617 1.00 0.00 C ATOM 757 SD MET A 46 -10.559 -6.086 -18.783 1.00 0.00 S ATOM 758 CE MET A 46 -12.297 -5.717 -19.015 1.00 0.00 C ATOM 0 H MET A 46 -9.536 -0.868 -18.403 1.00 0.00 H new ATOM 0 HA MET A 46 -7.526 -2.960 -18.973 1.00 0.00 H new ATOM 0 HB2 MET A 46 -9.323 -3.859 -17.698 1.00 0.00 H new ATOM 0 HB3 MET A 46 -10.530 -2.952 -18.588 1.00 0.00 H new ATOM 0 HG2 MET A 46 -10.426 -4.376 -20.455 1.00 0.00 H new ATOM 0 HG3 MET A 46 -8.838 -4.985 -20.033 1.00 0.00 H new ATOM 0 HE1 MET A 46 -12.863 -6.074 -18.154 1.00 0.00 H new ATOM 0 HE2 MET A 46 -12.430 -4.640 -19.116 1.00 0.00 H new ATOM 0 HE3 MET A 46 -12.657 -6.213 -19.916 1.00 0.00 H new ATOM 768 N ASP A 47 -7.617 -2.703 -21.420 1.00 0.00 N ATOM 769 CA ASP A 47 -7.621 -2.546 -22.870 1.00 0.00 C ATOM 770 C ASP A 47 -8.768 -3.331 -23.499 1.00 0.00 C ATOM 771 O ASP A 47 -9.708 -3.734 -22.812 1.00 0.00 O ATOM 772 CB ASP A 47 -6.287 -3.010 -23.458 1.00 0.00 C ATOM 773 CG ASP A 47 -5.806 -2.112 -24.580 1.00 0.00 C ATOM 774 OD1 ASP A 47 -6.648 -1.419 -25.189 1.00 0.00 O ATOM 775 OD2 ASP A 47 -4.587 -2.102 -24.850 1.00 0.00 O ATOM 0 H ASP A 47 -6.775 -3.141 -21.046 1.00 0.00 H new ATOM 0 HA ASP A 47 -7.761 -1.489 -23.096 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -5.535 -3.036 -22.669 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -6.392 -4.029 -23.831 1.00 0.00 H new ATOM 780 N LEU A 48 -8.685 -3.544 -24.807 1.00 0.00 N ATOM 781 CA LEU A 48 -9.717 -4.280 -25.530 1.00 0.00 C ATOM 782 C LEU A 48 -9.181 -4.806 -26.858 1.00 0.00 C ATOM 783 O LEU A 48 -9.372 -5.974 -27.198 1.00 0.00 O ATOM 784 CB LEU A 48 -10.932 -3.384 -25.775 1.00 0.00 C ATOM 785 CG LEU A 48 -12.288 -4.089 -25.817 1.00 0.00 C ATOM 786 CD1 LEU A 48 -13.356 -3.160 -26.373 1.00 0.00 C ATOM 787 CD2 LEU A 48 -12.202 -5.362 -26.647 1.00 0.00 C ATOM 0 H LEU A 48 -7.914 -3.218 -25.389 1.00 0.00 H new ATOM 0 HA LEU A 48 -10.018 -5.131 -24.919 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -10.963 -2.626 -24.992 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -10.788 -2.861 -26.720 1.00 0.00 H new ATOM 0 HG LEU A 48 -12.566 -4.361 -24.799 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -14.314 -3.679 -26.395 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -13.436 -2.277 -25.739 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -13.084 -2.857 -27.384 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -13.176 -5.851 -26.666 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -11.901 -5.113 -27.665 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -11.467 -6.035 -26.206 1.00 0.00 H new ATOM 799 N LYS A 49 -8.509 -3.936 -27.605 1.00 0.00 N ATOM 800 CA LYS A 49 -7.942 -4.313 -28.894 1.00 0.00 C ATOM 801 C LYS A 49 -6.689 -5.163 -28.711 1.00 0.00 C ATOM 802 O LYS A 49 -6.367 -5.999 -29.553 1.00 0.00 O ATOM 803 CB LYS A 49 -7.608 -3.063 -29.712 1.00 0.00 C ATOM 804 CG LYS A 49 -8.605 -2.778 -30.822 1.00 0.00 C ATOM 805 CD LYS A 49 -8.191 -1.571 -31.647 1.00 0.00 C ATOM 806 CE LYS A 49 -9.258 -1.199 -32.665 1.00 0.00 C ATOM 807 NZ LYS A 49 -9.875 0.123 -32.364 1.00 0.00 N ATOM 0 H LYS A 49 -8.344 -2.965 -27.339 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.685 -4.904 -29.430 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -7.565 -2.203 -29.044 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -6.615 -3.178 -30.147 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -8.689 -3.651 -31.469 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -9.591 -2.604 -30.391 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -8.006 -0.724 -30.987 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -7.254 -1.785 -32.162 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -8.817 -1.175 -33.661 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -10.032 -1.967 -32.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -10.597 0.340 -33.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -10.318 0.093 -31.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -9.141 0.860 -32.378 1.00 0.00 H new ATOM 821 N ASN A 50 -5.988 -4.943 -27.603 1.00 0.00 N ATOM 822 CA ASN A 50 -4.770 -5.691 -27.309 1.00 0.00 C ATOM 823 C ASN A 50 -5.031 -6.761 -26.253 1.00 0.00 C ATOM 824 O ASN A 50 -4.291 -7.740 -26.151 1.00 0.00 O ATOM 825 CB ASN A 50 -3.669 -4.743 -26.830 1.00 0.00 C ATOM 826 CG ASN A 50 -2.384 -4.905 -27.618 1.00 0.00 C ATOM 827 OD1 ASN A 50 -2.083 -5.988 -28.120 1.00 0.00 O ATOM 828 ND2 ASN A 50 -1.618 -3.826 -27.730 1.00 0.00 N ATOM 0 H ASN A 50 -6.242 -4.254 -26.895 1.00 0.00 H new ATOM 0 HA ASN A 50 -4.444 -6.183 -28.226 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -4.017 -3.714 -26.915 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -3.470 -4.926 -25.774 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -0.741 -3.875 -28.249 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -1.907 -2.948 -27.298 1.00 0.00 H new ATOM 835 N VAL A 51 -6.087 -6.567 -25.470 1.00 0.00 N ATOM 836 CA VAL A 51 -6.447 -7.516 -24.424 1.00 0.00 C ATOM 837 C VAL A 51 -5.391 -7.549 -23.325 1.00 0.00 C ATOM 838 O VAL A 51 -4.919 -8.617 -22.933 1.00 0.00 O ATOM 839 CB VAL A 51 -6.626 -8.937 -24.991 1.00 0.00 C ATOM 840 CG1 VAL A 51 -7.320 -9.834 -23.977 1.00 0.00 C ATOM 841 CG2 VAL A 51 -7.404 -8.894 -26.297 1.00 0.00 C ATOM 0 H VAL A 51 -6.708 -5.761 -25.540 1.00 0.00 H new ATOM 0 HA VAL A 51 -7.395 -7.179 -24.004 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.640 -9.355 -25.195 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -7.438 -10.833 -24.396 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -6.720 -9.889 -23.069 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -8.301 -9.423 -23.739 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -7.521 -9.906 -26.684 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -8.387 -8.456 -26.121 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.862 -8.288 -27.024 1.00 0.00 H new ATOM 851 N LYS A 52 -5.023 -6.372 -22.830 1.00 0.00 N ATOM 852 CA LYS A 52 -4.023 -6.264 -21.775 1.00 0.00 C ATOM 853 C LYS A 52 -4.479 -5.294 -20.690 1.00 0.00 C ATOM 854 O LYS A 52 -5.359 -4.462 -20.917 1.00 0.00 O ATOM 855 CB LYS A 52 -2.685 -5.801 -22.357 1.00 0.00 C ATOM 856 CG LYS A 52 -1.528 -5.904 -21.378 1.00 0.00 C ATOM 857 CD LYS A 52 -0.188 -5.874 -22.093 1.00 0.00 C ATOM 858 CE LYS A 52 0.150 -4.475 -22.586 1.00 0.00 C ATOM 859 NZ LYS A 52 -0.100 -4.326 -24.047 1.00 0.00 N ATOM 0 H LYS A 52 -5.403 -5.479 -23.143 1.00 0.00 H new ATOM 0 HA LYS A 52 -3.896 -7.250 -21.327 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -2.457 -6.397 -23.240 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -2.780 -4.766 -22.687 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.579 -5.081 -20.665 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.615 -6.828 -20.806 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.594 -6.222 -21.418 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -0.209 -6.563 -22.937 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -0.445 -3.744 -22.039 1.00 0.00 H new ATOM 0 HE3 LYS A 52 1.197 -4.258 -22.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 0.142 -3.359 -24.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 0.487 -5.006 -24.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -1.104 -4.508 -24.248 1.00 0.00 H new ATOM 873 N LEU A 53 -3.876 -5.405 -19.512 1.00 0.00 N ATOM 874 CA LEU A 53 -4.220 -4.536 -18.391 1.00 0.00 C ATOM 875 C LEU A 53 -3.083 -3.566 -18.086 1.00 0.00 C ATOM 876 O LEU A 53 -1.921 -3.962 -18.000 1.00 0.00 O ATOM 877 CB LEU A 53 -4.539 -5.373 -17.151 1.00 0.00 C ATOM 878 CG LEU A 53 -6.006 -5.406 -16.723 1.00 0.00 C ATOM 879 CD1 LEU A 53 -6.855 -6.097 -17.779 1.00 0.00 C ATOM 880 CD2 LEU A 53 -6.154 -6.102 -15.378 1.00 0.00 C ATOM 0 H LEU A 53 -3.146 -6.088 -19.308 1.00 0.00 H new ATOM 0 HA LEU A 53 -5.102 -3.958 -18.668 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.212 -6.396 -17.334 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -3.947 -4.993 -16.319 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.357 -4.379 -16.619 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -7.896 -6.111 -17.457 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -6.774 -5.556 -18.722 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -6.504 -7.120 -17.916 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -7.205 -6.116 -15.089 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -5.785 -7.125 -15.455 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -5.578 -5.564 -14.625 1.00 0.00 H new ATOM 892 N VAL A 54 -3.427 -2.292 -17.920 1.00 0.00 N ATOM 893 CA VAL A 54 -2.437 -1.265 -17.621 1.00 0.00 C ATOM 894 C VAL A 54 -3.038 -0.154 -16.768 1.00 0.00 C ATOM 895 O VAL A 54 -4.250 -0.102 -16.564 1.00 0.00 O ATOM 896 CB VAL A 54 -1.857 -0.652 -18.909 1.00 0.00 C ATOM 897 CG1 VAL A 54 -1.289 -1.739 -19.810 1.00 0.00 C ATOM 898 CG2 VAL A 54 -2.919 0.156 -19.640 1.00 0.00 C ATOM 0 H VAL A 54 -4.385 -1.947 -17.988 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.635 -1.751 -17.066 1.00 0.00 H new ATOM 0 HB VAL A 54 -1.045 0.021 -18.636 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.884 -1.286 -20.715 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.496 -2.270 -19.284 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -2.080 -2.440 -20.078 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.491 0.582 -20.548 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -3.754 -0.494 -19.902 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -3.273 0.959 -18.994 1.00 0.00 H new ATOM 908 N GLU A 55 -2.181 0.734 -16.273 1.00 0.00 N ATOM 909 CA GLU A 55 -2.629 1.845 -15.442 1.00 0.00 C ATOM 910 C GLU A 55 -2.691 3.138 -16.249 1.00 0.00 C ATOM 911 O GLU A 55 -1.662 3.685 -16.645 1.00 0.00 O ATOM 912 CB GLU A 55 -1.695 2.023 -14.243 1.00 0.00 C ATOM 913 CG GLU A 55 -2.314 1.603 -12.921 1.00 0.00 C ATOM 914 CD GLU A 55 -1.600 2.204 -11.726 1.00 0.00 C ATOM 915 OE1 GLU A 55 -1.865 3.383 -11.408 1.00 0.00 O ATOM 916 OE2 GLU A 55 -0.777 1.497 -11.108 1.00 0.00 O ATOM 0 H GLU A 55 -1.174 0.705 -16.433 1.00 0.00 H new ATOM 0 HA GLU A 55 -3.631 1.614 -15.081 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -0.788 1.442 -14.411 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -1.396 3.069 -14.178 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -3.362 1.904 -12.903 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -2.293 0.516 -12.843 1.00 0.00 H new ATOM 923 N SER A 56 -3.906 3.621 -16.490 1.00 0.00 N ATOM 924 CA SER A 56 -4.103 4.848 -17.254 1.00 0.00 C ATOM 925 C SER A 56 -5.330 5.606 -16.756 1.00 0.00 C ATOM 926 O SER A 56 -6.146 5.067 -16.009 1.00 0.00 O ATOM 927 CB SER A 56 -4.256 4.528 -18.742 1.00 0.00 C ATOM 928 OG SER A 56 -4.644 5.678 -19.474 1.00 0.00 O ATOM 0 H SER A 56 -4.768 3.182 -16.168 1.00 0.00 H new ATOM 0 HA SER A 56 -3.226 5.479 -17.114 1.00 0.00 H new ATOM 0 HB2 SER A 56 -3.314 4.145 -19.133 1.00 0.00 H new ATOM 0 HB3 SER A 56 -4.999 3.742 -18.873 1.00 0.00 H new ATOM 0 HG SER A 56 -4.733 5.447 -20.422 1.00 0.00 H new ATOM 934 N ASP A 57 -5.452 6.860 -17.176 1.00 0.00 N ATOM 935 CA ASP A 57 -6.579 7.694 -16.774 1.00 0.00 C ATOM 936 C ASP A 57 -7.618 7.778 -17.889 1.00 0.00 C ATOM 937 O ASP A 57 -8.470 8.667 -17.892 1.00 0.00 O ATOM 938 CB ASP A 57 -6.097 9.098 -16.404 1.00 0.00 C ATOM 939 CG ASP A 57 -6.576 9.531 -15.033 1.00 0.00 C ATOM 940 OD1 ASP A 57 -7.708 9.164 -14.657 1.00 0.00 O ATOM 941 OD2 ASP A 57 -5.819 10.239 -14.335 1.00 0.00 O ATOM 0 H ASP A 57 -4.785 7.322 -17.794 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.044 7.236 -15.901 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -5.008 9.124 -16.430 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -6.451 9.809 -17.151 1.00 0.00 H new ATOM 946 N ASP A 58 -7.539 6.848 -18.834 1.00 0.00 N ATOM 947 CA ASP A 58 -8.472 6.816 -19.955 1.00 0.00 C ATOM 948 C ASP A 58 -9.863 6.392 -19.493 1.00 0.00 C ATOM 949 O ASP A 58 -10.018 5.791 -18.430 1.00 0.00 O ATOM 950 CB ASP A 58 -7.968 5.862 -21.039 1.00 0.00 C ATOM 951 CG ASP A 58 -8.796 5.937 -22.307 1.00 0.00 C ATOM 952 OD1 ASP A 58 -8.803 7.008 -22.948 1.00 0.00 O ATOM 953 OD2 ASP A 58 -9.438 4.924 -22.657 1.00 0.00 O ATOM 0 H ASP A 58 -6.839 6.106 -18.847 1.00 0.00 H new ATOM 0 HA ASP A 58 -8.538 7.822 -20.369 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -6.930 6.098 -21.272 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -7.985 4.841 -20.657 1.00 0.00 H new ATOM 958 N ALA A 59 -10.871 6.709 -20.298 1.00 0.00 N ATOM 959 CA ALA A 59 -12.248 6.360 -19.973 1.00 0.00 C ATOM 960 C ALA A 59 -12.679 5.091 -20.700 1.00 0.00 C ATOM 961 O ALA A 59 -12.168 4.776 -21.774 1.00 0.00 O ATOM 962 CB ALA A 59 -13.180 7.511 -20.318 1.00 0.00 C ATOM 0 H ALA A 59 -10.760 7.207 -21.181 1.00 0.00 H new ATOM 0 HA ALA A 59 -12.305 6.170 -18.901 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -14.205 7.236 -20.070 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -12.893 8.395 -19.748 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -13.111 7.728 -21.384 1.00 0.00 H new ATOM 968 N ALA A 60 -13.622 4.366 -20.107 1.00 0.00 N ATOM 969 CA ALA A 60 -14.122 3.132 -20.699 1.00 0.00 C ATOM 970 C ALA A 60 -15.642 3.162 -20.829 1.00 0.00 C ATOM 971 O ALA A 60 -16.293 4.101 -20.374 1.00 0.00 O ATOM 972 CB ALA A 60 -13.685 1.933 -19.871 1.00 0.00 C ATOM 0 H ALA A 60 -14.055 4.612 -19.217 1.00 0.00 H new ATOM 0 HA ALA A 60 -13.699 3.041 -21.700 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -14.066 1.019 -20.326 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -12.596 1.894 -19.834 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -14.079 2.027 -18.859 1.00 0.00 H new ATOM 978 N GLU A 61 -16.198 2.128 -21.453 1.00 0.00 N ATOM 979 CA GLU A 61 -17.641 2.038 -21.643 1.00 0.00 C ATOM 980 C GLU A 61 -18.371 2.091 -20.303 1.00 0.00 C ATOM 981 O GLU A 61 -19.548 2.442 -20.239 1.00 0.00 O ATOM 982 CB GLU A 61 -18.002 0.748 -22.381 1.00 0.00 C ATOM 983 CG GLU A 61 -17.616 0.760 -23.851 1.00 0.00 C ATOM 984 CD GLU A 61 -18.108 2.000 -24.573 1.00 0.00 C ATOM 985 OE1 GLU A 61 -19.324 2.089 -24.840 1.00 0.00 O ATOM 986 OE2 GLU A 61 -17.275 2.882 -24.870 1.00 0.00 O ATOM 0 H GLU A 61 -15.672 1.342 -21.835 1.00 0.00 H new ATOM 0 HA GLU A 61 -17.956 2.892 -22.243 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -17.508 -0.091 -21.891 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -19.076 0.580 -22.297 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -16.531 0.699 -23.939 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -18.025 -0.126 -24.338 1.00 0.00 H new ATOM 993 N ALA A 62 -17.662 1.740 -19.236 1.00 0.00 N ATOM 994 CA ALA A 62 -18.240 1.748 -17.898 1.00 0.00 C ATOM 995 C ALA A 62 -17.152 1.779 -16.830 1.00 0.00 C ATOM 996 O ALA A 62 -15.994 1.458 -17.098 1.00 0.00 O ATOM 997 CB ALA A 62 -19.139 0.536 -17.704 1.00 0.00 C ATOM 0 H ALA A 62 -16.686 1.446 -19.272 1.00 0.00 H new ATOM 0 HA ALA A 62 -18.840 2.652 -17.794 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -19.564 0.555 -16.700 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -19.944 0.558 -18.439 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -18.555 -0.375 -17.833 1.00 0.00 H new ATOM 1003 N THR A 63 -17.531 2.168 -15.616 1.00 0.00 N ATOM 1004 CA THR A 63 -16.588 2.242 -14.508 1.00 0.00 C ATOM 1005 C THR A 63 -17.087 1.447 -13.307 1.00 0.00 C ATOM 1006 O THR A 63 -18.236 1.592 -12.887 1.00 0.00 O ATOM 1007 CB THR A 63 -16.340 3.700 -14.077 1.00 0.00 C ATOM 1008 OG1 THR A 63 -16.057 4.509 -15.225 1.00 0.00 O ATOM 1009 CG2 THR A 63 -15.183 3.785 -13.094 1.00 0.00 C ATOM 0 H THR A 63 -18.485 2.437 -15.376 1.00 0.00 H new ATOM 0 HA THR A 63 -15.651 1.811 -14.862 1.00 0.00 H new ATOM 0 HB THR A 63 -17.241 4.068 -13.586 1.00 0.00 H new ATOM 0 HG1 THR A 63 -15.902 5.435 -14.943 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.027 4.824 -12.804 1.00 0.00 H new ATOM 0 HG22 THR A 63 -15.413 3.192 -12.209 1.00 0.00 H new ATOM 0 HG23 THR A 63 -14.278 3.400 -13.563 1.00 0.00 H new ATOM 1017 N LEU A 64 -16.217 0.608 -12.756 1.00 0.00 N ATOM 1018 CA LEU A 64 -16.569 -0.210 -11.601 1.00 0.00 C ATOM 1019 C LEU A 64 -15.682 0.123 -10.406 1.00 0.00 C ATOM 1020 O LEU A 64 -14.479 -0.140 -10.419 1.00 0.00 O ATOM 1021 CB LEU A 64 -16.444 -1.695 -11.945 1.00 0.00 C ATOM 1022 CG LEU A 64 -16.445 -2.662 -10.760 1.00 0.00 C ATOM 1023 CD1 LEU A 64 -17.839 -2.771 -10.162 1.00 0.00 C ATOM 1024 CD2 LEU A 64 -15.937 -4.031 -11.188 1.00 0.00 C ATOM 0 H LEU A 64 -15.262 0.476 -13.091 1.00 0.00 H new ATOM 0 HA LEU A 64 -17.603 0.009 -11.334 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -17.266 -1.964 -12.608 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -15.521 -1.841 -12.506 1.00 0.00 H new ATOM 0 HG LEU A 64 -15.774 -2.271 -9.996 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -17.821 -3.463 -9.320 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -18.165 -1.790 -9.818 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -18.532 -3.139 -10.919 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -15.945 -4.706 -10.332 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -16.582 -4.430 -11.971 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -14.920 -3.939 -11.568 1.00 0.00 H new ATOM 1036 N THR A 65 -16.283 0.702 -9.372 1.00 0.00 N ATOM 1037 CA THR A 65 -15.549 1.071 -8.168 1.00 0.00 C ATOM 1038 C THR A 65 -15.796 0.070 -7.045 1.00 0.00 C ATOM 1039 O THR A 65 -16.940 -0.271 -6.746 1.00 0.00 O ATOM 1040 CB THR A 65 -15.938 2.479 -7.681 1.00 0.00 C ATOM 1041 OG1 THR A 65 -15.774 3.427 -8.741 1.00 0.00 O ATOM 1042 CG2 THR A 65 -15.090 2.893 -6.488 1.00 0.00 C ATOM 0 H THR A 65 -17.278 0.926 -9.344 1.00 0.00 H new ATOM 0 HA THR A 65 -14.491 1.066 -8.429 1.00 0.00 H new ATOM 0 HB THR A 65 -16.983 2.456 -7.373 1.00 0.00 H new ATOM 0 HG1 THR A 65 -16.025 4.319 -8.423 1.00 0.00 H new ATOM 0 HG21 THR A 65 -15.383 3.891 -6.162 1.00 0.00 H new ATOM 0 HG22 THR A 65 -15.240 2.186 -5.672 1.00 0.00 H new ATOM 0 HG23 THR A 65 -14.038 2.899 -6.774 1.00 0.00 H new ATOM 1050 N MET A 66 -14.716 -0.396 -6.426 1.00 0.00 N ATOM 1051 CA MET A 66 -14.818 -1.356 -5.333 1.00 0.00 C ATOM 1052 C MET A 66 -13.567 -1.321 -4.460 1.00 0.00 C ATOM 1053 O MET A 66 -12.460 -1.113 -4.955 1.00 0.00 O ATOM 1054 CB MET A 66 -15.029 -2.768 -5.884 1.00 0.00 C ATOM 1055 CG MET A 66 -16.478 -3.225 -5.845 1.00 0.00 C ATOM 1056 SD MET A 66 -16.643 -5.018 -5.933 1.00 0.00 S ATOM 1057 CE MET A 66 -16.571 -5.279 -7.703 1.00 0.00 C ATOM 0 H MET A 66 -13.762 -0.125 -6.662 1.00 0.00 H new ATOM 0 HA MET A 66 -15.676 -1.080 -4.720 1.00 0.00 H new ATOM 0 HB2 MET A 66 -14.673 -2.804 -6.913 1.00 0.00 H new ATOM 0 HB3 MET A 66 -14.420 -3.468 -5.311 1.00 0.00 H new ATOM 0 HG2 MET A 66 -16.944 -2.866 -4.927 1.00 0.00 H new ATOM 0 HG3 MET A 66 -17.020 -2.773 -6.676 1.00 0.00 H new ATOM 0 HE1 MET A 66 -17.537 -5.638 -8.057 1.00 0.00 H new ATOM 0 HE2 MET A 66 -16.329 -4.340 -8.200 1.00 0.00 H new ATOM 0 HE3 MET A 66 -15.803 -6.018 -7.931 1.00 0.00 H new ATOM 1067 N GLU A 67 -13.753 -1.524 -3.160 1.00 0.00 N ATOM 1068 CA GLU A 67 -12.638 -1.514 -2.219 1.00 0.00 C ATOM 1069 C GLU A 67 -11.681 -2.669 -2.497 1.00 0.00 C ATOM 1070 O GLU A 67 -11.993 -3.576 -3.270 1.00 0.00 O ATOM 1071 CB GLU A 67 -13.155 -1.600 -0.781 1.00 0.00 C ATOM 1072 CG GLU A 67 -13.778 -0.308 -0.280 1.00 0.00 C ATOM 1073 CD GLU A 67 -15.077 -0.539 0.469 1.00 0.00 C ATOM 1074 OE1 GLU A 67 -15.170 -1.551 1.195 1.00 0.00 O ATOM 1075 OE2 GLU A 67 -15.999 0.290 0.328 1.00 0.00 O ATOM 0 H GLU A 67 -14.664 -1.697 -2.734 1.00 0.00 H new ATOM 0 HA GLU A 67 -12.096 -0.577 -2.347 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -13.894 -2.399 -0.717 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -12.330 -1.875 -0.123 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -13.071 0.202 0.375 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -13.963 0.354 -1.126 1.00 0.00 H new ATOM 1082 N ASP A 68 -10.514 -2.628 -1.863 1.00 0.00 N ATOM 1083 CA ASP A 68 -9.511 -3.671 -2.040 1.00 0.00 C ATOM 1084 C ASP A 68 -9.992 -4.995 -1.454 1.00 0.00 C ATOM 1085 O ASP A 68 -9.855 -6.048 -2.077 1.00 0.00 O ATOM 1086 CB ASP A 68 -8.193 -3.258 -1.384 1.00 0.00 C ATOM 1087 CG ASP A 68 -7.010 -4.045 -1.913 1.00 0.00 C ATOM 1088 OD1 ASP A 68 -6.978 -4.320 -3.130 1.00 0.00 O ATOM 1089 OD2 ASP A 68 -6.116 -4.385 -1.110 1.00 0.00 O ATOM 0 H ASP A 68 -10.240 -1.884 -1.222 1.00 0.00 H new ATOM 0 HA ASP A 68 -9.349 -3.806 -3.109 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -8.024 -2.195 -1.554 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -8.267 -3.400 -0.306 1.00 0.00 H new ATOM 1094 N ASP A 69 -10.555 -4.933 -0.252 1.00 0.00 N ATOM 1095 CA ASP A 69 -11.057 -6.127 0.419 1.00 0.00 C ATOM 1096 C ASP A 69 -12.328 -6.635 -0.255 1.00 0.00 C ATOM 1097 O ASP A 69 -12.630 -7.828 -0.214 1.00 0.00 O ATOM 1098 CB ASP A 69 -11.330 -5.831 1.894 1.00 0.00 C ATOM 1099 CG ASP A 69 -10.117 -6.084 2.769 1.00 0.00 C ATOM 1100 OD1 ASP A 69 -9.646 -7.239 2.810 1.00 0.00 O ATOM 1101 OD2 ASP A 69 -9.640 -5.126 3.413 1.00 0.00 O ATOM 0 H ASP A 69 -10.675 -4.069 0.277 1.00 0.00 H new ATOM 0 HA ASP A 69 -10.295 -6.903 0.347 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -11.642 -4.792 2.002 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -12.159 -6.450 2.239 1.00 0.00 H new ATOM 1106 N ILE A 70 -13.070 -5.721 -0.872 1.00 0.00 N ATOM 1107 CA ILE A 70 -14.309 -6.077 -1.554 1.00 0.00 C ATOM 1108 C ILE A 70 -14.028 -6.663 -2.933 1.00 0.00 C ATOM 1109 O ILE A 70 -14.519 -7.739 -3.273 1.00 0.00 O ATOM 1110 CB ILE A 70 -15.238 -4.858 -1.705 1.00 0.00 C ATOM 1111 CG1 ILE A 70 -15.373 -4.124 -0.370 1.00 0.00 C ATOM 1112 CG2 ILE A 70 -16.603 -5.294 -2.217 1.00 0.00 C ATOM 1113 CD1 ILE A 70 -16.328 -4.793 0.594 1.00 0.00 C ATOM 0 H ILE A 70 -12.835 -4.729 -0.914 1.00 0.00 H new ATOM 0 HA ILE A 70 -14.805 -6.827 -0.938 1.00 0.00 H new ATOM 0 HB ILE A 70 -14.801 -4.173 -2.431 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -14.390 -4.051 0.096 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -15.713 -3.105 -0.557 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -17.249 -4.422 -2.319 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -16.490 -5.777 -3.187 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -17.049 -5.996 -1.512 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -16.374 -4.218 1.519 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -17.321 -4.842 0.147 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -15.978 -5.802 0.811 1.00 0.00 H new ATOM 1125 N MET A 71 -13.234 -5.948 -3.723 1.00 0.00 N ATOM 1126 CA MET A 71 -12.885 -6.399 -5.066 1.00 0.00 C ATOM 1127 C MET A 71 -12.290 -7.803 -5.030 1.00 0.00 C ATOM 1128 O MET A 71 -12.435 -8.574 -5.979 1.00 0.00 O ATOM 1129 CB MET A 71 -11.894 -5.429 -5.711 1.00 0.00 C ATOM 1130 CG MET A 71 -11.571 -5.764 -7.158 1.00 0.00 C ATOM 1131 SD MET A 71 -12.597 -4.853 -8.328 1.00 0.00 S ATOM 1132 CE MET A 71 -11.541 -3.453 -8.687 1.00 0.00 C ATOM 0 H MET A 71 -12.820 -5.054 -3.457 1.00 0.00 H new ATOM 0 HA MET A 71 -13.797 -6.425 -5.662 1.00 0.00 H new ATOM 0 HB2 MET A 71 -12.302 -4.420 -5.663 1.00 0.00 H new ATOM 0 HB3 MET A 71 -10.970 -5.427 -5.132 1.00 0.00 H new ATOM 0 HG2 MET A 71 -10.521 -5.543 -7.352 1.00 0.00 H new ATOM 0 HG3 MET A 71 -11.706 -6.834 -7.318 1.00 0.00 H new ATOM 0 HE1 MET A 71 -11.780 -3.061 -9.675 1.00 0.00 H new ATOM 0 HE2 MET A 71 -11.701 -2.676 -7.940 1.00 0.00 H new ATOM 0 HE3 MET A 71 -10.498 -3.769 -8.665 1.00 0.00 H new ATOM 1142 N PHE A 72 -11.620 -8.130 -3.929 1.00 0.00 N ATOM 1143 CA PHE A 72 -11.002 -9.441 -3.771 1.00 0.00 C ATOM 1144 C PHE A 72 -12.053 -10.547 -3.819 1.00 0.00 C ATOM 1145 O PHE A 72 -11.861 -11.571 -4.472 1.00 0.00 O ATOM 1146 CB PHE A 72 -10.233 -9.509 -2.450 1.00 0.00 C ATOM 1147 CG PHE A 72 -9.105 -10.501 -2.464 1.00 0.00 C ATOM 1148 CD1 PHE A 72 -7.988 -10.290 -3.256 1.00 0.00 C ATOM 1149 CD2 PHE A 72 -9.162 -11.646 -1.685 1.00 0.00 C ATOM 1150 CE1 PHE A 72 -6.949 -11.201 -3.271 1.00 0.00 C ATOM 1151 CE2 PHE A 72 -8.126 -12.560 -1.696 1.00 0.00 C ATOM 1152 CZ PHE A 72 -7.018 -12.338 -2.491 1.00 0.00 C ATOM 0 H PHE A 72 -11.492 -7.505 -3.133 1.00 0.00 H new ATOM 0 HA PHE A 72 -10.306 -9.590 -4.597 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -9.835 -8.521 -2.219 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -10.925 -9.769 -1.649 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -7.929 -9.403 -3.869 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -10.026 -11.826 -1.062 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -6.084 -11.024 -3.892 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -8.182 -13.448 -1.083 1.00 0.00 H new ATOM 0 HZ PHE A 72 -6.208 -13.052 -2.502 1.00 0.00 H new ATOM 1162 N ALA A 73 -13.163 -10.330 -3.120 1.00 0.00 N ATOM 1163 CA ALA A 73 -14.244 -11.307 -3.083 1.00 0.00 C ATOM 1164 C ALA A 73 -14.839 -11.520 -4.471 1.00 0.00 C ATOM 1165 O ALA A 73 -14.948 -12.652 -4.943 1.00 0.00 O ATOM 1166 CB ALA A 73 -15.323 -10.862 -2.107 1.00 0.00 C ATOM 0 H ALA A 73 -13.337 -9.487 -2.572 1.00 0.00 H new ATOM 0 HA ALA A 73 -13.831 -12.257 -2.744 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -16.124 -11.601 -2.089 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -14.894 -10.767 -1.109 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -15.724 -9.899 -2.423 1.00 0.00 H new ATOM 1172 N ILE A 74 -15.223 -10.426 -5.120 1.00 0.00 N ATOM 1173 CA ILE A 74 -15.806 -10.494 -6.454 1.00 0.00 C ATOM 1174 C ILE A 74 -14.771 -10.931 -7.485 1.00 0.00 C ATOM 1175 O ILE A 74 -15.117 -11.342 -8.592 1.00 0.00 O ATOM 1176 CB ILE A 74 -16.397 -9.137 -6.880 1.00 0.00 C ATOM 1177 CG1 ILE A 74 -17.107 -8.471 -5.699 1.00 0.00 C ATOM 1178 CG2 ILE A 74 -17.356 -9.320 -8.047 1.00 0.00 C ATOM 1179 CD1 ILE A 74 -18.098 -9.376 -5.003 1.00 0.00 C ATOM 0 H ILE A 74 -15.141 -9.482 -4.743 1.00 0.00 H new ATOM 0 HA ILE A 74 -16.607 -11.232 -6.411 1.00 0.00 H new ATOM 0 HB ILE A 74 -15.583 -8.488 -7.202 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -16.361 -8.139 -4.977 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -17.626 -7.580 -6.053 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -17.765 -8.352 -8.337 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -16.822 -9.756 -8.892 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -18.168 -9.983 -7.750 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -18.563 -8.839 -4.177 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -18.866 -9.688 -5.711 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -17.580 -10.255 -4.619 1.00 0.00 H new ATOM 1191 N GLY A 75 -13.498 -10.843 -7.112 1.00 0.00 N ATOM 1192 CA GLY A 75 -12.431 -11.235 -8.015 1.00 0.00 C ATOM 1193 C GLY A 75 -12.052 -12.694 -7.865 1.00 0.00 C ATOM 1194 O GLY A 75 -11.689 -13.353 -8.840 1.00 0.00 O ATOM 0 H GLY A 75 -13.186 -10.507 -6.201 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -12.742 -11.047 -9.043 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -11.555 -10.614 -7.828 1.00 0.00 H new ATOM 1198 N THR A 76 -12.134 -13.203 -6.639 1.00 0.00 N ATOM 1199 CA THR A 76 -11.794 -14.593 -6.364 1.00 0.00 C ATOM 1200 C THR A 76 -13.040 -15.471 -6.349 1.00 0.00 C ATOM 1201 O THR A 76 -13.083 -16.493 -5.665 1.00 0.00 O ATOM 1202 CB THR A 76 -11.063 -14.736 -5.016 1.00 0.00 C ATOM 1203 OG1 THR A 76 -11.870 -14.202 -3.961 1.00 0.00 O ATOM 1204 CG2 THR A 76 -9.722 -14.018 -5.049 1.00 0.00 C ATOM 0 H THR A 76 -12.433 -12.672 -5.821 1.00 0.00 H new ATOM 0 HA THR A 76 -11.131 -14.921 -7.165 1.00 0.00 H new ATOM 0 HB THR A 76 -10.886 -15.796 -4.835 1.00 0.00 H new ATOM 0 HG1 THR A 76 -11.704 -13.240 -3.877 1.00 0.00 H new ATOM 0 HG21 THR A 76 -9.224 -14.133 -4.086 1.00 0.00 H new ATOM 0 HG22 THR A 76 -9.099 -14.447 -5.833 1.00 0.00 H new ATOM 0 HG23 THR A 76 -9.881 -12.959 -5.251 1.00 0.00 H new ATOM 1212 N GLY A 77 -14.053 -15.067 -7.109 1.00 0.00 N ATOM 1213 CA GLY A 77 -15.286 -15.829 -7.169 1.00 0.00 C ATOM 1214 C GLY A 77 -15.868 -16.099 -5.796 1.00 0.00 C ATOM 1215 O GLY A 77 -16.644 -17.037 -5.617 1.00 0.00 O ATOM 0 H GLY A 77 -14.042 -14.225 -7.685 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -16.016 -15.286 -7.769 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -15.100 -16.777 -7.674 1.00 0.00 H new ATOM 1219 N ALA A 78 -15.491 -15.277 -4.823 1.00 0.00 N ATOM 1220 CA ALA A 78 -15.981 -15.431 -3.458 1.00 0.00 C ATOM 1221 C ALA A 78 -17.430 -14.971 -3.340 1.00 0.00 C ATOM 1222 O ALA A 78 -18.324 -15.769 -3.055 1.00 0.00 O ATOM 1223 CB ALA A 78 -15.098 -14.657 -2.490 1.00 0.00 C ATOM 0 H ALA A 78 -14.847 -14.497 -4.954 1.00 0.00 H new ATOM 0 HA ALA A 78 -15.942 -16.490 -3.201 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -15.475 -14.781 -1.475 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -14.077 -15.035 -2.546 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -15.108 -13.600 -2.754 1.00 0.00 H new ATOM 1229 N LEU A 79 -17.656 -13.681 -3.560 1.00 0.00 N ATOM 1230 CA LEU A 79 -18.997 -13.114 -3.477 1.00 0.00 C ATOM 1231 C LEU A 79 -19.458 -12.604 -4.839 1.00 0.00 C ATOM 1232 O LEU A 79 -18.673 -12.084 -5.632 1.00 0.00 O ATOM 1233 CB LEU A 79 -19.030 -11.976 -2.456 1.00 0.00 C ATOM 1234 CG LEU A 79 -19.359 -12.375 -1.017 1.00 0.00 C ATOM 1235 CD1 LEU A 79 -18.952 -11.273 -0.051 1.00 0.00 C ATOM 1236 CD2 LEU A 79 -20.841 -12.690 -0.876 1.00 0.00 C ATOM 0 H LEU A 79 -16.928 -13.008 -3.797 1.00 0.00 H new ATOM 0 HA LEU A 79 -19.678 -13.902 -3.155 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -18.059 -11.481 -2.462 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -19.764 -11.241 -2.785 1.00 0.00 H new ATOM 0 HG LEU A 79 -18.792 -13.273 -0.771 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -19.194 -11.575 0.968 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -17.880 -11.096 -0.132 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -19.491 -10.357 -0.296 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -21.057 -12.972 0.155 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -21.427 -11.810 -1.142 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -21.103 -13.514 -1.540 1.00 0.00 H new ATOM 1248 N PRO A 80 -20.762 -12.752 -5.117 1.00 0.00 N ATOM 1249 CA PRO A 80 -21.357 -12.310 -6.382 1.00 0.00 C ATOM 1250 C PRO A 80 -21.404 -10.790 -6.500 1.00 0.00 C ATOM 1251 O PRO A 80 -21.866 -10.102 -5.590 1.00 0.00 O ATOM 1252 CB PRO A 80 -22.774 -12.887 -6.328 1.00 0.00 C ATOM 1253 CG PRO A 80 -23.067 -13.034 -4.875 1.00 0.00 C ATOM 1254 CD PRO A 80 -21.755 -13.363 -4.218 1.00 0.00 C ATOM 0 HA PRO A 80 -20.779 -12.644 -7.244 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -23.491 -12.223 -6.811 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -22.831 -13.846 -6.843 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -23.488 -12.115 -4.467 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -23.798 -13.824 -4.703 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -21.694 -12.949 -3.211 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -21.609 -14.439 -4.129 1.00 0.00 H new ATOM 1262 N ALA A 81 -20.924 -10.274 -7.626 1.00 0.00 N ATOM 1263 CA ALA A 81 -20.914 -8.836 -7.864 1.00 0.00 C ATOM 1264 C ALA A 81 -22.325 -8.260 -7.804 1.00 0.00 C ATOM 1265 O ALA A 81 -22.513 -7.082 -7.500 1.00 0.00 O ATOM 1266 CB ALA A 81 -20.273 -8.528 -9.209 1.00 0.00 C ATOM 0 H ALA A 81 -20.537 -10.830 -8.388 1.00 0.00 H new ATOM 0 HA ALA A 81 -20.324 -8.366 -7.077 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -20.272 -7.450 -9.374 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -19.247 -8.897 -9.216 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -20.839 -9.016 -10.002 1.00 0.00 H new ATOM 1272 N LYS A 82 -23.314 -9.098 -8.095 1.00 0.00 N ATOM 1273 CA LYS A 82 -24.709 -8.673 -8.074 1.00 0.00 C ATOM 1274 C LYS A 82 -25.145 -8.307 -6.659 1.00 0.00 C ATOM 1275 O LYS A 82 -25.618 -7.198 -6.413 1.00 0.00 O ATOM 1276 CB LYS A 82 -25.609 -9.780 -8.626 1.00 0.00 C ATOM 1277 CG LYS A 82 -26.942 -9.276 -9.151 1.00 0.00 C ATOM 1278 CD LYS A 82 -27.800 -10.413 -9.680 1.00 0.00 C ATOM 1279 CE LYS A 82 -29.268 -10.021 -9.742 1.00 0.00 C ATOM 1280 NZ LYS A 82 -30.157 -11.211 -9.844 1.00 0.00 N ATOM 0 H LYS A 82 -23.175 -10.076 -8.348 1.00 0.00 H new ATOM 0 HA LYS A 82 -24.803 -7.789 -8.704 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -25.084 -10.297 -9.429 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -25.791 -10.514 -7.841 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -27.475 -8.757 -8.354 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -26.770 -8.549 -9.945 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -27.456 -10.698 -10.674 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -27.682 -11.287 -9.040 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -29.529 -9.448 -8.852 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -29.434 -9.369 -10.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -31.149 -10.901 -9.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -29.926 -11.744 -10.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -30.018 -11.820 -9.013 1.00 0.00 H new ATOM 1294 N GLU A 83 -24.980 -9.247 -5.732 1.00 0.00 N ATOM 1295 CA GLU A 83 -25.357 -9.021 -4.342 1.00 0.00 C ATOM 1296 C GLU A 83 -24.594 -7.836 -3.757 1.00 0.00 C ATOM 1297 O GLU A 83 -25.184 -6.947 -3.144 1.00 0.00 O ATOM 1298 CB GLU A 83 -25.088 -10.276 -3.508 1.00 0.00 C ATOM 1299 CG GLU A 83 -25.880 -11.490 -3.963 1.00 0.00 C ATOM 1300 CD GLU A 83 -27.377 -11.301 -3.815 1.00 0.00 C ATOM 1301 OE1 GLU A 83 -27.789 -10.441 -3.008 1.00 0.00 O ATOM 1302 OE2 GLU A 83 -28.136 -12.013 -4.505 1.00 0.00 O ATOM 0 H GLU A 83 -24.588 -10.170 -5.919 1.00 0.00 H new ATOM 0 HA GLU A 83 -26.423 -8.795 -4.313 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -24.024 -10.510 -3.551 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -25.326 -10.067 -2.465 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -25.646 -11.701 -5.006 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -25.569 -12.360 -3.384 1.00 0.00 H new ATOM 1309 N ALA A 84 -23.280 -7.831 -3.951 1.00 0.00 N ATOM 1310 CA ALA A 84 -22.436 -6.756 -3.445 1.00 0.00 C ATOM 1311 C ALA A 84 -22.986 -5.392 -3.847 1.00 0.00 C ATOM 1312 O ALA A 84 -23.005 -4.459 -3.045 1.00 0.00 O ATOM 1313 CB ALA A 84 -21.010 -6.922 -3.949 1.00 0.00 C ATOM 0 H ALA A 84 -22.776 -8.560 -4.456 1.00 0.00 H new ATOM 0 HA ALA A 84 -22.433 -6.811 -2.356 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -20.391 -6.112 -3.563 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -20.612 -7.877 -3.607 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -21.004 -6.896 -5.039 1.00 0.00 H new ATOM 1319 N MET A 85 -23.431 -5.283 -5.095 1.00 0.00 N ATOM 1320 CA MET A 85 -23.981 -4.031 -5.603 1.00 0.00 C ATOM 1321 C MET A 85 -25.284 -3.682 -4.891 1.00 0.00 C ATOM 1322 O MET A 85 -25.630 -2.509 -4.751 1.00 0.00 O ATOM 1323 CB MET A 85 -24.221 -4.130 -7.111 1.00 0.00 C ATOM 1324 CG MET A 85 -23.537 -3.032 -7.908 1.00 0.00 C ATOM 1325 SD MET A 85 -24.601 -2.336 -9.188 1.00 0.00 S ATOM 1326 CE MET A 85 -25.006 -3.807 -10.126 1.00 0.00 C ATOM 0 H MET A 85 -23.422 -6.046 -5.772 1.00 0.00 H new ATOM 0 HA MET A 85 -23.258 -3.239 -5.409 1.00 0.00 H new ATOM 0 HB2 MET A 85 -23.867 -5.098 -7.464 1.00 0.00 H new ATOM 0 HB3 MET A 85 -25.293 -4.093 -7.303 1.00 0.00 H new ATOM 0 HG2 MET A 85 -23.224 -2.238 -7.230 1.00 0.00 H new ATOM 0 HG3 MET A 85 -22.634 -3.432 -8.369 1.00 0.00 H new ATOM 0 HE1 MET A 85 -25.429 -3.520 -11.089 1.00 0.00 H new ATOM 0 HE2 MET A 85 -24.103 -4.396 -10.287 1.00 0.00 H new ATOM 0 HE3 MET A 85 -25.733 -4.402 -9.574 1.00 0.00 H new ATOM 1336 N ALA A 86 -26.002 -4.706 -4.443 1.00 0.00 N ATOM 1337 CA ALA A 86 -27.265 -4.506 -3.744 1.00 0.00 C ATOM 1338 C ALA A 86 -27.031 -4.056 -2.306 1.00 0.00 C ATOM 1339 O ALA A 86 -27.880 -3.394 -1.708 1.00 0.00 O ATOM 1340 CB ALA A 86 -28.091 -5.784 -3.770 1.00 0.00 C ATOM 0 H ALA A 86 -25.730 -5.683 -4.552 1.00 0.00 H new ATOM 0 HA ALA A 86 -27.816 -3.719 -4.259 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -29.032 -5.620 -3.244 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -28.297 -6.063 -4.803 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -27.537 -6.585 -3.281 1.00 0.00 H new ATOM 1346 N GLN A 87 -25.877 -4.419 -1.757 1.00 0.00 N ATOM 1347 CA GLN A 87 -25.533 -4.052 -0.388 1.00 0.00 C ATOM 1348 C GLN A 87 -24.852 -2.689 -0.344 1.00 0.00 C ATOM 1349 O GLN A 87 -24.345 -2.270 0.697 1.00 0.00 O ATOM 1350 CB GLN A 87 -24.621 -5.112 0.233 1.00 0.00 C ATOM 1351 CG GLN A 87 -25.300 -6.457 0.432 1.00 0.00 C ATOM 1352 CD GLN A 87 -25.063 -7.031 1.816 1.00 0.00 C ATOM 1353 OE1 GLN A 87 -25.010 -6.298 2.803 1.00 0.00 O ATOM 1354 NE2 GLN A 87 -24.920 -8.349 1.894 1.00 0.00 N ATOM 0 H GLN A 87 -25.164 -4.967 -2.239 1.00 0.00 H new ATOM 0 HA GLN A 87 -26.456 -3.995 0.189 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -23.747 -5.246 -0.405 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -24.260 -4.750 1.196 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -26.372 -6.347 0.267 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -24.933 -7.159 -0.316 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -24.971 -8.918 1.049 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -24.759 -8.792 2.799 1.00 0.00 H new ATOM 1363 N ASP A 88 -24.842 -2.001 -1.481 1.00 0.00 N ATOM 1364 CA ASP A 88 -24.223 -0.684 -1.573 1.00 0.00 C ATOM 1365 C ASP A 88 -22.722 -0.770 -1.311 1.00 0.00 C ATOM 1366 O ASP A 88 -22.060 0.245 -1.092 1.00 0.00 O ATOM 1367 CB ASP A 88 -24.873 0.279 -0.578 1.00 0.00 C ATOM 1368 CG ASP A 88 -24.907 1.705 -1.090 1.00 0.00 C ATOM 1369 OD1 ASP A 88 -25.324 1.909 -2.249 1.00 0.00 O ATOM 1370 OD2 ASP A 88 -24.515 2.618 -0.333 1.00 0.00 O ATOM 0 H ASP A 88 -25.256 -2.334 -2.352 1.00 0.00 H new ATOM 0 HA ASP A 88 -24.376 -0.307 -2.584 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -25.890 -0.053 -0.367 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -24.326 0.247 0.364 1.00 0.00 H new ATOM 1375 N LYS A 89 -22.191 -1.987 -1.334 1.00 0.00 N ATOM 1376 CA LYS A 89 -20.769 -2.207 -1.099 1.00 0.00 C ATOM 1377 C LYS A 89 -19.967 -1.992 -2.379 1.00 0.00 C ATOM 1378 O LYS A 89 -18.739 -2.070 -2.373 1.00 0.00 O ATOM 1379 CB LYS A 89 -20.532 -3.622 -0.567 1.00 0.00 C ATOM 1380 CG LYS A 89 -21.119 -3.860 0.813 1.00 0.00 C ATOM 1381 CD LYS A 89 -20.040 -4.198 1.828 1.00 0.00 C ATOM 1382 CE LYS A 89 -20.633 -4.804 3.091 1.00 0.00 C ATOM 1383 NZ LYS A 89 -19.582 -5.148 4.088 1.00 0.00 N ATOM 0 H LYS A 89 -22.725 -2.838 -1.513 1.00 0.00 H new ATOM 0 HA LYS A 89 -20.433 -1.485 -0.355 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -20.963 -4.340 -1.265 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -19.459 -3.814 -0.534 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -21.659 -2.971 1.138 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -21.843 -4.673 0.766 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -19.330 -4.897 1.386 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -19.483 -3.296 2.083 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -21.338 -4.101 3.535 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -21.197 -5.701 2.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -20.027 -5.558 4.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -18.923 -5.838 3.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -19.061 -4.288 4.353 1.00 0.00 H new ATOM 1397 N MET A 90 -20.670 -1.720 -3.473 1.00 0.00 N ATOM 1398 CA MET A 90 -20.022 -1.491 -4.760 1.00 0.00 C ATOM 1399 C MET A 90 -20.950 -0.742 -5.710 1.00 0.00 C ATOM 1400 O MET A 90 -22.168 -0.913 -5.666 1.00 0.00 O ATOM 1401 CB MET A 90 -19.598 -2.822 -5.385 1.00 0.00 C ATOM 1402 CG MET A 90 -20.764 -3.653 -5.893 1.00 0.00 C ATOM 1403 SD MET A 90 -20.231 -5.154 -6.738 1.00 0.00 S ATOM 1404 CE MET A 90 -20.223 -4.599 -8.441 1.00 0.00 C ATOM 0 H MET A 90 -21.688 -1.653 -3.495 1.00 0.00 H new ATOM 0 HA MET A 90 -19.136 -0.879 -4.589 1.00 0.00 H new ATOM 0 HB2 MET A 90 -18.916 -2.625 -6.212 1.00 0.00 H new ATOM 0 HB3 MET A 90 -19.044 -3.401 -4.646 1.00 0.00 H new ATOM 0 HG2 MET A 90 -21.406 -3.921 -5.054 1.00 0.00 H new ATOM 0 HG3 MET A 90 -21.365 -3.051 -6.575 1.00 0.00 H new ATOM 0 HE1 MET A 90 -19.407 -5.083 -8.977 1.00 0.00 H new ATOM 0 HE2 MET A 90 -21.171 -4.858 -8.913 1.00 0.00 H new ATOM 0 HE3 MET A 90 -20.087 -3.518 -8.471 1.00 0.00 H new ATOM 1414 N GLU A 91 -20.366 0.088 -6.569 1.00 0.00 N ATOM 1415 CA GLU A 91 -21.143 0.864 -7.529 1.00 0.00 C ATOM 1416 C GLU A 91 -20.543 0.755 -8.928 1.00 0.00 C ATOM 1417 O GLU A 91 -19.394 0.347 -9.093 1.00 0.00 O ATOM 1418 CB GLU A 91 -21.205 2.332 -7.101 1.00 0.00 C ATOM 1419 CG GLU A 91 -22.141 3.174 -7.951 1.00 0.00 C ATOM 1420 CD GLU A 91 -22.683 4.377 -7.204 1.00 0.00 C ATOM 1421 OE1 GLU A 91 -21.880 5.090 -6.566 1.00 0.00 O ATOM 1422 OE2 GLU A 91 -23.910 4.605 -7.256 1.00 0.00 O ATOM 0 H GLU A 91 -19.359 0.240 -6.620 1.00 0.00 H new ATOM 0 HA GLU A 91 -22.154 0.458 -7.553 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -21.526 2.385 -6.061 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -20.203 2.758 -7.148 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -21.612 3.512 -8.842 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -22.973 2.556 -8.290 1.00 0.00 H new ATOM 1429 N VAL A 92 -21.331 1.123 -9.933 1.00 0.00 N ATOM 1430 CA VAL A 92 -20.879 1.068 -11.318 1.00 0.00 C ATOM 1431 C VAL A 92 -21.521 2.173 -12.150 1.00 0.00 C ATOM 1432 O VAL A 92 -22.696 2.495 -11.972 1.00 0.00 O ATOM 1433 CB VAL A 92 -21.201 -0.295 -11.960 1.00 0.00 C ATOM 1434 CG1 VAL A 92 -22.698 -0.441 -12.181 1.00 0.00 C ATOM 1435 CG2 VAL A 92 -20.441 -0.460 -13.267 1.00 0.00 C ATOM 0 H VAL A 92 -22.285 1.462 -9.814 1.00 0.00 H new ATOM 0 HA VAL A 92 -19.798 1.209 -11.304 1.00 0.00 H new ATOM 0 HB VAL A 92 -20.881 -1.083 -11.279 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -22.906 -1.410 -12.635 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -23.216 -0.370 -11.224 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -23.047 0.352 -12.842 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -20.680 -1.428 -13.707 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -20.728 0.333 -13.957 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -19.370 -0.404 -13.075 1.00 0.00 H new ATOM 1445 N ASP A 93 -20.743 2.749 -13.059 1.00 0.00 N ATOM 1446 CA ASP A 93 -21.236 3.818 -13.921 1.00 0.00 C ATOM 1447 C ASP A 93 -21.017 3.474 -15.391 1.00 0.00 C ATOM 1448 O ASP A 93 -20.278 2.548 -15.719 1.00 0.00 O ATOM 1449 CB ASP A 93 -20.539 5.137 -13.583 1.00 0.00 C ATOM 1450 CG ASP A 93 -21.523 6.258 -13.311 1.00 0.00 C ATOM 1451 OD1 ASP A 93 -22.579 5.985 -12.704 1.00 0.00 O ATOM 1452 OD2 ASP A 93 -21.236 7.408 -13.706 1.00 0.00 O ATOM 0 H ASP A 93 -19.768 2.494 -13.219 1.00 0.00 H new ATOM 0 HA ASP A 93 -22.307 3.928 -13.748 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -19.903 4.995 -12.709 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -19.887 5.422 -14.409 1.00 0.00 H new ATOM 1457 N GLY A 94 -21.667 4.228 -16.273 1.00 0.00 N ATOM 1458 CA GLY A 94 -21.531 3.987 -17.698 1.00 0.00 C ATOM 1459 C GLY A 94 -22.768 3.348 -18.298 1.00 0.00 C ATOM 1460 O GLY A 94 -23.874 3.867 -18.152 1.00 0.00 O ATOM 0 H GLY A 94 -22.285 5.001 -16.026 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -21.331 4.931 -18.206 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -20.671 3.341 -17.874 1.00 0.00 H new ATOM 1464 N GLN A 95 -22.580 2.221 -18.976 1.00 0.00 N ATOM 1465 CA GLN A 95 -23.689 1.512 -19.602 1.00 0.00 C ATOM 1466 C GLN A 95 -24.137 0.334 -18.744 1.00 0.00 C ATOM 1467 O GLN A 95 -23.490 -0.712 -18.721 1.00 0.00 O ATOM 1468 CB GLN A 95 -23.288 1.021 -20.994 1.00 0.00 C ATOM 1469 CG GLN A 95 -23.852 1.866 -22.125 1.00 0.00 C ATOM 1470 CD GLN A 95 -25.346 2.092 -21.995 1.00 0.00 C ATOM 1471 OE1 GLN A 95 -25.803 3.225 -21.847 1.00 0.00 O ATOM 1472 NE2 GLN A 95 -26.115 1.011 -22.050 1.00 0.00 N ATOM 0 H GLN A 95 -21.670 1.779 -19.106 1.00 0.00 H new ATOM 0 HA GLN A 95 -24.523 2.207 -19.696 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -22.200 1.011 -21.067 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -23.625 -0.008 -21.118 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -23.343 2.830 -22.143 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -23.644 1.378 -23.077 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -25.693 0.091 -22.174 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -27.128 1.101 -21.968 1.00 0.00 H new ATOM 1481 N VAL A 96 -25.250 0.512 -18.038 1.00 0.00 N ATOM 1482 CA VAL A 96 -25.785 -0.536 -17.178 1.00 0.00 C ATOM 1483 C VAL A 96 -25.994 -1.831 -17.955 1.00 0.00 C ATOM 1484 O VAL A 96 -25.933 -2.922 -17.389 1.00 0.00 O ATOM 1485 CB VAL A 96 -27.122 -0.111 -16.541 1.00 0.00 C ATOM 1486 CG1 VAL A 96 -27.644 -1.202 -15.618 1.00 0.00 C ATOM 1487 CG2 VAL A 96 -26.960 1.201 -15.790 1.00 0.00 C ATOM 0 H VAL A 96 -25.798 1.372 -18.045 1.00 0.00 H new ATOM 0 HA VAL A 96 -25.052 -0.703 -16.389 1.00 0.00 H new ATOM 0 HB VAL A 96 -27.852 0.039 -17.336 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -28.589 -0.884 -15.177 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -27.799 -2.118 -16.189 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -26.918 -1.387 -14.826 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -27.914 1.486 -15.346 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -26.215 1.080 -15.003 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -26.634 1.978 -16.481 1.00 0.00 H new ATOM 1497 N GLU A 97 -26.241 -1.702 -19.255 1.00 0.00 N ATOM 1498 CA GLU A 97 -26.459 -2.863 -20.110 1.00 0.00 C ATOM 1499 C GLU A 97 -25.147 -3.593 -20.381 1.00 0.00 C ATOM 1500 O GLU A 97 -25.124 -4.814 -20.540 1.00 0.00 O ATOM 1501 CB GLU A 97 -27.101 -2.437 -21.432 1.00 0.00 C ATOM 1502 CG GLU A 97 -28.442 -1.742 -21.261 1.00 0.00 C ATOM 1503 CD GLU A 97 -29.588 -2.720 -21.091 1.00 0.00 C ATOM 1504 OE1 GLU A 97 -29.493 -3.597 -20.206 1.00 0.00 O ATOM 1505 OE2 GLU A 97 -30.580 -2.609 -21.841 1.00 0.00 O ATOM 0 H GLU A 97 -26.295 -0.806 -19.739 1.00 0.00 H new ATOM 0 HA GLU A 97 -27.133 -3.544 -19.590 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -26.419 -1.769 -21.959 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -27.235 -3.317 -22.061 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -28.398 -1.085 -20.393 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -28.633 -1.111 -22.129 1.00 0.00 H new ATOM 1512 N LEU A 98 -24.056 -2.837 -20.433 1.00 0.00 N ATOM 1513 CA LEU A 98 -22.739 -3.411 -20.686 1.00 0.00 C ATOM 1514 C LEU A 98 -22.189 -4.084 -19.432 1.00 0.00 C ATOM 1515 O LEU A 98 -21.806 -5.254 -19.461 1.00 0.00 O ATOM 1516 CB LEU A 98 -21.771 -2.327 -21.163 1.00 0.00 C ATOM 1517 CG LEU A 98 -21.669 -2.137 -22.676 1.00 0.00 C ATOM 1518 CD1 LEU A 98 -21.318 -3.452 -23.356 1.00 0.00 C ATOM 1519 CD2 LEU A 98 -22.969 -1.577 -23.233 1.00 0.00 C ATOM 0 H LEU A 98 -24.057 -1.825 -20.303 1.00 0.00 H new ATOM 0 HA LEU A 98 -22.842 -4.165 -21.466 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -22.071 -1.379 -20.717 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -20.778 -2.560 -20.778 1.00 0.00 H new ATOM 0 HG LEU A 98 -20.872 -1.421 -22.880 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -21.250 -3.298 -24.433 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -20.361 -3.812 -22.979 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -22.092 -4.189 -23.144 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -22.877 -1.448 -24.312 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -23.784 -2.268 -23.018 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -23.178 -0.613 -22.769 1.00 0.00 H new ATOM 1531 N ILE A 99 -22.154 -3.338 -18.333 1.00 0.00 N ATOM 1532 CA ILE A 99 -21.654 -3.864 -17.069 1.00 0.00 C ATOM 1533 C ILE A 99 -22.355 -5.167 -16.700 1.00 0.00 C ATOM 1534 O ILE A 99 -21.782 -6.024 -16.026 1.00 0.00 O ATOM 1535 CB ILE A 99 -21.841 -2.851 -15.924 1.00 0.00 C ATOM 1536 CG1 ILE A 99 -23.321 -2.739 -15.551 1.00 0.00 C ATOM 1537 CG2 ILE A 99 -21.286 -1.492 -16.323 1.00 0.00 C ATOM 1538 CD1 ILE A 99 -23.720 -3.625 -14.392 1.00 0.00 C ATOM 0 H ILE A 99 -22.466 -2.368 -18.292 1.00 0.00 H new ATOM 0 HA ILE A 99 -20.589 -4.053 -17.205 1.00 0.00 H new ATOM 0 HB ILE A 99 -21.291 -3.204 -15.052 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -23.547 -1.703 -15.300 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -23.927 -2.996 -16.420 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -21.426 -0.787 -15.503 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -20.223 -1.584 -16.545 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -21.811 -1.130 -17.207 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -24.782 -3.494 -14.183 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -23.526 -4.667 -14.647 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -23.140 -3.353 -13.510 1.00 0.00 H new ATOM 1550 N PHE A 100 -23.598 -5.311 -17.148 1.00 0.00 N ATOM 1551 CA PHE A 100 -24.378 -6.511 -16.866 1.00 0.00 C ATOM 1552 C PHE A 100 -23.834 -7.708 -17.640 1.00 0.00 C ATOM 1553 O PHE A 100 -23.828 -8.834 -17.142 1.00 0.00 O ATOM 1554 CB PHE A 100 -25.848 -6.284 -17.222 1.00 0.00 C ATOM 1555 CG PHE A 100 -26.805 -6.913 -16.250 1.00 0.00 C ATOM 1556 CD1 PHE A 100 -27.066 -6.314 -15.028 1.00 0.00 C ATOM 1557 CD2 PHE A 100 -27.442 -8.105 -16.557 1.00 0.00 C ATOM 1558 CE1 PHE A 100 -27.946 -6.890 -14.131 1.00 0.00 C ATOM 1559 CE2 PHE A 100 -28.323 -8.685 -15.664 1.00 0.00 C ATOM 1560 CZ PHE A 100 -28.574 -8.078 -14.450 1.00 0.00 C ATOM 0 H PHE A 100 -24.087 -4.612 -17.708 1.00 0.00 H new ATOM 0 HA PHE A 100 -24.298 -6.724 -15.800 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -26.041 -5.212 -17.267 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -26.038 -6.685 -18.218 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -26.576 -5.386 -14.773 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -27.248 -8.586 -17.504 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -28.142 -6.412 -13.183 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -28.815 -9.613 -15.916 1.00 0.00 H new ATOM 0 HZ PHE A 100 -29.261 -8.531 -13.750 1.00 0.00 H new ATOM 1570 N LEU A 101 -23.378 -7.456 -18.863 1.00 0.00 N ATOM 1571 CA LEU A 101 -22.832 -8.513 -19.708 1.00 0.00 C ATOM 1572 C LEU A 101 -21.535 -9.061 -19.124 1.00 0.00 C ATOM 1573 O LEU A 101 -21.034 -10.098 -19.561 1.00 0.00 O ATOM 1574 CB LEU A 101 -22.586 -7.984 -21.122 1.00 0.00 C ATOM 1575 CG LEU A 101 -23.631 -8.362 -22.172 1.00 0.00 C ATOM 1576 CD1 LEU A 101 -23.522 -9.837 -22.527 1.00 0.00 C ATOM 1577 CD2 LEU A 101 -25.031 -8.035 -21.673 1.00 0.00 C ATOM 0 H LEU A 101 -23.376 -6.530 -19.291 1.00 0.00 H new ATOM 0 HA LEU A 101 -23.559 -9.324 -19.751 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -22.524 -6.897 -21.076 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -21.614 -8.345 -21.459 1.00 0.00 H new ATOM 0 HG LEU A 101 -23.441 -7.777 -23.072 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -24.274 -10.088 -23.276 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -22.529 -10.043 -22.927 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -23.685 -10.439 -21.633 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -25.762 -8.311 -22.433 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -25.231 -8.593 -20.758 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -25.104 -6.967 -21.470 1.00 0.00 H new ATOM 1589 N LEU A 102 -20.995 -8.361 -18.133 1.00 0.00 N ATOM 1590 CA LEU A 102 -19.756 -8.779 -17.486 1.00 0.00 C ATOM 1591 C LEU A 102 -20.039 -9.749 -16.344 1.00 0.00 C ATOM 1592 O LEU A 102 -19.311 -10.723 -16.150 1.00 0.00 O ATOM 1593 CB LEU A 102 -18.996 -7.560 -16.959 1.00 0.00 C ATOM 1594 CG LEU A 102 -18.139 -6.811 -17.980 1.00 0.00 C ATOM 1595 CD1 LEU A 102 -17.447 -5.624 -17.327 1.00 0.00 C ATOM 1596 CD2 LEU A 102 -17.116 -7.748 -18.607 1.00 0.00 C ATOM 0 H LEU A 102 -21.396 -7.501 -17.759 1.00 0.00 H new ATOM 0 HA LEU A 102 -19.142 -9.289 -18.228 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -19.718 -6.861 -16.538 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -18.352 -7.884 -16.142 1.00 0.00 H new ATOM 0 HG LEU A 102 -18.791 -6.437 -18.769 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -16.842 -5.103 -18.068 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -18.196 -4.942 -16.926 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -16.807 -5.976 -16.518 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -16.515 -7.198 -19.331 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -16.468 -8.152 -17.829 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -17.632 -8.566 -19.110 1.00 0.00 H new ATOM 1608 N GLU A 103 -21.101 -9.477 -15.592 1.00 0.00 N ATOM 1609 CA GLU A 103 -21.479 -10.328 -14.469 1.00 0.00 C ATOM 1610 C GLU A 103 -21.263 -11.801 -14.806 1.00 0.00 C ATOM 1611 O GLU A 103 -20.520 -12.515 -14.133 1.00 0.00 O ATOM 1612 CB GLU A 103 -22.942 -10.089 -14.091 1.00 0.00 C ATOM 1613 CG GLU A 103 -23.120 -9.137 -12.920 1.00 0.00 C ATOM 1614 CD GLU A 103 -23.633 -7.775 -13.348 1.00 0.00 C ATOM 1615 OE1 GLU A 103 -22.807 -6.928 -13.747 1.00 0.00 O ATOM 1616 OE2 GLU A 103 -24.861 -7.558 -13.285 1.00 0.00 O ATOM 0 H GLU A 103 -21.714 -8.675 -15.740 1.00 0.00 H new ATOM 0 HA GLU A 103 -20.845 -10.071 -13.621 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -23.472 -9.690 -14.956 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -23.406 -11.044 -13.846 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -23.815 -9.574 -12.204 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -22.166 -9.017 -12.406 1.00 0.00 H new ATOM 1623 N PRO A 104 -21.929 -12.267 -15.873 1.00 0.00 N ATOM 1624 CA PRO A 104 -21.827 -13.658 -16.324 1.00 0.00 C ATOM 1625 C PRO A 104 -20.458 -13.977 -16.916 1.00 0.00 C ATOM 1626 O PRO A 104 -20.003 -15.120 -16.873 1.00 0.00 O ATOM 1627 CB PRO A 104 -22.912 -13.763 -17.399 1.00 0.00 C ATOM 1628 CG PRO A 104 -23.084 -12.371 -17.901 1.00 0.00 C ATOM 1629 CD PRO A 104 -22.832 -11.472 -16.722 1.00 0.00 C ATOM 0 HA PRO A 104 -21.952 -14.363 -15.502 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -22.612 -14.438 -18.200 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -23.842 -14.153 -16.986 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -22.385 -12.159 -18.710 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -24.088 -12.221 -18.299 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -22.373 -10.531 -17.025 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -23.757 -11.223 -16.202 1.00 0.00 H new ATOM 1637 N PHE A 105 -19.806 -12.959 -17.467 1.00 0.00 N ATOM 1638 CA PHE A 105 -18.488 -13.132 -18.068 1.00 0.00 C ATOM 1639 C PHE A 105 -17.490 -13.669 -17.047 1.00 0.00 C ATOM 1640 O PHE A 105 -16.535 -14.361 -17.401 1.00 0.00 O ATOM 1641 CB PHE A 105 -17.986 -11.803 -18.638 1.00 0.00 C ATOM 1642 CG PHE A 105 -16.961 -11.965 -19.723 1.00 0.00 C ATOM 1643 CD1 PHE A 105 -17.346 -12.265 -21.020 1.00 0.00 C ATOM 1644 CD2 PHE A 105 -15.611 -11.817 -19.447 1.00 0.00 C ATOM 1645 CE1 PHE A 105 -16.404 -12.416 -22.020 1.00 0.00 C ATOM 1646 CE2 PHE A 105 -14.665 -11.966 -20.443 1.00 0.00 C ATOM 1647 CZ PHE A 105 -15.062 -12.265 -21.731 1.00 0.00 C ATOM 0 H PHE A 105 -20.168 -12.006 -17.510 1.00 0.00 H new ATOM 0 HA PHE A 105 -18.578 -13.857 -18.877 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -18.834 -11.242 -19.031 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -17.558 -11.209 -17.830 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -18.394 -12.382 -21.252 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -15.295 -11.582 -18.441 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -16.717 -12.652 -23.026 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -13.616 -11.849 -20.214 1.00 0.00 H new ATOM 0 HZ PHE A 105 -14.324 -12.381 -22.511 1.00 0.00 H new ATOM 1657 N ILE A 106 -17.719 -13.346 -15.778 1.00 0.00 N ATOM 1658 CA ILE A 106 -16.841 -13.796 -14.705 1.00 0.00 C ATOM 1659 C ILE A 106 -16.775 -15.319 -14.652 1.00 0.00 C ATOM 1660 O ILE A 106 -15.783 -15.892 -14.203 1.00 0.00 O ATOM 1661 CB ILE A 106 -17.307 -13.266 -13.337 1.00 0.00 C ATOM 1662 CG1 ILE A 106 -17.341 -11.736 -13.343 1.00 0.00 C ATOM 1663 CG2 ILE A 106 -16.394 -13.776 -12.232 1.00 0.00 C ATOM 1664 CD1 ILE A 106 -18.145 -11.145 -12.206 1.00 0.00 C ATOM 0 H ILE A 106 -18.505 -12.774 -15.468 1.00 0.00 H new ATOM 0 HA ILE A 106 -15.849 -13.398 -14.921 1.00 0.00 H new ATOM 0 HB ILE A 106 -18.316 -13.633 -13.146 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -16.320 -11.358 -13.290 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -17.759 -11.394 -14.289 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -16.737 -13.393 -11.271 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -16.415 -14.866 -12.216 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -15.375 -13.436 -12.416 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -18.125 -10.057 -12.273 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -19.176 -11.494 -12.269 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -17.714 -11.457 -11.255 1.00 0.00 H new ATOM 1676 N ALA A 107 -17.838 -15.968 -15.116 1.00 0.00 N ATOM 1677 CA ALA A 107 -17.899 -17.425 -15.125 1.00 0.00 C ATOM 1678 C ALA A 107 -16.812 -18.014 -16.018 1.00 0.00 C ATOM 1679 O ALA A 107 -16.436 -19.177 -15.869 1.00 0.00 O ATOM 1680 CB ALA A 107 -19.272 -17.893 -15.582 1.00 0.00 C ATOM 0 H ALA A 107 -18.668 -15.508 -15.490 1.00 0.00 H new ATOM 0 HA ALA A 107 -17.728 -17.778 -14.108 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -19.303 -18.983 -15.584 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -20.032 -17.509 -14.902 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -19.466 -17.523 -16.589 1.00 0.00 H new ATOM 1686 N SER A 108 -16.313 -17.205 -16.947 1.00 0.00 N ATOM 1687 CA SER A 108 -15.273 -17.649 -17.867 1.00 0.00 C ATOM 1688 C SER A 108 -13.992 -17.996 -17.114 1.00 0.00 C ATOM 1689 O SER A 108 -13.495 -19.120 -17.196 1.00 0.00 O ATOM 1690 CB SER A 108 -14.987 -16.564 -18.908 1.00 0.00 C ATOM 1691 OG SER A 108 -14.569 -17.134 -20.137 1.00 0.00 O ATOM 0 H SER A 108 -16.612 -16.239 -17.082 1.00 0.00 H new ATOM 0 HA SER A 108 -15.630 -18.546 -18.374 1.00 0.00 H new ATOM 0 HB2 SER A 108 -15.883 -15.964 -19.068 1.00 0.00 H new ATOM 0 HB3 SER A 108 -14.215 -15.891 -18.534 1.00 0.00 H new ATOM 0 HG SER A 108 -14.394 -16.421 -20.786 1.00 0.00 H new