USER MOD reduce.3.24.130724 H: found=0, std=0, add=944, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 945 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 19 MET CE :methyl 127:sc= -2.6 (180deg=-4.46!) USER MOD Set 1.2: B 68 HIS : no HD1:sc= -3.96 K(o=-6.6,f=-12!) USER MOD Set 2.1: B 55 THR OG1 : rot 107:sc= 0.69 USER MOD Set 2.2: B 57 SER OG : rot 180:sc= 1.01 USER MOD Set 3.1: B 19 SER OG : rot 180:sc= 0 USER MOD Set 3.2: B 20 SER OG : rot 180:sc= 0 USER MOD Set 4.1: B 7 THR OG1 : rot 128:sc= 0.119 USER MOD Set 4.2: B 9 THR OG1 : rot 180:sc= 0.245 USER MOD Set 5.1: A 35 ASN : amide:sc= -0.381 K(o=0.4,f=0.99) USER MOD Set 5.2: A 42 THR OG1 : rot 113:sc= 0.783 USER MOD Set 6.1: A 9 HIS : no HE2:sc= -3.7 K(o=-3.2,f=-4.5!) USER MOD Set 6.2: A 37 ASN : amide:sc= 0.497 K(o=-3.2,f=-7.1!) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -145:sc= -0.914 (180deg=-2.62!) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -167:sc= -0.0744 (180deg=-0.32) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ -163:sc= -0.0425 (180deg=-0.335) USER MOD Single : A 29 GLN : amide:sc= -1.09! K(o=-1.1!,f=0) USER MOD Single : A 31 HIS : no HE2:sc= -18.6! C(o=-19!,f=-26!) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 LYS NZ :NH3+ 138:sc= -3.49! (180deg=-6.41!) USER MOD Single : B 1 MET CE :methyl 170:sc= -0.581 (180deg=-0.942) USER MOD Single : B 1 MET N :NH3+ 142:sc= 0.0126 (180deg=0) USER MOD Single : B 2 GLN : amide:sc= -2.05! C(o=-2!,f=-8!) USER MOD Single : B 6 LYS NZ :NH3+ -117:sc= -3.27! (180deg=-4.7!) USER MOD Single : B 11 LYS NZ :NH3+ -130:sc= -1.19 (180deg=-2.29) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot 180:sc= 0 USER MOD Single : B 22 THR OG1 : rot -98:sc= -1.41 USER MOD Single : B 25 ASN : amide:sc= -3.44! K(o=-3.4!,f=-1.2) USER MOD Single : B 27 LYS NZ :NH3+ 140:sc= -2.21! (180deg=-3.14!) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 29 LYS NZ :NH3+ -135:sc= 1.04 (180deg=-0.131) USER MOD Single : B 31 GLN : amide:sc= -3.12! K(o=-3.1!,f=-1.3) USER MOD Single : B 33 LYS NZ :NH3+ -152:sc= -2.68! (180deg=-4.65!) USER MOD Single : B 40 GLN : amide:sc= -1.38 K(o=-1.4,f=-5!) USER MOD Single : B 41 GLN : amide:sc= -0.752 K(o=-0.75,f=-1.8!) USER MOD Single : B 48 LYS NZ :NH3+ -138:sc= -2.65! (180deg=-5.46!) USER MOD Single : B 49 GLN : amide:sc= -3.3! K(o=-3.3!,f=-0.65) USER MOD Single : B 59 TYR OH : rot -95:sc= 0.00233 USER MOD Single : B 60 ASN : amide:sc= -0.478 K(o=-0.48,f=-2) USER MOD Single : B 62 GLN : amide:sc= -0.752 K(o=-0.75,f=-2.9!) USER MOD Single : B 63 LYS NZ :NH3+ -165:sc= -0.0338 (180deg=-0.28) USER MOD Single : B 65 SER OG : rot 90:sc= -0.433 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 27 N ASP A 8 16.047 1.937 -0.982 1.00 0.00 N ATOM 28 CA ASP A 8 14.988 1.298 -1.759 1.00 0.00 C ATOM 29 C ASP A 8 13.629 1.927 -1.469 1.00 0.00 C ATOM 30 O ASP A 8 12.620 1.226 -1.387 1.00 0.00 O ATOM 31 CB ASP A 8 14.929 -0.203 -1.454 1.00 0.00 C ATOM 32 CG ASP A 8 16.206 -0.929 -1.827 1.00 0.00 C ATOM 33 OD1 ASP A 8 16.583 -0.895 -3.017 1.00 0.00 O ATOM 34 OD2 ASP A 8 16.827 -1.536 -0.930 1.00 0.00 O ATOM 0 HA ASP A 8 15.222 1.446 -2.813 1.00 0.00 H new ATOM 0 HB2 ASP A 8 14.733 -0.346 -0.391 1.00 0.00 H new ATOM 0 HB3 ASP A 8 14.093 -0.646 -1.995 1.00 0.00 H new ATOM 39 N HIS A 9 13.601 3.249 -1.322 1.00 0.00 N ATOM 40 CA HIS A 9 12.349 3.943 -1.052 1.00 0.00 C ATOM 41 C HIS A 9 11.521 4.061 -2.327 1.00 0.00 C ATOM 42 O HIS A 9 10.302 4.203 -2.271 1.00 0.00 O ATOM 43 CB HIS A 9 12.578 5.325 -0.413 1.00 0.00 C ATOM 44 CG HIS A 9 12.887 6.445 -1.366 1.00 0.00 C ATOM 45 ND1 HIS A 9 12.632 7.766 -1.058 1.00 0.00 N ATOM 46 CD2 HIS A 9 13.436 6.455 -2.606 1.00 0.00 C ATOM 47 CE1 HIS A 9 13.002 8.534 -2.063 1.00 0.00 C ATOM 48 NE2 HIS A 9 13.495 7.765 -3.015 1.00 0.00 N ATOM 0 H HIS A 9 14.420 3.853 -1.385 1.00 0.00 H new ATOM 0 HA HIS A 9 11.793 3.348 -0.328 1.00 0.00 H new ATOM 0 HB2 HIS A 9 11.688 5.593 0.156 1.00 0.00 H new ATOM 0 HB3 HIS A 9 13.399 5.243 0.299 1.00 0.00 H new ATOM 0 HD1 HIS A 9 12.220 8.097 -0.186 1.00 0.00 H new ATOM 0 HD2 HIS A 9 13.766 5.593 -3.167 1.00 0.00 H new ATOM 0 HE1 HIS A 9 12.916 9.610 -2.101 1.00 0.00 H new ATOM 57 N GLU A 10 12.201 4.018 -3.475 1.00 0.00 N ATOM 58 CA GLU A 10 11.539 4.136 -4.771 1.00 0.00 C ATOM 59 C GLU A 10 10.376 3.158 -4.879 1.00 0.00 C ATOM 60 O GLU A 10 9.313 3.506 -5.392 1.00 0.00 O ATOM 61 CB GLU A 10 12.528 3.889 -5.916 1.00 0.00 C ATOM 62 CG GLU A 10 13.701 4.858 -5.942 1.00 0.00 C ATOM 63 CD GLU A 10 14.792 4.499 -4.949 1.00 0.00 C ATOM 64 OE1 GLU A 10 14.724 3.400 -4.359 1.00 0.00 O ATOM 65 OE2 GLU A 10 15.725 5.311 -4.775 1.00 0.00 O ATOM 0 H GLU A 10 13.213 3.902 -3.531 1.00 0.00 H new ATOM 0 HA GLU A 10 11.154 5.152 -4.851 1.00 0.00 H new ATOM 0 HB2 GLU A 10 12.912 2.872 -5.837 1.00 0.00 H new ATOM 0 HB3 GLU A 10 11.994 3.956 -6.864 1.00 0.00 H new ATOM 0 HG2 GLU A 10 14.125 4.880 -6.946 1.00 0.00 H new ATOM 0 HG3 GLU A 10 13.339 5.863 -5.727 1.00 0.00 H new ATOM 72 N SER A 11 10.573 1.940 -4.382 1.00 0.00 N ATOM 73 CA SER A 11 9.521 0.932 -4.415 1.00 0.00 C ATOM 74 C SER A 11 8.303 1.440 -3.653 1.00 0.00 C ATOM 75 O SER A 11 7.169 1.356 -4.133 1.00 0.00 O ATOM 76 CB SER A 11 10.015 -0.382 -3.805 1.00 0.00 C ATOM 77 OG SER A 11 11.118 -0.898 -4.530 1.00 0.00 O ATOM 0 H SER A 11 11.446 1.630 -3.955 1.00 0.00 H new ATOM 0 HA SER A 11 9.245 0.744 -5.453 1.00 0.00 H new ATOM 0 HB2 SER A 11 10.303 -0.219 -2.766 1.00 0.00 H new ATOM 0 HB3 SER A 11 9.205 -1.112 -3.801 1.00 0.00 H new ATOM 0 HG SER A 11 11.416 -1.736 -4.119 1.00 0.00 H new ATOM 83 N LYS A 12 8.555 1.989 -2.469 1.00 0.00 N ATOM 84 CA LYS A 12 7.496 2.540 -1.637 1.00 0.00 C ATOM 85 C LYS A 12 6.831 3.705 -2.357 1.00 0.00 C ATOM 86 O LYS A 12 5.608 3.848 -2.340 1.00 0.00 O ATOM 87 CB LYS A 12 8.065 3.007 -0.298 1.00 0.00 C ATOM 88 CG LYS A 12 8.873 1.939 0.420 1.00 0.00 C ATOM 89 CD LYS A 12 9.483 2.470 1.707 1.00 0.00 C ATOM 90 CE LYS A 12 10.369 1.428 2.371 1.00 0.00 C ATOM 91 NZ LYS A 12 10.957 1.929 3.645 1.00 0.00 N ATOM 0 H LYS A 12 9.488 2.063 -2.064 1.00 0.00 H new ATOM 0 HA LYS A 12 6.753 1.765 -1.448 1.00 0.00 H new ATOM 0 HB2 LYS A 12 8.697 3.879 -0.465 1.00 0.00 H new ATOM 0 HB3 LYS A 12 7.245 3.326 0.346 1.00 0.00 H new ATOM 0 HG2 LYS A 12 8.232 1.087 0.645 1.00 0.00 H new ATOM 0 HG3 LYS A 12 9.665 1.578 -0.237 1.00 0.00 H new ATOM 0 HD2 LYS A 12 10.068 3.364 1.492 1.00 0.00 H new ATOM 0 HD3 LYS A 12 8.689 2.766 2.393 1.00 0.00 H new ATOM 0 HE2 LYS A 12 9.786 0.529 2.569 1.00 0.00 H new ATOM 0 HE3 LYS A 12 11.170 1.144 1.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 11.554 1.189 4.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 11.534 2.772 3.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 10.193 2.176 4.306 1.00 0.00 H new ATOM 105 N LEU A 13 7.653 4.527 -3.006 1.00 0.00 N ATOM 106 CA LEU A 13 7.158 5.671 -3.756 1.00 0.00 C ATOM 107 C LEU A 13 6.214 5.190 -4.845 1.00 0.00 C ATOM 108 O LEU A 13 5.181 5.806 -5.107 1.00 0.00 O ATOM 109 CB LEU A 13 8.321 6.457 -4.367 1.00 0.00 C ATOM 110 CG LEU A 13 7.922 7.696 -5.174 1.00 0.00 C ATOM 111 CD1 LEU A 13 7.162 8.686 -4.302 1.00 0.00 C ATOM 112 CD2 LEU A 13 9.154 8.354 -5.778 1.00 0.00 C ATOM 0 H LEU A 13 8.667 4.419 -3.025 1.00 0.00 H new ATOM 0 HA LEU A 13 6.619 6.335 -3.080 1.00 0.00 H new ATOM 0 HB2 LEU A 13 8.990 6.767 -3.564 1.00 0.00 H new ATOM 0 HB3 LEU A 13 8.889 5.789 -5.015 1.00 0.00 H new ATOM 0 HG LEU A 13 7.264 7.381 -5.984 1.00 0.00 H new ATOM 0 HD11 LEU A 13 6.888 9.558 -4.896 1.00 0.00 H new ATOM 0 HD12 LEU A 13 6.259 8.212 -3.916 1.00 0.00 H new ATOM 0 HD13 LEU A 13 7.793 8.997 -3.470 1.00 0.00 H new ATOM 0 HD21 LEU A 13 8.854 9.233 -6.349 1.00 0.00 H new ATOM 0 HD22 LEU A 13 9.834 8.654 -4.981 1.00 0.00 H new ATOM 0 HD23 LEU A 13 9.657 7.647 -6.438 1.00 0.00 H new ATOM 124 N SER A 14 6.568 4.062 -5.458 1.00 0.00 N ATOM 125 CA SER A 14 5.744 3.469 -6.498 1.00 0.00 C ATOM 126 C SER A 14 4.382 3.128 -5.918 1.00 0.00 C ATOM 127 O SER A 14 3.342 3.419 -6.519 1.00 0.00 O ATOM 128 CB SER A 14 6.409 2.211 -7.060 1.00 0.00 C ATOM 129 OG SER A 14 5.616 1.624 -8.077 1.00 0.00 O ATOM 0 H SER A 14 7.421 3.544 -5.249 1.00 0.00 H new ATOM 0 HA SER A 14 5.627 4.183 -7.314 1.00 0.00 H new ATOM 0 HB2 SER A 14 7.391 2.463 -7.461 1.00 0.00 H new ATOM 0 HB3 SER A 14 6.568 1.491 -6.257 1.00 0.00 H new ATOM 0 HG SER A 14 6.064 0.823 -8.420 1.00 0.00 H new ATOM 135 N ILE A 15 4.396 2.532 -4.725 1.00 0.00 N ATOM 136 CA ILE A 15 3.160 2.179 -4.046 1.00 0.00 C ATOM 137 C ILE A 15 2.300 3.420 -3.896 1.00 0.00 C ATOM 138 O ILE A 15 1.090 3.372 -4.077 1.00 0.00 O ATOM 139 CB ILE A 15 3.399 1.595 -2.638 1.00 0.00 C ATOM 140 CG1 ILE A 15 4.516 0.547 -2.645 1.00 0.00 C ATOM 141 CG2 ILE A 15 2.110 0.994 -2.101 1.00 0.00 C ATOM 142 CD1 ILE A 15 4.304 -0.579 -3.633 1.00 0.00 C ATOM 0 H ILE A 15 5.246 2.287 -4.216 1.00 0.00 H new ATOM 0 HA ILE A 15 2.671 1.418 -4.654 1.00 0.00 H new ATOM 0 HB ILE A 15 3.716 2.408 -1.984 1.00 0.00 H new ATOM 0 HG12 ILE A 15 5.461 1.041 -2.872 1.00 0.00 H new ATOM 0 HG13 ILE A 15 4.609 0.125 -1.644 1.00 0.00 H new ATOM 0 HG21 ILE A 15 2.286 0.584 -1.107 1.00 0.00 H new ATOM 0 HG22 ILE A 15 1.344 1.767 -2.044 1.00 0.00 H new ATOM 0 HG23 ILE A 15 1.774 0.199 -2.767 1.00 0.00 H new ATOM 0 HD11 ILE A 15 5.139 -1.277 -3.574 1.00 0.00 H new ATOM 0 HD12 ILE A 15 3.377 -1.101 -3.396 1.00 0.00 H new ATOM 0 HD13 ILE A 15 4.242 -0.171 -4.642 1.00 0.00 H new ATOM 154 N LEU A 16 2.953 4.532 -3.562 1.00 0.00 N ATOM 155 CA LEU A 16 2.274 5.809 -3.382 1.00 0.00 C ATOM 156 C LEU A 16 1.621 6.271 -4.678 1.00 0.00 C ATOM 157 O LEU A 16 0.480 6.728 -4.676 1.00 0.00 O ATOM 158 CB LEU A 16 3.265 6.868 -2.897 1.00 0.00 C ATOM 159 CG LEU A 16 3.906 6.586 -1.538 1.00 0.00 C ATOM 160 CD1 LEU A 16 4.982 7.615 -1.240 1.00 0.00 C ATOM 161 CD2 LEU A 16 2.854 6.587 -0.440 1.00 0.00 C ATOM 0 H LEU A 16 3.961 4.571 -3.410 1.00 0.00 H new ATOM 0 HA LEU A 16 1.494 5.673 -2.633 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.056 6.969 -3.640 1.00 0.00 H new ATOM 0 HB3 LEU A 16 2.751 7.828 -2.846 1.00 0.00 H new ATOM 0 HG LEU A 16 4.367 5.599 -1.572 1.00 0.00 H new ATOM 0 HD11 LEU A 16 5.430 7.402 -0.269 1.00 0.00 H new ATOM 0 HD12 LEU A 16 5.751 7.572 -2.012 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.539 8.611 -1.225 1.00 0.00 H new ATOM 0 HD21 LEU A 16 3.330 6.385 0.520 1.00 0.00 H new ATOM 0 HD22 LEU A 16 2.366 7.561 -0.405 1.00 0.00 H new ATOM 0 HD23 LEU A 16 2.112 5.816 -0.647 1.00 0.00 H new ATOM 173 N MET A 17 2.352 6.149 -5.783 1.00 0.00 N ATOM 174 CA MET A 17 1.833 6.554 -7.084 1.00 0.00 C ATOM 175 C MET A 17 0.510 5.854 -7.360 1.00 0.00 C ATOM 176 O MET A 17 -0.482 6.491 -7.715 1.00 0.00 O ATOM 177 CB MET A 17 2.841 6.227 -8.188 1.00 0.00 C ATOM 178 CG MET A 17 4.183 6.921 -8.018 1.00 0.00 C ATOM 179 SD MET A 17 5.351 6.501 -9.326 1.00 0.00 S ATOM 180 CE MET A 17 6.785 7.450 -8.823 1.00 0.00 C ATOM 0 H MET A 17 3.301 5.775 -5.803 1.00 0.00 H new ATOM 0 HA MET A 17 1.668 7.631 -7.072 1.00 0.00 H new ATOM 0 HB2 MET A 17 3.001 5.149 -8.214 1.00 0.00 H new ATOM 0 HB3 MET A 17 2.416 6.510 -9.151 1.00 0.00 H new ATOM 0 HG2 MET A 17 4.031 8.000 -8.005 1.00 0.00 H new ATOM 0 HG3 MET A 17 4.610 6.647 -7.053 1.00 0.00 H new ATOM 0 HE1 MET A 17 7.309 7.814 -9.707 1.00 0.00 H new ATOM 0 HE2 MET A 17 6.466 8.297 -8.216 1.00 0.00 H new ATOM 0 HE3 MET A 17 7.454 6.817 -8.240 1.00 0.00 H new ATOM 190 N ASP A 18 0.503 4.538 -7.180 1.00 0.00 N ATOM 191 CA ASP A 18 -0.686 3.740 -7.389 1.00 0.00 C ATOM 192 C ASP A 18 -1.685 3.944 -6.250 1.00 0.00 C ATOM 193 O ASP A 18 -2.898 3.863 -6.447 1.00 0.00 O ATOM 194 CB ASP A 18 -0.289 2.272 -7.491 1.00 0.00 C ATOM 195 CG ASP A 18 0.587 1.988 -8.696 1.00 0.00 C ATOM 196 OD1 ASP A 18 1.683 2.580 -8.786 1.00 0.00 O ATOM 197 OD2 ASP A 18 0.177 1.173 -9.548 1.00 0.00 O ATOM 0 H ASP A 18 1.320 4.002 -6.887 1.00 0.00 H new ATOM 0 HA ASP A 18 -1.168 4.053 -8.315 1.00 0.00 H new ATOM 0 HB2 ASP A 18 0.240 1.979 -6.584 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -1.189 1.659 -7.548 1.00 0.00 H new ATOM 202 N MET A 19 -1.157 4.202 -5.057 1.00 0.00 N ATOM 203 CA MET A 19 -1.977 4.415 -3.866 1.00 0.00 C ATOM 204 C MET A 19 -2.866 5.643 -4.031 1.00 0.00 C ATOM 205 O MET A 19 -4.019 5.648 -3.597 1.00 0.00 O ATOM 206 CB MET A 19 -1.080 4.580 -2.632 1.00 0.00 C ATOM 207 CG MET A 19 -1.836 4.628 -1.314 1.00 0.00 C ATOM 208 SD MET A 19 -2.614 3.059 -0.896 1.00 0.00 S ATOM 209 CE MET A 19 -1.191 2.098 -0.390 1.00 0.00 C ATOM 0 H MET A 19 -0.153 4.269 -4.888 1.00 0.00 H new ATOM 0 HA MET A 19 -2.617 3.543 -3.731 1.00 0.00 H new ATOM 0 HB2 MET A 19 -0.369 3.754 -2.600 1.00 0.00 H new ATOM 0 HB3 MET A 19 -0.499 5.496 -2.739 1.00 0.00 H new ATOM 0 HG2 MET A 19 -1.149 4.911 -0.517 1.00 0.00 H new ATOM 0 HG3 MET A 19 -2.600 5.404 -1.367 1.00 0.00 H new ATOM 0 HE1 MET A 19 -1.371 1.674 0.598 1.00 0.00 H new ATOM 0 HE2 MET A 19 -1.023 1.293 -1.105 1.00 0.00 H new ATOM 0 HE3 MET A 19 -0.312 2.741 -0.355 1.00 0.00 H new ATOM 219 N PHE A 20 -2.322 6.685 -4.655 1.00 0.00 N ATOM 220 CA PHE A 20 -3.068 7.920 -4.868 1.00 0.00 C ATOM 221 C PHE A 20 -3.033 8.332 -6.341 1.00 0.00 C ATOM 222 O PHE A 20 -2.061 8.931 -6.800 1.00 0.00 O ATOM 223 CB PHE A 20 -2.487 9.044 -4.007 1.00 0.00 C ATOM 224 CG PHE A 20 -2.139 8.612 -2.611 1.00 0.00 C ATOM 225 CD1 PHE A 20 -3.123 8.483 -1.645 1.00 0.00 C ATOM 226 CD2 PHE A 20 -0.824 8.335 -2.266 1.00 0.00 C ATOM 227 CE1 PHE A 20 -2.805 8.084 -0.361 1.00 0.00 C ATOM 228 CE2 PHE A 20 -0.500 7.936 -0.983 1.00 0.00 C ATOM 229 CZ PHE A 20 -1.493 7.809 -0.030 1.00 0.00 C ATOM 0 H PHE A 20 -1.370 6.698 -5.021 1.00 0.00 H new ATOM 0 HA PHE A 20 -4.104 7.742 -4.580 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -1.592 9.436 -4.491 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -3.206 9.861 -3.957 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -4.151 8.697 -1.898 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -0.045 8.432 -3.008 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -3.582 7.987 0.383 1.00 0.00 H new ATOM 0 HE2 PHE A 20 0.527 7.724 -0.726 1.00 0.00 H new ATOM 0 HZ PHE A 20 -1.243 7.495 0.973 1.00 0.00 H new ATOM 239 N PRO A 21 -4.098 8.014 -7.103 1.00 0.00 N ATOM 240 CA PRO A 21 -4.182 8.357 -8.526 1.00 0.00 C ATOM 241 C PRO A 21 -4.551 9.820 -8.754 1.00 0.00 C ATOM 242 O PRO A 21 -5.468 10.125 -9.517 1.00 0.00 O ATOM 243 CB PRO A 21 -5.295 7.442 -9.033 1.00 0.00 C ATOM 244 CG PRO A 21 -6.192 7.264 -7.858 1.00 0.00 C ATOM 245 CD PRO A 21 -5.303 7.295 -6.640 1.00 0.00 C ATOM 0 HA PRO A 21 -3.228 8.226 -9.037 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -5.825 7.890 -9.874 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -4.898 6.487 -9.378 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -6.939 8.057 -7.815 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -6.733 6.320 -7.921 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -5.782 7.811 -5.808 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -5.061 6.290 -6.295 1.00 0.00 H new ATOM 253 N ALA A 22 -3.837 10.724 -8.089 1.00 0.00 N ATOM 254 CA ALA A 22 -4.102 12.152 -8.224 1.00 0.00 C ATOM 255 C ALA A 22 -2.935 12.988 -7.707 1.00 0.00 C ATOM 256 O ALA A 22 -2.566 13.992 -8.317 1.00 0.00 O ATOM 257 CB ALA A 22 -5.382 12.522 -7.490 1.00 0.00 C ATOM 0 H ALA A 22 -3.073 10.494 -7.453 1.00 0.00 H new ATOM 0 HA ALA A 22 -4.224 12.370 -9.285 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.568 13.590 -7.599 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.218 11.963 -7.912 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.279 12.278 -6.433 1.00 0.00 H new ATOM 263 N ILE A 23 -2.358 12.574 -6.583 1.00 0.00 N ATOM 264 CA ILE A 23 -1.237 13.297 -5.995 1.00 0.00 C ATOM 265 C ILE A 23 -0.045 13.328 -6.946 1.00 0.00 C ATOM 266 O ILE A 23 0.353 12.300 -7.494 1.00 0.00 O ATOM 267 CB ILE A 23 -0.798 12.672 -4.656 1.00 0.00 C ATOM 268 CG1 ILE A 23 -1.955 12.699 -3.653 1.00 0.00 C ATOM 269 CG2 ILE A 23 0.414 13.409 -4.101 1.00 0.00 C ATOM 270 CD1 ILE A 23 -1.614 12.086 -2.310 1.00 0.00 C ATOM 0 H ILE A 23 -2.647 11.745 -6.063 1.00 0.00 H new ATOM 0 HA ILE A 23 -1.581 14.315 -5.812 1.00 0.00 H new ATOM 0 HB ILE A 23 -0.518 11.633 -4.829 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -2.268 13.732 -3.501 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -2.806 12.167 -4.079 1.00 0.00 H new ATOM 0 HG21 ILE A 23 0.713 12.957 -3.155 1.00 0.00 H new ATOM 0 HG22 ILE A 23 1.238 13.342 -4.812 1.00 0.00 H new ATOM 0 HG23 ILE A 23 0.160 14.456 -3.938 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -2.482 12.142 -1.654 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -1.330 11.043 -2.448 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -0.784 12.632 -1.861 1.00 0.00 H new ATOM 282 N SER A 24 0.521 14.516 -7.132 1.00 0.00 N ATOM 283 CA SER A 24 1.671 14.688 -8.011 1.00 0.00 C ATOM 284 C SER A 24 2.889 13.963 -7.450 1.00 0.00 C ATOM 285 O SER A 24 3.100 13.936 -6.238 1.00 0.00 O ATOM 286 CB SER A 24 1.984 16.174 -8.191 1.00 0.00 C ATOM 287 OG SER A 24 2.308 16.782 -6.952 1.00 0.00 O ATOM 0 H SER A 24 0.201 15.375 -6.685 1.00 0.00 H new ATOM 0 HA SER A 24 1.427 14.258 -8.982 1.00 0.00 H new ATOM 0 HB2 SER A 24 2.816 16.292 -8.886 1.00 0.00 H new ATOM 0 HB3 SER A 24 1.125 16.679 -8.633 1.00 0.00 H new ATOM 0 HG SER A 24 2.506 17.731 -7.095 1.00 0.00 H new ATOM 293 N LYS A 25 3.687 13.377 -8.339 1.00 0.00 N ATOM 294 CA LYS A 25 4.885 12.652 -7.930 1.00 0.00 C ATOM 295 C LYS A 25 5.773 13.525 -7.049 1.00 0.00 C ATOM 296 O LYS A 25 6.417 13.035 -6.121 1.00 0.00 O ATOM 297 CB LYS A 25 5.670 12.180 -9.157 1.00 0.00 C ATOM 298 CG LYS A 25 6.934 11.409 -8.810 1.00 0.00 C ATOM 299 CD LYS A 25 7.686 10.977 -10.058 1.00 0.00 C ATOM 300 CE LYS A 25 8.943 10.198 -9.708 1.00 0.00 C ATOM 301 NZ LYS A 25 9.872 10.994 -8.858 1.00 0.00 N ATOM 0 H LYS A 25 3.525 13.390 -9.346 1.00 0.00 H new ATOM 0 HA LYS A 25 4.572 11.782 -7.353 1.00 0.00 H new ATOM 0 HB2 LYS A 25 5.026 11.549 -9.770 1.00 0.00 H new ATOM 0 HB3 LYS A 25 5.937 13.046 -9.763 1.00 0.00 H new ATOM 0 HG2 LYS A 25 7.581 12.030 -8.191 1.00 0.00 H new ATOM 0 HG3 LYS A 25 6.675 10.531 -8.219 1.00 0.00 H new ATOM 0 HD2 LYS A 25 7.037 10.362 -10.681 1.00 0.00 H new ATOM 0 HD3 LYS A 25 7.953 11.855 -10.646 1.00 0.00 H new ATOM 0 HE2 LYS A 25 8.668 9.282 -9.186 1.00 0.00 H new ATOM 0 HE3 LYS A 25 9.453 9.902 -10.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 10.799 10.524 -8.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 9.981 11.947 -9.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 9.485 11.068 -7.896 1.00 0.00 H new ATOM 315 N SER A 26 5.804 14.821 -7.348 1.00 0.00 N ATOM 316 CA SER A 26 6.612 15.766 -6.586 1.00 0.00 C ATOM 317 C SER A 26 6.239 15.741 -5.106 1.00 0.00 C ATOM 318 O SER A 26 7.108 15.635 -4.241 1.00 0.00 O ATOM 319 CB SER A 26 6.435 17.181 -7.139 1.00 0.00 C ATOM 320 OG SER A 26 6.864 17.262 -8.487 1.00 0.00 O ATOM 0 H SER A 26 5.277 15.240 -8.114 1.00 0.00 H new ATOM 0 HA SER A 26 7.656 15.468 -6.684 1.00 0.00 H new ATOM 0 HB2 SER A 26 5.387 17.473 -7.070 1.00 0.00 H new ATOM 0 HB3 SER A 26 7.003 17.885 -6.531 1.00 0.00 H new ATOM 0 HG SER A 26 6.738 18.177 -8.816 1.00 0.00 H new ATOM 326 N LYS A 27 4.943 15.839 -4.822 1.00 0.00 N ATOM 327 CA LYS A 27 4.456 15.828 -3.447 1.00 0.00 C ATOM 328 C LYS A 27 4.775 14.505 -2.760 1.00 0.00 C ATOM 329 O LYS A 27 5.218 14.485 -1.613 1.00 0.00 O ATOM 330 CB LYS A 27 2.949 16.088 -3.417 1.00 0.00 C ATOM 331 CG LYS A 27 2.348 16.035 -2.021 1.00 0.00 C ATOM 332 CD LYS A 27 0.860 16.347 -2.040 1.00 0.00 C ATOM 333 CE LYS A 27 0.592 17.790 -2.442 1.00 0.00 C ATOM 334 NZ LYS A 27 1.225 18.755 -1.501 1.00 0.00 N ATOM 0 H LYS A 27 4.211 15.927 -5.527 1.00 0.00 H new ATOM 0 HA LYS A 27 4.965 16.623 -2.903 1.00 0.00 H new ATOM 0 HB2 LYS A 27 2.749 17.067 -3.852 1.00 0.00 H new ATOM 0 HB3 LYS A 27 2.449 15.352 -4.046 1.00 0.00 H new ATOM 0 HG2 LYS A 27 2.507 15.045 -1.593 1.00 0.00 H new ATOM 0 HG3 LYS A 27 2.862 16.748 -1.376 1.00 0.00 H new ATOM 0 HD2 LYS A 27 0.356 15.676 -2.736 1.00 0.00 H new ATOM 0 HD3 LYS A 27 0.436 16.160 -1.053 1.00 0.00 H new ATOM 0 HE2 LYS A 27 0.972 17.963 -3.449 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -0.483 17.965 -2.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 0.797 19.694 -1.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 1.076 18.435 -0.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 2.245 18.811 -1.695 1.00 0.00 H new ATOM 348 N LEU A 28 4.545 13.403 -3.467 1.00 0.00 N ATOM 349 CA LEU A 28 4.808 12.078 -2.918 1.00 0.00 C ATOM 350 C LEU A 28 6.264 11.944 -2.478 1.00 0.00 C ATOM 351 O LEU A 28 6.551 11.425 -1.399 1.00 0.00 O ATOM 352 CB LEU A 28 4.457 10.996 -3.945 1.00 0.00 C ATOM 353 CG LEU A 28 2.966 10.878 -4.286 1.00 0.00 C ATOM 354 CD1 LEU A 28 2.746 9.859 -5.393 1.00 0.00 C ATOM 355 CD2 LEU A 28 2.165 10.495 -3.052 1.00 0.00 C ATOM 0 H LEU A 28 4.178 13.401 -4.419 1.00 0.00 H new ATOM 0 HA LEU A 28 4.177 11.945 -2.039 1.00 0.00 H new ATOM 0 HB2 LEU A 28 5.009 11.197 -4.863 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.804 10.034 -3.568 1.00 0.00 H new ATOM 0 HG LEU A 28 2.621 11.850 -4.638 1.00 0.00 H new ATOM 0 HD11 LEU A 28 1.682 9.791 -5.619 1.00 0.00 H new ATOM 0 HD12 LEU A 28 3.288 10.170 -6.286 1.00 0.00 H new ATOM 0 HD13 LEU A 28 3.111 8.885 -5.068 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.110 10.416 -3.313 1.00 0.00 H new ATOM 0 HD22 LEU A 28 2.518 9.536 -2.673 1.00 0.00 H new ATOM 0 HD23 LEU A 28 2.293 11.258 -2.284 1.00 0.00 H new ATOM 367 N GLN A 29 7.177 12.418 -3.316 1.00 0.00 N ATOM 368 CA GLN A 29 8.603 12.353 -3.012 1.00 0.00 C ATOM 369 C GLN A 29 8.952 13.223 -1.805 1.00 0.00 C ATOM 370 O GLN A 29 9.726 12.815 -0.941 1.00 0.00 O ATOM 371 CB GLN A 29 9.421 12.798 -4.227 1.00 0.00 C ATOM 372 CG GLN A 29 10.925 12.714 -4.016 1.00 0.00 C ATOM 373 CD GLN A 29 11.725 13.188 -5.219 1.00 0.00 C ATOM 374 OE1 GLN A 29 12.956 13.184 -5.195 1.00 0.00 O ATOM 375 NE2 GLN A 29 11.035 13.602 -6.278 1.00 0.00 N ATOM 0 H GLN A 29 6.957 12.852 -4.212 1.00 0.00 H new ATOM 0 HA GLN A 29 8.848 11.319 -2.769 1.00 0.00 H new ATOM 0 HB2 GLN A 29 9.148 12.181 -5.083 1.00 0.00 H new ATOM 0 HB3 GLN A 29 9.155 13.825 -4.477 1.00 0.00 H new ATOM 0 HG2 GLN A 29 11.198 13.313 -3.147 1.00 0.00 H new ATOM 0 HG3 GLN A 29 11.197 11.683 -3.790 1.00 0.00 H new ATOM 0 HE21 GLN A 29 10.015 13.590 -6.259 1.00 0.00 H new ATOM 0 HE22 GLN A 29 11.526 13.932 -7.109 1.00 0.00 H new ATOM 384 N VAL A 30 8.390 14.428 -1.762 1.00 0.00 N ATOM 385 CA VAL A 30 8.658 15.363 -0.671 1.00 0.00 C ATOM 386 C VAL A 30 8.237 14.805 0.688 1.00 0.00 C ATOM 387 O VAL A 30 9.052 14.727 1.613 1.00 0.00 O ATOM 388 CB VAL A 30 7.946 16.712 -0.904 1.00 0.00 C ATOM 389 CG1 VAL A 30 8.140 17.640 0.286 1.00 0.00 C ATOM 390 CG2 VAL A 30 8.454 17.365 -2.179 1.00 0.00 C ATOM 0 H VAL A 30 7.746 14.781 -2.470 1.00 0.00 H new ATOM 0 HA VAL A 30 9.737 15.516 -0.661 1.00 0.00 H new ATOM 0 HB VAL A 30 6.878 16.521 -1.013 1.00 0.00 H new ATOM 0 HG11 VAL A 30 7.629 18.584 0.098 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.726 17.175 1.181 1.00 0.00 H new ATOM 0 HG13 VAL A 30 9.204 17.826 0.433 1.00 0.00 H new ATOM 0 HG21 VAL A 30 7.942 18.316 -2.330 1.00 0.00 H new ATOM 0 HG22 VAL A 30 9.527 17.539 -2.096 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.258 16.709 -3.027 1.00 0.00 H new ATOM 400 N HIS A 31 6.966 14.429 0.818 1.00 0.00 N ATOM 401 CA HIS A 31 6.468 13.900 2.082 1.00 0.00 C ATOM 402 C HIS A 31 7.202 12.625 2.468 1.00 0.00 C ATOM 403 O HIS A 31 7.561 12.431 3.628 1.00 0.00 O ATOM 404 CB HIS A 31 4.955 13.648 2.031 1.00 0.00 C ATOM 405 CG HIS A 31 4.513 12.547 1.121 1.00 0.00 C ATOM 406 ND1 HIS A 31 4.940 11.245 1.252 1.00 0.00 N ATOM 407 CD2 HIS A 31 3.621 12.547 0.107 1.00 0.00 C ATOM 408 CE1 HIS A 31 4.328 10.492 0.360 1.00 0.00 C ATOM 409 NE2 HIS A 31 3.519 11.255 -0.347 1.00 0.00 N ATOM 0 H HIS A 31 6.271 14.480 0.073 1.00 0.00 H new ATOM 0 HA HIS A 31 6.659 14.655 2.845 1.00 0.00 H new ATOM 0 HB2 HIS A 31 4.608 13.423 3.040 1.00 0.00 H new ATOM 0 HB3 HIS A 31 4.462 14.570 1.723 1.00 0.00 H new ATOM 0 HD1 HIS A 31 5.623 10.914 1.933 1.00 0.00 H new ATOM 0 HD2 HIS A 31 3.087 13.404 -0.276 1.00 0.00 H new ATOM 0 HE1 HIS A 31 4.466 9.429 0.230 1.00 0.00 H new ATOM 418 N LEU A 32 7.412 11.758 1.491 1.00 0.00 N ATOM 419 CA LEU A 32 8.095 10.492 1.722 1.00 0.00 C ATOM 420 C LEU A 32 9.483 10.709 2.320 1.00 0.00 C ATOM 421 O LEU A 32 9.854 10.058 3.293 1.00 0.00 O ATOM 422 CB LEU A 32 8.209 9.705 0.416 1.00 0.00 C ATOM 423 CG LEU A 32 8.814 8.308 0.554 1.00 0.00 C ATOM 424 CD1 LEU A 32 7.962 7.446 1.473 1.00 0.00 C ATOM 425 CD2 LEU A 32 8.955 7.651 -0.809 1.00 0.00 C ATOM 0 H LEU A 32 7.118 11.907 0.526 1.00 0.00 H new ATOM 0 HA LEU A 32 7.503 9.921 2.437 1.00 0.00 H new ATOM 0 HB2 LEU A 32 7.215 9.612 -0.023 1.00 0.00 H new ATOM 0 HB3 LEU A 32 8.815 10.279 -0.285 1.00 0.00 H new ATOM 0 HG LEU A 32 9.806 8.406 0.994 1.00 0.00 H new ATOM 0 HD11 LEU A 32 8.408 6.455 1.559 1.00 0.00 H new ATOM 0 HD12 LEU A 32 7.909 7.907 2.459 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.957 7.357 1.060 1.00 0.00 H new ATOM 0 HD21 LEU A 32 9.387 6.657 -0.691 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.974 7.567 -1.276 1.00 0.00 H new ATOM 0 HD23 LEU A 32 9.605 8.257 -1.440 1.00 0.00 H new ATOM 437 N LEU A 33 10.246 11.623 1.728 1.00 0.00 N ATOM 438 CA LEU A 33 11.597 11.918 2.201 1.00 0.00 C ATOM 439 C LEU A 33 11.591 12.442 3.635 1.00 0.00 C ATOM 440 O LEU A 33 12.366 11.984 4.475 1.00 0.00 O ATOM 441 CB LEU A 33 12.267 12.946 1.286 1.00 0.00 C ATOM 442 CG LEU A 33 12.560 12.467 -0.137 1.00 0.00 C ATOM 443 CD1 LEU A 33 13.070 13.619 -0.989 1.00 0.00 C ATOM 444 CD2 LEU A 33 13.572 11.331 -0.122 1.00 0.00 C ATOM 0 H LEU A 33 9.953 12.173 0.920 1.00 0.00 H new ATOM 0 HA LEU A 33 12.160 10.985 2.181 1.00 0.00 H new ATOM 0 HB2 LEU A 33 11.629 13.828 1.230 1.00 0.00 H new ATOM 0 HB3 LEU A 33 13.204 13.260 1.746 1.00 0.00 H new ATOM 0 HG LEU A 33 11.632 12.096 -0.573 1.00 0.00 H new ATOM 0 HD11 LEU A 33 13.274 13.262 -1.999 1.00 0.00 H new ATOM 0 HD12 LEU A 33 12.316 14.405 -1.027 1.00 0.00 H new ATOM 0 HD13 LEU A 33 13.986 14.016 -0.553 1.00 0.00 H new ATOM 0 HD21 LEU A 33 13.767 11.004 -1.143 1.00 0.00 H new ATOM 0 HD22 LEU A 33 14.501 11.677 0.332 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.174 10.497 0.456 1.00 0.00 H new ATOM 456 N GLU A 34 10.729 13.417 3.902 1.00 0.00 N ATOM 457 CA GLU A 34 10.640 14.020 5.230 1.00 0.00 C ATOM 458 C GLU A 34 10.200 13.012 6.295 1.00 0.00 C ATOM 459 O GLU A 34 10.772 12.967 7.385 1.00 0.00 O ATOM 460 CB GLU A 34 9.673 15.205 5.201 1.00 0.00 C ATOM 461 CG GLU A 34 10.106 16.321 4.261 1.00 0.00 C ATOM 462 CD GLU A 34 11.368 17.027 4.723 1.00 0.00 C ATOM 463 OE1 GLU A 34 11.895 16.667 5.797 1.00 0.00 O ATOM 464 OE2 GLU A 34 11.827 17.946 4.011 1.00 0.00 O ATOM 0 H GLU A 34 10.081 13.808 3.218 1.00 0.00 H new ATOM 0 HA GLU A 34 11.638 14.365 5.500 1.00 0.00 H new ATOM 0 HB2 GLU A 34 8.687 14.851 4.901 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.575 15.608 6.209 1.00 0.00 H new ATOM 0 HG2 GLU A 34 10.271 15.907 3.266 1.00 0.00 H new ATOM 0 HG3 GLU A 34 9.300 17.049 4.174 1.00 0.00 H new ATOM 471 N ASN A 35 9.175 12.222 5.988 1.00 0.00 N ATOM 472 CA ASN A 35 8.655 11.236 6.936 1.00 0.00 C ATOM 473 C ASN A 35 9.531 9.984 7.015 1.00 0.00 C ATOM 474 O ASN A 35 9.026 8.883 7.234 1.00 0.00 O ATOM 475 CB ASN A 35 7.224 10.845 6.560 1.00 0.00 C ATOM 476 CG ASN A 35 6.259 12.009 6.667 1.00 0.00 C ATOM 477 OD1 ASN A 35 6.096 12.599 7.736 1.00 0.00 O ATOM 478 ND2 ASN A 35 5.612 12.346 5.559 1.00 0.00 N ATOM 0 H ASN A 35 8.687 12.244 5.092 1.00 0.00 H new ATOM 0 HA ASN A 35 8.663 11.704 7.921 1.00 0.00 H new ATOM 0 HB2 ASN A 35 7.212 10.459 5.541 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.888 10.037 7.211 1.00 0.00 H new ATOM 0 HD21 ASN A 35 4.949 13.121 5.571 1.00 0.00 H new ATOM 0 HD22 ASN A 35 5.777 11.830 4.695 1.00 0.00 H new ATOM 485 N ASN A 36 10.840 10.157 6.856 1.00 0.00 N ATOM 486 CA ASN A 36 11.782 9.039 6.928 1.00 0.00 C ATOM 487 C ASN A 36 11.312 7.847 6.091 1.00 0.00 C ATOM 488 O ASN A 36 11.424 6.697 6.517 1.00 0.00 O ATOM 489 CB ASN A 36 11.978 8.608 8.384 1.00 0.00 C ATOM 490 CG ASN A 36 12.545 9.721 9.245 1.00 0.00 C ATOM 491 OD1 ASN A 36 13.641 10.220 8.991 1.00 0.00 O ATOM 492 ND2 ASN A 36 11.798 10.117 10.269 1.00 0.00 N ATOM 0 H ASN A 36 11.275 11.062 6.676 1.00 0.00 H new ATOM 0 HA ASN A 36 12.732 9.382 6.518 1.00 0.00 H new ATOM 0 HB2 ASN A 36 11.022 8.284 8.796 1.00 0.00 H new ATOM 0 HB3 ASN A 36 12.647 7.748 8.419 1.00 0.00 H new ATOM 0 HD21 ASN A 36 12.127 10.863 10.882 1.00 0.00 H new ATOM 0 HD22 ASN A 36 10.895 9.675 10.443 1.00 0.00 H new ATOM 499 N ASN A 37 10.797 8.132 4.899 1.00 0.00 N ATOM 500 CA ASN A 37 10.318 7.090 3.991 1.00 0.00 C ATOM 501 C ASN A 37 9.265 6.201 4.656 1.00 0.00 C ATOM 502 O ASN A 37 9.246 4.988 4.447 1.00 0.00 O ATOM 503 CB ASN A 37 11.489 6.233 3.508 1.00 0.00 C ATOM 504 CG ASN A 37 12.541 7.047 2.781 1.00 0.00 C ATOM 505 OD1 ASN A 37 12.258 7.681 1.765 1.00 0.00 O ATOM 506 ND2 ASN A 37 13.764 7.033 3.300 1.00 0.00 N ATOM 0 H ASN A 37 10.700 9.080 4.536 1.00 0.00 H new ATOM 0 HA ASN A 37 9.851 7.584 3.139 1.00 0.00 H new ATOM 0 HB2 ASN A 37 11.946 5.733 4.362 1.00 0.00 H new ATOM 0 HB3 ASN A 37 11.115 5.453 2.845 1.00 0.00 H new ATOM 0 HD21 ASN A 37 14.513 7.562 2.854 1.00 0.00 H new ATOM 0 HD22 ASN A 37 13.954 6.493 4.144 1.00 0.00 H new ATOM 513 N ASP A 38 8.388 6.809 5.452 1.00 0.00 N ATOM 514 CA ASP A 38 7.333 6.063 6.137 1.00 0.00 C ATOM 515 C ASP A 38 6.047 6.059 5.312 1.00 0.00 C ATOM 516 O ASP A 38 5.597 7.104 4.844 1.00 0.00 O ATOM 517 CB ASP A 38 7.071 6.667 7.520 1.00 0.00 C ATOM 518 CG ASP A 38 6.079 5.860 8.337 1.00 0.00 C ATOM 519 OD1 ASP A 38 5.597 4.821 7.838 1.00 0.00 O ATOM 520 OD2 ASP A 38 5.789 6.266 9.482 1.00 0.00 O ATOM 0 H ASP A 38 8.386 7.812 5.639 1.00 0.00 H new ATOM 0 HA ASP A 38 7.666 5.032 6.258 1.00 0.00 H new ATOM 0 HB2 ASP A 38 8.012 6.736 8.065 1.00 0.00 H new ATOM 0 HB3 ASP A 38 6.696 7.683 7.402 1.00 0.00 H new ATOM 525 N LEU A 39 5.463 4.876 5.135 1.00 0.00 N ATOM 526 CA LEU A 39 4.231 4.739 4.363 1.00 0.00 C ATOM 527 C LEU A 39 2.994 4.739 5.260 1.00 0.00 C ATOM 528 O LEU A 39 1.992 5.372 4.944 1.00 0.00 O ATOM 529 CB LEU A 39 4.259 3.453 3.528 1.00 0.00 C ATOM 530 CG LEU A 39 5.320 3.406 2.424 1.00 0.00 C ATOM 531 CD1 LEU A 39 5.264 2.076 1.684 1.00 0.00 C ATOM 532 CD2 LEU A 39 5.132 4.561 1.451 1.00 0.00 C ATOM 0 H LEU A 39 5.822 4.000 5.515 1.00 0.00 H new ATOM 0 HA LEU A 39 4.170 5.603 3.701 1.00 0.00 H new ATOM 0 HB2 LEU A 39 4.420 2.609 4.198 1.00 0.00 H new ATOM 0 HB3 LEU A 39 3.279 3.315 3.072 1.00 0.00 H new ATOM 0 HG LEU A 39 6.301 3.502 2.889 1.00 0.00 H new ATOM 0 HD11 LEU A 39 6.025 2.061 0.904 1.00 0.00 H new ATOM 0 HD12 LEU A 39 5.447 1.262 2.385 1.00 0.00 H new ATOM 0 HD13 LEU A 39 4.279 1.952 1.233 1.00 0.00 H new ATOM 0 HD21 LEU A 39 5.895 4.510 0.674 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.144 4.495 0.994 1.00 0.00 H new ATOM 0 HD23 LEU A 39 5.222 5.506 1.987 1.00 0.00 H new ATOM 544 N ASP A 40 3.060 4.006 6.366 1.00 0.00 N ATOM 545 CA ASP A 40 1.927 3.906 7.285 1.00 0.00 C ATOM 546 C ASP A 40 1.481 5.271 7.812 1.00 0.00 C ATOM 547 O ASP A 40 0.295 5.601 7.765 1.00 0.00 O ATOM 548 CB ASP A 40 2.285 2.995 8.461 1.00 0.00 C ATOM 549 CG ASP A 40 1.150 2.864 9.459 1.00 0.00 C ATOM 550 OD1 ASP A 40 0.063 2.394 9.064 1.00 0.00 O ATOM 551 OD2 ASP A 40 1.349 3.234 10.636 1.00 0.00 O ATOM 0 H ASP A 40 3.882 3.473 6.649 1.00 0.00 H new ATOM 0 HA ASP A 40 1.095 3.482 6.723 1.00 0.00 H new ATOM 0 HB2 ASP A 40 2.549 2.007 8.084 1.00 0.00 H new ATOM 0 HB3 ASP A 40 3.166 3.389 8.967 1.00 0.00 H new ATOM 556 N LEU A 41 2.425 6.053 8.327 1.00 0.00 N ATOM 557 CA LEU A 41 2.108 7.369 8.878 1.00 0.00 C ATOM 558 C LEU A 41 1.725 8.364 7.785 1.00 0.00 C ATOM 559 O LEU A 41 0.659 8.984 7.841 1.00 0.00 O ATOM 560 CB LEU A 41 3.295 7.909 9.679 1.00 0.00 C ATOM 561 CG LEU A 41 3.065 9.266 10.349 1.00 0.00 C ATOM 562 CD1 LEU A 41 1.919 9.184 11.347 1.00 0.00 C ATOM 563 CD2 LEU A 41 4.336 9.742 11.034 1.00 0.00 C ATOM 0 H LEU A 41 3.412 5.801 8.375 1.00 0.00 H new ATOM 0 HA LEU A 41 1.249 7.248 9.538 1.00 0.00 H new ATOM 0 HB2 LEU A 41 3.555 7.181 10.448 1.00 0.00 H new ATOM 0 HB3 LEU A 41 4.155 7.991 9.014 1.00 0.00 H new ATOM 0 HG LEU A 41 2.796 9.989 9.579 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.771 10.159 11.812 1.00 0.00 H new ATOM 0 HD12 LEU A 41 1.007 8.887 10.830 1.00 0.00 H new ATOM 0 HD13 LEU A 41 2.157 8.448 12.115 1.00 0.00 H new ATOM 0 HD21 LEU A 41 4.155 10.708 11.505 1.00 0.00 H new ATOM 0 HD22 LEU A 41 4.633 9.018 11.793 1.00 0.00 H new ATOM 0 HD23 LEU A 41 5.132 9.842 10.296 1.00 0.00 H new ATOM 575 N THR A 42 2.603 8.521 6.799 1.00 0.00 N ATOM 576 CA THR A 42 2.362 9.451 5.702 1.00 0.00 C ATOM 577 C THR A 42 1.025 9.175 5.025 1.00 0.00 C ATOM 578 O THR A 42 0.173 10.059 4.933 1.00 0.00 O ATOM 579 CB THR A 42 3.485 9.377 4.652 1.00 0.00 C ATOM 580 OG1 THR A 42 4.745 9.678 5.261 1.00 0.00 O ATOM 581 CG2 THR A 42 3.226 10.348 3.511 1.00 0.00 C ATOM 0 H THR A 42 3.487 8.016 6.738 1.00 0.00 H new ATOM 0 HA THR A 42 2.342 10.452 6.134 1.00 0.00 H new ATOM 0 HB THR A 42 3.507 8.365 4.249 1.00 0.00 H new ATOM 0 HG1 THR A 42 5.310 8.877 5.256 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.033 10.277 2.782 1.00 0.00 H new ATOM 0 HG22 THR A 42 2.280 10.100 3.030 1.00 0.00 H new ATOM 0 HG23 THR A 42 3.179 11.364 3.902 1.00 0.00 H new ATOM 589 N ILE A 43 0.843 7.944 4.560 1.00 0.00 N ATOM 590 CA ILE A 43 -0.397 7.561 3.899 1.00 0.00 C ATOM 591 C ILE A 43 -1.585 7.725 4.838 1.00 0.00 C ATOM 592 O ILE A 43 -2.645 8.195 4.427 1.00 0.00 O ATOM 593 CB ILE A 43 -0.351 6.107 3.388 1.00 0.00 C ATOM 594 CG1 ILE A 43 0.731 5.951 2.316 1.00 0.00 C ATOM 595 CG2 ILE A 43 -1.710 5.697 2.843 1.00 0.00 C ATOM 596 CD1 ILE A 43 0.859 4.539 1.782 1.00 0.00 C ATOM 0 H ILE A 43 1.535 7.198 4.628 1.00 0.00 H new ATOM 0 HA ILE A 43 -0.514 8.225 3.042 1.00 0.00 H new ATOM 0 HB ILE A 43 -0.102 5.451 4.222 1.00 0.00 H new ATOM 0 HG12 ILE A 43 0.510 6.625 1.488 1.00 0.00 H new ATOM 0 HG13 ILE A 43 1.690 6.261 2.732 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -1.663 4.668 2.486 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -2.457 5.773 3.633 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -1.985 6.355 2.019 1.00 0.00 H new ATOM 0 HD11 ILE A 43 1.644 4.505 1.027 1.00 0.00 H new ATOM 0 HD12 ILE A 43 1.111 3.863 2.599 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -0.087 4.232 1.336 1.00 0.00 H new ATOM 608 N GLY A 44 -1.401 7.340 6.100 1.00 0.00 N ATOM 609 CA GLY A 44 -2.471 7.462 7.073 1.00 0.00 C ATOM 610 C GLY A 44 -3.080 8.849 7.076 1.00 0.00 C ATOM 611 O GLY A 44 -4.301 9.000 7.048 1.00 0.00 O ATOM 0 H GLY A 44 -0.533 6.947 6.463 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.245 6.727 6.854 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -2.085 7.233 8.067 1.00 0.00 H new ATOM 615 N LEU A 45 -2.222 9.865 7.094 1.00 0.00 N ATOM 616 CA LEU A 45 -2.678 11.251 7.084 1.00 0.00 C ATOM 617 C LEU A 45 -3.285 11.610 5.730 1.00 0.00 C ATOM 618 O LEU A 45 -4.274 12.336 5.655 1.00 0.00 O ATOM 619 CB LEU A 45 -1.514 12.194 7.400 1.00 0.00 C ATOM 620 CG LEU A 45 -1.867 13.684 7.415 1.00 0.00 C ATOM 621 CD1 LEU A 45 -2.866 13.987 8.522 1.00 0.00 C ATOM 622 CD2 LEU A 45 -0.612 14.527 7.582 1.00 0.00 C ATOM 0 H LEU A 45 -1.208 9.755 7.116 1.00 0.00 H new ATOM 0 HA LEU A 45 -3.446 11.363 7.850 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -1.103 11.925 8.373 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -0.726 12.031 6.665 1.00 0.00 H new ATOM 0 HG LEU A 45 -2.327 13.937 6.460 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -3.104 15.051 8.516 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -3.776 13.410 8.358 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -2.434 13.717 9.486 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.882 15.583 7.590 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.123 14.270 8.522 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.069 14.333 6.754 1.00 0.00 H new ATOM 634 N LEU A 46 -2.680 11.102 4.661 1.00 0.00 N ATOM 635 CA LEU A 46 -3.157 11.374 3.308 1.00 0.00 C ATOM 636 C LEU A 46 -4.577 10.849 3.097 1.00 0.00 C ATOM 637 O LEU A 46 -5.367 11.452 2.370 1.00 0.00 O ATOM 638 CB LEU A 46 -2.209 10.755 2.277 1.00 0.00 C ATOM 639 CG LEU A 46 -0.774 11.295 2.303 1.00 0.00 C ATOM 640 CD1 LEU A 46 0.092 10.559 1.293 1.00 0.00 C ATOM 641 CD2 LEU A 46 -0.758 12.791 2.025 1.00 0.00 C ATOM 0 H LEU A 46 -1.858 10.499 4.705 1.00 0.00 H new ATOM 0 HA LEU A 46 -3.176 12.456 3.175 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -2.178 9.677 2.437 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.624 10.918 1.282 1.00 0.00 H new ATOM 0 HG LEU A 46 -0.364 11.126 3.299 1.00 0.00 H new ATOM 0 HD11 LEU A 46 1.107 10.956 1.326 1.00 0.00 H new ATOM 0 HD12 LEU A 46 0.110 9.496 1.535 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.319 10.696 0.293 1.00 0.00 H new ATOM 0 HD21 LEU A 46 0.269 13.154 2.048 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -1.189 12.983 1.042 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -1.343 13.309 2.785 1.00 0.00 H new ATOM 653 N LEU A 47 -4.894 9.721 3.730 1.00 0.00 N ATOM 654 CA LEU A 47 -6.218 9.115 3.603 1.00 0.00 C ATOM 655 C LEU A 47 -7.320 10.091 4.012 1.00 0.00 C ATOM 656 O LEU A 47 -8.290 10.286 3.280 1.00 0.00 O ATOM 657 CB LEU A 47 -6.313 7.853 4.464 1.00 0.00 C ATOM 658 CG LEU A 47 -5.323 6.741 4.108 1.00 0.00 C ATOM 659 CD1 LEU A 47 -5.490 5.558 5.047 1.00 0.00 C ATOM 660 CD2 LEU A 47 -5.507 6.303 2.664 1.00 0.00 C ATOM 0 H LEU A 47 -4.253 9.209 4.335 1.00 0.00 H new ATOM 0 HA LEU A 47 -6.358 8.853 2.554 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -6.161 8.132 5.507 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -7.325 7.455 4.385 1.00 0.00 H new ATOM 0 HG LEU A 47 -4.312 7.133 4.222 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -4.778 4.777 4.779 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -5.307 5.879 6.073 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -6.504 5.168 4.964 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.794 5.512 2.430 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -6.522 5.930 2.523 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.337 7.152 2.002 1.00 0.00 H new ATOM 672 N LYS A 48 -7.170 10.690 5.192 1.00 0.00 N ATOM 673 CA LYS A 48 -8.161 11.632 5.705 1.00 0.00 C ATOM 674 C LYS A 48 -8.228 12.897 4.851 1.00 0.00 C ATOM 675 O LYS A 48 -9.300 13.477 4.676 1.00 0.00 O ATOM 676 CB LYS A 48 -7.858 11.998 7.163 1.00 0.00 C ATOM 677 CG LYS A 48 -6.602 12.834 7.344 1.00 0.00 C ATOM 678 CD LYS A 48 -6.382 13.226 8.801 1.00 0.00 C ATOM 679 CE LYS A 48 -7.455 14.183 9.308 1.00 0.00 C ATOM 680 NZ LYS A 48 -8.786 13.526 9.437 1.00 0.00 N ATOM 0 H LYS A 48 -6.372 10.540 5.810 1.00 0.00 H new ATOM 0 HA LYS A 48 -9.132 11.140 5.658 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -8.707 12.544 7.573 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -7.758 11.081 7.743 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -5.739 12.274 6.985 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -6.674 13.734 6.733 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -6.376 12.329 9.420 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -5.402 13.692 8.906 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -7.154 14.582 10.277 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -7.535 15.029 8.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -9.240 13.832 10.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -9.385 13.793 8.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -8.664 12.493 9.450 1.00 0.00 H new ATOM 694 N GLU A 49 -7.079 13.324 4.330 1.00 0.00 N ATOM 695 CA GLU A 49 -7.009 14.527 3.501 1.00 0.00 C ATOM 696 C GLU A 49 -8.084 14.518 2.417 1.00 0.00 C ATOM 697 O GLU A 49 -8.724 15.538 2.160 1.00 0.00 O ATOM 698 CB GLU A 49 -5.625 14.658 2.861 1.00 0.00 C ATOM 699 CG GLU A 49 -4.505 14.888 3.865 1.00 0.00 C ATOM 700 CD GLU A 49 -4.637 16.207 4.605 1.00 0.00 C ATOM 701 OE1 GLU A 49 -5.579 16.970 4.304 1.00 0.00 O ATOM 702 OE2 GLU A 49 -3.791 16.480 5.483 1.00 0.00 O ATOM 0 H GLU A 49 -6.184 12.855 4.467 1.00 0.00 H new ATOM 0 HA GLU A 49 -7.185 15.385 4.150 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.411 13.753 2.292 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -5.640 15.485 2.151 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -4.498 14.071 4.587 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -3.547 14.863 3.345 1.00 0.00 H new ATOM 782 N MET B 1 -17.519 -11.420 -10.742 1.00 0.00 N ATOM 783 CA MET B 1 -16.769 -10.182 -10.407 1.00 0.00 C ATOM 784 C MET B 1 -15.723 -10.447 -9.328 1.00 0.00 C ATOM 785 O MET B 1 -15.960 -11.213 -8.393 1.00 0.00 O ATOM 786 CB MET B 1 -17.761 -9.118 -9.934 1.00 0.00 C ATOM 787 CG MET B 1 -17.111 -7.782 -9.613 1.00 0.00 C ATOM 788 SD MET B 1 -18.307 -6.532 -9.105 1.00 0.00 S ATOM 789 CE MET B 1 -17.237 -5.113 -8.882 1.00 0.00 C ATOM 0 H1 MET B 1 -18.518 -11.185 -10.912 1.00 0.00 H new ATOM 0 H2 MET B 1 -17.114 -11.851 -11.598 1.00 0.00 H new ATOM 0 H3 MET B 1 -17.451 -12.092 -9.951 1.00 0.00 H new ATOM 0 HA MET B 1 -16.243 -9.832 -11.296 1.00 0.00 H new ATOM 0 HB2 MET B 1 -18.517 -8.969 -10.705 1.00 0.00 H new ATOM 0 HB3 MET B 1 -18.278 -9.484 -9.047 1.00 0.00 H new ATOM 0 HG2 MET B 1 -16.377 -7.921 -8.819 1.00 0.00 H new ATOM 0 HG3 MET B 1 -16.569 -7.426 -10.489 1.00 0.00 H new ATOM 0 HE1 MET B 1 -17.844 -4.218 -8.741 1.00 0.00 H new ATOM 0 HE2 MET B 1 -16.607 -5.266 -8.005 1.00 0.00 H new ATOM 0 HE3 MET B 1 -16.608 -4.990 -9.763 1.00 0.00 H new ATOM 801 N GLN B 2 -14.566 -9.808 -9.466 1.00 0.00 N ATOM 802 CA GLN B 2 -13.479 -9.971 -8.509 1.00 0.00 C ATOM 803 C GLN B 2 -12.598 -8.729 -8.470 1.00 0.00 C ATOM 804 O GLN B 2 -12.353 -8.096 -9.496 1.00 0.00 O ATOM 805 CB GLN B 2 -12.626 -11.196 -8.848 1.00 0.00 C ATOM 806 CG GLN B 2 -11.909 -11.117 -10.192 1.00 0.00 C ATOM 807 CD GLN B 2 -12.832 -11.306 -11.384 1.00 0.00 C ATOM 808 OE1 GLN B 2 -13.698 -10.476 -11.659 1.00 0.00 O ATOM 809 NE2 GLN B 2 -12.648 -12.407 -12.103 1.00 0.00 N ATOM 0 H GLN B 2 -14.357 -9.170 -10.234 1.00 0.00 H new ATOM 0 HA GLN B 2 -13.928 -10.117 -7.527 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -11.883 -11.334 -8.062 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -13.264 -12.080 -8.843 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -11.415 -10.149 -10.275 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -11.128 -11.877 -10.223 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -11.919 -13.071 -11.842 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -13.236 -12.589 -12.916 1.00 0.00 H new ATOM 818 N ILE B 3 -12.132 -8.383 -7.276 1.00 0.00 N ATOM 819 CA ILE B 3 -11.287 -7.212 -7.092 1.00 0.00 C ATOM 820 C ILE B 3 -9.909 -7.597 -6.560 1.00 0.00 C ATOM 821 O ILE B 3 -9.785 -8.456 -5.686 1.00 0.00 O ATOM 822 CB ILE B 3 -11.945 -6.210 -6.128 1.00 0.00 C ATOM 823 CG1 ILE B 3 -12.138 -6.849 -4.750 1.00 0.00 C ATOM 824 CG2 ILE B 3 -13.277 -5.750 -6.700 1.00 0.00 C ATOM 825 CD1 ILE B 3 -12.717 -5.909 -3.715 1.00 0.00 C ATOM 0 H ILE B 3 -12.327 -8.900 -6.418 1.00 0.00 H new ATOM 0 HA ILE B 3 -11.166 -6.745 -8.070 1.00 0.00 H new ATOM 0 HB ILE B 3 -11.295 -5.343 -6.012 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -12.795 -7.713 -4.850 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -11.177 -7.219 -4.394 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -13.741 -5.040 -6.015 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -13.112 -5.269 -7.664 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -13.933 -6.610 -6.831 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -12.824 -6.434 -2.766 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -12.051 -5.056 -3.585 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -13.694 -5.559 -4.048 1.00 0.00 H new ATOM 837 N PHE B 4 -8.877 -6.951 -7.093 1.00 0.00 N ATOM 838 CA PHE B 4 -7.507 -7.218 -6.674 1.00 0.00 C ATOM 839 C PHE B 4 -7.194 -6.521 -5.355 1.00 0.00 C ATOM 840 O PHE B 4 -7.690 -5.428 -5.087 1.00 0.00 O ATOM 841 CB PHE B 4 -6.515 -6.767 -7.752 1.00 0.00 C ATOM 842 CG PHE B 4 -6.524 -7.623 -8.990 1.00 0.00 C ATOM 843 CD1 PHE B 4 -7.711 -7.929 -9.639 1.00 0.00 C ATOM 844 CD2 PHE B 4 -5.338 -8.120 -9.505 1.00 0.00 C ATOM 845 CE1 PHE B 4 -7.712 -8.714 -10.777 1.00 0.00 C ATOM 846 CE2 PHE B 4 -5.333 -8.905 -10.642 1.00 0.00 C ATOM 847 CZ PHE B 4 -6.522 -9.203 -11.279 1.00 0.00 C ATOM 0 H PHE B 4 -8.964 -6.238 -7.817 1.00 0.00 H new ATOM 0 HA PHE B 4 -7.406 -8.294 -6.530 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -6.742 -5.738 -8.032 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -5.510 -6.768 -7.330 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -8.645 -7.550 -9.251 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -4.405 -7.891 -9.011 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -8.643 -8.945 -11.273 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -4.401 -9.285 -11.032 1.00 0.00 H new ATOM 0 HZ PHE B 4 -6.521 -9.817 -12.168 1.00 0.00 H new ATOM 857 N VAL B 5 -6.366 -7.159 -4.537 1.00 0.00 N ATOM 858 CA VAL B 5 -5.981 -6.600 -3.247 1.00 0.00 C ATOM 859 C VAL B 5 -4.463 -6.546 -3.115 1.00 0.00 C ATOM 860 O VAL B 5 -3.841 -7.458 -2.567 1.00 0.00 O ATOM 861 CB VAL B 5 -6.571 -7.414 -2.079 1.00 0.00 C ATOM 862 CG1 VAL B 5 -6.177 -6.801 -0.743 1.00 0.00 C ATOM 863 CG2 VAL B 5 -8.084 -7.503 -2.205 1.00 0.00 C ATOM 0 H VAL B 5 -5.947 -8.066 -4.745 1.00 0.00 H new ATOM 0 HA VAL B 5 -6.384 -5.588 -3.200 1.00 0.00 H new ATOM 0 HB VAL B 5 -6.162 -8.424 -2.122 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -6.604 -7.391 0.068 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -5.091 -6.792 -0.653 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -6.554 -5.780 -0.686 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -8.485 -8.081 -1.372 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -8.510 -6.500 -2.189 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -8.343 -7.992 -3.144 1.00 0.00 H new ATOM 873 N LYS B 6 -3.874 -5.474 -3.635 1.00 0.00 N ATOM 874 CA LYS B 6 -2.427 -5.290 -3.590 1.00 0.00 C ATOM 875 C LYS B 6 -1.973 -4.824 -2.211 1.00 0.00 C ATOM 876 O LYS B 6 -2.552 -3.907 -1.634 1.00 0.00 O ATOM 877 CB LYS B 6 -1.995 -4.283 -4.657 1.00 0.00 C ATOM 878 CG LYS B 6 -0.498 -4.027 -4.689 1.00 0.00 C ATOM 879 CD LYS B 6 -0.128 -3.045 -5.789 1.00 0.00 C ATOM 880 CE LYS B 6 1.362 -2.752 -5.792 1.00 0.00 C ATOM 881 NZ LYS B 6 1.808 -2.151 -4.505 1.00 0.00 N ATOM 0 H LYS B 6 -4.379 -4.716 -4.095 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.955 -6.252 -3.792 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -2.313 -4.645 -5.635 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -2.512 -3.339 -4.483 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -0.173 -3.635 -3.725 1.00 0.00 H new ATOM 0 HG3 LYS B 6 0.030 -4.967 -4.845 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -0.422 -3.452 -6.756 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -0.683 -2.117 -5.652 1.00 0.00 H new ATOM 0 HE2 LYS B 6 1.914 -3.674 -5.973 1.00 0.00 H new ATOM 0 HE3 LYS B 6 1.598 -2.073 -6.612 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 2.171 -1.192 -4.677 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 1.004 -2.104 -3.847 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 2.561 -2.737 -4.091 1.00 0.00 H new ATOM 895 N THR B 7 -0.928 -5.461 -1.693 1.00 0.00 N ATOM 896 CA THR B 7 -0.387 -5.114 -0.384 1.00 0.00 C ATOM 897 C THR B 7 0.730 -4.083 -0.508 1.00 0.00 C ATOM 898 O THR B 7 1.422 -4.023 -1.525 1.00 0.00 O ATOM 899 CB THR B 7 0.152 -6.355 0.353 1.00 0.00 C ATOM 900 OG1 THR B 7 1.201 -6.964 -0.410 1.00 0.00 O ATOM 901 CG2 THR B 7 -0.960 -7.366 0.595 1.00 0.00 C ATOM 0 H THR B 7 -0.438 -6.223 -2.162 1.00 0.00 H new ATOM 0 HA THR B 7 -1.208 -4.690 0.194 1.00 0.00 H new ATOM 0 HB THR B 7 0.546 -6.034 1.317 1.00 0.00 H new ATOM 0 HG1 THR B 7 1.993 -7.079 0.156 1.00 0.00 H new ATOM 0 HG21 THR B 7 -0.556 -8.234 1.117 1.00 0.00 H new ATOM 0 HG22 THR B 7 -1.741 -6.909 1.202 1.00 0.00 H new ATOM 0 HG23 THR B 7 -1.380 -7.680 -0.360 1.00 0.00 H new ATOM 909 N LEU B 8 0.901 -3.276 0.536 1.00 0.00 N ATOM 910 CA LEU B 8 1.934 -2.247 0.556 1.00 0.00 C ATOM 911 C LEU B 8 3.294 -2.853 0.220 1.00 0.00 C ATOM 912 O LEU B 8 4.120 -2.226 -0.444 1.00 0.00 O ATOM 913 CB LEU B 8 1.983 -1.578 1.932 1.00 0.00 C ATOM 914 CG LEU B 8 2.790 -0.281 1.995 1.00 0.00 C ATOM 915 CD1 LEU B 8 2.079 0.830 1.233 1.00 0.00 C ATOM 916 CD2 LEU B 8 3.032 0.130 3.439 1.00 0.00 C ATOM 0 H LEU B 8 0.334 -3.316 1.383 1.00 0.00 H new ATOM 0 HA LEU B 8 1.692 -1.495 -0.195 1.00 0.00 H new ATOM 0 HB2 LEU B 8 0.963 -1.369 2.253 1.00 0.00 H new ATOM 0 HB3 LEU B 8 2.404 -2.285 2.647 1.00 0.00 H new ATOM 0 HG LEU B 8 3.757 -0.456 1.523 1.00 0.00 H new ATOM 0 HD11 LEU B 8 2.669 1.745 1.289 1.00 0.00 H new ATOM 0 HD12 LEU B 8 1.961 0.538 0.189 1.00 0.00 H new ATOM 0 HD13 LEU B 8 1.097 1.003 1.674 1.00 0.00 H new ATOM 0 HD21 LEU B 8 3.608 1.055 3.462 1.00 0.00 H new ATOM 0 HD22 LEU B 8 2.076 0.285 3.938 1.00 0.00 H new ATOM 0 HD23 LEU B 8 3.586 -0.655 3.953 1.00 0.00 H new ATOM 928 N THR B 9 3.517 -4.080 0.688 1.00 0.00 N ATOM 929 CA THR B 9 4.773 -4.780 0.444 1.00 0.00 C ATOM 930 C THR B 9 4.916 -5.192 -1.019 1.00 0.00 C ATOM 931 O THR B 9 5.844 -4.759 -1.704 1.00 0.00 O ATOM 932 CB THR B 9 4.896 -6.033 1.331 1.00 0.00 C ATOM 933 OG1 THR B 9 3.803 -6.923 1.077 1.00 0.00 O ATOM 934 CG2 THR B 9 4.914 -5.653 2.804 1.00 0.00 C ATOM 0 H THR B 9 2.841 -4.609 1.239 1.00 0.00 H new ATOM 0 HA THR B 9 5.571 -4.080 0.693 1.00 0.00 H new ATOM 0 HB THR B 9 5.834 -6.532 1.088 1.00 0.00 H new ATOM 0 HG1 THR B 9 3.890 -7.718 1.644 1.00 0.00 H new ATOM 0 HG21 THR B 9 5.001 -6.554 3.411 1.00 0.00 H new ATOM 0 HG22 THR B 9 5.764 -4.999 3.001 1.00 0.00 H new ATOM 0 HG23 THR B 9 3.990 -5.133 3.057 1.00 0.00 H new ATOM 942 N GLY B 10 3.999 -6.033 -1.497 1.00 0.00 N ATOM 943 CA GLY B 10 4.061 -6.480 -2.878 1.00 0.00 C ATOM 944 C GLY B 10 3.344 -7.798 -3.117 1.00 0.00 C ATOM 945 O GLY B 10 3.971 -8.786 -3.499 1.00 0.00 O ATOM 0 H GLY B 10 3.220 -6.410 -0.956 1.00 0.00 H new ATOM 0 HA2 GLY B 10 3.624 -5.715 -3.520 1.00 0.00 H new ATOM 0 HA3 GLY B 10 5.105 -6.584 -3.172 1.00 0.00 H new ATOM 949 N LYS B 11 2.030 -7.818 -2.901 1.00 0.00 N ATOM 950 CA LYS B 11 1.244 -9.033 -3.107 1.00 0.00 C ATOM 951 C LYS B 11 -0.226 -8.701 -3.350 1.00 0.00 C ATOM 952 O LYS B 11 -0.868 -8.042 -2.533 1.00 0.00 O ATOM 953 CB LYS B 11 1.372 -9.960 -1.896 1.00 0.00 C ATOM 954 CG LYS B 11 0.606 -11.265 -2.042 1.00 0.00 C ATOM 955 CD LYS B 11 0.735 -12.131 -0.799 1.00 0.00 C ATOM 956 CE LYS B 11 0.013 -13.458 -0.966 1.00 0.00 C ATOM 957 NZ LYS B 11 -1.439 -13.270 -1.239 1.00 0.00 N ATOM 0 H LYS B 11 1.490 -7.012 -2.585 1.00 0.00 H new ATOM 0 HA LYS B 11 1.634 -9.539 -3.990 1.00 0.00 H new ATOM 0 HB2 LYS B 11 2.426 -10.184 -1.731 1.00 0.00 H new ATOM 0 HB3 LYS B 11 1.015 -9.436 -1.009 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -0.446 -11.051 -2.230 1.00 0.00 H new ATOM 0 HG3 LYS B 11 0.979 -11.812 -2.908 1.00 0.00 H new ATOM 0 HD2 LYS B 11 1.789 -12.313 -0.589 1.00 0.00 H new ATOM 0 HD3 LYS B 11 0.326 -11.599 0.060 1.00 0.00 H new ATOM 0 HE2 LYS B 11 0.467 -14.018 -1.784 1.00 0.00 H new ATOM 0 HE3 LYS B 11 0.138 -14.056 -0.063 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -1.994 -13.867 -0.593 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -1.693 -12.272 -1.092 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -1.645 -13.539 -2.222 1.00 0.00 H new ATOM 971 N THR B 12 -0.753 -9.164 -4.481 1.00 0.00 N ATOM 972 CA THR B 12 -2.146 -8.916 -4.836 1.00 0.00 C ATOM 973 C THR B 12 -3.002 -10.164 -4.649 1.00 0.00 C ATOM 974 O THR B 12 -2.598 -11.267 -5.018 1.00 0.00 O ATOM 975 CB THR B 12 -2.279 -8.440 -6.295 1.00 0.00 C ATOM 976 OG1 THR B 12 -1.790 -9.449 -7.187 1.00 0.00 O ATOM 977 CG2 THR B 12 -1.509 -7.147 -6.517 1.00 0.00 C ATOM 0 H THR B 12 -0.235 -9.713 -5.167 1.00 0.00 H new ATOM 0 HA THR B 12 -2.500 -8.133 -4.166 1.00 0.00 H new ATOM 0 HB THR B 12 -3.334 -8.256 -6.497 1.00 0.00 H new ATOM 0 HG1 THR B 12 -1.880 -9.139 -8.112 1.00 0.00 H new ATOM 0 HG21 THR B 12 -1.619 -6.832 -7.555 1.00 0.00 H new ATOM 0 HG22 THR B 12 -1.902 -6.372 -5.859 1.00 0.00 H new ATOM 0 HG23 THR B 12 -0.454 -7.309 -6.297 1.00 0.00 H new ATOM 985 N ILE B 13 -4.192 -9.981 -4.082 1.00 0.00 N ATOM 986 CA ILE B 13 -5.110 -11.093 -3.858 1.00 0.00 C ATOM 987 C ILE B 13 -6.443 -10.849 -4.556 1.00 0.00 C ATOM 988 O ILE B 13 -7.056 -9.794 -4.389 1.00 0.00 O ATOM 989 CB ILE B 13 -5.371 -11.321 -2.355 1.00 0.00 C ATOM 990 CG1 ILE B 13 -4.055 -11.594 -1.623 1.00 0.00 C ATOM 991 CG2 ILE B 13 -6.349 -12.475 -2.155 1.00 0.00 C ATOM 992 CD1 ILE B 13 -4.212 -11.742 -0.124 1.00 0.00 C ATOM 0 H ILE B 13 -4.542 -9.075 -3.770 1.00 0.00 H new ATOM 0 HA ILE B 13 -4.634 -11.981 -4.274 1.00 0.00 H new ATOM 0 HB ILE B 13 -5.816 -10.418 -1.936 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -3.608 -12.504 -2.024 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -3.360 -10.780 -1.828 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -6.523 -12.624 -1.089 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -7.293 -12.242 -2.648 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -5.931 -13.385 -2.585 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -3.238 -11.934 0.327 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -4.629 -10.824 0.290 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -4.882 -12.575 0.091 1.00 0.00 H new ATOM 1004 N THR B 14 -6.892 -11.831 -5.331 1.00 0.00 N ATOM 1005 CA THR B 14 -8.159 -11.721 -6.043 1.00 0.00 C ATOM 1006 C THR B 14 -9.312 -12.211 -5.172 1.00 0.00 C ATOM 1007 O THR B 14 -9.310 -13.352 -4.711 1.00 0.00 O ATOM 1008 CB THR B 14 -8.140 -12.528 -7.356 1.00 0.00 C ATOM 1009 OG1 THR B 14 -7.075 -12.071 -8.198 1.00 0.00 O ATOM 1010 CG2 THR B 14 -9.465 -12.396 -8.094 1.00 0.00 C ATOM 0 H THR B 14 -6.398 -12.710 -5.482 1.00 0.00 H new ATOM 0 HA THR B 14 -8.303 -10.667 -6.281 1.00 0.00 H new ATOM 0 HB THR B 14 -7.983 -13.577 -7.107 1.00 0.00 H new ATOM 0 HG1 THR B 14 -7.069 -12.590 -9.029 1.00 0.00 H new ATOM 0 HG21 THR B 14 -9.427 -12.974 -9.017 1.00 0.00 H new ATOM 0 HG22 THR B 14 -10.271 -12.771 -7.464 1.00 0.00 H new ATOM 0 HG23 THR B 14 -9.647 -11.348 -8.330 1.00 0.00 H new ATOM 1018 N LEU B 15 -10.298 -11.346 -4.955 1.00 0.00 N ATOM 1019 CA LEU B 15 -11.460 -11.698 -4.144 1.00 0.00 C ATOM 1020 C LEU B 15 -12.747 -11.487 -4.932 1.00 0.00 C ATOM 1021 O LEU B 15 -13.008 -10.391 -5.425 1.00 0.00 O ATOM 1022 CB LEU B 15 -11.512 -10.858 -2.858 1.00 0.00 C ATOM 1023 CG LEU B 15 -10.422 -11.127 -1.820 1.00 0.00 C ATOM 1024 CD1 LEU B 15 -10.452 -12.578 -1.375 1.00 0.00 C ATOM 1025 CD2 LEU B 15 -9.056 -10.759 -2.362 1.00 0.00 C ATOM 0 H LEU B 15 -10.316 -10.397 -5.329 1.00 0.00 H new ATOM 0 HA LEU B 15 -11.366 -12.750 -3.876 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -11.465 -9.805 -3.137 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -12.481 -11.019 -2.385 1.00 0.00 H new ATOM 0 HG LEU B 15 -10.620 -10.499 -0.951 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -9.669 -12.748 -0.636 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -11.423 -12.803 -0.933 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -10.286 -13.226 -2.236 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -8.298 -10.960 -1.605 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -8.846 -11.352 -3.252 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -9.040 -9.700 -2.620 1.00 0.00 H new ATOM 1037 N GLU B 16 -13.557 -12.535 -5.036 1.00 0.00 N ATOM 1038 CA GLU B 16 -14.822 -12.446 -5.755 1.00 0.00 C ATOM 1039 C GLU B 16 -15.849 -11.695 -4.917 1.00 0.00 C ATOM 1040 O GLU B 16 -16.067 -12.027 -3.752 1.00 0.00 O ATOM 1041 CB GLU B 16 -15.342 -13.844 -6.097 1.00 0.00 C ATOM 1042 CG GLU B 16 -16.656 -13.834 -6.860 1.00 0.00 C ATOM 1043 CD GLU B 16 -17.146 -15.228 -7.196 1.00 0.00 C ATOM 1044 OE1 GLU B 16 -17.378 -16.019 -6.258 1.00 0.00 O ATOM 1045 OE2 GLU B 16 -17.297 -15.530 -8.399 1.00 0.00 O ATOM 0 H GLU B 16 -13.361 -13.452 -4.634 1.00 0.00 H new ATOM 0 HA GLU B 16 -14.656 -11.900 -6.684 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -14.591 -14.367 -6.690 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -15.471 -14.410 -5.175 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -17.412 -13.320 -6.267 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -16.533 -13.265 -7.781 1.00 0.00 H new ATOM 1052 N VAL B 17 -16.471 -10.678 -5.507 1.00 0.00 N ATOM 1053 CA VAL B 17 -17.465 -9.879 -4.795 1.00 0.00 C ATOM 1054 C VAL B 17 -18.555 -9.368 -5.731 1.00 0.00 C ATOM 1055 O VAL B 17 -18.281 -8.936 -6.851 1.00 0.00 O ATOM 1056 CB VAL B 17 -16.819 -8.669 -4.087 1.00 0.00 C ATOM 1057 CG1 VAL B 17 -15.814 -9.120 -3.037 1.00 0.00 C ATOM 1058 CG2 VAL B 17 -16.161 -7.755 -5.104 1.00 0.00 C ATOM 0 H VAL B 17 -16.306 -10.388 -6.471 1.00 0.00 H new ATOM 0 HA VAL B 17 -17.910 -10.541 -4.052 1.00 0.00 H new ATOM 0 HB VAL B 17 -17.605 -8.113 -3.576 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -15.375 -8.247 -2.555 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -16.319 -9.732 -2.289 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -15.027 -9.705 -3.514 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -15.709 -6.906 -4.591 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -15.390 -8.306 -5.643 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -16.911 -7.396 -5.809 1.00 0.00 H new ATOM 1068 N GLU B 18 -19.793 -9.414 -5.253 1.00 0.00 N ATOM 1069 CA GLU B 18 -20.939 -8.949 -6.026 1.00 0.00 C ATOM 1070 C GLU B 18 -20.927 -7.432 -6.163 1.00 0.00 C ATOM 1071 O GLU B 18 -20.465 -6.723 -5.270 1.00 0.00 O ATOM 1072 CB GLU B 18 -22.245 -9.394 -5.366 1.00 0.00 C ATOM 1073 CG GLU B 18 -22.502 -10.886 -5.476 1.00 0.00 C ATOM 1074 CD GLU B 18 -23.757 -11.321 -4.744 1.00 0.00 C ATOM 1075 OE1 GLU B 18 -24.437 -10.451 -4.159 1.00 0.00 O ATOM 1076 OE2 GLU B 18 -24.061 -12.532 -4.756 1.00 0.00 O ATOM 0 H GLU B 18 -20.030 -9.771 -4.327 1.00 0.00 H new ATOM 0 HA GLU B 18 -20.870 -9.390 -7.021 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -22.224 -9.114 -4.313 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -23.075 -8.856 -5.823 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -22.587 -11.159 -6.528 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -21.646 -11.428 -5.074 1.00 0.00 H new ATOM 1083 N SER B 19 -21.446 -6.940 -7.283 1.00 0.00 N ATOM 1084 CA SER B 19 -21.504 -5.505 -7.528 1.00 0.00 C ATOM 1085 C SER B 19 -22.234 -4.802 -6.388 1.00 0.00 C ATOM 1086 O SER B 19 -21.884 -3.683 -6.010 1.00 0.00 O ATOM 1087 CB SER B 19 -22.207 -5.218 -8.857 1.00 0.00 C ATOM 1088 OG SER B 19 -23.534 -5.714 -8.849 1.00 0.00 O ATOM 0 H SER B 19 -21.832 -7.513 -8.034 1.00 0.00 H new ATOM 0 HA SER B 19 -20.485 -5.123 -7.582 1.00 0.00 H new ATOM 0 HB2 SER B 19 -22.218 -4.144 -9.042 1.00 0.00 H new ATOM 0 HB3 SER B 19 -21.649 -5.676 -9.674 1.00 0.00 H new ATOM 0 HG SER B 19 -23.962 -5.517 -9.708 1.00 0.00 H new ATOM 1094 N SER B 20 -23.248 -5.469 -5.843 1.00 0.00 N ATOM 1095 CA SER B 20 -24.026 -4.910 -4.741 1.00 0.00 C ATOM 1096 C SER B 20 -23.666 -5.586 -3.420 1.00 0.00 C ATOM 1097 O SER B 20 -24.526 -5.794 -2.563 1.00 0.00 O ATOM 1098 CB SER B 20 -25.523 -5.068 -5.016 1.00 0.00 C ATOM 1099 OG SER B 20 -25.893 -4.413 -6.217 1.00 0.00 O ATOM 0 H SER B 20 -23.550 -6.395 -6.146 1.00 0.00 H new ATOM 0 HA SER B 20 -23.787 -3.850 -4.662 1.00 0.00 H new ATOM 0 HB2 SER B 20 -25.774 -6.127 -5.083 1.00 0.00 H new ATOM 0 HB3 SER B 20 -26.094 -4.657 -4.183 1.00 0.00 H new ATOM 0 HG SER B 20 -26.854 -4.530 -6.371 1.00 0.00 H new ATOM 1105 N ASP B 21 -22.391 -5.926 -3.260 1.00 0.00 N ATOM 1106 CA ASP B 21 -21.920 -6.577 -2.043 1.00 0.00 C ATOM 1107 C ASP B 21 -21.640 -5.539 -0.952 1.00 0.00 C ATOM 1108 O ASP B 21 -22.502 -4.720 -0.634 1.00 0.00 O ATOM 1109 CB ASP B 21 -20.668 -7.410 -2.341 1.00 0.00 C ATOM 1110 CG ASP B 21 -20.277 -8.317 -1.188 1.00 0.00 C ATOM 1111 OD1 ASP B 21 -20.990 -8.317 -0.162 1.00 0.00 O ATOM 1112 OD2 ASP B 21 -19.259 -9.030 -1.314 1.00 0.00 O ATOM 0 H ASP B 21 -21.666 -5.761 -3.958 1.00 0.00 H new ATOM 0 HA ASP B 21 -22.699 -7.246 -1.678 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -20.843 -8.015 -3.230 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -19.838 -6.741 -2.569 1.00 0.00 H new ATOM 1117 N THR B 22 -20.435 -5.574 -0.383 1.00 0.00 N ATOM 1118 CA THR B 22 -20.053 -4.636 0.664 1.00 0.00 C ATOM 1119 C THR B 22 -18.558 -4.725 0.953 1.00 0.00 C ATOM 1120 O THR B 22 -17.982 -5.813 0.958 1.00 0.00 O ATOM 1121 CB THR B 22 -20.840 -4.888 1.965 1.00 0.00 C ATOM 1122 OG1 THR B 22 -20.385 -4.000 2.991 1.00 0.00 O ATOM 1123 CG2 THR B 22 -20.682 -6.328 2.428 1.00 0.00 C ATOM 0 H THR B 22 -19.708 -6.244 -0.632 1.00 0.00 H new ATOM 0 HA THR B 22 -20.292 -3.637 0.301 1.00 0.00 H new ATOM 0 HB THR B 22 -21.895 -4.704 1.764 1.00 0.00 H new ATOM 0 HG1 THR B 22 -19.743 -4.466 3.566 1.00 0.00 H new ATOM 0 HG21 THR B 22 -21.247 -6.479 3.348 1.00 0.00 H new ATOM 0 HG22 THR B 22 -21.057 -7.001 1.657 1.00 0.00 H new ATOM 0 HG23 THR B 22 -19.628 -6.538 2.611 1.00 0.00 H new ATOM 1131 N ILE B 23 -17.935 -3.573 1.182 1.00 0.00 N ATOM 1132 CA ILE B 23 -16.503 -3.518 1.460 1.00 0.00 C ATOM 1133 C ILE B 23 -16.141 -4.388 2.663 1.00 0.00 C ATOM 1134 O ILE B 23 -15.120 -5.080 2.656 1.00 0.00 O ATOM 1135 CB ILE B 23 -16.035 -2.073 1.728 1.00 0.00 C ATOM 1136 CG1 ILE B 23 -16.510 -1.131 0.615 1.00 0.00 C ATOM 1137 CG2 ILE B 23 -14.519 -2.027 1.852 1.00 0.00 C ATOM 1138 CD1 ILE B 23 -15.992 -1.491 -0.762 1.00 0.00 C ATOM 0 H ILE B 23 -18.399 -2.665 1.181 1.00 0.00 H new ATOM 0 HA ILE B 23 -15.996 -3.898 0.573 1.00 0.00 H new ATOM 0 HB ILE B 23 -16.475 -1.737 2.667 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -17.600 -1.132 0.593 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -16.197 -0.115 0.855 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -14.200 -1.002 2.041 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -14.202 -2.664 2.678 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -14.067 -2.382 0.926 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -16.373 -0.777 -1.492 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -14.902 -1.461 -0.760 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -16.327 -2.494 -1.026 1.00 0.00 H new ATOM 1150 N ASP B 24 -16.984 -4.348 3.694 1.00 0.00 N ATOM 1151 CA ASP B 24 -16.752 -5.133 4.903 1.00 0.00 C ATOM 1152 C ASP B 24 -16.555 -6.605 4.556 1.00 0.00 C ATOM 1153 O ASP B 24 -15.671 -7.269 5.101 1.00 0.00 O ATOM 1154 CB ASP B 24 -17.924 -4.974 5.875 1.00 0.00 C ATOM 1155 CG ASP B 24 -17.692 -5.695 7.190 1.00 0.00 C ATOM 1156 OD1 ASP B 24 -17.554 -6.937 7.172 1.00 0.00 O ATOM 1157 OD2 ASP B 24 -17.647 -5.018 8.238 1.00 0.00 O ATOM 0 H ASP B 24 -17.832 -3.781 3.715 1.00 0.00 H new ATOM 0 HA ASP B 24 -15.845 -4.764 5.383 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -18.089 -3.914 6.070 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -18.832 -5.357 5.410 1.00 0.00 H new ATOM 1162 N ASN B 25 -17.378 -7.105 3.640 1.00 0.00 N ATOM 1163 CA ASN B 25 -17.289 -8.495 3.211 1.00 0.00 C ATOM 1164 C ASN B 25 -15.898 -8.780 2.656 1.00 0.00 C ATOM 1165 O ASN B 25 -15.297 -9.813 2.951 1.00 0.00 O ATOM 1166 CB ASN B 25 -18.349 -8.792 2.147 1.00 0.00 C ATOM 1167 CG ASN B 25 -18.444 -10.268 1.790 1.00 0.00 C ATOM 1168 OD1 ASN B 25 -19.207 -10.649 0.903 1.00 0.00 O ATOM 1169 ND2 ASN B 25 -17.680 -11.109 2.481 1.00 0.00 N ATOM 0 H ASN B 25 -18.114 -6.568 3.181 1.00 0.00 H new ATOM 0 HA ASN B 25 -17.468 -9.140 4.072 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -19.320 -8.448 2.505 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -18.121 -8.221 1.247 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -17.714 -12.109 2.283 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -17.060 -10.754 3.209 1.00 0.00 H new ATOM 1176 N VAL B 26 -15.392 -7.844 1.857 1.00 0.00 N ATOM 1177 CA VAL B 26 -14.069 -7.976 1.262 1.00 0.00 C ATOM 1178 C VAL B 26 -13.007 -8.126 2.344 1.00 0.00 C ATOM 1179 O VAL B 26 -12.134 -8.988 2.253 1.00 0.00 O ATOM 1180 CB VAL B 26 -13.727 -6.758 0.381 1.00 0.00 C ATOM 1181 CG1 VAL B 26 -12.366 -6.934 -0.278 1.00 0.00 C ATOM 1182 CG2 VAL B 26 -14.809 -6.536 -0.664 1.00 0.00 C ATOM 0 H VAL B 26 -15.881 -6.984 1.607 1.00 0.00 H new ATOM 0 HA VAL B 26 -14.081 -8.869 0.637 1.00 0.00 H new ATOM 0 HB VAL B 26 -13.681 -5.875 1.019 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -12.145 -6.063 -0.895 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -11.600 -7.038 0.491 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -12.377 -7.827 -0.902 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -14.551 -5.672 -1.277 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -14.890 -7.419 -1.297 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -15.763 -6.357 -0.168 1.00 0.00 H new ATOM 1192 N LYS B 27 -13.093 -7.286 3.374 1.00 0.00 N ATOM 1193 CA LYS B 27 -12.139 -7.335 4.479 1.00 0.00 C ATOM 1194 C LYS B 27 -12.159 -8.703 5.153 1.00 0.00 C ATOM 1195 O LYS B 27 -11.112 -9.251 5.498 1.00 0.00 O ATOM 1196 CB LYS B 27 -12.449 -6.251 5.514 1.00 0.00 C ATOM 1197 CG LYS B 27 -12.260 -4.833 5.000 1.00 0.00 C ATOM 1198 CD LYS B 27 -12.443 -3.814 6.115 1.00 0.00 C ATOM 1199 CE LYS B 27 -12.194 -2.398 5.624 1.00 0.00 C ATOM 1200 NZ LYS B 27 -13.144 -2.010 4.547 1.00 0.00 N ATOM 0 H LYS B 27 -13.810 -6.567 3.466 1.00 0.00 H new ATOM 0 HA LYS B 27 -11.146 -7.158 4.066 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -13.478 -6.370 5.852 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -11.809 -6.400 6.384 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -11.264 -4.729 4.569 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -12.975 -4.635 4.202 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -13.454 -3.889 6.515 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -11.759 -4.042 6.933 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -12.287 -1.703 6.458 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -11.172 -2.316 5.254 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -13.442 -1.023 4.685 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -12.678 -2.105 3.622 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -13.978 -2.631 4.579 1.00 0.00 H new ATOM 1214 N SER B 28 -13.359 -9.244 5.345 1.00 0.00 N ATOM 1215 CA SER B 28 -13.522 -10.544 5.988 1.00 0.00 C ATOM 1216 C SER B 28 -12.827 -11.650 5.197 1.00 0.00 C ATOM 1217 O SER B 28 -12.093 -12.461 5.764 1.00 0.00 O ATOM 1218 CB SER B 28 -15.006 -10.872 6.146 1.00 0.00 C ATOM 1219 OG SER B 28 -15.187 -12.131 6.771 1.00 0.00 O ATOM 0 H SER B 28 -14.234 -8.801 5.064 1.00 0.00 H new ATOM 0 HA SER B 28 -13.057 -10.489 6.972 1.00 0.00 H new ATOM 0 HB2 SER B 28 -15.492 -10.096 6.737 1.00 0.00 H new ATOM 0 HB3 SER B 28 -15.487 -10.876 5.168 1.00 0.00 H new ATOM 0 HG SER B 28 -16.145 -12.316 6.862 1.00 0.00 H new ATOM 1225 N LYS B 29 -13.066 -11.682 3.889 1.00 0.00 N ATOM 1226 CA LYS B 29 -12.465 -12.696 3.027 1.00 0.00 C ATOM 1227 C LYS B 29 -10.944 -12.589 3.032 1.00 0.00 C ATOM 1228 O LYS B 29 -10.243 -13.593 3.177 1.00 0.00 O ATOM 1229 CB LYS B 29 -13.005 -12.570 1.602 1.00 0.00 C ATOM 1230 CG LYS B 29 -14.503 -12.803 1.510 1.00 0.00 C ATOM 1231 CD LYS B 29 -14.998 -12.737 0.076 1.00 0.00 C ATOM 1232 CE LYS B 29 -16.487 -13.029 -0.009 1.00 0.00 C ATOM 1233 NZ LYS B 29 -16.983 -12.993 -1.412 1.00 0.00 N ATOM 0 H LYS B 29 -13.670 -11.019 3.403 1.00 0.00 H new ATOM 0 HA LYS B 29 -12.735 -13.677 3.419 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -12.774 -11.576 1.219 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -12.492 -13.286 0.961 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -14.746 -13.778 1.934 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -15.024 -12.056 2.109 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -14.795 -11.748 -0.336 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -14.449 -13.455 -0.534 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -16.689 -14.009 0.422 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -17.034 -12.299 0.588 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -17.874 -12.458 -1.452 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -16.275 -12.532 -2.019 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -17.146 -13.964 -1.747 1.00 0.00 H new ATOM 1247 N ILE B 30 -10.437 -11.368 2.889 1.00 0.00 N ATOM 1248 CA ILE B 30 -8.998 -11.140 2.897 1.00 0.00 C ATOM 1249 C ILE B 30 -8.400 -11.660 4.199 1.00 0.00 C ATOM 1250 O ILE B 30 -7.334 -12.278 4.209 1.00 0.00 O ATOM 1251 CB ILE B 30 -8.664 -9.642 2.740 1.00 0.00 C ATOM 1252 CG1 ILE B 30 -9.229 -9.111 1.420 1.00 0.00 C ATOM 1253 CG2 ILE B 30 -7.159 -9.424 2.807 1.00 0.00 C ATOM 1254 CD1 ILE B 30 -9.031 -7.622 1.225 1.00 0.00 C ATOM 0 H ILE B 30 -10.999 -10.526 2.767 1.00 0.00 H new ATOM 0 HA ILE B 30 -8.569 -11.676 2.051 1.00 0.00 H new ATOM 0 HB ILE B 30 -9.125 -9.092 3.560 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -8.757 -9.642 0.594 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -10.295 -9.335 1.375 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -6.940 -8.362 2.695 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -6.783 -9.772 3.769 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -6.675 -9.981 2.005 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -9.457 -7.321 0.268 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -9.527 -7.080 2.030 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -7.966 -7.392 1.236 1.00 0.00 H new ATOM 1266 N GLN B 31 -9.114 -11.414 5.293 1.00 0.00 N ATOM 1267 CA GLN B 31 -8.689 -11.860 6.613 1.00 0.00 C ATOM 1268 C GLN B 31 -8.629 -13.381 6.670 1.00 0.00 C ATOM 1269 O GLN B 31 -7.734 -13.956 7.280 1.00 0.00 O ATOM 1270 CB GLN B 31 -9.651 -11.333 7.680 1.00 0.00 C ATOM 1271 CG GLN B 31 -9.390 -11.897 9.067 1.00 0.00 C ATOM 1272 CD GLN B 31 -10.264 -11.274 10.143 1.00 0.00 C ATOM 1273 OE1 GLN B 31 -10.157 -11.623 11.319 1.00 0.00 O ATOM 1274 NE2 GLN B 31 -11.136 -10.349 9.752 1.00 0.00 N ATOM 0 H GLN B 31 -9.997 -10.904 5.289 1.00 0.00 H new ATOM 0 HA GLN B 31 -7.691 -11.466 6.807 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -9.577 -10.246 7.719 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -10.673 -11.572 7.386 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -9.557 -12.974 9.051 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -8.342 -11.741 9.324 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -11.195 -10.087 8.768 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -11.746 -9.902 10.436 1.00 0.00 H new ATOM 1283 N ASP B 32 -9.596 -14.024 6.036 1.00 0.00 N ATOM 1284 CA ASP B 32 -9.662 -15.480 6.013 1.00 0.00 C ATOM 1285 C ASP B 32 -8.443 -16.080 5.314 1.00 0.00 C ATOM 1286 O ASP B 32 -7.872 -17.065 5.783 1.00 0.00 O ATOM 1287 CB ASP B 32 -10.942 -15.940 5.313 1.00 0.00 C ATOM 1288 CG ASP B 32 -11.070 -17.450 5.270 1.00 0.00 C ATOM 1289 OD1 ASP B 32 -11.115 -18.074 6.351 1.00 0.00 O ATOM 1290 OD2 ASP B 32 -11.125 -18.010 4.155 1.00 0.00 O ATOM 0 H ASP B 32 -10.349 -13.561 5.528 1.00 0.00 H new ATOM 0 HA ASP B 32 -9.669 -15.831 7.045 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -11.805 -15.520 5.829 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -10.957 -15.548 4.296 1.00 0.00 H new ATOM 1295 N LYS B 33 -8.059 -15.493 4.182 1.00 0.00 N ATOM 1296 CA LYS B 33 -6.920 -15.985 3.414 1.00 0.00 C ATOM 1297 C LYS B 33 -5.587 -15.742 4.124 1.00 0.00 C ATOM 1298 O LYS B 33 -4.881 -16.689 4.472 1.00 0.00 O ATOM 1299 CB LYS B 33 -6.894 -15.324 2.035 1.00 0.00 C ATOM 1300 CG LYS B 33 -8.048 -15.731 1.133 1.00 0.00 C ATOM 1301 CD LYS B 33 -7.933 -15.082 -0.239 1.00 0.00 C ATOM 1302 CE LYS B 33 -9.007 -15.586 -1.189 1.00 0.00 C ATOM 1303 NZ LYS B 33 -8.900 -14.955 -2.533 1.00 0.00 N ATOM 0 H LYS B 33 -8.520 -14.678 3.778 1.00 0.00 H new ATOM 0 HA LYS B 33 -7.045 -17.063 3.311 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -6.910 -14.242 2.162 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -5.955 -15.574 1.541 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -8.063 -16.815 1.025 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -8.992 -15.444 1.595 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -8.015 -14.000 -0.138 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -6.949 -15.290 -0.659 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -8.925 -16.668 -1.289 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -9.991 -15.378 -0.768 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -9.839 -14.926 -2.979 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -8.534 -13.987 -2.434 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -8.252 -15.511 -3.127 1.00 0.00 H new ATOM 1317 N GLU B 34 -5.235 -14.473 4.315 1.00 0.00 N ATOM 1318 CA GLU B 34 -3.970 -14.113 4.958 1.00 0.00 C ATOM 1319 C GLU B 34 -3.990 -14.378 6.460 1.00 0.00 C ATOM 1320 O GLU B 34 -3.035 -14.922 7.016 1.00 0.00 O ATOM 1321 CB GLU B 34 -3.649 -12.640 4.706 1.00 0.00 C ATOM 1322 CG GLU B 34 -3.504 -12.291 3.235 1.00 0.00 C ATOM 1323 CD GLU B 34 -2.382 -13.056 2.560 1.00 0.00 C ATOM 1324 OE1 GLU B 34 -1.217 -12.897 2.981 1.00 0.00 O ATOM 1325 OE2 GLU B 34 -2.668 -13.816 1.611 1.00 0.00 O ATOM 0 H GLU B 34 -5.806 -13.676 4.035 1.00 0.00 H new ATOM 0 HA GLU B 34 -3.197 -14.743 4.517 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -4.438 -12.026 5.140 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -2.725 -12.385 5.224 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -4.442 -12.502 2.722 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -3.320 -11.221 3.136 1.00 0.00 H new ATOM 1332 N GLY B 35 -5.068 -13.970 7.113 1.00 0.00 N ATOM 1333 CA GLY B 35 -5.181 -14.148 8.549 1.00 0.00 C ATOM 1334 C GLY B 35 -4.713 -12.920 9.302 1.00 0.00 C ATOM 1335 O GLY B 35 -4.213 -13.017 10.423 1.00 0.00 O ATOM 0 H GLY B 35 -5.870 -13.517 6.674 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -6.218 -14.362 8.809 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -4.591 -15.011 8.857 1.00 0.00 H new ATOM 1339 N ILE B 36 -4.881 -11.760 8.674 1.00 0.00 N ATOM 1340 CA ILE B 36 -4.482 -10.490 9.266 1.00 0.00 C ATOM 1341 C ILE B 36 -5.690 -9.753 9.843 1.00 0.00 C ATOM 1342 O ILE B 36 -6.735 -9.667 9.198 1.00 0.00 O ATOM 1343 CB ILE B 36 -3.794 -9.588 8.222 1.00 0.00 C ATOM 1344 CG1 ILE B 36 -2.552 -10.281 7.652 1.00 0.00 C ATOM 1345 CG2 ILE B 36 -3.427 -8.241 8.830 1.00 0.00 C ATOM 1346 CD1 ILE B 36 -1.492 -10.589 8.690 1.00 0.00 C ATOM 0 H ILE B 36 -5.295 -11.675 7.746 1.00 0.00 H new ATOM 0 HA ILE B 36 -3.779 -10.712 10.069 1.00 0.00 H new ATOM 0 HB ILE B 36 -4.495 -9.411 7.406 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -2.855 -11.210 7.170 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -2.117 -9.648 6.879 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -2.943 -7.621 8.075 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -4.330 -7.743 9.184 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -2.745 -8.393 9.667 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -0.645 -11.079 8.210 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -1.159 -9.662 9.156 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -1.909 -11.248 9.451 1.00 0.00 H new ATOM 1358 N PRO B 37 -5.565 -9.202 11.066 1.00 0.00 N ATOM 1359 CA PRO B 37 -6.659 -8.467 11.710 1.00 0.00 C ATOM 1360 C PRO B 37 -7.162 -7.317 10.839 1.00 0.00 C ATOM 1361 O PRO B 37 -6.367 -6.579 10.257 1.00 0.00 O ATOM 1362 CB PRO B 37 -6.025 -7.926 12.995 1.00 0.00 C ATOM 1363 CG PRO B 37 -4.866 -8.822 13.259 1.00 0.00 C ATOM 1364 CD PRO B 37 -4.358 -9.248 11.911 1.00 0.00 C ATOM 0 HA PRO B 37 -7.528 -9.100 11.888 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -5.704 -6.892 12.872 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -6.734 -7.943 13.823 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -4.091 -8.302 13.822 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -5.167 -9.685 13.853 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -3.583 -8.576 11.542 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -3.926 -10.248 11.941 1.00 0.00 H new ATOM 1372 N PRO B 38 -8.493 -7.147 10.736 1.00 0.00 N ATOM 1373 CA PRO B 38 -9.094 -6.079 9.928 1.00 0.00 C ATOM 1374 C PRO B 38 -8.634 -4.693 10.367 1.00 0.00 C ATOM 1375 O PRO B 38 -8.348 -3.831 9.535 1.00 0.00 O ATOM 1376 CB PRO B 38 -10.601 -6.242 10.165 1.00 0.00 C ATOM 1377 CG PRO B 38 -10.715 -7.073 11.398 1.00 0.00 C ATOM 1378 CD PRO B 38 -9.516 -7.975 11.394 1.00 0.00 C ATOM 0 HA PRO B 38 -8.808 -6.158 8.879 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -11.086 -5.275 10.296 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -11.083 -6.728 9.317 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -10.731 -6.448 12.291 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -11.639 -7.651 11.396 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -9.219 -8.259 12.404 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -9.705 -8.898 10.845 1.00 0.00 H new ATOM 1386 N ASP B 39 -8.568 -4.486 11.678 1.00 0.00 N ATOM 1387 CA ASP B 39 -8.146 -3.205 12.233 1.00 0.00 C ATOM 1388 C ASP B 39 -6.729 -2.850 11.791 1.00 0.00 C ATOM 1389 O ASP B 39 -6.452 -1.708 11.423 1.00 0.00 O ATOM 1390 CB ASP B 39 -8.218 -3.244 13.762 1.00 0.00 C ATOM 1391 CG ASP B 39 -9.620 -3.521 14.272 1.00 0.00 C ATOM 1392 OD1 ASP B 39 -10.540 -3.665 13.439 1.00 0.00 O ATOM 1393 OD2 ASP B 39 -9.798 -3.593 15.507 1.00 0.00 O ATOM 0 H ASP B 39 -8.802 -5.191 12.377 1.00 0.00 H new ATOM 0 HA ASP B 39 -8.823 -2.438 11.858 1.00 0.00 H new ATOM 0 HB2 ASP B 39 -7.541 -4.013 14.135 1.00 0.00 H new ATOM 0 HB3 ASP B 39 -7.871 -2.292 14.163 1.00 0.00 H new ATOM 1398 N GLN B 40 -5.833 -3.832 11.838 1.00 0.00 N ATOM 1399 CA GLN B 40 -4.441 -3.619 11.451 1.00 0.00 C ATOM 1400 C GLN B 40 -4.320 -3.276 9.968 1.00 0.00 C ATOM 1401 O GLN B 40 -3.704 -2.274 9.603 1.00 0.00 O ATOM 1402 CB GLN B 40 -3.609 -4.866 11.763 1.00 0.00 C ATOM 1403 CG GLN B 40 -3.640 -5.273 13.228 1.00 0.00 C ATOM 1404 CD GLN B 40 -3.023 -4.230 14.143 1.00 0.00 C ATOM 1405 OE1 GLN B 40 -3.487 -3.092 14.212 1.00 0.00 O ATOM 1406 NE2 GLN B 40 -1.971 -4.618 14.855 1.00 0.00 N ATOM 0 H GLN B 40 -6.046 -4.783 12.140 1.00 0.00 H new ATOM 0 HA GLN B 40 -4.062 -2.775 12.027 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -3.973 -5.696 11.157 1.00 0.00 H new ATOM 0 HB3 GLN B 40 -2.576 -4.685 11.467 1.00 0.00 H new ATOM 0 HG2 GLN B 40 -4.673 -5.449 13.530 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -3.108 -6.216 13.349 1.00 0.00 H new ATOM 0 HE21 GLN B 40 -1.619 -5.571 14.767 1.00 0.00 H new ATOM 0 HE22 GLN B 40 -1.515 -3.963 15.490 1.00 0.00 H new ATOM 1415 N GLN B 41 -4.902 -4.116 9.118 1.00 0.00 N ATOM 1416 CA GLN B 41 -4.851 -3.903 7.675 1.00 0.00 C ATOM 1417 C GLN B 41 -5.675 -2.687 7.264 1.00 0.00 C ATOM 1418 O GLN B 41 -6.801 -2.499 7.726 1.00 0.00 O ATOM 1419 CB GLN B 41 -5.354 -5.145 6.936 1.00 0.00 C ATOM 1420 CG GLN B 41 -6.790 -5.516 7.269 1.00 0.00 C ATOM 1421 CD GLN B 41 -7.289 -6.698 6.460 1.00 0.00 C ATOM 1422 OE1 GLN B 41 -7.342 -6.645 5.232 1.00 0.00 O ATOM 1423 NE2 GLN B 41 -7.659 -7.772 7.147 1.00 0.00 N ATOM 0 H GLN B 41 -5.414 -4.951 9.403 1.00 0.00 H new ATOM 0 HA GLN B 41 -3.812 -3.719 7.403 1.00 0.00 H new ATOM 0 HB2 GLN B 41 -5.272 -4.976 5.862 1.00 0.00 H new ATOM 0 HB3 GLN B 41 -4.706 -5.987 7.177 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -6.864 -5.750 8.331 1.00 0.00 H new ATOM 0 HG3 GLN B 41 -7.435 -4.657 7.086 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -7.598 -7.772 8.165 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -8.004 -8.597 6.657 1.00 0.00 H new ATOM 1432 N ARG B 42 -5.108 -1.867 6.383 1.00 0.00 N ATOM 1433 CA ARG B 42 -5.792 -0.674 5.896 1.00 0.00 C ATOM 1434 C ARG B 42 -6.179 -0.840 4.430 1.00 0.00 C ATOM 1435 O ARG B 42 -5.319 -0.841 3.549 1.00 0.00 O ATOM 1436 CB ARG B 42 -4.899 0.559 6.064 1.00 0.00 C ATOM 1437 CG ARG B 42 -4.486 0.827 7.503 1.00 0.00 C ATOM 1438 CD ARG B 42 -5.690 1.095 8.393 1.00 0.00 C ATOM 1439 NE ARG B 42 -5.297 1.413 9.763 1.00 0.00 N ATOM 1440 CZ ARG B 42 -6.164 1.662 10.740 1.00 0.00 C ATOM 1441 NH1 ARG B 42 -7.469 1.612 10.503 1.00 0.00 N ATOM 1442 NH2 ARG B 42 -5.727 1.958 11.956 1.00 0.00 N ATOM 0 H ARG B 42 -4.176 -2.007 5.992 1.00 0.00 H new ATOM 0 HA ARG B 42 -6.699 -0.536 6.484 1.00 0.00 H new ATOM 0 HB2 ARG B 42 -4.003 0.432 5.456 1.00 0.00 H new ATOM 0 HB3 ARG B 42 -5.425 1.432 5.678 1.00 0.00 H new ATOM 0 HG2 ARG B 42 -3.932 -0.029 7.888 1.00 0.00 H new ATOM 0 HG3 ARG B 42 -3.812 1.683 7.535 1.00 0.00 H new ATOM 0 HD2 ARG B 42 -6.269 1.921 7.981 1.00 0.00 H new ATOM 0 HD3 ARG B 42 -6.341 0.220 8.396 1.00 0.00 H new ATOM 0 HE ARG B 42 -4.302 1.446 9.983 1.00 0.00 H new ATOM 0 HH11 ARG B 42 -7.809 1.382 9.569 1.00 0.00 H new ATOM 0 HH12 ARG B 42 -8.132 1.803 11.255 1.00 0.00 H new ATOM 0 HH21 ARG B 42 -4.725 1.995 12.143 1.00 0.00 H new ATOM 0 HH22 ARG B 42 -6.393 2.149 12.705 1.00 0.00 H new ATOM 1456 N LEU B 43 -7.476 -0.979 4.174 1.00 0.00 N ATOM 1457 CA LEU B 43 -7.972 -1.147 2.812 1.00 0.00 C ATOM 1458 C LEU B 43 -8.093 0.201 2.108 1.00 0.00 C ATOM 1459 O LEU B 43 -9.170 0.792 2.055 1.00 0.00 O ATOM 1460 CB LEU B 43 -9.328 -1.864 2.818 1.00 0.00 C ATOM 1461 CG LEU B 43 -9.305 -3.321 3.298 1.00 0.00 C ATOM 1462 CD1 LEU B 43 -8.332 -4.148 2.469 1.00 0.00 C ATOM 1463 CD2 LEU B 43 -8.948 -3.395 4.773 1.00 0.00 C ATOM 0 H LEU B 43 -8.202 -0.979 4.891 1.00 0.00 H new ATOM 0 HA LEU B 43 -7.255 -1.758 2.264 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -10.013 -1.302 3.453 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -9.736 -1.839 1.808 1.00 0.00 H new ATOM 0 HG LEU B 43 -10.304 -3.737 3.166 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -8.332 -5.177 2.827 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -8.637 -4.128 1.423 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -7.329 -3.732 2.563 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -8.937 -4.437 5.093 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -7.963 -2.957 4.931 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -9.688 -2.845 5.354 1.00 0.00 H new ATOM 1475 N ILE B 44 -6.975 0.682 1.571 1.00 0.00 N ATOM 1476 CA ILE B 44 -6.945 1.962 0.872 1.00 0.00 C ATOM 1477 C ILE B 44 -7.371 1.818 -0.585 1.00 0.00 C ATOM 1478 O ILE B 44 -7.057 0.825 -1.245 1.00 0.00 O ATOM 1479 CB ILE B 44 -5.542 2.597 0.920 1.00 0.00 C ATOM 1480 CG1 ILE B 44 -5.112 2.822 2.368 1.00 0.00 C ATOM 1481 CG2 ILE B 44 -5.528 3.912 0.150 1.00 0.00 C ATOM 1482 CD1 ILE B 44 -3.641 3.130 2.517 1.00 0.00 C ATOM 0 H ILE B 44 -6.076 0.202 1.607 1.00 0.00 H new ATOM 0 HA ILE B 44 -7.653 2.611 1.388 1.00 0.00 H new ATOM 0 HB ILE B 44 -4.834 1.914 0.450 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -5.692 3.644 2.788 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -5.350 1.933 2.952 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -4.530 4.348 0.193 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -5.799 3.728 -0.890 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -6.245 4.602 0.595 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -3.405 3.278 3.571 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -3.054 2.298 2.127 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -3.401 4.036 1.960 1.00 0.00 H new ATOM 1494 N PHE B 45 -8.074 2.830 -1.078 1.00 0.00 N ATOM 1495 CA PHE B 45 -8.541 2.852 -2.456 1.00 0.00 C ATOM 1496 C PHE B 45 -9.013 4.257 -2.813 1.00 0.00 C ATOM 1497 O PHE B 45 -9.602 4.949 -1.984 1.00 0.00 O ATOM 1498 CB PHE B 45 -9.672 1.843 -2.661 1.00 0.00 C ATOM 1499 CG PHE B 45 -10.073 1.671 -4.100 1.00 0.00 C ATOM 1500 CD1 PHE B 45 -9.117 1.445 -5.080 1.00 0.00 C ATOM 1501 CD2 PHE B 45 -11.406 1.729 -4.472 1.00 0.00 C ATOM 1502 CE1 PHE B 45 -9.484 1.283 -6.402 1.00 0.00 C ATOM 1503 CE2 PHE B 45 -11.779 1.566 -5.793 1.00 0.00 C ATOM 1504 CZ PHE B 45 -10.817 1.343 -6.759 1.00 0.00 C ATOM 0 H PHE B 45 -8.335 3.654 -0.536 1.00 0.00 H new ATOM 0 HA PHE B 45 -7.716 2.573 -3.112 1.00 0.00 H new ATOM 0 HB2 PHE B 45 -9.363 0.877 -2.261 1.00 0.00 H new ATOM 0 HB3 PHE B 45 -10.541 2.163 -2.086 1.00 0.00 H new ATOM 0 HD1 PHE B 45 -8.074 1.395 -4.806 1.00 0.00 H new ATOM 0 HD2 PHE B 45 -12.163 1.904 -3.721 1.00 0.00 H new ATOM 0 HE1 PHE B 45 -8.730 1.110 -7.155 1.00 0.00 H new ATOM 0 HE2 PHE B 45 -12.822 1.613 -6.070 1.00 0.00 H new ATOM 0 HZ PHE B 45 -11.107 1.216 -7.792 1.00 0.00 H new ATOM 1514 N ALA B 46 -8.732 4.685 -4.038 1.00 0.00 N ATOM 1515 CA ALA B 46 -9.115 6.020 -4.478 1.00 0.00 C ATOM 1516 C ALA B 46 -8.521 7.074 -3.548 1.00 0.00 C ATOM 1517 O ALA B 46 -9.120 8.123 -3.307 1.00 0.00 O ATOM 1518 CB ALA B 46 -10.631 6.147 -4.537 1.00 0.00 C ATOM 0 H ALA B 46 -8.243 4.130 -4.740 1.00 0.00 H new ATOM 0 HA ALA B 46 -8.720 6.183 -5.481 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -10.899 7.150 -4.867 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -11.030 5.415 -5.239 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -11.050 5.967 -3.547 1.00 0.00 H new ATOM 1524 N GLY B 47 -7.330 6.777 -3.036 1.00 0.00 N ATOM 1525 CA GLY B 47 -6.641 7.687 -2.140 1.00 0.00 C ATOM 1526 C GLY B 47 -7.281 7.788 -0.765 1.00 0.00 C ATOM 1527 O GLY B 47 -7.149 8.812 -0.095 1.00 0.00 O ATOM 0 H GLY B 47 -6.826 5.912 -3.229 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -5.607 7.360 -2.027 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -6.614 8.678 -2.593 1.00 0.00 H new ATOM 1531 N LYS B 48 -7.960 6.725 -0.332 1.00 0.00 N ATOM 1532 CA LYS B 48 -8.597 6.717 0.985 1.00 0.00 C ATOM 1533 C LYS B 48 -9.169 5.344 1.328 1.00 0.00 C ATOM 1534 O LYS B 48 -9.761 4.676 0.481 1.00 0.00 O ATOM 1535 CB LYS B 48 -9.700 7.774 1.060 1.00 0.00 C ATOM 1536 CG LYS B 48 -10.413 7.806 2.403 1.00 0.00 C ATOM 1537 CD LYS B 48 -11.340 9.007 2.536 1.00 0.00 C ATOM 1538 CE LYS B 48 -12.505 8.950 1.555 1.00 0.00 C ATOM 1539 NZ LYS B 48 -12.067 9.139 0.144 1.00 0.00 N ATOM 0 H LYS B 48 -8.082 5.866 -0.868 1.00 0.00 H new ATOM 0 HA LYS B 48 -7.825 6.954 1.717 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -9.268 8.755 0.863 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -10.430 7.584 0.273 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -10.989 6.889 2.528 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -9.674 7.830 3.204 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -11.727 9.053 3.554 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -10.772 9.922 2.369 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -13.010 7.989 1.650 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -13.232 9.720 1.813 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -12.738 9.763 -0.347 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -11.120 9.568 0.129 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -12.037 8.217 -0.337 1.00 0.00 H new ATOM 1553 N GLN B 49 -8.993 4.933 2.581 1.00 0.00 N ATOM 1554 CA GLN B 49 -9.498 3.644 3.042 1.00 0.00 C ATOM 1555 C GLN B 49 -11.013 3.563 2.871 1.00 0.00 C ATOM 1556 O GLN B 49 -11.742 4.462 3.290 1.00 0.00 O ATOM 1557 CB GLN B 49 -9.125 3.427 4.511 1.00 0.00 C ATOM 1558 CG GLN B 49 -9.604 2.099 5.074 1.00 0.00 C ATOM 1559 CD GLN B 49 -9.244 1.923 6.536 1.00 0.00 C ATOM 1560 OE1 GLN B 49 -9.651 2.715 7.386 1.00 0.00 O ATOM 1561 NE2 GLN B 49 -8.476 0.882 6.837 1.00 0.00 N ATOM 0 H GLN B 49 -8.505 5.474 3.295 1.00 0.00 H new ATOM 0 HA GLN B 49 -9.040 2.861 2.438 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -8.041 3.485 4.614 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -9.546 4.237 5.107 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -10.686 2.028 4.959 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -9.168 1.285 4.495 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -8.161 0.251 6.100 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -8.201 0.714 7.805 1.00 0.00 H new ATOM 1570 N LEU B 50 -11.478 2.483 2.250 1.00 0.00 N ATOM 1571 CA LEU B 50 -12.906 2.288 2.021 1.00 0.00 C ATOM 1572 C LEU B 50 -13.631 1.982 3.328 1.00 0.00 C ATOM 1573 O LEU B 50 -13.173 1.165 4.128 1.00 0.00 O ATOM 1574 CB LEU B 50 -13.133 1.157 1.015 1.00 0.00 C ATOM 1575 CG LEU B 50 -12.397 1.316 -0.319 1.00 0.00 C ATOM 1576 CD1 LEU B 50 -12.733 0.166 -1.257 1.00 0.00 C ATOM 1577 CD2 LEU B 50 -12.740 2.649 -0.968 1.00 0.00 C ATOM 0 H LEU B 50 -10.887 1.730 1.897 1.00 0.00 H new ATOM 0 HA LEU B 50 -13.313 3.213 1.612 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -12.824 0.217 1.473 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -14.202 1.078 0.815 1.00 0.00 H new ATOM 0 HG LEU B 50 -11.325 1.297 -0.120 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -12.200 0.297 -2.199 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -12.433 -0.777 -0.799 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -13.806 0.152 -1.446 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -12.206 2.741 -1.914 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -13.813 2.699 -1.150 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -12.446 3.463 -0.305 1.00 0.00 H new ATOM 1589 N GLU B 51 -14.763 2.647 3.537 1.00 0.00 N ATOM 1590 CA GLU B 51 -15.555 2.454 4.746 1.00 0.00 C ATOM 1591 C GLU B 51 -16.154 1.054 4.798 1.00 0.00 C ATOM 1592 O GLU B 51 -16.694 0.562 3.807 1.00 0.00 O ATOM 1593 CB GLU B 51 -16.673 3.493 4.819 1.00 0.00 C ATOM 1594 CG GLU B 51 -16.170 4.927 4.824 1.00 0.00 C ATOM 1595 CD GLU B 51 -17.294 5.941 4.900 1.00 0.00 C ATOM 1596 OE1 GLU B 51 -18.059 5.905 5.886 1.00 0.00 O ATOM 1597 OE2 GLU B 51 -17.409 6.771 3.973 1.00 0.00 O ATOM 0 H GLU B 51 -15.153 3.326 2.883 1.00 0.00 H new ATOM 0 HA GLU B 51 -14.890 2.576 5.601 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -17.343 3.354 3.970 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -17.261 3.320 5.720 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -15.500 5.070 5.672 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -15.585 5.106 3.922 1.00 0.00 H new ATOM 1604 N ASP B 52 -16.063 0.423 5.963 1.00 0.00 N ATOM 1605 CA ASP B 52 -16.604 -0.916 6.151 1.00 0.00 C ATOM 1606 C ASP B 52 -18.127 -0.905 6.057 1.00 0.00 C ATOM 1607 O ASP B 52 -18.786 -0.006 6.580 1.00 0.00 O ATOM 1608 CB ASP B 52 -16.163 -1.491 7.501 1.00 0.00 C ATOM 1609 CG ASP B 52 -16.534 -0.600 8.673 1.00 0.00 C ATOM 1610 OD1 ASP B 52 -17.084 0.496 8.440 1.00 0.00 O ATOM 1611 OD2 ASP B 52 -16.267 -0.999 9.826 1.00 0.00 O ATOM 0 H ASP B 52 -15.619 0.818 6.792 1.00 0.00 H new ATOM 0 HA ASP B 52 -16.214 -1.551 5.356 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -16.618 -2.472 7.639 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -15.083 -1.639 7.492 1.00 0.00 H new ATOM 1616 N GLY B 53 -18.680 -1.911 5.389 1.00 0.00 N ATOM 1617 CA GLY B 53 -20.121 -2.004 5.239 1.00 0.00 C ATOM 1618 C GLY B 53 -20.679 -1.002 4.245 1.00 0.00 C ATOM 1619 O GLY B 53 -21.693 -0.357 4.511 1.00 0.00 O ATOM 0 H GLY B 53 -18.155 -2.666 4.947 1.00 0.00 H new ATOM 0 HA2 GLY B 53 -20.383 -3.012 4.917 1.00 0.00 H new ATOM 0 HA3 GLY B 53 -20.593 -1.847 6.209 1.00 0.00 H new ATOM 1623 N ARG B 54 -20.022 -0.876 3.095 1.00 0.00 N ATOM 1624 CA ARG B 54 -20.467 0.050 2.058 1.00 0.00 C ATOM 1625 C ARG B 54 -20.519 -0.639 0.695 1.00 0.00 C ATOM 1626 O ARG B 54 -19.566 -1.302 0.287 1.00 0.00 O ATOM 1627 CB ARG B 54 -19.539 1.265 1.996 1.00 0.00 C ATOM 1628 CG ARG B 54 -19.518 2.082 3.279 1.00 0.00 C ATOM 1629 CD ARG B 54 -20.890 2.656 3.602 1.00 0.00 C ATOM 1630 NE ARG B 54 -21.369 3.563 2.560 1.00 0.00 N ATOM 1631 CZ ARG B 54 -20.782 4.718 2.253 1.00 0.00 C ATOM 1632 NH1 ARG B 54 -19.695 5.110 2.904 1.00 0.00 N ATOM 1633 NH2 ARG B 54 -21.284 5.483 1.293 1.00 0.00 N ATOM 0 H ARG B 54 -19.181 -1.403 2.858 1.00 0.00 H new ATOM 0 HA ARG B 54 -21.473 0.384 2.313 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -18.527 0.927 1.774 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -19.849 1.907 1.172 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -19.182 1.455 4.105 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -18.797 2.894 3.182 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -21.603 1.841 3.727 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -20.845 3.189 4.552 1.00 0.00 H new ATOM 0 HE ARG B 54 -22.203 3.295 2.037 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -19.305 4.526 3.644 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -19.249 5.996 2.665 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -22.120 5.187 0.790 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -20.834 6.368 1.058 1.00 0.00 H new ATOM 1647 N THR B 55 -21.641 -0.479 -0.001 1.00 0.00 N ATOM 1648 CA THR B 55 -21.824 -1.088 -1.315 1.00 0.00 C ATOM 1649 C THR B 55 -20.900 -0.463 -2.359 1.00 0.00 C ATOM 1650 O THR B 55 -20.629 0.738 -2.327 1.00 0.00 O ATOM 1651 CB THR B 55 -23.282 -0.965 -1.795 1.00 0.00 C ATOM 1652 OG1 THR B 55 -23.650 0.413 -1.903 1.00 0.00 O ATOM 1653 CG2 THR B 55 -24.227 -1.673 -0.836 1.00 0.00 C ATOM 0 H THR B 55 -22.438 0.068 0.324 1.00 0.00 H new ATOM 0 HA THR B 55 -21.572 -2.143 -1.205 1.00 0.00 H new ATOM 0 HB THR B 55 -23.359 -1.437 -2.774 1.00 0.00 H new ATOM 0 HG1 THR B 55 -23.698 0.666 -2.849 1.00 0.00 H new ATOM 0 HG21 THR B 55 -25.251 -1.573 -1.195 1.00 0.00 H new ATOM 0 HG22 THR B 55 -23.964 -2.729 -0.779 1.00 0.00 H new ATOM 0 HG23 THR B 55 -24.144 -1.225 0.154 1.00 0.00 H new ATOM 1661 N LEU B 56 -20.422 -1.294 -3.282 1.00 0.00 N ATOM 1662 CA LEU B 56 -19.527 -0.846 -4.347 1.00 0.00 C ATOM 1663 C LEU B 56 -20.135 0.309 -5.138 1.00 0.00 C ATOM 1664 O LEU B 56 -19.418 1.173 -5.640 1.00 0.00 O ATOM 1665 CB LEU B 56 -19.216 -2.007 -5.297 1.00 0.00 C ATOM 1666 CG LEU B 56 -18.473 -3.191 -4.672 1.00 0.00 C ATOM 1667 CD1 LEU B 56 -18.418 -4.357 -5.646 1.00 0.00 C ATOM 1668 CD2 LEU B 56 -17.067 -2.782 -4.262 1.00 0.00 C ATOM 0 H LEU B 56 -20.642 -2.290 -3.314 1.00 0.00 H new ATOM 0 HA LEU B 56 -18.607 -0.495 -3.880 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -20.154 -2.370 -5.717 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -18.621 -1.625 -6.127 1.00 0.00 H new ATOM 0 HG LEU B 56 -19.017 -3.506 -3.781 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -17.887 -5.190 -5.186 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -19.432 -4.668 -5.899 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -17.896 -4.050 -6.552 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -16.554 -3.636 -3.820 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -16.516 -2.442 -5.139 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -17.121 -1.974 -3.533 1.00 0.00 H new ATOM 1680 N SER B 57 -21.459 0.303 -5.263 1.00 0.00 N ATOM 1681 CA SER B 57 -22.172 1.335 -6.013 1.00 0.00 C ATOM 1682 C SER B 57 -21.790 2.746 -5.562 1.00 0.00 C ATOM 1683 O SER B 57 -21.589 3.632 -6.393 1.00 0.00 O ATOM 1684 CB SER B 57 -23.683 1.139 -5.875 1.00 0.00 C ATOM 1685 OG SER B 57 -24.085 1.197 -4.517 1.00 0.00 O ATOM 0 H SER B 57 -22.063 -0.409 -4.853 1.00 0.00 H new ATOM 0 HA SER B 57 -21.881 1.232 -7.058 1.00 0.00 H new ATOM 0 HB2 SER B 57 -24.206 1.907 -6.445 1.00 0.00 H new ATOM 0 HB3 SER B 57 -23.968 0.177 -6.301 1.00 0.00 H new ATOM 0 HG SER B 57 -25.055 1.070 -4.457 1.00 0.00 H new ATOM 1691 N ASP B 58 -21.703 2.955 -4.251 1.00 0.00 N ATOM 1692 CA ASP B 58 -21.358 4.270 -3.712 1.00 0.00 C ATOM 1693 C ASP B 58 -19.997 4.743 -4.216 1.00 0.00 C ATOM 1694 O ASP B 58 -19.878 5.840 -4.762 1.00 0.00 O ATOM 1695 CB ASP B 58 -21.367 4.241 -2.183 1.00 0.00 C ATOM 1696 CG ASP B 58 -22.756 4.009 -1.621 1.00 0.00 C ATOM 1697 OD1 ASP B 58 -23.364 2.971 -1.952 1.00 0.00 O ATOM 1698 OD2 ASP B 58 -23.236 4.867 -0.851 1.00 0.00 O ATOM 0 H ASP B 58 -21.865 2.237 -3.545 1.00 0.00 H new ATOM 0 HA ASP B 58 -22.112 4.976 -4.061 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -20.699 3.454 -1.833 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -20.976 5.184 -1.801 1.00 0.00 H new ATOM 1703 N TYR B 59 -18.973 3.916 -4.031 1.00 0.00 N ATOM 1704 CA TYR B 59 -17.626 4.264 -4.472 1.00 0.00 C ATOM 1705 C TYR B 59 -17.472 4.081 -5.978 1.00 0.00 C ATOM 1706 O TYR B 59 -16.463 4.482 -6.560 1.00 0.00 O ATOM 1707 CB TYR B 59 -16.583 3.424 -3.734 1.00 0.00 C ATOM 1708 CG TYR B 59 -16.537 3.689 -2.247 1.00 0.00 C ATOM 1709 CD1 TYR B 59 -17.497 3.159 -1.393 1.00 0.00 C ATOM 1710 CD2 TYR B 59 -15.539 4.484 -1.698 1.00 0.00 C ATOM 1711 CE1 TYR B 59 -17.461 3.412 -0.036 1.00 0.00 C ATOM 1712 CE2 TYR B 59 -15.495 4.739 -0.342 1.00 0.00 C ATOM 1713 CZ TYR B 59 -16.458 4.201 0.485 1.00 0.00 C ATOM 1714 OH TYR B 59 -16.419 4.457 1.836 1.00 0.00 O ATOM 0 H TYR B 59 -19.049 3.004 -3.581 1.00 0.00 H new ATOM 0 HA TYR B 59 -17.464 5.316 -4.237 1.00 0.00 H new ATOM 0 HB2 TYR B 59 -16.795 2.368 -3.900 1.00 0.00 H new ATOM 0 HB3 TYR B 59 -15.600 3.623 -4.161 1.00 0.00 H new ATOM 0 HD1 TYR B 59 -18.284 2.539 -1.797 1.00 0.00 H new ATOM 0 HD2 TYR B 59 -14.785 4.910 -2.343 1.00 0.00 H new ATOM 0 HE1 TYR B 59 -18.215 2.994 0.614 1.00 0.00 H new ATOM 0 HE2 TYR B 59 -14.710 5.357 0.069 1.00 0.00 H new ATOM 0 HH TYR B 59 -16.864 5.311 2.020 1.00 0.00 H new ATOM 1724 N ASN B 60 -18.475 3.468 -6.601 1.00 0.00 N ATOM 1725 CA ASN B 60 -18.452 3.222 -8.039 1.00 0.00 C ATOM 1726 C ASN B 60 -17.238 2.382 -8.425 1.00 0.00 C ATOM 1727 O ASN B 60 -16.614 2.612 -9.462 1.00 0.00 O ATOM 1728 CB ASN B 60 -18.439 4.543 -8.812 1.00 0.00 C ATOM 1729 CG ASN B 60 -19.659 5.396 -8.527 1.00 0.00 C ATOM 1730 OD1 ASN B 60 -19.921 5.764 -7.383 1.00 0.00 O ATOM 1731 ND2 ASN B 60 -20.413 5.718 -9.573 1.00 0.00 N ATOM 0 H ASN B 60 -19.315 3.132 -6.131 1.00 0.00 H new ATOM 0 HA ASN B 60 -19.355 2.671 -8.300 1.00 0.00 H new ATOM 0 HB2 ASN B 60 -17.540 5.103 -8.553 1.00 0.00 H new ATOM 0 HB3 ASN B 60 -18.388 4.334 -9.881 1.00 0.00 H new ATOM 0 HD21 ASN B 60 -21.246 6.292 -9.444 1.00 0.00 H new ATOM 0 HD22 ASN B 60 -20.159 5.391 -10.505 1.00 0.00 H new ATOM 1738 N ILE B 61 -16.910 1.406 -7.583 1.00 0.00 N ATOM 1739 CA ILE B 61 -15.773 0.529 -7.834 1.00 0.00 C ATOM 1740 C ILE B 61 -16.036 -0.369 -9.040 1.00 0.00 C ATOM 1741 O ILE B 61 -17.047 -1.071 -9.095 1.00 0.00 O ATOM 1742 CB ILE B 61 -15.459 -0.342 -6.600 1.00 0.00 C ATOM 1743 CG1 ILE B 61 -15.082 0.548 -5.411 1.00 0.00 C ATOM 1744 CG2 ILE B 61 -14.341 -1.328 -6.911 1.00 0.00 C ATOM 1745 CD1 ILE B 61 -14.803 -0.220 -4.137 1.00 0.00 C ATOM 0 H ILE B 61 -17.416 1.203 -6.721 1.00 0.00 H new ATOM 0 HA ILE B 61 -14.912 1.163 -8.043 1.00 0.00 H new ATOM 0 HB ILE B 61 -16.350 -0.913 -6.338 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -14.200 1.133 -5.672 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -15.891 1.255 -5.228 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -14.134 -1.933 -6.029 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -14.646 -1.976 -7.732 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -13.442 -0.781 -7.195 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -14.543 0.478 -3.341 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -15.691 -0.784 -3.850 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -13.974 -0.908 -4.301 1.00 0.00 H new ATOM 1757 N GLN B 62 -15.121 -0.337 -10.004 1.00 0.00 N ATOM 1758 CA GLN B 62 -15.251 -1.143 -11.213 1.00 0.00 C ATOM 1759 C GLN B 62 -14.896 -2.603 -10.939 1.00 0.00 C ATOM 1760 O GLN B 62 -15.000 -3.074 -9.806 1.00 0.00 O ATOM 1761 CB GLN B 62 -14.347 -0.580 -12.314 1.00 0.00 C ATOM 1762 CG GLN B 62 -14.660 0.862 -12.687 1.00 0.00 C ATOM 1763 CD GLN B 62 -16.044 1.031 -13.284 1.00 0.00 C ATOM 1764 OE1 GLN B 62 -17.053 0.753 -12.635 1.00 0.00 O ATOM 1765 NE2 GLN B 62 -16.099 1.490 -14.529 1.00 0.00 N ATOM 0 H GLN B 62 -14.280 0.239 -9.971 1.00 0.00 H new ATOM 0 HA GLN B 62 -16.289 -1.102 -11.543 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -13.309 -0.644 -11.987 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -14.441 -1.204 -13.203 1.00 0.00 H new ATOM 0 HG2 GLN B 62 -14.574 1.488 -11.799 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -13.916 1.217 -13.401 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -15.238 1.708 -15.031 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -17.002 1.625 -14.983 1.00 0.00 H new ATOM 1774 N LYS B 63 -14.470 -3.313 -11.981 1.00 0.00 N ATOM 1775 CA LYS B 63 -14.093 -4.715 -11.850 1.00 0.00 C ATOM 1776 C LYS B 63 -12.576 -4.865 -11.831 1.00 0.00 C ATOM 1777 O LYS B 63 -11.862 -4.128 -12.512 1.00 0.00 O ATOM 1778 CB LYS B 63 -14.692 -5.542 -12.991 1.00 0.00 C ATOM 1779 CG LYS B 63 -14.251 -5.092 -14.374 1.00 0.00 C ATOM 1780 CD LYS B 63 -14.889 -5.940 -15.463 1.00 0.00 C ATOM 1781 CE LYS B 63 -14.473 -5.475 -16.849 1.00 0.00 C ATOM 1782 NZ LYS B 63 -14.904 -4.076 -17.118 1.00 0.00 N ATOM 0 H LYS B 63 -14.378 -2.939 -12.925 1.00 0.00 H new ATOM 0 HA LYS B 63 -14.490 -5.086 -10.905 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -14.414 -6.587 -12.854 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -15.779 -5.491 -12.932 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -14.520 -4.046 -14.521 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -13.166 -5.156 -14.450 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -14.603 -6.983 -15.327 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -15.974 -5.893 -15.373 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -13.390 -5.546 -16.946 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -14.904 -6.138 -17.599 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -14.834 -3.881 -18.137 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -15.889 -3.950 -16.808 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -14.290 -3.417 -16.597 1.00 0.00 H new ATOM 1796 N GLU B 64 -12.092 -5.818 -11.040 1.00 0.00 N ATOM 1797 CA GLU B 64 -10.659 -6.065 -10.919 1.00 0.00 C ATOM 1798 C GLU B 64 -9.939 -4.828 -10.397 1.00 0.00 C ATOM 1799 O GLU B 64 -8.815 -4.531 -10.804 1.00 0.00 O ATOM 1800 CB GLU B 64 -10.065 -6.486 -12.267 1.00 0.00 C ATOM 1801 CG GLU B 64 -10.619 -7.798 -12.795 1.00 0.00 C ATOM 1802 CD GLU B 64 -10.003 -8.195 -14.123 1.00 0.00 C ATOM 1803 OE1 GLU B 64 -8.766 -8.361 -14.178 1.00 0.00 O ATOM 1804 OE2 GLU B 64 -10.757 -8.339 -15.108 1.00 0.00 O ATOM 0 H GLU B 64 -12.673 -6.434 -10.472 1.00 0.00 H new ATOM 0 HA GLU B 64 -10.519 -6.877 -10.206 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -10.255 -5.701 -12.999 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -8.983 -6.573 -12.166 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -10.438 -8.586 -12.064 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -11.700 -7.713 -12.910 1.00 0.00 H new ATOM 1811 N SER B 65 -10.593 -4.114 -9.487 1.00 0.00 N ATOM 1812 CA SER B 65 -10.015 -2.913 -8.901 1.00 0.00 C ATOM 1813 C SER B 65 -8.828 -3.267 -8.014 1.00 0.00 C ATOM 1814 O SER B 65 -8.889 -4.211 -7.225 1.00 0.00 O ATOM 1815 CB SER B 65 -11.067 -2.155 -8.092 1.00 0.00 C ATOM 1816 OG SER B 65 -12.145 -1.748 -8.917 1.00 0.00 O ATOM 0 H SER B 65 -11.523 -4.347 -9.140 1.00 0.00 H new ATOM 0 HA SER B 65 -9.665 -2.272 -9.711 1.00 0.00 H new ATOM 0 HB2 SER B 65 -11.439 -2.789 -7.288 1.00 0.00 H new ATOM 0 HB3 SER B 65 -10.612 -1.282 -7.625 1.00 0.00 H new ATOM 0 HG SER B 65 -12.831 -2.448 -8.928 1.00 0.00 H new ATOM 1822 N THR B 66 -7.746 -2.509 -8.154 1.00 0.00 N ATOM 1823 CA THR B 66 -6.541 -2.745 -7.370 1.00 0.00 C ATOM 1824 C THR B 66 -6.587 -2.001 -6.037 1.00 0.00 C ATOM 1825 O THR B 66 -6.116 -0.867 -5.932 1.00 0.00 O ATOM 1826 CB THR B 66 -5.277 -2.320 -8.143 1.00 0.00 C ATOM 1827 OG1 THR B 66 -5.208 -3.019 -9.392 1.00 0.00 O ATOM 1828 CG2 THR B 66 -4.022 -2.607 -7.330 1.00 0.00 C ATOM 0 H THR B 66 -7.679 -1.726 -8.804 1.00 0.00 H new ATOM 0 HA THR B 66 -6.498 -3.817 -7.177 1.00 0.00 H new ATOM 0 HB THR B 66 -5.336 -1.247 -8.328 1.00 0.00 H new ATOM 0 HG1 THR B 66 -4.403 -2.742 -9.878 1.00 0.00 H new ATOM 0 HG21 THR B 66 -3.143 -2.299 -7.896 1.00 0.00 H new ATOM 0 HG22 THR B 66 -4.062 -2.054 -6.392 1.00 0.00 H new ATOM 0 HG23 THR B 66 -3.961 -3.675 -7.119 1.00 0.00 H new ATOM 1836 N LEU B 67 -7.144 -2.648 -5.018 1.00 0.00 N ATOM 1837 CA LEU B 67 -7.234 -2.050 -3.690 1.00 0.00 C ATOM 1838 C LEU B 67 -5.952 -2.308 -2.906 1.00 0.00 C ATOM 1839 O LEU B 67 -5.492 -3.446 -2.808 1.00 0.00 O ATOM 1840 CB LEU B 67 -8.434 -2.607 -2.916 1.00 0.00 C ATOM 1841 CG LEU B 67 -9.814 -2.159 -3.412 1.00 0.00 C ATOM 1842 CD1 LEU B 67 -10.101 -2.707 -4.800 1.00 0.00 C ATOM 1843 CD2 LEU B 67 -10.894 -2.597 -2.435 1.00 0.00 C ATOM 0 H LEU B 67 -7.540 -3.586 -5.086 1.00 0.00 H new ATOM 0 HA LEU B 67 -7.370 -0.976 -3.814 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -8.392 -3.696 -2.952 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -8.333 -2.318 -1.870 1.00 0.00 H new ATOM 0 HG LEU B 67 -9.815 -1.071 -3.473 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -11.086 -2.373 -5.126 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -9.346 -2.345 -5.497 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -10.077 -3.796 -4.773 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -11.868 -2.272 -2.800 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -10.884 -3.683 -2.345 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -10.705 -2.150 -1.459 1.00 0.00 H new ATOM 1855 N HIS B 68 -5.376 -1.245 -2.354 1.00 0.00 N ATOM 1856 CA HIS B 68 -4.143 -1.360 -1.583 1.00 0.00 C ATOM 1857 C HIS B 68 -4.417 -1.680 -0.120 1.00 0.00 C ATOM 1858 O HIS B 68 -5.391 -1.205 0.462 1.00 0.00 O ATOM 1859 CB HIS B 68 -3.321 -0.077 -1.694 1.00 0.00 C ATOM 1860 CG HIS B 68 -2.705 0.124 -3.044 1.00 0.00 C ATOM 1861 ND1 HIS B 68 -1.895 1.197 -3.350 1.00 0.00 N ATOM 1862 CD2 HIS B 68 -2.772 -0.626 -4.170 1.00 0.00 C ATOM 1863 CE1 HIS B 68 -1.492 1.098 -4.603 1.00 0.00 C ATOM 1864 NE2 HIS B 68 -2.009 0.001 -5.123 1.00 0.00 N ATOM 0 H HIS B 68 -5.742 -0.296 -2.426 1.00 0.00 H new ATOM 0 HA HIS B 68 -3.573 -2.189 -2.004 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -3.960 0.775 -1.465 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -2.532 -0.095 -0.942 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -3.323 -1.546 -4.295 1.00 0.00 H new ATOM 0 HE1 HIS B 68 -0.848 1.797 -5.116 1.00 0.00 H new ATOM 0 HE2 HIS B 68 -1.865 -0.328 -6.078 1.00 0.00 H new ATOM 1873 N LEU B 69 -3.539 -2.487 0.468 1.00 0.00 N ATOM 1874 CA LEU B 69 -3.664 -2.876 1.867 1.00 0.00 C ATOM 1875 C LEU B 69 -2.361 -2.579 2.603 1.00 0.00 C ATOM 1876 O LEU B 69 -1.306 -3.096 2.244 1.00 0.00 O ATOM 1877 CB LEU B 69 -4.012 -4.370 1.965 1.00 0.00 C ATOM 1878 CG LEU B 69 -4.381 -4.886 3.363 1.00 0.00 C ATOM 1879 CD1 LEU B 69 -5.007 -6.268 3.265 1.00 0.00 C ATOM 1880 CD2 LEU B 69 -3.159 -4.934 4.270 1.00 0.00 C ATOM 0 H LEU B 69 -2.729 -2.886 -0.007 1.00 0.00 H new ATOM 0 HA LEU B 69 -4.466 -2.302 2.332 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -4.846 -4.573 1.293 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -3.161 -4.945 1.600 1.00 0.00 H new ATOM 0 HG LEU B 69 -5.103 -4.194 3.797 1.00 0.00 H new ATOM 0 HD11 LEU B 69 -5.264 -6.623 4.263 1.00 0.00 H new ATOM 0 HD12 LEU B 69 -5.909 -6.217 2.655 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -4.298 -6.957 2.807 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -3.450 -5.303 5.253 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -2.412 -5.600 3.839 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -2.739 -3.933 4.368 1.00 0.00 H new ATOM 1892 N VAL B 70 -2.441 -1.743 3.634 1.00 0.00 N ATOM 1893 CA VAL B 70 -1.262 -1.383 4.414 1.00 0.00 C ATOM 1894 C VAL B 70 -1.402 -1.849 5.860 1.00 0.00 C ATOM 1895 O VAL B 70 -2.349 -1.479 6.553 1.00 0.00 O ATOM 1896 CB VAL B 70 -1.018 0.140 4.383 1.00 0.00 C ATOM 1897 CG1 VAL B 70 0.193 0.514 5.225 1.00 0.00 C ATOM 1898 CG2 VAL B 70 -0.845 0.621 2.949 1.00 0.00 C ATOM 0 H VAL B 70 -3.306 -1.304 3.948 1.00 0.00 H new ATOM 0 HA VAL B 70 -0.407 -1.884 3.961 1.00 0.00 H new ATOM 0 HB VAL B 70 -1.890 0.634 4.811 1.00 0.00 H new ATOM 0 HG11 VAL B 70 0.344 1.593 5.187 1.00 0.00 H new ATOM 0 HG12 VAL B 70 0.027 0.207 6.258 1.00 0.00 H new ATOM 0 HG13 VAL B 70 1.077 0.010 4.835 1.00 0.00 H new ATOM 0 HG21 VAL B 70 -0.674 1.697 2.944 1.00 0.00 H new ATOM 0 HG22 VAL B 70 0.008 0.116 2.496 1.00 0.00 H new ATOM 0 HG23 VAL B 70 -1.745 0.395 2.378 1.00 0.00 H new ATOM 1908 N LEU B 71 -0.454 -2.668 6.305 1.00 0.00 N ATOM 1909 CA LEU B 71 -0.471 -3.194 7.665 1.00 0.00 C ATOM 1910 C LEU B 71 -0.090 -2.126 8.682 1.00 0.00 C ATOM 1911 O LEU B 71 0.895 -1.407 8.508 1.00 0.00 O ATOM 1912 CB LEU B 71 0.476 -4.389 7.782 1.00 0.00 C ATOM 1913 CG LEU B 71 0.132 -5.573 6.880 1.00 0.00 C ATOM 1914 CD1 LEU B 71 1.179 -6.668 7.007 1.00 0.00 C ATOM 1915 CD2 LEU B 71 -1.250 -6.114 7.213 1.00 0.00 C ATOM 0 H LEU B 71 0.337 -2.982 5.742 1.00 0.00 H new ATOM 0 HA LEU B 71 -1.489 -3.518 7.883 1.00 0.00 H new ATOM 0 HB2 LEU B 71 1.488 -4.056 7.550 1.00 0.00 H new ATOM 0 HB3 LEU B 71 0.482 -4.729 8.817 1.00 0.00 H new ATOM 0 HG LEU B 71 0.126 -5.225 5.847 1.00 0.00 H new ATOM 0 HD11 LEU B 71 0.915 -7.502 6.356 1.00 0.00 H new ATOM 0 HD12 LEU B 71 2.153 -6.275 6.716 1.00 0.00 H new ATOM 0 HD13 LEU B 71 1.221 -7.013 8.040 1.00 0.00 H new ATOM 0 HD21 LEU B 71 -1.478 -6.957 6.560 1.00 0.00 H new ATOM 0 HD22 LEU B 71 -1.271 -6.443 8.252 1.00 0.00 H new ATOM 0 HD23 LEU B 71 -1.993 -5.330 7.066 1.00 0.00 H new ATOM 1927 N ARG B 72 -0.877 -2.039 9.746 1.00 0.00 N ATOM 1928 CA ARG B 72 -0.633 -1.070 10.808 1.00 0.00 C ATOM 1929 C ARG B 72 0.553 -1.495 11.670 1.00 0.00 C ATOM 1930 O ARG B 72 1.381 -0.670 12.057 1.00 0.00 O ATOM 1931 CB ARG B 72 -1.883 -0.912 11.677 1.00 0.00 C ATOM 1932 CG ARG B 72 -1.703 0.052 12.839 1.00 0.00 C ATOM 1933 CD ARG B 72 -2.976 0.178 13.660 1.00 0.00 C ATOM 1934 NE ARG B 72 -2.806 1.075 14.801 1.00 0.00 N ATOM 1935 CZ ARG B 72 -3.775 1.358 15.666 1.00 0.00 C ATOM 1936 NH1 ARG B 72 -4.978 0.820 15.519 1.00 0.00 N ATOM 1937 NH2 ARG B 72 -3.540 2.180 16.681 1.00 0.00 N ATOM 0 H ARG B 72 -1.694 -2.631 9.898 1.00 0.00 H new ATOM 0 HA ARG B 72 -0.397 -0.111 10.347 1.00 0.00 H new ATOM 0 HB2 ARG B 72 -2.707 -0.565 11.053 1.00 0.00 H new ATOM 0 HB3 ARG B 72 -2.169 -1.889 12.068 1.00 0.00 H new ATOM 0 HG2 ARG B 72 -0.890 -0.294 13.477 1.00 0.00 H new ATOM 0 HG3 ARG B 72 -1.415 1.032 12.459 1.00 0.00 H new ATOM 0 HD2 ARG B 72 -3.781 0.548 13.025 1.00 0.00 H new ATOM 0 HD3 ARG B 72 -3.277 -0.807 14.015 1.00 0.00 H new ATOM 0 HE ARG B 72 -1.893 1.508 14.942 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -5.162 0.187 14.741 1.00 0.00 H new ATOM 0 HH12 ARG B 72 -5.719 1.039 16.184 1.00 0.00 H new ATOM 0 HH21 ARG B 72 -2.616 2.595 16.798 1.00 0.00 H new ATOM 0 HH22 ARG B 72 -4.284 2.397 17.344 1.00 0.00 H new