USER MOD reduce.3.24.130724 H: found=0, std=0, add=803, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 803 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: C 69 SER OG : rot -91:sc= 1.39 USER MOD Set 1.2: C 71 THR OG1 : rot 26:sc= 0.426 USER MOD Set 2.1: C 16 GLN : amide:sc= -0.693 K(o=-2.2,f=-5.5!) USER MOD Set 2.2: C 85 MET CE :methyl 172:sc= -1.46 (180deg=-2.09!) USER MOD Single : C 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 1 MET N :NH3+ -169:sc= -0.0234 (180deg=-0.145) USER MOD Single : C 5 TYR OH : rot 180:sc= 0 USER MOD Single : C 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 11 GLN : amide:sc= -0.162 X(o=-0.16,f=-0.021) USER MOD Single : C 13 THR OG1 : rot 180:sc= -0.0841 USER MOD Single : C 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 18 ASN : amide:sc= -4.3! C(o=-4.3!,f=-5.9!) USER MOD Single : C 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 35 CYS SG : rot 180:sc= 0.0189 USER MOD Single : C 37 SER OG : rot 180:sc= 0 USER MOD Single : C 38 THR OG1 : rot -78:sc= -0.0304 USER MOD Single : C 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 45 MET CE :methyl -128:sc= -7.8! (180deg=-8.39!) USER MOD Single : C 47 MET CE :methyl 163:sc= -7.79! (180deg=-11.1!) USER MOD Single : C 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 51 ASN : amide:sc= -0.0522 X(o=-0.052,f=0) USER MOD Single : C 53 THR OG1 : rot 180:sc= -0.117 USER MOD Single : C 58 GLN : amide:sc= 0 X(o=0,f=-0.093) USER MOD Single : C 60 MET CE :methyl -147:sc= -0.864 (180deg=-2.02!) USER MOD Single : C 80 MET CE :methyl -146:sc= -0.438 (180deg=-1.88!) USER MOD Single : C 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 84 CYS SG : rot -162:sc= 0.0917 USER MOD Single : C 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 89 SER OG : rot 180:sc= 0 USER MOD Single : I 1 ARG N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : I 3 SER OG : rot 180:sc= 0.195 USER MOD Single : I 7 MET CE :methyl -160:sc= -1.99 (180deg=-3.3!) USER MOD Single : I 8 MET CE :methyl -115:sc= -5.07! (180deg=-8.85!) USER MOD Single : I 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : I 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 58.809 -10.960 20.010 1.00 0.00 N ATOM 2 CA MET C 1 59.717 -9.980 19.348 1.00 0.00 C ATOM 3 C MET C 1 60.019 -10.422 17.914 1.00 0.00 C ATOM 4 O MET C 1 60.244 -9.611 17.038 1.00 0.00 O ATOM 5 CB MET C 1 60.992 -9.989 20.192 1.00 0.00 C ATOM 6 CG MET C 1 61.368 -8.554 20.566 1.00 0.00 C ATOM 7 SD MET C 1 62.119 -8.537 22.213 1.00 0.00 S ATOM 8 CE MET C 1 63.480 -7.407 21.830 1.00 0.00 C ATOM 0 H1 MET C 1 58.463 -10.562 20.906 1.00 0.00 H new ATOM 0 H2 MET C 1 58.002 -11.161 19.386 1.00 0.00 H new ATOM 0 H3 MET C 1 59.328 -11.841 20.200 1.00 0.00 H new ATOM 0 HA MET C 1 59.276 -8.985 19.286 1.00 0.00 H new ATOM 0 HB2 MET C 1 60.840 -10.583 21.093 1.00 0.00 H new ATOM 0 HB3 MET C 1 61.805 -10.456 19.636 1.00 0.00 H new ATOM 0 HG2 MET C 1 62.064 -8.146 19.833 1.00 0.00 H new ATOM 0 HG3 MET C 1 60.482 -7.919 20.552 1.00 0.00 H new ATOM 0 HE1 MET C 1 64.086 -7.251 22.723 1.00 0.00 H new ATOM 0 HE2 MET C 1 64.099 -7.837 21.042 1.00 0.00 H new ATOM 0 HE3 MET C 1 63.076 -6.452 21.494 1.00 0.00 H new ATOM 20 N ASP C 2 60.025 -11.703 17.666 1.00 0.00 N ATOM 21 CA ASP C 2 60.312 -12.194 16.286 1.00 0.00 C ATOM 22 C ASP C 2 59.179 -13.103 15.802 1.00 0.00 C ATOM 23 O ASP C 2 58.299 -13.470 16.556 1.00 0.00 O ATOM 24 CB ASP C 2 61.616 -12.982 16.408 1.00 0.00 C ATOM 25 CG ASP C 2 62.758 -12.031 16.770 1.00 0.00 C ATOM 26 OD1 ASP C 2 62.469 -10.924 17.197 1.00 0.00 O ATOM 27 OD2 ASP C 2 63.902 -12.424 16.614 1.00 0.00 O ATOM 0 H ASP C 2 59.844 -12.431 18.357 1.00 0.00 H new ATOM 0 HA ASP C 2 60.395 -11.379 15.567 1.00 0.00 H new ATOM 0 HB2 ASP C 2 61.516 -13.754 17.171 1.00 0.00 H new ATOM 0 HB3 ASP C 2 61.836 -13.489 15.468 1.00 0.00 H new ATOM 32 N ASP C 3 59.194 -13.469 14.550 1.00 0.00 N ATOM 33 CA ASP C 3 58.120 -14.355 14.018 1.00 0.00 C ATOM 34 C ASP C 3 56.768 -13.638 14.066 1.00 0.00 C ATOM 35 O ASP C 3 55.740 -14.246 14.294 1.00 0.00 O ATOM 36 CB ASP C 3 58.117 -15.569 14.945 1.00 0.00 C ATOM 37 CG ASP C 3 58.083 -16.850 14.109 1.00 0.00 C ATOM 38 OD1 ASP C 3 57.063 -17.103 13.490 1.00 0.00 O ATOM 39 OD2 ASP C 3 59.078 -17.556 14.103 1.00 0.00 O ATOM 0 H ASP C 3 59.904 -13.193 13.872 1.00 0.00 H new ATOM 0 HA ASP C 3 58.292 -14.635 12.979 1.00 0.00 H new ATOM 0 HB2 ASP C 3 59.004 -15.559 15.578 1.00 0.00 H new ATOM 0 HB3 ASP C 3 57.252 -15.532 15.608 1.00 0.00 H new ATOM 44 N ILE C 4 56.759 -12.351 13.851 1.00 0.00 N ATOM 45 CA ILE C 4 55.472 -11.600 13.884 1.00 0.00 C ATOM 46 C ILE C 4 55.199 -10.961 12.520 1.00 0.00 C ATOM 47 O ILE C 4 54.117 -11.071 11.979 1.00 0.00 O ATOM 48 CB ILE C 4 55.669 -10.525 14.952 1.00 0.00 C ATOM 49 CG1 ILE C 4 55.628 -11.172 16.338 1.00 0.00 C ATOM 50 CG2 ILE C 4 54.552 -9.486 14.842 1.00 0.00 C ATOM 51 CD1 ILE C 4 55.749 -10.090 17.411 1.00 0.00 C ATOM 0 H ILE C 4 57.586 -11.788 13.654 1.00 0.00 H new ATOM 0 HA ILE C 4 54.622 -12.244 14.108 1.00 0.00 H new ATOM 0 HB ILE C 4 56.633 -10.039 14.805 1.00 0.00 H new ATOM 0 HG12 ILE C 4 54.696 -11.723 16.466 1.00 0.00 H new ATOM 0 HG13 ILE C 4 56.441 -11.892 16.439 1.00 0.00 H new ATOM 0 HG21 ILE C 4 54.692 -8.719 15.604 1.00 0.00 H new ATOM 0 HG22 ILE C 4 54.579 -9.026 13.854 1.00 0.00 H new ATOM 0 HG23 ILE C 4 53.587 -9.972 14.989 1.00 0.00 H new ATOM 0 HD11 ILE C 4 55.720 -10.552 18.398 1.00 0.00 H new ATOM 0 HD12 ILE C 4 56.692 -9.558 17.287 1.00 0.00 H new ATOM 0 HD13 ILE C 4 54.921 -9.387 17.314 1.00 0.00 H new ATOM 63 N TYR C 5 56.170 -10.294 11.961 1.00 0.00 N ATOM 64 CA TYR C 5 55.962 -9.650 10.633 1.00 0.00 C ATOM 65 C TYR C 5 56.144 -10.678 9.512 1.00 0.00 C ATOM 66 O TYR C 5 55.325 -10.790 8.622 1.00 0.00 O ATOM 67 CB TYR C 5 57.037 -8.565 10.543 1.00 0.00 C ATOM 68 CG TYR C 5 56.779 -7.514 11.597 1.00 0.00 C ATOM 69 CD1 TYR C 5 55.745 -6.586 11.423 1.00 0.00 C ATOM 70 CD2 TYR C 5 57.576 -7.466 12.747 1.00 0.00 C ATOM 71 CE1 TYR C 5 55.507 -5.611 12.400 1.00 0.00 C ATOM 72 CE2 TYR C 5 57.338 -6.491 13.723 1.00 0.00 C ATOM 73 CZ TYR C 5 56.304 -5.564 13.550 1.00 0.00 C ATOM 74 OH TYR C 5 56.070 -4.603 14.513 1.00 0.00 O ATOM 0 H TYR C 5 57.098 -10.167 12.365 1.00 0.00 H new ATOM 0 HA TYR C 5 54.958 -9.238 10.528 1.00 0.00 H new ATOM 0 HB2 TYR C 5 58.025 -9.004 10.685 1.00 0.00 H new ATOM 0 HB3 TYR C 5 57.029 -8.111 9.552 1.00 0.00 H new ATOM 0 HD1 TYR C 5 55.131 -6.622 10.535 1.00 0.00 H new ATOM 0 HD2 TYR C 5 58.374 -8.181 12.881 1.00 0.00 H new ATOM 0 HE1 TYR C 5 54.709 -4.896 12.266 1.00 0.00 H new ATOM 0 HE2 TYR C 5 57.953 -6.454 14.610 1.00 0.00 H new ATOM 0 HH TYR C 5 56.711 -4.711 15.246 1.00 0.00 H new ATOM 84 N LYS C 6 57.210 -11.431 9.548 1.00 0.00 N ATOM 85 CA LYS C 6 57.438 -12.449 8.483 1.00 0.00 C ATOM 86 C LYS C 6 56.141 -13.208 8.193 1.00 0.00 C ATOM 87 O LYS C 6 55.936 -13.714 7.109 1.00 0.00 O ATOM 88 CB LYS C 6 58.501 -13.392 9.051 1.00 0.00 C ATOM 89 CG LYS C 6 57.898 -14.236 10.176 1.00 0.00 C ATOM 90 CD LYS C 6 58.810 -15.432 10.462 1.00 0.00 C ATOM 91 CE LYS C 6 57.956 -16.670 10.744 1.00 0.00 C ATOM 92 NZ LYS C 6 58.035 -17.484 9.499 1.00 0.00 N ATOM 0 H LYS C 6 57.932 -11.385 10.267 1.00 0.00 H new ATOM 0 HA LYS C 6 57.759 -11.999 7.543 1.00 0.00 H new ATOM 0 HB2 LYS C 6 58.884 -14.040 8.263 1.00 0.00 H new ATOM 0 HB3 LYS C 6 59.346 -12.817 9.429 1.00 0.00 H new ATOM 0 HG2 LYS C 6 57.780 -13.632 11.075 1.00 0.00 H new ATOM 0 HG3 LYS C 6 56.904 -14.582 9.892 1.00 0.00 H new ATOM 0 HD2 LYS C 6 59.465 -15.615 9.610 1.00 0.00 H new ATOM 0 HD3 LYS C 6 59.451 -15.217 11.317 1.00 0.00 H new ATOM 0 HE2 LYS C 6 58.335 -17.224 11.603 1.00 0.00 H new ATOM 0 HE3 LYS C 6 56.926 -16.396 10.972 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 57.473 -18.351 9.615 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 57.661 -16.933 8.700 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 59.026 -17.736 9.311 1.00 0.00 H new ATOM 106 N ALA C 7 55.267 -13.291 9.158 1.00 0.00 N ATOM 107 CA ALA C 7 53.985 -14.019 8.939 1.00 0.00 C ATOM 108 C ALA C 7 53.065 -13.207 8.021 1.00 0.00 C ATOM 109 O ALA C 7 52.406 -13.746 7.155 1.00 0.00 O ATOM 110 CB ALA C 7 53.366 -14.163 10.329 1.00 0.00 C ATOM 0 H ALA C 7 55.385 -12.887 10.087 1.00 0.00 H new ATOM 0 HA ALA C 7 54.137 -14.986 8.460 1.00 0.00 H new ATOM 0 HB1 ALA C 7 52.416 -14.691 10.251 1.00 0.00 H new ATOM 0 HB2 ALA C 7 54.042 -14.726 10.972 1.00 0.00 H new ATOM 0 HB3 ALA C 7 53.198 -13.175 10.757 1.00 0.00 H new ATOM 116 N ALA C 8 53.017 -11.914 8.201 1.00 0.00 N ATOM 117 CA ALA C 8 52.140 -11.075 7.335 1.00 0.00 C ATOM 118 C ALA C 8 52.609 -11.150 5.879 1.00 0.00 C ATOM 119 O ALA C 8 51.902 -10.765 4.969 1.00 0.00 O ATOM 120 CB ALA C 8 52.291 -9.652 7.873 1.00 0.00 C ATOM 0 H ALA C 8 53.546 -11.404 8.908 1.00 0.00 H new ATOM 0 HA ALA C 8 51.102 -11.408 7.354 1.00 0.00 H new ATOM 0 HB1 ALA C 8 51.673 -8.973 7.285 1.00 0.00 H new ATOM 0 HB2 ALA C 8 51.973 -9.621 8.915 1.00 0.00 H new ATOM 0 HB3 ALA C 8 53.335 -9.345 7.803 1.00 0.00 H new ATOM 126 N VAL C 9 53.797 -11.643 5.652 1.00 0.00 N ATOM 127 CA VAL C 9 54.308 -11.740 4.254 1.00 0.00 C ATOM 128 C VAL C 9 53.700 -12.957 3.554 1.00 0.00 C ATOM 129 O VAL C 9 53.143 -12.854 2.480 1.00 0.00 O ATOM 130 CB VAL C 9 55.820 -11.908 4.396 1.00 0.00 C ATOM 131 CG1 VAL C 9 56.476 -11.812 3.017 1.00 0.00 C ATOM 132 CG2 VAL C 9 56.370 -10.803 5.298 1.00 0.00 C ATOM 0 H VAL C 9 54.435 -11.982 6.372 1.00 0.00 H new ATOM 0 HA VAL C 9 54.048 -10.865 3.658 1.00 0.00 H new ATOM 0 HB VAL C 9 56.039 -12.881 4.835 1.00 0.00 H new ATOM 0 HG11 VAL C 9 57.555 -11.932 3.118 1.00 0.00 H new ATOM 0 HG12 VAL C 9 56.083 -12.597 2.371 1.00 0.00 H new ATOM 0 HG13 VAL C 9 56.259 -10.838 2.578 1.00 0.00 H new ATOM 0 HG21 VAL C 9 57.449 -10.921 5.401 1.00 0.00 H new ATOM 0 HG22 VAL C 9 56.151 -9.831 4.857 1.00 0.00 H new ATOM 0 HG23 VAL C 9 55.902 -10.869 6.280 1.00 0.00 H new ATOM 142 N GLU C 10 53.803 -14.108 4.157 1.00 0.00 N ATOM 143 CA GLU C 10 53.231 -15.334 3.528 1.00 0.00 C ATOM 144 C GLU C 10 51.777 -15.090 3.114 1.00 0.00 C ATOM 145 O GLU C 10 51.234 -15.789 2.280 1.00 0.00 O ATOM 146 CB GLU C 10 53.308 -16.408 4.614 1.00 0.00 C ATOM 147 CG GLU C 10 54.459 -17.367 4.304 1.00 0.00 C ATOM 148 CD GLU C 10 53.903 -18.642 3.668 1.00 0.00 C ATOM 149 OE1 GLU C 10 52.943 -19.176 4.200 1.00 0.00 O ATOM 150 OE2 GLU C 10 54.445 -19.064 2.660 1.00 0.00 O ATOM 0 H GLU C 10 54.258 -14.254 5.058 1.00 0.00 H new ATOM 0 HA GLU C 10 53.771 -15.626 2.627 1.00 0.00 H new ATOM 0 HB2 GLU C 10 53.460 -15.944 5.589 1.00 0.00 H new ATOM 0 HB3 GLU C 10 52.367 -16.957 4.665 1.00 0.00 H new ATOM 0 HG2 GLU C 10 55.171 -16.892 3.629 1.00 0.00 H new ATOM 0 HG3 GLU C 10 55.000 -17.610 5.218 1.00 0.00 H new ATOM 157 N GLN C 11 51.141 -14.108 3.690 1.00 0.00 N ATOM 158 CA GLN C 11 49.721 -13.824 3.330 1.00 0.00 C ATOM 159 C GLN C 11 49.653 -12.834 2.163 1.00 0.00 C ATOM 160 O GLN C 11 48.635 -12.217 1.920 1.00 0.00 O ATOM 161 CB GLN C 11 49.112 -13.208 4.590 1.00 0.00 C ATOM 162 CG GLN C 11 48.371 -14.288 5.381 1.00 0.00 C ATOM 163 CD GLN C 11 49.382 -15.147 6.143 1.00 0.00 C ATOM 164 OE1 GLN C 11 49.823 -16.167 5.653 1.00 0.00 O ATOM 165 NE2 GLN C 11 49.768 -14.774 7.333 1.00 0.00 N ATOM 0 H GLN C 11 51.542 -13.489 4.395 1.00 0.00 H new ATOM 0 HA GLN C 11 49.189 -14.721 3.013 1.00 0.00 H new ATOM 0 HB2 GLN C 11 49.895 -12.765 5.205 1.00 0.00 H new ATOM 0 HB3 GLN C 11 48.426 -12.405 4.320 1.00 0.00 H new ATOM 0 HG2 GLN C 11 47.671 -13.827 6.078 1.00 0.00 H new ATOM 0 HG3 GLN C 11 47.785 -14.911 4.705 1.00 0.00 H new ATOM 0 HE21 GLN C 11 49.397 -13.917 7.744 1.00 0.00 H new ATOM 0 HE22 GLN C 11 50.440 -15.339 7.852 1.00 0.00 H new ATOM 174 N LEU C 12 50.728 -12.677 1.439 1.00 0.00 N ATOM 175 CA LEU C 12 50.717 -11.725 0.290 1.00 0.00 C ATOM 176 C LEU C 12 49.997 -12.348 -0.909 1.00 0.00 C ATOM 177 O LEU C 12 50.152 -13.517 -1.201 1.00 0.00 O ATOM 178 CB LEU C 12 52.192 -11.484 -0.035 1.00 0.00 C ATOM 179 CG LEU C 12 52.754 -10.420 0.911 1.00 0.00 C ATOM 180 CD1 LEU C 12 54.282 -10.443 0.857 1.00 0.00 C ATOM 181 CD2 LEU C 12 52.252 -9.040 0.481 1.00 0.00 C ATOM 0 H LEU C 12 51.611 -13.165 1.592 1.00 0.00 H new ATOM 0 HA LEU C 12 50.193 -10.798 0.526 1.00 0.00 H new ATOM 0 HB2 LEU C 12 52.755 -12.412 0.068 1.00 0.00 H new ATOM 0 HB3 LEU C 12 52.299 -11.159 -1.070 1.00 0.00 H new ATOM 0 HG LEU C 12 52.423 -10.629 1.928 1.00 0.00 H new ATOM 0 HD11 LEU C 12 54.681 -9.685 1.531 1.00 0.00 H new ATOM 0 HD12 LEU C 12 54.642 -11.426 1.162 1.00 0.00 H new ATOM 0 HD13 LEU C 12 54.613 -10.235 -0.160 1.00 0.00 H new ATOM 0 HD21 LEU C 12 52.652 -8.281 1.154 1.00 0.00 H new ATOM 0 HD22 LEU C 12 52.583 -8.833 -0.537 1.00 0.00 H new ATOM 0 HD23 LEU C 12 51.163 -9.021 0.519 1.00 0.00 H new ATOM 193 N THR C 13 49.206 -11.575 -1.604 1.00 0.00 N ATOM 194 CA THR C 13 48.474 -12.121 -2.783 1.00 0.00 C ATOM 195 C THR C 13 49.269 -11.867 -4.067 1.00 0.00 C ATOM 196 O THR C 13 50.202 -11.088 -4.087 1.00 0.00 O ATOM 197 CB THR C 13 47.149 -11.359 -2.815 1.00 0.00 C ATOM 198 OG1 THR C 13 47.353 -10.037 -2.334 1.00 0.00 O ATOM 199 CG2 THR C 13 46.126 -12.073 -1.929 1.00 0.00 C ATOM 0 H THR C 13 49.035 -10.589 -1.406 1.00 0.00 H new ATOM 0 HA THR C 13 48.324 -13.198 -2.711 1.00 0.00 H new ATOM 0 HB THR C 13 46.776 -11.321 -3.839 1.00 0.00 H new ATOM 0 HG1 THR C 13 46.505 -9.547 -2.355 1.00 0.00 H new ATOM 0 HG21 THR C 13 45.182 -11.529 -1.952 1.00 0.00 H new ATOM 0 HG22 THR C 13 45.970 -13.087 -2.298 1.00 0.00 H new ATOM 0 HG23 THR C 13 46.497 -12.113 -0.905 1.00 0.00 H new ATOM 207 N GLU C 14 48.905 -12.516 -5.139 1.00 0.00 N ATOM 208 CA GLU C 14 49.638 -12.311 -6.422 1.00 0.00 C ATOM 209 C GLU C 14 49.623 -10.828 -6.807 1.00 0.00 C ATOM 210 O GLU C 14 50.617 -10.279 -7.241 1.00 0.00 O ATOM 211 CB GLU C 14 48.874 -13.142 -7.453 1.00 0.00 C ATOM 212 CG GLU C 14 49.853 -14.035 -8.216 1.00 0.00 C ATOM 213 CD GLU C 14 49.717 -15.478 -7.728 1.00 0.00 C ATOM 214 OE1 GLU C 14 48.598 -15.891 -7.469 1.00 0.00 O ATOM 215 OE2 GLU C 14 50.732 -16.145 -7.620 1.00 0.00 O ATOM 0 H GLU C 14 48.132 -13.180 -5.183 1.00 0.00 H new ATOM 0 HA GLU C 14 50.684 -12.611 -6.353 1.00 0.00 H new ATOM 0 HB2 GLU C 14 48.120 -13.752 -6.957 1.00 0.00 H new ATOM 0 HB3 GLU C 14 48.348 -12.486 -8.146 1.00 0.00 H new ATOM 0 HG2 GLU C 14 49.652 -13.982 -9.286 1.00 0.00 H new ATOM 0 HG3 GLU C 14 50.874 -13.684 -8.066 1.00 0.00 H new ATOM 222 N GLU C 15 48.503 -10.178 -6.652 1.00 0.00 N ATOM 223 CA GLU C 15 48.423 -8.732 -7.009 1.00 0.00 C ATOM 224 C GLU C 15 49.258 -7.899 -6.033 1.00 0.00 C ATOM 225 O GLU C 15 50.193 -7.226 -6.418 1.00 0.00 O ATOM 226 CB GLU C 15 46.941 -8.376 -6.885 1.00 0.00 C ATOM 227 CG GLU C 15 46.265 -8.520 -8.250 1.00 0.00 C ATOM 228 CD GLU C 15 45.216 -7.418 -8.419 1.00 0.00 C ATOM 229 OE1 GLU C 15 45.610 -6.272 -8.565 1.00 0.00 O ATOM 230 OE2 GLU C 15 44.040 -7.738 -8.399 1.00 0.00 O ATOM 0 H GLU C 15 47.639 -10.585 -6.294 1.00 0.00 H new ATOM 0 HA GLU C 15 48.809 -8.531 -8.008 1.00 0.00 H new ATOM 0 HB2 GLU C 15 46.459 -9.029 -6.158 1.00 0.00 H new ATOM 0 HB3 GLU C 15 46.831 -7.355 -6.519 1.00 0.00 H new ATOM 0 HG2 GLU C 15 47.008 -8.454 -9.045 1.00 0.00 H new ATOM 0 HG3 GLU C 15 45.795 -9.500 -8.333 1.00 0.00 H new ATOM 237 N GLN C 16 48.928 -7.939 -4.771 1.00 0.00 N ATOM 238 CA GLN C 16 49.706 -7.150 -3.773 1.00 0.00 C ATOM 239 C GLN C 16 51.207 -7.369 -3.981 1.00 0.00 C ATOM 240 O GLN C 16 51.973 -6.431 -4.092 1.00 0.00 O ATOM 241 CB GLN C 16 49.270 -7.693 -2.411 1.00 0.00 C ATOM 242 CG GLN C 16 50.066 -6.998 -1.306 1.00 0.00 C ATOM 243 CD GLN C 16 49.111 -6.218 -0.401 1.00 0.00 C ATOM 244 OE1 GLN C 16 47.909 -6.285 -0.565 1.00 0.00 O ATOM 245 NE2 GLN C 16 49.597 -5.474 0.554 1.00 0.00 N ATOM 0 H GLN C 16 48.155 -8.483 -4.388 1.00 0.00 H new ATOM 0 HA GLN C 16 49.525 -6.079 -3.862 1.00 0.00 H new ATOM 0 HB2 GLN C 16 48.203 -7.525 -2.265 1.00 0.00 H new ATOM 0 HB3 GLN C 16 49.432 -8.770 -2.368 1.00 0.00 H new ATOM 0 HG2 GLN C 16 50.617 -7.735 -0.722 1.00 0.00 H new ATOM 0 HG3 GLN C 16 50.802 -6.323 -1.743 1.00 0.00 H new ATOM 0 HE21 GLN C 16 50.606 -5.417 0.693 1.00 0.00 H new ATOM 0 HE22 GLN C 16 48.968 -4.949 1.162 1.00 0.00 H new ATOM 254 N LYS C 17 51.634 -8.601 -4.037 1.00 0.00 N ATOM 255 CA LYS C 17 53.085 -8.881 -4.239 1.00 0.00 C ATOM 256 C LYS C 17 53.637 -8.030 -5.385 1.00 0.00 C ATOM 257 O LYS C 17 54.707 -7.462 -5.288 1.00 0.00 O ATOM 258 CB LYS C 17 53.156 -10.368 -4.592 1.00 0.00 C ATOM 259 CG LYS C 17 53.646 -11.158 -3.375 1.00 0.00 C ATOM 260 CD LYS C 17 52.848 -12.457 -3.253 1.00 0.00 C ATOM 261 CE LYS C 17 53.797 -13.605 -2.900 1.00 0.00 C ATOM 262 NZ LYS C 17 53.056 -14.843 -3.275 1.00 0.00 N ATOM 0 H LYS C 17 51.041 -9.426 -3.952 1.00 0.00 H new ATOM 0 HA LYS C 17 53.677 -8.642 -3.356 1.00 0.00 H new ATOM 0 HB2 LYS C 17 52.174 -10.727 -4.901 1.00 0.00 H new ATOM 0 HB3 LYS C 17 53.831 -10.521 -5.434 1.00 0.00 H new ATOM 0 HG2 LYS C 17 54.708 -11.380 -3.476 1.00 0.00 H new ATOM 0 HG3 LYS C 17 53.530 -10.561 -2.470 1.00 0.00 H new ATOM 0 HD2 LYS C 17 52.081 -12.355 -2.485 1.00 0.00 H new ATOM 0 HD3 LYS C 17 52.334 -12.670 -4.190 1.00 0.00 H new ATOM 0 HE2 LYS C 17 54.736 -13.525 -3.448 1.00 0.00 H new ATOM 0 HE3 LYS C 17 54.046 -13.600 -1.839 1.00 0.00 H new ATOM 0 HZ1 LYS C 17 53.642 -15.676 -3.063 1.00 0.00 H new ATOM 0 HZ2 LYS C 17 52.170 -14.895 -2.732 1.00 0.00 H new ATOM 0 HZ3 LYS C 17 52.838 -14.823 -4.292 1.00 0.00 H new ATOM 276 N ASN C 18 52.919 -7.938 -6.470 1.00 0.00 N ATOM 277 CA ASN C 18 53.407 -7.121 -7.619 1.00 0.00 C ATOM 278 C ASN C 18 53.335 -5.632 -7.272 1.00 0.00 C ATOM 279 O ASN C 18 53.948 -4.802 -7.916 1.00 0.00 O ATOM 280 CB ASN C 18 52.458 -7.449 -8.773 1.00 0.00 C ATOM 281 CG ASN C 18 52.229 -8.960 -8.836 1.00 0.00 C ATOM 282 OD1 ASN C 18 53.007 -9.727 -8.305 1.00 0.00 O ATOM 283 ND2 ASN C 18 51.185 -9.425 -9.468 1.00 0.00 N ATOM 0 H ASN C 18 52.017 -8.392 -6.612 1.00 0.00 H new ATOM 0 HA ASN C 18 54.444 -7.341 -7.872 1.00 0.00 H new ATOM 0 HB2 ASN C 18 51.508 -6.933 -8.634 1.00 0.00 H new ATOM 0 HB3 ASN C 18 52.878 -7.095 -9.714 1.00 0.00 H new ATOM 0 HD21 ASN C 18 51.024 -10.431 -9.515 1.00 0.00 H new ATOM 0 HD22 ASN C 18 50.531 -8.782 -9.914 1.00 0.00 H new ATOM 290 N GLU C 19 52.589 -5.285 -6.258 1.00 0.00 N ATOM 291 CA GLU C 19 52.474 -3.850 -5.871 1.00 0.00 C ATOM 292 C GLU C 19 53.783 -3.354 -5.250 1.00 0.00 C ATOM 293 O GLU C 19 54.394 -2.421 -5.733 1.00 0.00 O ATOM 294 CB GLU C 19 51.343 -3.806 -4.845 1.00 0.00 C ATOM 295 CG GLU C 19 50.892 -2.358 -4.646 1.00 0.00 C ATOM 296 CD GLU C 19 51.117 -1.947 -3.191 1.00 0.00 C ATOM 297 OE1 GLU C 19 52.155 -2.294 -2.650 1.00 0.00 O ATOM 298 OE2 GLU C 19 50.250 -1.289 -2.640 1.00 0.00 O ATOM 0 H GLU C 19 52.054 -5.934 -5.681 1.00 0.00 H new ATOM 0 HA GLU C 19 52.273 -3.209 -6.730 1.00 0.00 H new ATOM 0 HB2 GLU C 19 50.506 -4.416 -5.184 1.00 0.00 H new ATOM 0 HB3 GLU C 19 51.680 -4.227 -3.898 1.00 0.00 H new ATOM 0 HG2 GLU C 19 51.449 -1.698 -5.311 1.00 0.00 H new ATOM 0 HG3 GLU C 19 49.838 -2.256 -4.905 1.00 0.00 H new ATOM 305 N PHE C 20 54.220 -3.963 -4.179 1.00 0.00 N ATOM 306 CA PHE C 20 55.488 -3.509 -3.536 1.00 0.00 C ATOM 307 C PHE C 20 56.663 -3.681 -4.506 1.00 0.00 C ATOM 308 O PHE C 20 57.465 -2.788 -4.687 1.00 0.00 O ATOM 309 CB PHE C 20 55.649 -4.391 -2.288 1.00 0.00 C ATOM 310 CG PHE C 20 56.341 -5.690 -2.637 1.00 0.00 C ATOM 311 CD1 PHE C 20 57.741 -5.760 -2.631 1.00 0.00 C ATOM 312 CD2 PHE C 20 55.585 -6.822 -2.962 1.00 0.00 C ATOM 313 CE1 PHE C 20 58.382 -6.964 -2.949 1.00 0.00 C ATOM 314 CE2 PHE C 20 56.228 -8.024 -3.281 1.00 0.00 C ATOM 315 CZ PHE C 20 57.625 -8.096 -3.274 1.00 0.00 C ATOM 0 H PHE C 20 53.757 -4.750 -3.724 1.00 0.00 H new ATOM 0 HA PHE C 20 55.465 -2.453 -3.268 1.00 0.00 H new ATOM 0 HB2 PHE C 20 56.225 -3.858 -1.532 1.00 0.00 H new ATOM 0 HB3 PHE C 20 54.671 -4.599 -1.855 1.00 0.00 H new ATOM 0 HD1 PHE C 20 58.325 -4.886 -2.381 1.00 0.00 H new ATOM 0 HD2 PHE C 20 54.506 -6.768 -2.967 1.00 0.00 H new ATOM 0 HE1 PHE C 20 59.461 -7.019 -2.944 1.00 0.00 H new ATOM 0 HE2 PHE C 20 55.644 -8.897 -3.533 1.00 0.00 H new ATOM 0 HZ PHE C 20 58.119 -9.024 -3.519 1.00 0.00 H new ATOM 325 N LYS C 21 56.768 -4.821 -5.135 1.00 0.00 N ATOM 326 CA LYS C 21 57.887 -5.039 -6.095 1.00 0.00 C ATOM 327 C LYS C 21 58.055 -3.810 -6.993 1.00 0.00 C ATOM 328 O LYS C 21 59.147 -3.474 -7.404 1.00 0.00 O ATOM 329 CB LYS C 21 57.471 -6.257 -6.920 1.00 0.00 C ATOM 330 CG LYS C 21 58.244 -7.488 -6.440 1.00 0.00 C ATOM 331 CD LYS C 21 58.958 -8.140 -7.627 1.00 0.00 C ATOM 332 CE LYS C 21 57.954 -8.380 -8.756 1.00 0.00 C ATOM 333 NZ LYS C 21 58.294 -9.727 -9.293 1.00 0.00 N ATOM 0 H LYS C 21 56.129 -5.608 -5.026 1.00 0.00 H new ATOM 0 HA LYS C 21 58.841 -5.198 -5.592 1.00 0.00 H new ATOM 0 HB2 LYS C 21 56.399 -6.427 -6.822 1.00 0.00 H new ATOM 0 HB3 LYS C 21 57.670 -6.079 -7.977 1.00 0.00 H new ATOM 0 HG2 LYS C 21 58.970 -7.201 -5.679 1.00 0.00 H new ATOM 0 HG3 LYS C 21 57.562 -8.201 -5.977 1.00 0.00 H new ATOM 0 HD2 LYS C 21 59.767 -7.498 -7.976 1.00 0.00 H new ATOM 0 HD3 LYS C 21 59.409 -9.084 -7.320 1.00 0.00 H new ATOM 0 HE2 LYS C 21 56.929 -8.350 -8.386 1.00 0.00 H new ATOM 0 HE3 LYS C 21 58.037 -7.615 -9.528 1.00 0.00 H new ATOM 0 HZ1 LYS C 21 57.647 -9.963 -10.073 1.00 0.00 H new ATOM 0 HZ2 LYS C 21 59.273 -9.724 -9.644 1.00 0.00 H new ATOM 0 HZ3 LYS C 21 58.199 -10.436 -8.538 1.00 0.00 H new ATOM 347 N ALA C 22 56.979 -3.136 -7.295 1.00 0.00 N ATOM 348 CA ALA C 22 57.078 -1.927 -8.162 1.00 0.00 C ATOM 349 C ALA C 22 57.780 -0.796 -7.408 1.00 0.00 C ATOM 350 O ALA C 22 58.752 -0.236 -7.874 1.00 0.00 O ATOM 351 CB ALA C 22 55.630 -1.545 -8.475 1.00 0.00 C ATOM 0 H ALA C 22 56.037 -3.369 -6.980 1.00 0.00 H new ATOM 0 HA ALA C 22 57.655 -2.113 -9.068 1.00 0.00 H new ATOM 0 HB1 ALA C 22 55.617 -0.660 -9.112 1.00 0.00 H new ATOM 0 HB2 ALA C 22 55.139 -2.371 -8.990 1.00 0.00 H new ATOM 0 HB3 ALA C 22 55.101 -1.332 -7.546 1.00 0.00 H new ATOM 357 N ALA C 23 57.296 -0.458 -6.245 1.00 0.00 N ATOM 358 CA ALA C 23 57.937 0.635 -5.460 1.00 0.00 C ATOM 359 C ALA C 23 59.426 0.336 -5.263 1.00 0.00 C ATOM 360 O ALA C 23 60.263 1.213 -5.346 1.00 0.00 O ATOM 361 CB ALA C 23 57.208 0.635 -4.117 1.00 0.00 C ATOM 0 H ALA C 23 56.485 -0.891 -5.804 1.00 0.00 H new ATOM 0 HA ALA C 23 57.869 1.601 -5.960 1.00 0.00 H new ATOM 0 HB1 ALA C 23 57.622 1.415 -3.478 1.00 0.00 H new ATOM 0 HB2 ALA C 23 56.147 0.825 -4.279 1.00 0.00 H new ATOM 0 HB3 ALA C 23 57.334 -0.334 -3.635 1.00 0.00 H new ATOM 367 N PHE C 24 59.759 -0.898 -5.003 1.00 0.00 N ATOM 368 CA PHE C 24 61.191 -1.259 -4.799 1.00 0.00 C ATOM 369 C PHE C 24 62.008 -0.918 -6.049 1.00 0.00 C ATOM 370 O PHE C 24 63.035 -0.271 -5.974 1.00 0.00 O ATOM 371 CB PHE C 24 61.181 -2.770 -4.558 1.00 0.00 C ATOM 372 CG PHE C 24 62.577 -3.321 -4.730 1.00 0.00 C ATOM 373 CD1 PHE C 24 63.029 -3.693 -6.002 1.00 0.00 C ATOM 374 CD2 PHE C 24 63.417 -3.461 -3.619 1.00 0.00 C ATOM 375 CE1 PHE C 24 64.322 -4.204 -6.163 1.00 0.00 C ATOM 376 CE2 PHE C 24 64.710 -3.972 -3.781 1.00 0.00 C ATOM 377 CZ PHE C 24 65.163 -4.344 -5.053 1.00 0.00 C ATOM 0 H PHE C 24 59.101 -1.673 -4.923 1.00 0.00 H new ATOM 0 HA PHE C 24 61.643 -0.714 -3.970 1.00 0.00 H new ATOM 0 HB2 PHE C 24 60.815 -2.986 -3.554 1.00 0.00 H new ATOM 0 HB3 PHE C 24 60.499 -3.255 -5.257 1.00 0.00 H new ATOM 0 HD1 PHE C 24 62.380 -3.586 -6.859 1.00 0.00 H new ATOM 0 HD2 PHE C 24 63.068 -3.175 -2.638 1.00 0.00 H new ATOM 0 HE1 PHE C 24 64.671 -4.490 -7.144 1.00 0.00 H new ATOM 0 HE2 PHE C 24 65.359 -4.080 -2.924 1.00 0.00 H new ATOM 0 HZ PHE C 24 66.161 -4.739 -5.177 1.00 0.00 H new ATOM 387 N ASP C 25 61.563 -1.350 -7.196 1.00 0.00 N ATOM 388 CA ASP C 25 62.313 -1.054 -8.450 1.00 0.00 C ATOM 389 C ASP C 25 62.680 0.432 -8.517 1.00 0.00 C ATOM 390 O ASP C 25 63.796 0.792 -8.834 1.00 0.00 O ATOM 391 CB ASP C 25 61.352 -1.423 -9.581 1.00 0.00 C ATOM 392 CG ASP C 25 61.947 -2.564 -10.409 1.00 0.00 C ATOM 393 OD1 ASP C 25 62.935 -3.135 -9.975 1.00 0.00 O ATOM 394 OD2 ASP C 25 61.405 -2.849 -11.465 1.00 0.00 O ATOM 0 H ASP C 25 60.711 -1.896 -7.320 1.00 0.00 H new ATOM 0 HA ASP C 25 63.249 -1.610 -8.511 1.00 0.00 H new ATOM 0 HB2 ASP C 25 60.388 -1.723 -9.169 1.00 0.00 H new ATOM 0 HB3 ASP C 25 61.171 -0.556 -10.216 1.00 0.00 H new ATOM 399 N ILE C 26 61.748 1.299 -8.227 1.00 0.00 N ATOM 400 CA ILE C 26 62.047 2.761 -8.279 1.00 0.00 C ATOM 401 C ILE C 26 62.943 3.166 -7.104 1.00 0.00 C ATOM 402 O ILE C 26 63.733 4.084 -7.202 1.00 0.00 O ATOM 403 CB ILE C 26 60.686 3.449 -8.178 1.00 0.00 C ATOM 404 CG1 ILE C 26 59.915 3.245 -9.484 1.00 0.00 C ATOM 405 CG2 ILE C 26 60.880 4.948 -7.933 1.00 0.00 C ATOM 406 CD1 ILE C 26 59.071 1.973 -9.383 1.00 0.00 C ATOM 0 H ILE C 26 60.794 1.060 -7.957 1.00 0.00 H new ATOM 0 HA ILE C 26 62.578 3.039 -9.190 1.00 0.00 H new ATOM 0 HB ILE C 26 60.126 3.017 -7.349 1.00 0.00 H new ATOM 0 HG12 ILE C 26 59.274 4.105 -9.679 1.00 0.00 H new ATOM 0 HG13 ILE C 26 60.609 3.168 -10.321 1.00 0.00 H new ATOM 0 HG21 ILE C 26 59.907 5.434 -7.862 1.00 0.00 H new ATOM 0 HG22 ILE C 26 61.429 5.097 -7.003 1.00 0.00 H new ATOM 0 HG23 ILE C 26 61.443 5.382 -8.760 1.00 0.00 H new ATOM 0 HD11 ILE C 26 58.521 1.826 -10.313 1.00 0.00 H new ATOM 0 HD12 ILE C 26 59.723 1.117 -9.208 1.00 0.00 H new ATOM 0 HD13 ILE C 26 58.367 2.068 -8.556 1.00 0.00 H new ATOM 418 N PHE C 27 62.822 2.492 -5.993 1.00 0.00 N ATOM 419 CA PHE C 27 63.663 2.844 -4.812 1.00 0.00 C ATOM 420 C PHE C 27 65.148 2.646 -5.132 1.00 0.00 C ATOM 421 O PHE C 27 66.011 3.189 -4.472 1.00 0.00 O ATOM 422 CB PHE C 27 63.213 1.883 -3.710 1.00 0.00 C ATOM 423 CG PHE C 27 62.058 2.492 -2.947 1.00 0.00 C ATOM 424 CD1 PHE C 27 61.254 3.470 -3.548 1.00 0.00 C ATOM 425 CD2 PHE C 27 61.791 2.078 -1.636 1.00 0.00 C ATOM 426 CE1 PHE C 27 60.186 4.032 -2.839 1.00 0.00 C ATOM 427 CE2 PHE C 27 60.722 2.640 -0.928 1.00 0.00 C ATOM 428 CZ PHE C 27 59.920 3.618 -1.529 1.00 0.00 C ATOM 0 H PHE C 27 62.178 1.714 -5.851 1.00 0.00 H new ATOM 0 HA PHE C 27 63.546 3.887 -4.518 1.00 0.00 H new ATOM 0 HB2 PHE C 27 62.912 0.930 -4.145 1.00 0.00 H new ATOM 0 HB3 PHE C 27 64.042 1.677 -3.032 1.00 0.00 H new ATOM 0 HD1 PHE C 27 61.459 3.790 -4.559 1.00 0.00 H new ATOM 0 HD2 PHE C 27 62.410 1.325 -1.171 1.00 0.00 H new ATOM 0 HE1 PHE C 27 59.567 4.785 -3.303 1.00 0.00 H new ATOM 0 HE2 PHE C 27 60.516 2.319 0.082 1.00 0.00 H new ATOM 0 HZ PHE C 27 59.097 4.053 -0.982 1.00 0.00 H new ATOM 438 N VAL C 28 65.453 1.876 -6.139 1.00 0.00 N ATOM 439 CA VAL C 28 66.881 1.649 -6.502 1.00 0.00 C ATOM 440 C VAL C 28 67.161 2.208 -7.899 1.00 0.00 C ATOM 441 O VAL C 28 68.091 1.803 -8.567 1.00 0.00 O ATOM 442 CB VAL C 28 67.053 0.131 -6.486 1.00 0.00 C ATOM 443 CG1 VAL C 28 66.478 -0.435 -5.187 1.00 0.00 C ATOM 444 CG2 VAL C 28 66.312 -0.477 -7.678 1.00 0.00 C ATOM 0 H VAL C 28 64.774 1.393 -6.728 1.00 0.00 H new ATOM 0 HA VAL C 28 67.570 2.144 -5.817 1.00 0.00 H new ATOM 0 HB VAL C 28 68.113 -0.115 -6.551 1.00 0.00 H new ATOM 0 HG11 VAL C 28 66.601 -1.518 -5.176 1.00 0.00 H new ATOM 0 HG12 VAL C 28 67.004 -0.001 -4.337 1.00 0.00 H new ATOM 0 HG13 VAL C 28 65.418 -0.190 -5.121 1.00 0.00 H new ATOM 0 HG21 VAL C 28 66.434 -1.560 -7.668 1.00 0.00 H new ATOM 0 HG22 VAL C 28 65.252 -0.230 -7.612 1.00 0.00 H new ATOM 0 HG23 VAL C 28 66.721 -0.074 -8.605 1.00 0.00 H new ATOM 454 N LEU C 29 66.358 3.135 -8.345 1.00 0.00 N ATOM 455 CA LEU C 29 66.570 3.723 -9.700 1.00 0.00 C ATOM 456 C LEU C 29 67.996 4.267 -9.829 1.00 0.00 C ATOM 457 O LEU C 29 68.285 5.377 -9.429 1.00 0.00 O ATOM 458 CB LEU C 29 65.556 4.862 -9.797 1.00 0.00 C ATOM 459 CG LEU C 29 64.430 4.466 -10.753 1.00 0.00 C ATOM 460 CD1 LEU C 29 63.206 5.340 -10.482 1.00 0.00 C ATOM 461 CD2 LEU C 29 64.890 4.672 -12.198 1.00 0.00 C ATOM 0 H LEU C 29 65.563 3.512 -7.829 1.00 0.00 H new ATOM 0 HA LEU C 29 66.439 2.986 -10.493 1.00 0.00 H new ATOM 0 HB2 LEU C 29 65.148 5.084 -8.811 1.00 0.00 H new ATOM 0 HB3 LEU C 29 66.046 5.769 -10.151 1.00 0.00 H new ATOM 0 HG LEU C 29 64.174 3.418 -10.599 1.00 0.00 H new ATOM 0 HD11 LEU C 29 62.401 5.060 -11.162 1.00 0.00 H new ATOM 0 HD12 LEU C 29 62.877 5.197 -9.453 1.00 0.00 H new ATOM 0 HD13 LEU C 29 63.465 6.387 -10.638 1.00 0.00 H new ATOM 0 HD21 LEU C 29 64.087 4.390 -12.879 1.00 0.00 H new ATOM 0 HD22 LEU C 29 65.145 5.720 -12.353 1.00 0.00 H new ATOM 0 HD23 LEU C 29 65.766 4.053 -12.393 1.00 0.00 H new ATOM 473 N GLY C 30 68.887 3.495 -10.389 1.00 0.00 N ATOM 474 CA GLY C 30 70.290 3.973 -10.547 1.00 0.00 C ATOM 475 C GLY C 30 71.229 3.115 -9.697 1.00 0.00 C ATOM 476 O GLY C 30 72.428 3.110 -9.892 1.00 0.00 O ATOM 0 H GLY C 30 68.705 2.556 -10.743 1.00 0.00 H new ATOM 0 HA2 GLY C 30 70.585 3.922 -11.595 1.00 0.00 H new ATOM 0 HA3 GLY C 30 70.364 5.018 -10.245 1.00 0.00 H new ATOM 480 N ALA C 31 70.695 2.388 -8.753 1.00 0.00 N ATOM 481 CA ALA C 31 71.562 1.532 -7.892 1.00 0.00 C ATOM 482 C ALA C 31 72.524 0.712 -8.759 1.00 0.00 C ATOM 483 O ALA C 31 72.439 0.717 -9.971 1.00 0.00 O ATOM 484 CB ALA C 31 70.593 0.613 -7.147 1.00 0.00 C ATOM 0 H ALA C 31 69.698 2.349 -8.541 1.00 0.00 H new ATOM 0 HA ALA C 31 72.175 2.119 -7.208 1.00 0.00 H new ATOM 0 HB1 ALA C 31 71.154 -0.051 -6.490 1.00 0.00 H new ATOM 0 HB2 ALA C 31 69.905 1.215 -6.553 1.00 0.00 H new ATOM 0 HB3 ALA C 31 70.029 0.020 -7.866 1.00 0.00 H new ATOM 490 N GLU C 32 73.438 0.009 -8.148 1.00 0.00 N ATOM 491 CA GLU C 32 74.405 -0.807 -8.938 1.00 0.00 C ATOM 492 C GLU C 32 74.236 -2.293 -8.611 1.00 0.00 C ATOM 493 O GLU C 32 74.508 -3.153 -9.426 1.00 0.00 O ATOM 494 CB GLU C 32 75.787 -0.318 -8.506 1.00 0.00 C ATOM 495 CG GLU C 32 76.865 -1.135 -9.219 1.00 0.00 C ATOM 496 CD GLU C 32 78.145 -0.305 -9.333 1.00 0.00 C ATOM 497 OE1 GLU C 32 78.534 0.288 -8.340 1.00 0.00 O ATOM 498 OE2 GLU C 32 78.715 -0.276 -10.411 1.00 0.00 O ATOM 0 H GLU C 32 73.557 -0.036 -7.136 1.00 0.00 H new ATOM 0 HA GLU C 32 74.253 -0.698 -10.012 1.00 0.00 H new ATOM 0 HB2 GLU C 32 75.901 0.740 -8.744 1.00 0.00 H new ATOM 0 HB3 GLU C 32 75.897 -0.415 -7.426 1.00 0.00 H new ATOM 0 HG2 GLU C 32 77.063 -2.054 -8.668 1.00 0.00 H new ATOM 0 HG3 GLU C 32 76.519 -1.426 -10.211 1.00 0.00 H new ATOM 505 N ASP C 33 73.790 -2.603 -7.425 1.00 0.00 N ATOM 506 CA ASP C 33 73.606 -4.034 -7.050 1.00 0.00 C ATOM 507 C ASP C 33 72.132 -4.313 -6.742 1.00 0.00 C ATOM 508 O ASP C 33 71.731 -5.444 -6.553 1.00 0.00 O ATOM 509 CB ASP C 33 74.463 -4.231 -5.799 1.00 0.00 C ATOM 510 CG ASP C 33 75.416 -5.408 -6.014 1.00 0.00 C ATOM 511 OD1 ASP C 33 75.724 -5.693 -7.158 1.00 0.00 O ATOM 512 OD2 ASP C 33 75.819 -6.006 -5.029 1.00 0.00 O ATOM 0 H ASP C 33 73.545 -1.929 -6.700 1.00 0.00 H new ATOM 0 HA ASP C 33 73.897 -4.712 -7.852 1.00 0.00 H new ATOM 0 HB2 ASP C 33 75.030 -3.324 -5.587 1.00 0.00 H new ATOM 0 HB3 ASP C 33 73.826 -4.418 -4.935 1.00 0.00 H new ATOM 517 N GLY C 34 71.322 -3.290 -6.693 1.00 0.00 N ATOM 518 CA GLY C 34 69.876 -3.497 -6.399 1.00 0.00 C ATOM 519 C GLY C 34 69.614 -3.248 -4.913 1.00 0.00 C ATOM 520 O GLY C 34 69.014 -4.058 -4.236 1.00 0.00 O ATOM 0 H GLY C 34 71.600 -2.320 -6.844 1.00 0.00 H new ATOM 0 HA2 GLY C 34 69.271 -2.821 -7.004 1.00 0.00 H new ATOM 0 HA3 GLY C 34 69.582 -4.512 -6.665 1.00 0.00 H new ATOM 524 N CYS C 35 70.058 -2.134 -4.400 1.00 0.00 N ATOM 525 CA CYS C 35 69.834 -1.836 -2.957 1.00 0.00 C ATOM 526 C CYS C 35 69.400 -0.378 -2.781 1.00 0.00 C ATOM 527 O CYS C 35 69.240 0.351 -3.739 1.00 0.00 O ATOM 528 CB CYS C 35 71.186 -2.077 -2.286 1.00 0.00 C ATOM 529 SG CYS C 35 72.478 -1.201 -3.203 1.00 0.00 S ATOM 0 H CYS C 35 70.566 -1.417 -4.917 1.00 0.00 H new ATOM 0 HA CYS C 35 69.049 -2.457 -2.524 1.00 0.00 H new ATOM 0 HB2 CYS C 35 71.159 -1.730 -1.253 1.00 0.00 H new ATOM 0 HB3 CYS C 35 71.405 -3.144 -2.258 1.00 0.00 H new ATOM 0 HG CYS C 35 73.628 -1.403 -2.632 1.00 0.00 H new ATOM 535 N ILE C 36 69.207 0.053 -1.565 1.00 0.00 N ATOM 536 CA ILE C 36 68.785 1.464 -1.335 1.00 0.00 C ATOM 537 C ILE C 36 69.837 2.204 -0.505 1.00 0.00 C ATOM 538 O ILE C 36 70.609 1.607 0.217 1.00 0.00 O ATOM 539 CB ILE C 36 67.469 1.369 -0.565 1.00 0.00 C ATOM 540 CG1 ILE C 36 66.580 0.293 -1.196 1.00 0.00 C ATOM 541 CG2 ILE C 36 66.749 2.716 -0.622 1.00 0.00 C ATOM 542 CD1 ILE C 36 65.172 0.379 -0.604 1.00 0.00 C ATOM 0 H ILE C 36 69.323 -0.509 -0.722 1.00 0.00 H new ATOM 0 HA ILE C 36 68.671 2.014 -2.269 1.00 0.00 H new ATOM 0 HB ILE C 36 67.676 1.107 0.473 1.00 0.00 H new ATOM 0 HG12 ILE C 36 66.540 0.428 -2.277 1.00 0.00 H new ATOM 0 HG13 ILE C 36 67.002 -0.695 -1.014 1.00 0.00 H new ATOM 0 HG21 ILE C 36 65.810 2.650 -0.073 1.00 0.00 H new ATOM 0 HG22 ILE C 36 67.378 3.484 -0.173 1.00 0.00 H new ATOM 0 HG23 ILE C 36 66.545 2.976 -1.661 1.00 0.00 H new ATOM 0 HD11 ILE C 36 64.541 -0.387 -1.054 1.00 0.00 H new ATOM 0 HD12 ILE C 36 65.220 0.223 0.474 1.00 0.00 H new ATOM 0 HD13 ILE C 36 64.750 1.363 -0.809 1.00 0.00 H new ATOM 554 N SER C 37 69.873 3.504 -0.611 1.00 0.00 N ATOM 555 CA SER C 37 70.873 4.296 0.163 1.00 0.00 C ATOM 556 C SER C 37 70.393 5.738 0.297 1.00 0.00 C ATOM 557 O SER C 37 71.173 6.666 0.275 1.00 0.00 O ATOM 558 CB SER C 37 72.138 4.245 -0.675 1.00 0.00 C ATOM 559 OG SER C 37 73.224 3.813 0.133 1.00 0.00 O ATOM 0 H SER C 37 69.251 4.055 -1.203 1.00 0.00 H new ATOM 0 HA SER C 37 71.028 3.906 1.169 1.00 0.00 H new ATOM 0 HB2 SER C 37 72.003 3.564 -1.516 1.00 0.00 H new ATOM 0 HB3 SER C 37 72.350 5.229 -1.093 1.00 0.00 H new ATOM 0 HG SER C 37 74.041 3.778 -0.408 1.00 0.00 H new ATOM 565 N THR C 38 69.111 5.918 0.411 1.00 0.00 N ATOM 566 CA THR C 38 68.524 7.293 0.524 1.00 0.00 C ATOM 567 C THR C 38 68.609 7.995 -0.834 1.00 0.00 C ATOM 568 O THR C 38 67.620 8.465 -1.360 1.00 0.00 O ATOM 569 CB THR C 38 69.343 8.053 1.584 1.00 0.00 C ATOM 570 OG1 THR C 38 70.442 8.706 0.965 1.00 0.00 O ATOM 571 CG2 THR C 38 69.852 7.088 2.660 1.00 0.00 C ATOM 0 H THR C 38 68.427 5.162 0.432 1.00 0.00 H new ATOM 0 HA THR C 38 67.475 7.256 0.818 1.00 0.00 H new ATOM 0 HB THR C 38 68.700 8.796 2.056 1.00 0.00 H new ATOM 0 HG1 THR C 38 71.151 8.054 0.785 1.00 0.00 H new ATOM 0 HG21 THR C 38 70.429 7.641 3.401 1.00 0.00 H new ATOM 0 HG22 THR C 38 69.004 6.605 3.146 1.00 0.00 H new ATOM 0 HG23 THR C 38 70.486 6.330 2.199 1.00 0.00 H new ATOM 579 N LYS C 39 69.777 8.055 -1.417 1.00 0.00 N ATOM 580 CA LYS C 39 69.903 8.710 -2.748 1.00 0.00 C ATOM 581 C LYS C 39 68.860 8.125 -3.703 1.00 0.00 C ATOM 582 O LYS C 39 68.264 8.826 -4.495 1.00 0.00 O ATOM 583 CB LYS C 39 71.319 8.381 -3.226 1.00 0.00 C ATOM 584 CG LYS C 39 71.901 9.587 -3.965 1.00 0.00 C ATOM 585 CD LYS C 39 72.644 9.112 -5.215 1.00 0.00 C ATOM 586 CE LYS C 39 73.596 10.212 -5.691 1.00 0.00 C ATOM 587 NZ LYS C 39 73.291 10.386 -7.138 1.00 0.00 N ATOM 0 H LYS C 39 70.643 7.681 -1.030 1.00 0.00 H new ATOM 0 HA LYS C 39 69.738 9.787 -2.704 1.00 0.00 H new ATOM 0 HB2 LYS C 39 71.950 8.123 -2.376 1.00 0.00 H new ATOM 0 HB3 LYS C 39 71.299 7.512 -3.884 1.00 0.00 H new ATOM 0 HG2 LYS C 39 71.103 10.276 -4.243 1.00 0.00 H new ATOM 0 HG3 LYS C 39 72.581 10.134 -3.311 1.00 0.00 H new ATOM 0 HD2 LYS C 39 73.203 8.202 -4.995 1.00 0.00 H new ATOM 0 HD3 LYS C 39 71.932 8.866 -6.003 1.00 0.00 H new ATOM 0 HE2 LYS C 39 73.436 11.139 -5.140 1.00 0.00 H new ATOM 0 HE3 LYS C 39 74.637 9.926 -5.539 1.00 0.00 H new ATOM 0 HZ1 LYS C 39 73.905 11.125 -7.536 1.00 0.00 H new ATOM 0 HZ2 LYS C 39 73.459 9.490 -7.638 1.00 0.00 H new ATOM 0 HZ3 LYS C 39 72.295 10.665 -7.252 1.00 0.00 H new ATOM 601 N GLU C 40 68.626 6.842 -3.620 1.00 0.00 N ATOM 602 CA GLU C 40 67.612 6.208 -4.509 1.00 0.00 C ATOM 603 C GLU C 40 66.239 6.261 -3.835 1.00 0.00 C ATOM 604 O GLU C 40 65.213 6.221 -4.485 1.00 0.00 O ATOM 605 CB GLU C 40 68.068 4.757 -4.671 1.00 0.00 C ATOM 606 CG GLU C 40 69.554 4.721 -5.029 1.00 0.00 C ATOM 607 CD GLU C 40 69.760 5.323 -6.419 1.00 0.00 C ATOM 608 OE1 GLU C 40 69.437 4.654 -7.387 1.00 0.00 O ATOM 609 OE2 GLU C 40 70.239 6.443 -6.494 1.00 0.00 O ATOM 0 H GLU C 40 69.094 6.206 -2.974 1.00 0.00 H new ATOM 0 HA GLU C 40 67.528 6.713 -5.471 1.00 0.00 H new ATOM 0 HB2 GLU C 40 67.893 4.205 -3.747 1.00 0.00 H new ATOM 0 HB3 GLU C 40 67.484 4.267 -5.450 1.00 0.00 H new ATOM 0 HG2 GLU C 40 70.130 5.279 -4.291 1.00 0.00 H new ATOM 0 HG3 GLU C 40 69.919 3.694 -5.008 1.00 0.00 H new ATOM 616 N LEU C 41 66.220 6.350 -2.534 1.00 0.00 N ATOM 617 CA LEU C 41 64.921 6.407 -1.806 1.00 0.00 C ATOM 618 C LEU C 41 64.359 7.830 -1.845 1.00 0.00 C ATOM 619 O LEU C 41 63.297 8.073 -2.386 1.00 0.00 O ATOM 620 CB LEU C 41 65.258 5.999 -0.372 1.00 0.00 C ATOM 621 CG LEU C 41 63.992 5.506 0.330 1.00 0.00 C ATOM 622 CD1 LEU C 41 62.906 6.577 0.230 1.00 0.00 C ATOM 623 CD2 LEU C 41 63.505 4.220 -0.342 1.00 0.00 C ATOM 0 H LEU C 41 67.050 6.386 -1.942 1.00 0.00 H new ATOM 0 HA LEU C 41 64.166 5.757 -2.248 1.00 0.00 H new ATOM 0 HB2 LEU C 41 66.014 5.214 -0.374 1.00 0.00 H new ATOM 0 HB3 LEU C 41 65.680 6.846 0.169 1.00 0.00 H new ATOM 0 HG LEU C 41 64.211 5.307 1.379 1.00 0.00 H new ATOM 0 HD11 LEU C 41 62.003 6.227 0.730 1.00 0.00 H new ATOM 0 HD12 LEU C 41 63.253 7.493 0.708 1.00 0.00 H new ATOM 0 HD13 LEU C 41 62.686 6.776 -0.819 1.00 0.00 H new ATOM 0 HD21 LEU C 41 62.603 3.868 0.158 1.00 0.00 H new ATOM 0 HD22 LEU C 41 63.285 4.418 -1.391 1.00 0.00 H new ATOM 0 HD23 LEU C 41 64.280 3.457 -0.272 1.00 0.00 H new ATOM 635 N GLY C 42 65.062 8.773 -1.282 1.00 0.00 N ATOM 636 CA GLY C 42 64.566 10.178 -1.293 1.00 0.00 C ATOM 637 C GLY C 42 64.097 10.538 -2.703 1.00 0.00 C ATOM 638 O GLY C 42 63.206 11.344 -2.885 1.00 0.00 O ATOM 0 H GLY C 42 65.958 8.632 -0.815 1.00 0.00 H new ATOM 0 HA2 GLY C 42 63.745 10.292 -0.584 1.00 0.00 H new ATOM 0 HA3 GLY C 42 65.357 10.857 -0.976 1.00 0.00 H new ATOM 642 N LYS C 43 64.690 9.944 -3.703 1.00 0.00 N ATOM 643 CA LYS C 43 64.277 10.249 -5.104 1.00 0.00 C ATOM 644 C LYS C 43 62.756 10.155 -5.238 1.00 0.00 C ATOM 645 O LYS C 43 62.144 10.876 -6.001 1.00 0.00 O ATOM 646 CB LYS C 43 64.959 9.178 -5.957 1.00 0.00 C ATOM 647 CG LYS C 43 65.620 9.833 -7.170 1.00 0.00 C ATOM 648 CD LYS C 43 65.386 8.969 -8.406 1.00 0.00 C ATOM 649 CE LYS C 43 65.383 9.852 -9.656 1.00 0.00 C ATOM 650 NZ LYS C 43 64.291 9.307 -10.510 1.00 0.00 N ATOM 0 H LYS C 43 65.442 9.261 -3.611 1.00 0.00 H new ATOM 0 HA LYS C 43 64.560 11.256 -5.410 1.00 0.00 H new ATOM 0 HB2 LYS C 43 65.705 8.648 -5.365 1.00 0.00 H new ATOM 0 HB3 LYS C 43 64.228 8.439 -6.284 1.00 0.00 H new ATOM 0 HG2 LYS C 43 65.209 10.830 -7.327 1.00 0.00 H new ATOM 0 HG3 LYS C 43 66.689 9.953 -6.994 1.00 0.00 H new ATOM 0 HD2 LYS C 43 66.166 8.211 -8.485 1.00 0.00 H new ATOM 0 HD3 LYS C 43 64.436 8.441 -8.319 1.00 0.00 H new ATOM 0 HE2 LYS C 43 65.201 10.896 -9.401 1.00 0.00 H new ATOM 0 HE3 LYS C 43 66.343 9.812 -10.170 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 64.227 9.862 -11.387 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 64.495 8.314 -10.742 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 63.388 9.365 -9.997 1.00 0.00 H new ATOM 664 N VAL C 44 62.141 9.272 -4.501 1.00 0.00 N ATOM 665 CA VAL C 44 60.659 9.134 -4.587 1.00 0.00 C ATOM 666 C VAL C 44 59.981 10.132 -3.645 1.00 0.00 C ATOM 667 O VAL C 44 58.879 10.580 -3.889 1.00 0.00 O ATOM 668 CB VAL C 44 60.369 7.700 -4.150 1.00 0.00 C ATOM 669 CG1 VAL C 44 58.880 7.554 -3.834 1.00 0.00 C ATOM 670 CG2 VAL C 44 60.746 6.738 -5.279 1.00 0.00 C ATOM 0 H VAL C 44 62.599 8.641 -3.844 1.00 0.00 H new ATOM 0 HA VAL C 44 60.282 9.337 -5.589 1.00 0.00 H new ATOM 0 HB VAL C 44 60.954 7.466 -3.261 1.00 0.00 H new ATOM 0 HG11 VAL C 44 58.673 6.530 -3.522 1.00 0.00 H new ATOM 0 HG12 VAL C 44 58.609 8.240 -3.031 1.00 0.00 H new ATOM 0 HG13 VAL C 44 58.295 7.788 -4.723 1.00 0.00 H new ATOM 0 HG21 VAL C 44 60.540 5.714 -4.968 1.00 0.00 H new ATOM 0 HG22 VAL C 44 60.160 6.973 -6.168 1.00 0.00 H new ATOM 0 HG23 VAL C 44 61.807 6.841 -5.506 1.00 0.00 H new ATOM 680 N MET C 45 60.632 10.484 -2.569 1.00 0.00 N ATOM 681 CA MET C 45 60.025 11.454 -1.614 1.00 0.00 C ATOM 682 C MET C 45 59.708 12.770 -2.329 1.00 0.00 C ATOM 683 O MET C 45 58.732 13.430 -2.035 1.00 0.00 O ATOM 684 CB MET C 45 61.087 11.668 -0.535 1.00 0.00 C ATOM 685 CG MET C 45 60.916 10.621 0.567 1.00 0.00 C ATOM 686 SD MET C 45 61.154 8.967 -0.130 1.00 0.00 S ATOM 687 CE MET C 45 59.419 8.632 -0.514 1.00 0.00 C ATOM 0 H MET C 45 61.557 10.142 -2.311 1.00 0.00 H new ATOM 0 HA MET C 45 59.088 11.089 -1.193 1.00 0.00 H new ATOM 0 HB2 MET C 45 62.083 11.593 -0.971 1.00 0.00 H new ATOM 0 HB3 MET C 45 60.997 12.670 -0.116 1.00 0.00 H new ATOM 0 HG2 MET C 45 61.636 10.798 1.366 1.00 0.00 H new ATOM 0 HG3 MET C 45 59.923 10.702 1.009 1.00 0.00 H new ATOM 0 HE1 MET C 45 59.130 7.673 -0.085 1.00 0.00 H new ATOM 0 HE2 MET C 45 58.795 9.421 -0.094 1.00 0.00 H new ATOM 0 HE3 MET C 45 59.285 8.601 -1.595 1.00 0.00 H new ATOM 697 N ARG C 46 60.529 13.156 -3.269 1.00 0.00 N ATOM 698 CA ARG C 46 60.274 14.429 -4.003 1.00 0.00 C ATOM 699 C ARG C 46 59.116 14.244 -4.988 1.00 0.00 C ATOM 700 O ARG C 46 58.506 15.198 -5.431 1.00 0.00 O ATOM 701 CB ARG C 46 61.577 14.725 -4.750 1.00 0.00 C ATOM 702 CG ARG C 46 61.705 13.788 -5.952 1.00 0.00 C ATOM 703 CD ARG C 46 63.185 13.548 -6.258 1.00 0.00 C ATOM 704 NE ARG C 46 63.482 14.419 -7.429 1.00 0.00 N ATOM 705 CZ ARG C 46 64.700 14.496 -7.897 1.00 0.00 C ATOM 706 NH1 ARG C 46 65.630 13.703 -7.435 1.00 0.00 N ATOM 707 NH2 ARG C 46 64.987 15.364 -8.827 1.00 0.00 N ATOM 0 H ARG C 46 61.363 12.646 -3.560 1.00 0.00 H new ATOM 0 HA ARG C 46 59.996 15.245 -3.336 1.00 0.00 H new ATOM 0 HB2 ARG C 46 61.589 15.763 -5.083 1.00 0.00 H new ATOM 0 HB3 ARG C 46 62.428 14.594 -4.082 1.00 0.00 H new ATOM 0 HG2 ARG C 46 61.208 12.841 -5.743 1.00 0.00 H new ATOM 0 HG3 ARG C 46 61.209 14.223 -6.820 1.00 0.00 H new ATOM 0 HD2 ARG C 46 63.812 13.807 -5.404 1.00 0.00 H new ATOM 0 HD3 ARG C 46 63.376 12.500 -6.487 1.00 0.00 H new ATOM 0 HE ARG C 46 62.734 14.956 -7.867 1.00 0.00 H new ATOM 0 HH11 ARG C 46 65.406 13.023 -6.708 1.00 0.00 H new ATOM 0 HH12 ARG C 46 66.580 13.764 -7.801 1.00 0.00 H new ATOM 0 HH21 ARG C 46 64.261 15.982 -9.189 1.00 0.00 H new ATOM 0 HH22 ARG C 46 65.937 15.424 -9.192 1.00 0.00 H new ATOM 721 N MET C 47 58.809 13.024 -5.333 1.00 0.00 N ATOM 722 CA MET C 47 57.690 12.778 -6.289 1.00 0.00 C ATOM 723 C MET C 47 56.357 12.726 -5.537 1.00 0.00 C ATOM 724 O MET C 47 55.336 13.162 -6.033 1.00 0.00 O ATOM 725 CB MET C 47 58.003 11.424 -6.924 1.00 0.00 C ATOM 726 CG MET C 47 58.409 11.628 -8.384 1.00 0.00 C ATOM 727 SD MET C 47 59.449 10.248 -8.921 1.00 0.00 S ATOM 728 CE MET C 47 58.419 8.918 -8.253 1.00 0.00 C ATOM 0 H MET C 47 59.284 12.187 -4.995 1.00 0.00 H new ATOM 0 HA MET C 47 57.602 13.566 -7.037 1.00 0.00 H new ATOM 0 HB2 MET C 47 58.807 10.931 -6.377 1.00 0.00 H new ATOM 0 HB3 MET C 47 57.131 10.772 -6.865 1.00 0.00 H new ATOM 0 HG2 MET C 47 57.521 11.694 -9.013 1.00 0.00 H new ATOM 0 HG3 MET C 47 58.949 12.568 -8.494 1.00 0.00 H new ATOM 0 HE1 MET C 47 58.700 7.972 -8.717 1.00 0.00 H new ATOM 0 HE2 MET C 47 58.566 8.851 -7.175 1.00 0.00 H new ATOM 0 HE3 MET C 47 57.371 9.129 -8.464 1.00 0.00 H new ATOM 738 N LEU C 48 56.358 12.198 -4.345 1.00 0.00 N ATOM 739 CA LEU C 48 55.092 12.122 -3.563 1.00 0.00 C ATOM 740 C LEU C 48 54.802 13.472 -2.903 1.00 0.00 C ATOM 741 O LEU C 48 53.762 13.672 -2.306 1.00 0.00 O ATOM 742 CB LEU C 48 55.344 11.051 -2.501 1.00 0.00 C ATOM 743 CG LEU C 48 55.669 9.721 -3.183 1.00 0.00 C ATOM 744 CD1 LEU C 48 56.664 8.939 -2.325 1.00 0.00 C ATOM 745 CD2 LEU C 48 54.384 8.903 -3.343 1.00 0.00 C ATOM 0 H LEU C 48 57.180 11.816 -3.878 1.00 0.00 H new ATOM 0 HA LEU C 48 54.233 11.880 -4.189 1.00 0.00 H new ATOM 0 HB2 LEU C 48 56.169 11.352 -1.855 1.00 0.00 H new ATOM 0 HB3 LEU C 48 54.465 10.941 -1.865 1.00 0.00 H new ATOM 0 HG LEU C 48 56.104 9.912 -4.164 1.00 0.00 H new ATOM 0 HD11 LEU C 48 56.896 7.991 -2.810 1.00 0.00 H new ATOM 0 HD12 LEU C 48 57.579 9.520 -2.208 1.00 0.00 H new ATOM 0 HD13 LEU C 48 56.227 8.748 -1.345 1.00 0.00 H new ATOM 0 HD21 LEU C 48 54.614 7.955 -3.829 1.00 0.00 H new ATOM 0 HD22 LEU C 48 53.950 8.712 -2.362 1.00 0.00 H new ATOM 0 HD23 LEU C 48 53.672 9.459 -3.952 1.00 0.00 H new ATOM 757 N GLY C 49 55.714 14.399 -3.004 1.00 0.00 N ATOM 758 CA GLY C 49 55.494 15.734 -2.381 1.00 0.00 C ATOM 759 C GLY C 49 56.204 15.786 -1.029 1.00 0.00 C ATOM 760 O GLY C 49 55.714 16.366 -0.080 1.00 0.00 O ATOM 0 H GLY C 49 56.603 14.289 -3.492 1.00 0.00 H new ATOM 0 HA2 GLY C 49 55.874 16.520 -3.034 1.00 0.00 H new ATOM 0 HA3 GLY C 49 54.427 15.916 -2.251 1.00 0.00 H new ATOM 764 N GLN C 50 57.357 15.182 -0.931 1.00 0.00 N ATOM 765 CA GLN C 50 58.097 15.197 0.363 1.00 0.00 C ATOM 766 C GLN C 50 59.608 15.221 0.115 1.00 0.00 C ATOM 767 O GLN C 50 60.064 15.182 -1.011 1.00 0.00 O ATOM 768 CB GLN C 50 57.690 13.901 1.066 1.00 0.00 C ATOM 769 CG GLN C 50 57.068 14.233 2.423 1.00 0.00 C ATOM 770 CD GLN C 50 56.322 13.009 2.958 1.00 0.00 C ATOM 771 OE1 GLN C 50 56.916 12.134 3.557 1.00 0.00 O ATOM 772 NE2 GLN C 50 55.035 12.908 2.766 1.00 0.00 N ATOM 0 H GLN C 50 57.818 14.680 -1.690 1.00 0.00 H new ATOM 0 HA GLN C 50 57.862 16.078 0.960 1.00 0.00 H new ATOM 0 HB2 GLN C 50 56.978 13.350 0.452 1.00 0.00 H new ATOM 0 HB3 GLN C 50 58.560 13.258 1.200 1.00 0.00 H new ATOM 0 HG2 GLN C 50 57.844 14.535 3.126 1.00 0.00 H new ATOM 0 HG3 GLN C 50 56.383 15.075 2.324 1.00 0.00 H new ATOM 0 HE21 GLN C 50 54.535 13.642 2.264 1.00 0.00 H new ATOM 0 HE22 GLN C 50 54.529 12.096 3.118 1.00 0.00 H new ATOM 781 N ASN C 51 60.387 15.286 1.160 1.00 0.00 N ATOM 782 CA ASN C 51 61.867 15.315 0.991 1.00 0.00 C ATOM 783 C ASN C 51 62.552 15.315 2.359 1.00 0.00 C ATOM 784 O ASN C 51 62.907 16.356 2.876 1.00 0.00 O ATOM 785 CB ASN C 51 62.153 16.620 0.246 1.00 0.00 C ATOM 786 CG ASN C 51 63.044 16.335 -0.964 1.00 0.00 C ATOM 787 OD1 ASN C 51 62.741 16.748 -2.066 1.00 0.00 O ATOM 788 ND2 ASN C 51 64.139 15.644 -0.806 1.00 0.00 N ATOM 0 H ASN C 51 60.061 15.320 2.126 1.00 0.00 H new ATOM 0 HA ASN C 51 62.241 14.446 0.449 1.00 0.00 H new ATOM 0 HB2 ASN C 51 61.218 17.078 -0.078 1.00 0.00 H new ATOM 0 HB3 ASN C 51 62.643 17.331 0.912 1.00 0.00 H new ATOM 0 HD21 ASN C 51 64.740 15.451 -1.607 1.00 0.00 H new ATOM 0 HD22 ASN C 51 64.394 15.297 0.119 1.00 0.00 H new ATOM 795 N PRO C 52 62.712 14.139 2.901 1.00 0.00 N ATOM 796 CA PRO C 52 63.357 13.993 4.227 1.00 0.00 C ATOM 797 C PRO C 52 64.864 14.249 4.122 1.00 0.00 C ATOM 798 O PRO C 52 65.494 13.908 3.141 1.00 0.00 O ATOM 799 CB PRO C 52 63.073 12.542 4.606 1.00 0.00 C ATOM 800 CG PRO C 52 62.863 11.835 3.305 1.00 0.00 C ATOM 801 CD PRO C 52 62.310 12.848 2.335 1.00 0.00 C ATOM 0 HA PRO C 52 62.983 14.701 4.966 1.00 0.00 H new ATOM 0 HB2 PRO C 52 63.906 12.109 5.160 1.00 0.00 H new ATOM 0 HB3 PRO C 52 62.192 12.466 5.243 1.00 0.00 H new ATOM 0 HG2 PRO C 52 63.801 11.420 2.936 1.00 0.00 H new ATOM 0 HG3 PRO C 52 62.172 11.001 3.427 1.00 0.00 H new ATOM 0 HD2 PRO C 52 62.718 12.707 1.334 1.00 0.00 H new ATOM 0 HD3 PRO C 52 61.226 12.769 2.251 1.00 0.00 H new ATOM 809 N THR C 53 65.441 14.850 5.124 1.00 0.00 N ATOM 810 CA THR C 53 66.905 15.131 5.086 1.00 0.00 C ATOM 811 C THR C 53 67.691 13.831 4.892 1.00 0.00 C ATOM 812 O THR C 53 67.135 12.753 4.966 1.00 0.00 O ATOM 813 CB THR C 53 67.218 15.753 6.448 1.00 0.00 C ATOM 814 OG1 THR C 53 66.361 15.189 7.431 1.00 0.00 O ATOM 815 CG2 THR C 53 66.997 17.265 6.383 1.00 0.00 C ATOM 0 H THR C 53 64.962 15.160 5.970 1.00 0.00 H new ATOM 0 HA THR C 53 67.180 15.789 4.262 1.00 0.00 H new ATOM 0 HB THR C 53 68.256 15.551 6.711 1.00 0.00 H new ATOM 0 HG1 THR C 53 66.561 15.585 8.305 1.00 0.00 H new ATOM 0 HG21 THR C 53 67.220 17.707 7.354 1.00 0.00 H new ATOM 0 HG22 THR C 53 67.654 17.697 5.628 1.00 0.00 H new ATOM 0 HG23 THR C 53 65.959 17.470 6.121 1.00 0.00 H new ATOM 823 N PRO C 54 68.967 13.979 4.650 1.00 0.00 N ATOM 824 CA PRO C 54 69.844 12.799 4.444 1.00 0.00 C ATOM 825 C PRO C 54 70.052 12.055 5.766 1.00 0.00 C ATOM 826 O PRO C 54 70.250 10.856 5.790 1.00 0.00 O ATOM 827 CB PRO C 54 71.151 13.408 3.942 1.00 0.00 C ATOM 828 CG PRO C 54 71.148 14.811 4.461 1.00 0.00 C ATOM 829 CD PRO C 54 69.707 15.242 4.549 1.00 0.00 C ATOM 0 HA PRO C 54 69.430 12.068 3.749 1.00 0.00 H new ATOM 0 HB2 PRO C 54 72.013 12.852 4.311 1.00 0.00 H new ATOM 0 HB3 PRO C 54 71.203 13.390 2.853 1.00 0.00 H new ATOM 0 HG2 PRO C 54 71.627 14.862 5.439 1.00 0.00 H new ATOM 0 HG3 PRO C 54 71.708 15.470 3.797 1.00 0.00 H new ATOM 0 HD2 PRO C 54 69.532 15.878 5.417 1.00 0.00 H new ATOM 0 HD3 PRO C 54 69.406 15.812 3.670 1.00 0.00 H new ATOM 837 N GLU C 55 70.003 12.755 6.865 1.00 0.00 N ATOM 838 CA GLU C 55 70.190 12.084 8.182 1.00 0.00 C ATOM 839 C GLU C 55 68.899 11.373 8.594 1.00 0.00 C ATOM 840 O GLU C 55 68.905 10.470 9.406 1.00 0.00 O ATOM 841 CB GLU C 55 70.514 13.214 9.161 1.00 0.00 C ATOM 842 CG GLU C 55 69.391 14.253 9.128 1.00 0.00 C ATOM 843 CD GLU C 55 69.463 15.122 10.385 1.00 0.00 C ATOM 844 OE1 GLU C 55 70.502 15.720 10.607 1.00 0.00 O ATOM 845 OE2 GLU C 55 68.479 15.171 11.103 1.00 0.00 O ATOM 0 H GLU C 55 69.842 13.761 6.908 1.00 0.00 H new ATOM 0 HA GLU C 55 70.977 11.331 8.156 1.00 0.00 H new ATOM 0 HB2 GLU C 55 70.626 12.815 10.169 1.00 0.00 H new ATOM 0 HB3 GLU C 55 71.463 13.680 8.895 1.00 0.00 H new ATOM 0 HG2 GLU C 55 69.482 14.875 8.237 1.00 0.00 H new ATOM 0 HG3 GLU C 55 68.423 13.756 9.072 1.00 0.00 H new ATOM 852 N GLU C 56 67.790 11.778 8.037 1.00 0.00 N ATOM 853 CA GLU C 56 66.496 11.129 8.394 1.00 0.00 C ATOM 854 C GLU C 56 66.269 9.891 7.522 1.00 0.00 C ATOM 855 O GLU C 56 65.716 8.903 7.961 1.00 0.00 O ATOM 856 CB GLU C 56 65.432 12.188 8.109 1.00 0.00 C ATOM 857 CG GLU C 56 65.243 13.067 9.347 1.00 0.00 C ATOM 858 CD GLU C 56 63.902 13.796 9.259 1.00 0.00 C ATOM 859 OE1 GLU C 56 62.945 13.184 8.815 1.00 0.00 O ATOM 860 OE2 GLU C 56 63.854 14.955 9.637 1.00 0.00 O ATOM 0 H GLU C 56 67.724 12.530 7.351 1.00 0.00 H new ATOM 0 HA GLU C 56 66.472 10.796 9.431 1.00 0.00 H new ATOM 0 HB2 GLU C 56 65.731 12.800 7.258 1.00 0.00 H new ATOM 0 HB3 GLU C 56 64.490 11.710 7.842 1.00 0.00 H new ATOM 0 HG2 GLU C 56 65.277 12.455 10.248 1.00 0.00 H new ATOM 0 HG3 GLU C 56 66.057 13.789 9.421 1.00 0.00 H new ATOM 867 N LEU C 57 66.694 9.939 6.288 1.00 0.00 N ATOM 868 CA LEU C 57 66.503 8.766 5.389 1.00 0.00 C ATOM 869 C LEU C 57 67.166 7.525 5.995 1.00 0.00 C ATOM 870 O LEU C 57 66.585 6.460 6.041 1.00 0.00 O ATOM 871 CB LEU C 57 67.185 9.158 4.078 1.00 0.00 C ATOM 872 CG LEU C 57 66.169 9.830 3.154 1.00 0.00 C ATOM 873 CD1 LEU C 57 66.866 10.274 1.866 1.00 0.00 C ATOM 874 CD2 LEU C 57 65.054 8.838 2.813 1.00 0.00 C ATOM 0 H LEU C 57 67.164 10.739 5.865 1.00 0.00 H new ATOM 0 HA LEU C 57 65.451 8.522 5.241 1.00 0.00 H new ATOM 0 HB2 LEU C 57 68.015 9.836 4.276 1.00 0.00 H new ATOM 0 HB3 LEU C 57 67.603 8.275 3.595 1.00 0.00 H new ATOM 0 HG LEU C 57 65.742 10.699 3.655 1.00 0.00 H new ATOM 0 HD11 LEU C 57 66.142 10.753 1.207 1.00 0.00 H new ATOM 0 HD12 LEU C 57 67.660 10.980 2.107 1.00 0.00 H new ATOM 0 HD13 LEU C 57 67.293 9.405 1.365 1.00 0.00 H new ATOM 0 HD21 LEU C 57 64.330 9.317 2.154 1.00 0.00 H new ATOM 0 HD22 LEU C 57 65.481 7.969 2.312 1.00 0.00 H new ATOM 0 HD23 LEU C 57 64.557 8.521 3.729 1.00 0.00 H new ATOM 886 N GLN C 58 68.377 7.657 6.464 1.00 0.00 N ATOM 887 CA GLN C 58 69.072 6.486 7.070 1.00 0.00 C ATOM 888 C GLN C 58 68.125 5.758 8.028 1.00 0.00 C ATOM 889 O GLN C 58 68.243 4.570 8.251 1.00 0.00 O ATOM 890 CB GLN C 58 70.260 7.077 7.829 1.00 0.00 C ATOM 891 CG GLN C 58 71.542 6.343 7.424 1.00 0.00 C ATOM 892 CD GLN C 58 72.049 5.510 8.603 1.00 0.00 C ATOM 893 OE1 GLN C 58 72.260 6.027 9.682 1.00 0.00 O ATOM 894 NE2 GLN C 58 72.256 4.231 8.441 1.00 0.00 N ATOM 0 H GLN C 58 68.914 8.524 6.454 1.00 0.00 H new ATOM 0 HA GLN C 58 69.393 5.759 6.324 1.00 0.00 H new ATOM 0 HB2 GLN C 58 70.353 8.141 7.609 1.00 0.00 H new ATOM 0 HB3 GLN C 58 70.100 6.986 8.903 1.00 0.00 H new ATOM 0 HG2 GLN C 58 71.349 5.699 6.566 1.00 0.00 H new ATOM 0 HG3 GLN C 58 72.303 7.061 7.118 1.00 0.00 H new ATOM 0 HE21 GLN C 58 72.079 3.796 7.535 1.00 0.00 H new ATOM 0 HE22 GLN C 58 72.595 3.666 9.220 1.00 0.00 H new ATOM 903 N GLU C 59 67.183 6.463 8.591 1.00 0.00 N ATOM 904 CA GLU C 59 66.223 5.813 9.528 1.00 0.00 C ATOM 905 C GLU C 59 65.392 4.770 8.778 1.00 0.00 C ATOM 906 O GLU C 59 65.085 3.715 9.297 1.00 0.00 O ATOM 907 CB GLU C 59 65.333 6.948 10.035 1.00 0.00 C ATOM 908 CG GLU C 59 64.884 6.646 11.466 1.00 0.00 C ATOM 909 CD GLU C 59 66.112 6.512 12.368 1.00 0.00 C ATOM 910 OE1 GLU C 59 66.740 7.524 12.635 1.00 0.00 O ATOM 911 OE2 GLU C 59 66.403 5.400 12.779 1.00 0.00 O ATOM 0 H GLU C 59 67.036 7.461 8.443 1.00 0.00 H new ATOM 0 HA GLU C 59 66.724 5.296 10.347 1.00 0.00 H new ATOM 0 HB2 GLU C 59 65.877 7.892 10.005 1.00 0.00 H new ATOM 0 HB3 GLU C 59 64.464 7.060 9.386 1.00 0.00 H new ATOM 0 HG2 GLU C 59 64.236 7.443 11.831 1.00 0.00 H new ATOM 0 HG3 GLU C 59 64.300 5.726 11.489 1.00 0.00 H new ATOM 918 N MET C 60 65.032 5.057 7.557 1.00 0.00 N ATOM 919 CA MET C 60 64.227 4.082 6.768 1.00 0.00 C ATOM 920 C MET C 60 65.097 2.885 6.380 1.00 0.00 C ATOM 921 O MET C 60 64.605 1.807 6.112 1.00 0.00 O ATOM 922 CB MET C 60 63.783 4.850 5.523 1.00 0.00 C ATOM 923 CG MET C 60 62.358 5.370 5.725 1.00 0.00 C ATOM 924 SD MET C 60 61.975 6.589 4.443 1.00 0.00 S ATOM 925 CE MET C 60 60.768 7.546 5.392 1.00 0.00 C ATOM 0 H MET C 60 65.261 5.925 7.072 1.00 0.00 H new ATOM 0 HA MET C 60 63.376 3.693 7.328 1.00 0.00 H new ATOM 0 HB2 MET C 60 64.462 5.682 5.335 1.00 0.00 H new ATOM 0 HB3 MET C 60 63.824 4.201 4.648 1.00 0.00 H new ATOM 0 HG2 MET C 60 61.648 4.544 5.681 1.00 0.00 H new ATOM 0 HG3 MET C 60 62.260 5.821 6.712 1.00 0.00 H new ATOM 0 HE1 MET C 60 60.004 7.936 4.720 1.00 0.00 H new ATOM 0 HE2 MET C 60 60.301 6.904 6.139 1.00 0.00 H new ATOM 0 HE3 MET C 60 61.271 8.375 5.890 1.00 0.00 H new ATOM 935 N ILE C 61 66.389 3.066 6.354 1.00 0.00 N ATOM 936 CA ILE C 61 67.295 1.941 5.989 1.00 0.00 C ATOM 937 C ILE C 61 67.679 1.154 7.244 1.00 0.00 C ATOM 938 O ILE C 61 67.682 -0.060 7.251 1.00 0.00 O ATOM 939 CB ILE C 61 68.524 2.609 5.373 1.00 0.00 C ATOM 940 CG1 ILE C 61 68.168 3.147 3.985 1.00 0.00 C ATOM 941 CG2 ILE C 61 69.653 1.584 5.247 1.00 0.00 C ATOM 942 CD1 ILE C 61 67.614 4.567 4.116 1.00 0.00 C ATOM 0 H ILE C 61 66.857 3.946 6.570 1.00 0.00 H new ATOM 0 HA ILE C 61 66.830 1.236 5.300 1.00 0.00 H new ATOM 0 HB ILE C 61 68.849 3.431 6.011 1.00 0.00 H new ATOM 0 HG12 ILE C 61 69.051 3.147 3.346 1.00 0.00 H new ATOM 0 HG13 ILE C 61 67.431 2.500 3.510 1.00 0.00 H new ATOM 0 HG21 ILE C 61 70.529 2.060 4.808 1.00 0.00 H new ATOM 0 HG22 ILE C 61 69.906 1.198 6.235 1.00 0.00 H new ATOM 0 HG23 ILE C 61 69.329 0.762 4.609 1.00 0.00 H new ATOM 0 HD11 ILE C 61 67.360 4.951 3.128 1.00 0.00 H new ATOM 0 HD12 ILE C 61 66.721 4.553 4.740 1.00 0.00 H new ATOM 0 HD13 ILE C 61 68.366 5.210 4.573 1.00 0.00 H new ATOM 954 N ASP C 62 68.001 1.839 8.308 1.00 0.00 N ATOM 955 CA ASP C 62 68.380 1.131 9.565 1.00 0.00 C ATOM 956 C ASP C 62 67.131 0.562 10.242 1.00 0.00 C ATOM 957 O ASP C 62 67.214 -0.222 11.166 1.00 0.00 O ATOM 958 CB ASP C 62 69.024 2.203 10.444 1.00 0.00 C ATOM 959 CG ASP C 62 70.544 2.023 10.439 1.00 0.00 C ATOM 960 OD1 ASP C 62 71.060 1.544 9.443 1.00 0.00 O ATOM 961 OD2 ASP C 62 71.163 2.367 11.432 1.00 0.00 O ATOM 0 H ASP C 62 68.018 2.857 8.361 1.00 0.00 H new ATOM 0 HA ASP C 62 69.055 0.295 9.383 1.00 0.00 H new ATOM 0 HB2 ASP C 62 68.764 3.195 10.075 1.00 0.00 H new ATOM 0 HB3 ASP C 62 68.642 2.131 11.462 1.00 0.00 H new ATOM 966 N GLU C 63 65.972 0.954 9.788 1.00 0.00 N ATOM 967 CA GLU C 63 64.714 0.440 10.403 1.00 0.00 C ATOM 968 C GLU C 63 64.525 -1.042 10.067 1.00 0.00 C ATOM 969 O GLU C 63 63.740 -1.732 10.686 1.00 0.00 O ATOM 970 CB GLU C 63 63.600 1.277 9.776 1.00 0.00 C ATOM 971 CG GLU C 63 63.015 2.221 10.829 1.00 0.00 C ATOM 972 CD GLU C 63 61.694 2.799 10.319 1.00 0.00 C ATOM 973 OE1 GLU C 63 60.726 2.059 10.263 1.00 0.00 O ATOM 974 OE2 GLU C 63 61.672 3.976 9.993 1.00 0.00 O ATOM 0 H GLU C 63 65.841 1.609 9.017 1.00 0.00 H new ATOM 0 HA GLU C 63 64.724 0.519 11.490 1.00 0.00 H new ATOM 0 HB2 GLU C 63 63.991 1.850 8.935 1.00 0.00 H new ATOM 0 HB3 GLU C 63 62.819 0.626 9.382 1.00 0.00 H new ATOM 0 HG2 GLU C 63 62.853 1.684 11.764 1.00 0.00 H new ATOM 0 HG3 GLU C 63 63.718 3.026 11.042 1.00 0.00 H new ATOM 981 N VAL C 64 65.236 -1.536 9.090 1.00 0.00 N ATOM 982 CA VAL C 64 65.090 -2.973 8.718 1.00 0.00 C ATOM 983 C VAL C 64 66.449 -3.567 8.339 1.00 0.00 C ATOM 984 O VAL C 64 66.532 -4.641 7.776 1.00 0.00 O ATOM 985 CB VAL C 64 64.149 -2.977 7.514 1.00 0.00 C ATOM 986 CG1 VAL C 64 62.721 -2.684 7.980 1.00 0.00 C ATOM 987 CG2 VAL C 64 64.589 -1.900 6.519 1.00 0.00 C ATOM 0 H VAL C 64 65.910 -1.009 8.535 1.00 0.00 H new ATOM 0 HA VAL C 64 64.703 -3.573 9.541 1.00 0.00 H new ATOM 0 HB VAL C 64 64.182 -3.954 7.032 1.00 0.00 H new ATOM 0 HG11 VAL C 64 62.050 -2.687 7.121 1.00 0.00 H new ATOM 0 HG12 VAL C 64 62.406 -3.449 8.689 1.00 0.00 H new ATOM 0 HG13 VAL C 64 62.689 -1.707 8.462 1.00 0.00 H new ATOM 0 HG21 VAL C 64 63.918 -1.902 5.660 1.00 0.00 H new ATOM 0 HG22 VAL C 64 64.557 -0.923 7.002 1.00 0.00 H new ATOM 0 HG23 VAL C 64 65.606 -2.106 6.186 1.00 0.00 H new ATOM 997 N ASP C 65 67.516 -2.880 8.643 1.00 0.00 N ATOM 998 CA ASP C 65 68.867 -3.410 8.300 1.00 0.00 C ATOM 999 C ASP C 65 69.249 -4.545 9.254 1.00 0.00 C ATOM 1000 O ASP C 65 69.902 -4.331 10.256 1.00 0.00 O ATOM 1001 CB ASP C 65 69.816 -2.223 8.473 1.00 0.00 C ATOM 1002 CG ASP C 65 71.100 -2.476 7.681 1.00 0.00 C ATOM 1003 OD1 ASP C 65 71.280 -3.593 7.223 1.00 0.00 O ATOM 1004 OD2 ASP C 65 71.882 -1.549 7.546 1.00 0.00 O ATOM 0 H ASP C 65 67.511 -1.975 9.114 1.00 0.00 H new ATOM 0 HA ASP C 65 68.905 -3.818 7.290 1.00 0.00 H new ATOM 0 HB2 ASP C 65 69.337 -1.307 8.126 1.00 0.00 H new ATOM 0 HB3 ASP C 65 70.049 -2.081 9.528 1.00 0.00 H new ATOM 1009 N GLU C 66 68.849 -5.749 8.950 1.00 0.00 N ATOM 1010 CA GLU C 66 69.189 -6.895 9.841 1.00 0.00 C ATOM 1011 C GLU C 66 70.606 -7.396 9.543 1.00 0.00 C ATOM 1012 O GLU C 66 71.023 -8.431 10.024 1.00 0.00 O ATOM 1013 CB GLU C 66 68.159 -7.974 9.509 1.00 0.00 C ATOM 1014 CG GLU C 66 67.796 -8.741 10.782 1.00 0.00 C ATOM 1015 CD GLU C 66 66.322 -9.146 10.733 1.00 0.00 C ATOM 1016 OE1 GLU C 66 65.484 -8.290 10.966 1.00 0.00 O ATOM 1017 OE2 GLU C 66 66.055 -10.305 10.463 1.00 0.00 O ATOM 0 H GLU C 66 68.302 -5.989 8.124 1.00 0.00 H new ATOM 0 HA GLU C 66 69.165 -6.619 10.895 1.00 0.00 H new ATOM 0 HB2 GLU C 66 67.267 -7.520 9.078 1.00 0.00 H new ATOM 0 HB3 GLU C 66 68.561 -8.658 8.762 1.00 0.00 H new ATOM 0 HG2 GLU C 66 68.424 -9.627 10.877 1.00 0.00 H new ATOM 0 HG3 GLU C 66 67.985 -8.121 11.659 1.00 0.00 H new ATOM 1024 N ASP C 67 71.350 -6.667 8.757 1.00 0.00 N ATOM 1025 CA ASP C 67 72.740 -7.100 8.431 1.00 0.00 C ATOM 1026 C ASP C 67 73.719 -5.947 8.665 1.00 0.00 C ATOM 1027 O ASP C 67 74.914 -6.090 8.493 1.00 0.00 O ATOM 1028 CB ASP C 67 72.702 -7.483 6.950 1.00 0.00 C ATOM 1029 CG ASP C 67 71.908 -6.436 6.166 1.00 0.00 C ATOM 1030 OD1 ASP C 67 72.492 -5.431 5.800 1.00 0.00 O ATOM 1031 OD2 ASP C 67 70.729 -6.659 5.946 1.00 0.00 O ATOM 0 H ASP C 67 71.056 -5.790 8.326 1.00 0.00 H new ATOM 0 HA ASP C 67 73.072 -7.930 9.055 1.00 0.00 H new ATOM 0 HB2 ASP C 67 73.716 -7.554 6.557 1.00 0.00 H new ATOM 0 HB3 ASP C 67 72.244 -8.465 6.830 1.00 0.00 H new ATOM 1036 N GLY C 68 73.224 -4.806 9.060 1.00 0.00 N ATOM 1037 CA GLY C 68 74.125 -3.646 9.309 1.00 0.00 C ATOM 1038 C GLY C 68 74.875 -3.289 8.024 1.00 0.00 C ATOM 1039 O GLY C 68 76.034 -2.927 8.052 1.00 0.00 O ATOM 0 H GLY C 68 72.233 -4.627 9.221 1.00 0.00 H new ATOM 0 HA2 GLY C 68 73.544 -2.790 9.652 1.00 0.00 H new ATOM 0 HA3 GLY C 68 74.835 -3.888 10.100 1.00 0.00 H new ATOM 1043 N SER C 69 74.224 -3.387 6.896 1.00 0.00 N ATOM 1044 CA SER C 69 74.905 -3.052 5.613 1.00 0.00 C ATOM 1045 C SER C 69 74.624 -1.595 5.231 1.00 0.00 C ATOM 1046 O SER C 69 75.209 -1.062 4.309 1.00 0.00 O ATOM 1047 CB SER C 69 74.299 -4.001 4.581 1.00 0.00 C ATOM 1048 OG SER C 69 72.939 -3.651 4.361 1.00 0.00 O ATOM 0 H SER C 69 73.252 -3.684 6.808 1.00 0.00 H new ATOM 0 HA SER C 69 75.987 -3.161 5.680 1.00 0.00 H new ATOM 0 HB2 SER C 69 74.857 -3.944 3.646 1.00 0.00 H new ATOM 0 HB3 SER C 69 74.369 -5.031 4.932 1.00 0.00 H new ATOM 0 HG SER C 69 72.367 -4.158 4.974 1.00 0.00 H new ATOM 1054 N GLY C 70 73.733 -0.949 5.931 1.00 0.00 N ATOM 1055 CA GLY C 70 73.417 0.470 5.608 1.00 0.00 C ATOM 1056 C GLY C 70 72.683 0.538 4.267 1.00 0.00 C ATOM 1057 O GLY C 70 72.658 1.562 3.615 1.00 0.00 O ATOM 0 H GLY C 70 73.210 -1.343 6.713 1.00 0.00 H new ATOM 0 HA2 GLY C 70 72.800 0.904 6.395 1.00 0.00 H new ATOM 0 HA3 GLY C 70 74.335 1.057 5.562 1.00 0.00 H new ATOM 1061 N THR C 71 72.084 -0.544 3.851 1.00 0.00 N ATOM 1062 CA THR C 71 71.352 -0.537 2.552 1.00 0.00 C ATOM 1063 C THR C 71 70.160 -1.496 2.612 1.00 0.00 C ATOM 1064 O THR C 71 70.172 -2.471 3.337 1.00 0.00 O ATOM 1065 CB THR C 71 72.377 -1.010 1.520 1.00 0.00 C ATOM 1066 OG1 THR C 71 73.159 -2.058 2.078 1.00 0.00 O ATOM 1067 CG2 THR C 71 73.287 0.156 1.130 1.00 0.00 C ATOM 0 H THR C 71 72.070 -1.432 4.353 1.00 0.00 H new ATOM 0 HA THR C 71 70.952 0.446 2.306 1.00 0.00 H new ATOM 0 HB THR C 71 71.859 -1.375 0.633 1.00 0.00 H new ATOM 0 HG1 THR C 71 72.645 -2.512 2.778 1.00 0.00 H new ATOM 0 HG21 THR C 71 74.017 -0.182 0.395 1.00 0.00 H new ATOM 0 HG22 THR C 71 72.687 0.959 0.702 1.00 0.00 H new ATOM 0 HG23 THR C 71 73.807 0.523 2.015 1.00 0.00 H new ATOM 1075 N VAL C 72 69.127 -1.223 1.861 1.00 0.00 N ATOM 1076 CA VAL C 72 67.933 -2.119 1.881 1.00 0.00 C ATOM 1077 C VAL C 72 67.896 -2.987 0.620 1.00 0.00 C ATOM 1078 O VAL C 72 68.294 -2.567 -0.448 1.00 0.00 O ATOM 1079 CB VAL C 72 66.733 -1.173 1.917 1.00 0.00 C ATOM 1080 CG1 VAL C 72 65.458 -1.955 1.601 1.00 0.00 C ATOM 1081 CG2 VAL C 72 66.617 -0.552 3.311 1.00 0.00 C ATOM 0 H VAL C 72 69.057 -0.420 1.236 1.00 0.00 H new ATOM 0 HA VAL C 72 67.943 -2.801 2.731 1.00 0.00 H new ATOM 0 HB VAL C 72 66.869 -0.385 1.177 1.00 0.00 H new ATOM 0 HG11 VAL C 72 64.602 -1.281 1.627 1.00 0.00 H new ATOM 0 HG12 VAL C 72 65.540 -2.400 0.609 1.00 0.00 H new ATOM 0 HG13 VAL C 72 65.321 -2.743 2.342 1.00 0.00 H new ATOM 0 HG21 VAL C 72 65.762 0.123 3.339 1.00 0.00 H new ATOM 0 HG22 VAL C 72 66.481 -1.341 4.051 1.00 0.00 H new ATOM 0 HG23 VAL C 72 67.526 0.005 3.538 1.00 0.00 H new ATOM 1091 N ASP C 73 67.419 -4.196 0.738 1.00 0.00 N ATOM 1092 CA ASP C 73 67.353 -5.094 -0.452 1.00 0.00 C ATOM 1093 C ASP C 73 65.901 -5.490 -0.733 1.00 0.00 C ATOM 1094 O ASP C 73 65.012 -5.221 0.050 1.00 0.00 O ATOM 1095 CB ASP C 73 68.181 -6.320 -0.067 1.00 0.00 C ATOM 1096 CG ASP C 73 69.395 -6.428 -0.992 1.00 0.00 C ATOM 1097 OD1 ASP C 73 69.975 -5.399 -1.297 1.00 0.00 O ATOM 1098 OD2 ASP C 73 69.725 -7.537 -1.378 1.00 0.00 O ATOM 0 H ASP C 73 67.072 -4.602 1.607 1.00 0.00 H new ATOM 0 HA ASP C 73 67.731 -4.615 -1.355 1.00 0.00 H new ATOM 0 HB2 ASP C 73 68.507 -6.241 0.970 1.00 0.00 H new ATOM 0 HB3 ASP C 73 67.572 -7.221 -0.142 1.00 0.00 H new ATOM 1103 N PHE C 74 65.651 -6.127 -1.845 1.00 0.00 N ATOM 1104 CA PHE C 74 64.255 -6.538 -2.169 1.00 0.00 C ATOM 1105 C PHE C 74 63.678 -7.389 -1.035 1.00 0.00 C ATOM 1106 O PHE C 74 62.481 -7.567 -0.924 1.00 0.00 O ATOM 1107 CB PHE C 74 64.369 -7.361 -3.453 1.00 0.00 C ATOM 1108 CG PHE C 74 63.253 -6.975 -4.395 1.00 0.00 C ATOM 1109 CD1 PHE C 74 62.010 -6.590 -3.883 1.00 0.00 C ATOM 1110 CD2 PHE C 74 63.464 -7.003 -5.779 1.00 0.00 C ATOM 1111 CE1 PHE C 74 60.975 -6.230 -4.754 1.00 0.00 C ATOM 1112 CE2 PHE C 74 62.429 -6.642 -6.651 1.00 0.00 C ATOM 1113 CZ PHE C 74 61.184 -6.257 -6.138 1.00 0.00 C ATOM 0 H PHE C 74 66.352 -6.380 -2.542 1.00 0.00 H new ATOM 0 HA PHE C 74 63.592 -5.682 -2.293 1.00 0.00 H new ATOM 0 HB2 PHE C 74 65.336 -7.187 -3.926 1.00 0.00 H new ATOM 0 HB3 PHE C 74 64.314 -8.425 -3.223 1.00 0.00 H new ATOM 0 HD1 PHE C 74 61.848 -6.570 -2.815 1.00 0.00 H new ATOM 0 HD2 PHE C 74 64.424 -7.303 -6.174 1.00 0.00 H new ATOM 0 HE1 PHE C 74 60.015 -5.931 -4.358 1.00 0.00 H new ATOM 0 HE2 PHE C 74 62.591 -6.661 -7.719 1.00 0.00 H new ATOM 0 HZ PHE C 74 60.385 -5.981 -6.810 1.00 0.00 H new ATOM 1123 N ASP C 75 64.522 -7.918 -0.191 1.00 0.00 N ATOM 1124 CA ASP C 75 64.024 -8.757 0.936 1.00 0.00 C ATOM 1125 C ASP C 75 63.659 -7.873 2.133 1.00 0.00 C ATOM 1126 O ASP C 75 62.590 -7.984 2.697 1.00 0.00 O ATOM 1127 CB ASP C 75 65.193 -9.678 1.288 1.00 0.00 C ATOM 1128 CG ASP C 75 64.701 -10.804 2.198 1.00 0.00 C ATOM 1129 OD1 ASP C 75 63.874 -10.530 3.052 1.00 0.00 O ATOM 1130 OD2 ASP C 75 65.160 -11.921 2.025 1.00 0.00 O ATOM 0 H ASP C 75 65.535 -7.805 -0.233 1.00 0.00 H new ATOM 0 HA ASP C 75 63.128 -9.317 0.670 1.00 0.00 H new ATOM 0 HB2 ASP C 75 65.628 -10.094 0.379 1.00 0.00 H new ATOM 0 HB3 ASP C 75 65.979 -9.111 1.786 1.00 0.00 H new ATOM 1135 N GLU C 76 64.544 -6.996 2.523 1.00 0.00 N ATOM 1136 CA GLU C 76 64.253 -6.103 3.682 1.00 0.00 C ATOM 1137 C GLU C 76 63.134 -5.119 3.328 1.00 0.00 C ATOM 1138 O GLU C 76 62.399 -4.667 4.184 1.00 0.00 O ATOM 1139 CB GLU C 76 65.561 -5.354 3.937 1.00 0.00 C ATOM 1140 CG GLU C 76 66.626 -6.338 4.426 1.00 0.00 C ATOM 1141 CD GLU C 76 67.941 -5.592 4.662 1.00 0.00 C ATOM 1142 OE1 GLU C 76 68.024 -4.871 5.643 1.00 0.00 O ATOM 1143 OE2 GLU C 76 68.844 -5.753 3.855 1.00 0.00 O ATOM 0 H GLU C 76 65.457 -6.859 2.089 1.00 0.00 H new ATOM 0 HA GLU C 76 63.920 -6.659 4.558 1.00 0.00 H new ATOM 0 HB2 GLU C 76 65.896 -4.864 3.023 1.00 0.00 H new ATOM 0 HB3 GLU C 76 65.405 -4.571 4.680 1.00 0.00 H new ATOM 0 HG2 GLU C 76 66.297 -6.818 5.348 1.00 0.00 H new ATOM 0 HG3 GLU C 76 66.771 -7.129 3.690 1.00 0.00 H new ATOM 1150 N PHE C 77 63.004 -4.783 2.075 1.00 0.00 N ATOM 1151 CA PHE C 77 61.936 -3.825 1.665 1.00 0.00 C ATOM 1152 C PHE C 77 60.558 -4.342 2.090 1.00 0.00 C ATOM 1153 O PHE C 77 59.786 -3.639 2.711 1.00 0.00 O ATOM 1154 CB PHE C 77 62.036 -3.755 0.141 1.00 0.00 C ATOM 1155 CG PHE C 77 60.979 -2.819 -0.391 1.00 0.00 C ATOM 1156 CD1 PHE C 77 60.915 -1.499 0.070 1.00 0.00 C ATOM 1157 CD2 PHE C 77 60.060 -3.272 -1.346 1.00 0.00 C ATOM 1158 CE1 PHE C 77 59.934 -0.631 -0.423 1.00 0.00 C ATOM 1159 CE2 PHE C 77 59.079 -2.404 -1.839 1.00 0.00 C ATOM 1160 CZ PHE C 77 59.017 -1.084 -1.378 1.00 0.00 C ATOM 0 H PHE C 77 63.591 -5.130 1.316 1.00 0.00 H new ATOM 0 HA PHE C 77 62.060 -2.847 2.131 1.00 0.00 H new ATOM 0 HB2 PHE C 77 63.026 -3.407 -0.153 1.00 0.00 H new ATOM 0 HB3 PHE C 77 61.906 -4.748 -0.288 1.00 0.00 H new ATOM 0 HD1 PHE C 77 61.623 -1.150 0.807 1.00 0.00 H new ATOM 0 HD2 PHE C 77 60.108 -4.291 -1.702 1.00 0.00 H new ATOM 0 HE1 PHE C 77 59.885 0.387 -0.067 1.00 0.00 H new ATOM 0 HE2 PHE C 77 58.370 -2.753 -2.575 1.00 0.00 H new ATOM 0 HZ PHE C 77 58.261 -0.414 -1.760 1.00 0.00 H new ATOM 1170 N LEU C 78 60.243 -5.564 1.757 1.00 0.00 N ATOM 1171 CA LEU C 78 58.913 -6.125 2.138 1.00 0.00 C ATOM 1172 C LEU C 78 58.674 -5.971 3.643 1.00 0.00 C ATOM 1173 O LEU C 78 57.615 -5.560 4.074 1.00 0.00 O ATOM 1174 CB LEU C 78 58.987 -7.605 1.760 1.00 0.00 C ATOM 1175 CG LEU C 78 58.609 -7.779 0.289 1.00 0.00 C ATOM 1176 CD1 LEU C 78 59.068 -9.155 -0.197 1.00 0.00 C ATOM 1177 CD2 LEU C 78 57.090 -7.664 0.137 1.00 0.00 C ATOM 0 H LEU C 78 60.849 -6.199 1.237 1.00 0.00 H new ATOM 0 HA LEU C 78 58.094 -5.611 1.636 1.00 0.00 H new ATOM 0 HB2 LEU C 78 59.994 -7.985 1.935 1.00 0.00 H new ATOM 0 HB3 LEU C 78 58.313 -8.186 2.390 1.00 0.00 H new ATOM 0 HG LEU C 78 59.094 -7.005 -0.305 1.00 0.00 H new ATOM 0 HD11 LEU C 78 58.798 -9.279 -1.246 1.00 0.00 H new ATOM 0 HD12 LEU C 78 60.149 -9.237 -0.088 1.00 0.00 H new ATOM 0 HD13 LEU C 78 58.584 -9.931 0.396 1.00 0.00 H new ATOM 0 HD21 LEU C 78 56.819 -7.788 -0.911 1.00 0.00 H new ATOM 0 HD22 LEU C 78 56.605 -8.439 0.731 1.00 0.00 H new ATOM 0 HD23 LEU C 78 56.763 -6.683 0.483 1.00 0.00 H new ATOM 1189 N VAL C 79 59.647 -6.306 4.445 1.00 0.00 N ATOM 1190 CA VAL C 79 59.474 -6.189 5.923 1.00 0.00 C ATOM 1191 C VAL C 79 59.162 -4.742 6.319 1.00 0.00 C ATOM 1192 O VAL C 79 58.332 -4.488 7.169 1.00 0.00 O ATOM 1193 CB VAL C 79 60.816 -6.626 6.511 1.00 0.00 C ATOM 1194 CG1 VAL C 79 60.862 -6.272 7.998 1.00 0.00 C ATOM 1195 CG2 VAL C 79 60.975 -8.140 6.343 1.00 0.00 C ATOM 0 H VAL C 79 60.556 -6.656 4.142 1.00 0.00 H new ATOM 0 HA VAL C 79 58.646 -6.797 6.287 1.00 0.00 H new ATOM 0 HB VAL C 79 61.625 -6.113 5.991 1.00 0.00 H new ATOM 0 HG11 VAL C 79 61.819 -6.584 8.417 1.00 0.00 H new ATOM 0 HG12 VAL C 79 60.746 -5.195 8.119 1.00 0.00 H new ATOM 0 HG13 VAL C 79 60.054 -6.785 8.519 1.00 0.00 H new ATOM 0 HG21 VAL C 79 61.931 -8.454 6.761 1.00 0.00 H new ATOM 0 HG22 VAL C 79 60.165 -8.651 6.864 1.00 0.00 H new ATOM 0 HG23 VAL C 79 60.942 -8.394 5.284 1.00 0.00 H new ATOM 1205 N MET C 80 59.824 -3.792 5.715 1.00 0.00 N ATOM 1206 CA MET C 80 59.567 -2.366 6.068 1.00 0.00 C ATOM 1207 C MET C 80 58.108 -1.994 5.783 1.00 0.00 C ATOM 1208 O MET C 80 57.548 -1.118 6.412 1.00 0.00 O ATOM 1209 CB MET C 80 60.508 -1.561 5.171 1.00 0.00 C ATOM 1210 CG MET C 80 61.064 -0.371 5.955 1.00 0.00 C ATOM 1211 SD MET C 80 60.155 1.127 5.500 1.00 0.00 S ATOM 1212 CE MET C 80 60.662 1.181 3.764 1.00 0.00 C ATOM 0 H MET C 80 60.530 -3.941 4.994 1.00 0.00 H new ATOM 0 HA MET C 80 59.739 -2.170 7.126 1.00 0.00 H new ATOM 0 HB2 MET C 80 61.324 -2.193 4.821 1.00 0.00 H new ATOM 0 HB3 MET C 80 59.975 -1.211 4.287 1.00 0.00 H new ATOM 0 HG2 MET C 80 60.974 -0.553 7.026 1.00 0.00 H new ATOM 0 HG3 MET C 80 62.125 -0.245 5.741 1.00 0.00 H new ATOM 0 HE1 MET C 80 60.758 2.219 3.445 1.00 0.00 H new ATOM 0 HE2 MET C 80 61.621 0.676 3.649 1.00 0.00 H new ATOM 0 HE3 MET C 80 59.913 0.681 3.150 1.00 0.00 H new ATOM 1222 N MET C 81 57.489 -2.648 4.840 1.00 0.00 N ATOM 1223 CA MET C 81 56.070 -2.324 4.516 1.00 0.00 C ATOM 1224 C MET C 81 55.129 -2.932 5.562 1.00 0.00 C ATOM 1225 O MET C 81 54.275 -2.260 6.106 1.00 0.00 O ATOM 1226 CB MET C 81 55.824 -2.951 3.144 1.00 0.00 C ATOM 1227 CG MET C 81 56.190 -1.945 2.051 1.00 0.00 C ATOM 1228 SD MET C 81 54.677 -1.234 1.356 1.00 0.00 S ATOM 1229 CE MET C 81 55.215 0.494 1.362 1.00 0.00 C ATOM 0 H MET C 81 57.903 -3.393 4.279 1.00 0.00 H new ATOM 0 HA MET C 81 55.885 -1.250 4.514 1.00 0.00 H new ATOM 0 HB2 MET C 81 56.420 -3.857 3.034 1.00 0.00 H new ATOM 0 HB3 MET C 81 54.778 -3.244 3.048 1.00 0.00 H new ATOM 0 HG2 MET C 81 56.819 -1.156 2.463 1.00 0.00 H new ATOM 0 HG3 MET C 81 56.767 -2.436 1.268 1.00 0.00 H new ATOM 0 HE1 MET C 81 54.419 1.124 0.965 1.00 0.00 H new ATOM 0 HE2 MET C 81 55.445 0.800 2.383 1.00 0.00 H new ATOM 0 HE3 MET C 81 56.105 0.600 0.742 1.00 0.00 H new ATOM 1239 N VAL C 82 55.276 -4.197 5.847 1.00 0.00 N ATOM 1240 CA VAL C 82 54.387 -4.843 6.855 1.00 0.00 C ATOM 1241 C VAL C 82 54.197 -3.924 8.066 1.00 0.00 C ATOM 1242 O VAL C 82 53.091 -3.681 8.505 1.00 0.00 O ATOM 1243 CB VAL C 82 55.114 -6.124 7.263 1.00 0.00 C ATOM 1244 CG1 VAL C 82 54.218 -6.949 8.191 1.00 0.00 C ATOM 1245 CG2 VAL C 82 55.442 -6.941 6.012 1.00 0.00 C ATOM 0 H VAL C 82 55.973 -4.811 5.426 1.00 0.00 H new ATOM 0 HA VAL C 82 53.394 -5.047 6.455 1.00 0.00 H new ATOM 0 HB VAL C 82 56.036 -5.868 7.785 1.00 0.00 H new ATOM 0 HG11 VAL C 82 54.738 -7.862 8.481 1.00 0.00 H new ATOM 0 HG12 VAL C 82 53.983 -6.367 9.082 1.00 0.00 H new ATOM 0 HG13 VAL C 82 53.295 -7.206 7.671 1.00 0.00 H new ATOM 0 HG21 VAL C 82 55.961 -7.855 6.300 1.00 0.00 H new ATOM 0 HG22 VAL C 82 54.519 -7.196 5.492 1.00 0.00 H new ATOM 0 HG23 VAL C 82 56.081 -6.354 5.351 1.00 0.00 H new ATOM 1255 N ARG C 83 55.268 -3.414 8.607 1.00 0.00 N ATOM 1256 CA ARG C 83 55.146 -2.513 9.789 1.00 0.00 C ATOM 1257 C ARG C 83 54.108 -1.420 9.519 1.00 0.00 C ATOM 1258 O ARG C 83 53.226 -1.177 10.319 1.00 0.00 O ATOM 1259 CB ARG C 83 56.537 -1.903 9.967 1.00 0.00 C ATOM 1260 CG ARG C 83 57.574 -3.022 10.081 1.00 0.00 C ATOM 1261 CD ARG C 83 58.796 -2.510 10.847 1.00 0.00 C ATOM 1262 NE ARG C 83 58.282 -2.160 12.201 1.00 0.00 N ATOM 1263 CZ ARG C 83 58.943 -1.323 12.952 1.00 0.00 C ATOM 1264 NH1 ARG C 83 58.937 -0.049 12.670 1.00 0.00 N ATOM 1265 NH2 ARG C 83 59.609 -1.760 13.986 1.00 0.00 N ATOM 0 H ARG C 83 56.221 -3.581 8.283 1.00 0.00 H new ATOM 0 HA ARG C 83 54.818 -3.045 10.682 1.00 0.00 H new ATOM 0 HB2 ARG C 83 56.774 -1.258 9.121 1.00 0.00 H new ATOM 0 HB3 ARG C 83 56.560 -1.279 10.860 1.00 0.00 H new ATOM 0 HG2 ARG C 83 57.143 -3.881 10.595 1.00 0.00 H new ATOM 0 HG3 ARG C 83 57.870 -3.361 9.088 1.00 0.00 H new ATOM 0 HD2 ARG C 83 59.574 -3.272 10.905 1.00 0.00 H new ATOM 0 HD3 ARG C 83 59.235 -1.642 10.355 1.00 0.00 H new ATOM 0 HE ARG C 83 57.414 -2.575 12.540 1.00 0.00 H new ATOM 0 HH11 ARG C 83 58.416 0.292 11.862 1.00 0.00 H new ATOM 0 HH12 ARG C 83 59.454 0.606 13.257 1.00 0.00 H new ATOM 0 HH21 ARG C 83 59.613 -2.756 14.207 1.00 0.00 H new ATOM 0 HH22 ARG C 83 60.126 -1.106 14.573 1.00 0.00 H new ATOM 1279 N CYS C 84 54.205 -0.759 8.398 1.00 0.00 N ATOM 1280 CA CYS C 84 53.221 0.317 8.079 1.00 0.00 C ATOM 1281 C CYS C 84 51.824 -0.279 7.890 1.00 0.00 C ATOM 1282 O CYS C 84 50.828 0.411 7.980 1.00 0.00 O ATOM 1283 CB CYS C 84 53.721 0.937 6.774 1.00 0.00 C ATOM 1284 SG CYS C 84 53.518 2.734 6.843 1.00 0.00 S ATOM 0 H CYS C 84 54.922 -0.916 7.689 1.00 0.00 H new ATOM 0 HA CYS C 84 53.144 1.055 8.878 1.00 0.00 H new ATOM 0 HB2 CYS C 84 54.770 0.685 6.617 1.00 0.00 H new ATOM 0 HB3 CYS C 84 53.166 0.530 5.929 1.00 0.00 H new ATOM 0 HG CYS C 84 53.569 3.223 5.640 1.00 0.00 H new ATOM 1290 N MET C 85 51.742 -1.554 7.626 1.00 0.00 N ATOM 1291 CA MET C 85 50.408 -2.191 7.428 1.00 0.00 C ATOM 1292 C MET C 85 49.943 -2.865 8.722 1.00 0.00 C ATOM 1293 O MET C 85 50.710 -3.514 9.404 1.00 0.00 O ATOM 1294 CB MET C 85 50.625 -3.229 6.329 1.00 0.00 C ATOM 1295 CG MET C 85 51.335 -2.575 5.142 1.00 0.00 C ATOM 1296 SD MET C 85 51.764 -3.842 3.922 1.00 0.00 S ATOM 1297 CE MET C 85 50.150 -4.659 3.866 1.00 0.00 C ATOM 0 H MET C 85 52.540 -2.183 7.539 1.00 0.00 H new ATOM 0 HA MET C 85 49.641 -1.466 7.158 1.00 0.00 H new ATOM 0 HB2 MET C 85 51.220 -4.059 6.710 1.00 0.00 H new ATOM 0 HB3 MET C 85 49.668 -3.643 6.011 1.00 0.00 H new ATOM 0 HG2 MET C 85 50.690 -1.822 4.689 1.00 0.00 H new ATOM 0 HG3 MET C 85 52.235 -2.062 5.481 1.00 0.00 H new ATOM 0 HE1 MET C 85 50.143 -5.395 3.062 1.00 0.00 H new ATOM 0 HE2 MET C 85 49.961 -5.158 4.817 1.00 0.00 H new ATOM 0 HE3 MET C 85 49.373 -3.917 3.685 1.00 0.00 H new ATOM 1307 N LYS C 86 48.694 -2.713 9.063 1.00 0.00 N ATOM 1308 CA LYS C 86 48.180 -3.343 10.313 1.00 0.00 C ATOM 1309 C LYS C 86 48.907 -2.765 11.530 1.00 0.00 C ATOM 1310 O LYS C 86 50.118 -2.808 11.620 1.00 0.00 O ATOM 1311 CB LYS C 86 48.486 -4.833 10.162 1.00 0.00 C ATOM 1312 CG LYS C 86 47.379 -5.651 10.829 1.00 0.00 C ATOM 1313 CD LYS C 86 47.459 -5.479 12.347 1.00 0.00 C ATOM 1314 CE LYS C 86 46.841 -6.699 13.033 1.00 0.00 C ATOM 1315 NZ LYS C 86 45.676 -6.166 13.790 1.00 0.00 N ATOM 0 H LYS C 86 48.006 -2.180 8.531 1.00 0.00 H new ATOM 0 HA LYS C 86 47.116 -3.161 10.461 1.00 0.00 H new ATOM 0 HB2 LYS C 86 48.561 -5.095 9.107 1.00 0.00 H new ATOM 0 HB3 LYS C 86 49.449 -5.065 10.617 1.00 0.00 H new ATOM 0 HG2 LYS C 86 46.404 -5.326 10.467 1.00 0.00 H new ATOM 0 HG3 LYS C 86 47.482 -6.704 10.566 1.00 0.00 H new ATOM 0 HD2 LYS C 86 48.498 -5.362 12.656 1.00 0.00 H new ATOM 0 HD3 LYS C 86 46.933 -4.573 12.649 1.00 0.00 H new ATOM 0 HE2 LYS C 86 46.529 -7.446 12.303 1.00 0.00 H new ATOM 0 HE3 LYS C 86 47.556 -7.182 13.698 1.00 0.00 H new ATOM 0 HZ1 LYS C 86 45.200 -6.945 14.288 1.00 0.00 H new ATOM 0 HZ2 LYS C 86 46.004 -5.462 14.482 1.00 0.00 H new ATOM 0 HZ3 LYS C 86 45.009 -5.718 13.130 1.00 0.00 H new ATOM 1329 N ASP C 87 48.177 -2.224 12.466 1.00 0.00 N ATOM 1330 CA ASP C 87 48.826 -1.642 13.675 1.00 0.00 C ATOM 1331 C ASP C 87 48.453 -2.455 14.918 1.00 0.00 C ATOM 1332 O ASP C 87 47.682 -3.392 14.849 1.00 0.00 O ATOM 1333 CB ASP C 87 48.272 -0.220 13.775 1.00 0.00 C ATOM 1334 CG ASP C 87 46.771 -0.277 14.064 1.00 0.00 C ATOM 1335 OD1 ASP C 87 46.152 -1.259 13.690 1.00 0.00 O ATOM 1336 OD2 ASP C 87 46.265 0.664 14.654 1.00 0.00 O ATOM 0 H ASP C 87 47.159 -2.160 12.446 1.00 0.00 H new ATOM 0 HA ASP C 87 49.914 -1.651 13.606 1.00 0.00 H new ATOM 0 HB2 ASP C 87 48.785 0.327 14.566 1.00 0.00 H new ATOM 0 HB3 ASP C 87 48.454 0.319 12.845 1.00 0.00 H new ATOM 1341 N ASP C 88 48.992 -2.105 16.053 1.00 0.00 N ATOM 1342 CA ASP C 88 48.667 -2.861 17.296 1.00 0.00 C ATOM 1343 C ASP C 88 47.774 -2.020 18.211 1.00 0.00 C ATOM 1344 O ASP C 88 47.554 -0.849 17.974 1.00 0.00 O ATOM 1345 CB ASP C 88 50.017 -3.127 17.964 1.00 0.00 C ATOM 1346 CG ASP C 88 49.857 -4.223 19.018 1.00 0.00 C ATOM 1347 OD1 ASP C 88 48.813 -4.852 19.036 1.00 0.00 O ATOM 1348 OD2 ASP C 88 50.783 -4.415 19.790 1.00 0.00 O ATOM 0 H ASP C 88 49.643 -1.329 16.174 1.00 0.00 H new ATOM 0 HA ASP C 88 48.126 -3.784 17.086 1.00 0.00 H new ATOM 0 HB2 ASP C 88 50.751 -3.430 17.217 1.00 0.00 H new ATOM 0 HB3 ASP C 88 50.392 -2.214 18.427 1.00 0.00 H new ATOM 1353 N SER C 89 47.257 -2.609 19.255 1.00 0.00 N ATOM 1354 CA SER C 89 46.379 -1.841 20.184 1.00 0.00 C ATOM 1355 C SER C 89 45.191 -1.251 19.420 1.00 0.00 C ATOM 1356 O SER C 89 45.171 -0.046 19.234 1.00 0.00 O ATOM 1357 CB SER C 89 47.268 -0.729 20.739 1.00 0.00 C ATOM 1358 OG SER C 89 46.916 -0.478 22.094 1.00 0.00 O ATOM 1359 OXT SER C 89 44.320 -2.015 19.035 1.00 0.00 O ATOM 0 H SER C 89 47.404 -3.587 19.505 1.00 0.00 H new ATOM 0 HA SER C 89 45.967 -2.466 20.977 1.00 0.00 H new ATOM 0 HB2 SER C 89 48.317 -1.018 20.671 1.00 0.00 H new ATOM 0 HB3 SER C 89 47.149 0.178 20.146 1.00 0.00 H new ATOM 0 HG SER C 89 47.486 0.234 22.453 1.00 0.00 H new TER 1365 SER C 89 ATOM 1366 N ARG I 1 56.900 8.733 7.785 1.00 0.00 N ATOM 1367 CA ARG I 1 55.444 8.777 7.463 1.00 0.00 C ATOM 1368 C ARG I 1 55.213 8.364 6.006 1.00 0.00 C ATOM 1369 O ARG I 1 54.912 9.181 5.159 1.00 0.00 O ATOM 1370 CB ARG I 1 55.034 10.233 7.679 1.00 0.00 C ATOM 1371 CG ARG I 1 53.527 10.307 7.933 1.00 0.00 C ATOM 1372 CD ARG I 1 53.233 11.410 8.950 1.00 0.00 C ATOM 1373 NE ARG I 1 51.761 11.624 8.869 1.00 0.00 N ATOM 1374 CZ ARG I 1 51.278 12.534 8.067 1.00 0.00 C ATOM 1375 NH1 ARG I 1 51.485 13.798 8.313 1.00 0.00 N ATOM 1376 NH2 ARG I 1 50.588 12.178 7.019 1.00 0.00 N ATOM 0 H1 ARG I 1 57.045 9.015 8.775 1.00 0.00 H new ATOM 0 H2 ARG I 1 57.258 7.767 7.644 1.00 0.00 H new ATOM 0 H3 ARG I 1 57.414 9.387 7.160 1.00 0.00 H new ATOM 0 HA ARG I 1 54.863 8.094 8.083 1.00 0.00 H new ATOM 0 HB2 ARG I 1 55.577 10.653 8.526 1.00 0.00 H new ATOM 0 HB3 ARG I 1 55.296 10.829 6.805 1.00 0.00 H new ATOM 0 HG2 ARG I 1 53.000 10.508 7.000 1.00 0.00 H new ATOM 0 HG3 ARG I 1 53.163 9.349 8.305 1.00 0.00 H new ATOM 0 HD2 ARG I 1 53.534 11.112 9.954 1.00 0.00 H new ATOM 0 HD3 ARG I 1 53.779 12.323 8.711 1.00 0.00 H new ATOM 0 HE ARG I 1 51.131 11.060 9.440 1.00 0.00 H new ATOM 0 HH11 ARG I 1 52.025 14.076 9.133 1.00 0.00 H new ATOM 0 HH12 ARG I 1 51.107 14.508 7.686 1.00 0.00 H new ATOM 0 HH21 ARG I 1 50.426 11.189 6.827 1.00 0.00 H new ATOM 0 HH22 ARG I 1 50.210 12.888 6.392 1.00 0.00 H new ATOM 1392 N ILE I 2 55.353 7.101 5.709 1.00 0.00 N ATOM 1393 CA ILE I 2 55.142 6.635 4.308 1.00 0.00 C ATOM 1394 C ILE I 2 53.741 6.036 4.151 1.00 0.00 C ATOM 1395 O ILE I 2 53.572 4.835 4.090 1.00 0.00 O ATOM 1396 CB ILE I 2 56.208 5.563 4.082 1.00 0.00 C ATOM 1397 CG1 ILE I 2 57.575 6.109 4.503 1.00 0.00 C ATOM 1398 CG2 ILE I 2 56.248 5.181 2.601 1.00 0.00 C ATOM 1399 CD1 ILE I 2 58.645 5.040 4.273 1.00 0.00 C ATOM 0 H ILE I 2 55.604 6.371 6.376 1.00 0.00 H new ATOM 0 HA ILE I 2 55.221 7.450 3.588 1.00 0.00 H new ATOM 0 HB ILE I 2 55.966 4.682 4.676 1.00 0.00 H new ATOM 0 HG12 ILE I 2 57.812 7.005 3.930 1.00 0.00 H new ATOM 0 HG13 ILE I 2 57.555 6.398 5.554 1.00 0.00 H new ATOM 0 HG21 ILE I 2 57.009 4.417 2.443 1.00 0.00 H new ATOM 0 HG22 ILE I 2 55.275 4.793 2.299 1.00 0.00 H new ATOM 0 HG23 ILE I 2 56.488 6.061 2.005 1.00 0.00 H new ATOM 0 HD11 ILE I 2 59.618 5.429 4.573 1.00 0.00 H new ATOM 0 HD12 ILE I 2 58.409 4.156 4.865 1.00 0.00 H new ATOM 0 HD13 ILE I 2 58.671 4.772 3.217 1.00 0.00 H new ATOM 1411 N SER I 3 52.734 6.865 4.083 1.00 0.00 N ATOM 1412 CA SER I 3 51.348 6.337 3.927 1.00 0.00 C ATOM 1413 C SER I 3 51.274 5.409 2.711 1.00 0.00 C ATOM 1414 O SER I 3 51.370 5.844 1.580 1.00 0.00 O ATOM 1415 CB SER I 3 50.469 7.571 3.714 1.00 0.00 C ATOM 1416 OG SER I 3 51.202 8.739 4.063 1.00 0.00 O ATOM 0 H SER I 3 52.811 7.881 4.129 1.00 0.00 H new ATOM 0 HA SER I 3 51.028 5.757 4.793 1.00 0.00 H new ATOM 0 HB2 SER I 3 50.148 7.627 2.674 1.00 0.00 H new ATOM 0 HB3 SER I 3 49.568 7.499 4.323 1.00 0.00 H new ATOM 0 HG SER I 3 50.641 9.531 3.925 1.00 0.00 H new ATOM 1422 N ALA I 4 51.109 4.135 2.935 1.00 0.00 N ATOM 1423 CA ALA I 4 51.035 3.177 1.793 1.00 0.00 C ATOM 1424 C ALA I 4 50.167 3.750 0.668 1.00 0.00 C ATOM 1425 O ALA I 4 50.456 3.577 -0.500 1.00 0.00 O ATOM 1426 CB ALA I 4 50.391 1.918 2.374 1.00 0.00 C ATOM 0 H ALA I 4 51.022 3.714 3.860 1.00 0.00 H new ATOM 0 HA ALA I 4 52.016 2.976 1.363 1.00 0.00 H new ATOM 0 HB1 ALA I 4 50.301 1.162 1.594 1.00 0.00 H new ATOM 0 HB2 ALA I 4 51.011 1.532 3.183 1.00 0.00 H new ATOM 0 HB3 ALA I 4 49.401 2.161 2.760 1.00 0.00 H new ATOM 1432 N ASP I 5 49.104 4.425 1.008 1.00 0.00 N ATOM 1433 CA ASP I 5 48.217 5.000 -0.044 1.00 0.00 C ATOM 1434 C ASP I 5 48.880 6.213 -0.703 1.00 0.00 C ATOM 1435 O ASP I 5 48.591 6.550 -1.834 1.00 0.00 O ATOM 1436 CB ASP I 5 46.947 5.420 0.697 1.00 0.00 C ATOM 1437 CG ASP I 5 46.218 4.176 1.206 1.00 0.00 C ATOM 1438 OD1 ASP I 5 45.539 3.545 0.413 1.00 0.00 O ATOM 1439 OD2 ASP I 5 46.352 3.875 2.381 1.00 0.00 O ATOM 0 H ASP I 5 48.811 4.604 1.968 1.00 0.00 H new ATOM 0 HA ASP I 5 48.010 4.286 -0.841 1.00 0.00 H new ATOM 0 HB2 ASP I 5 47.200 6.073 1.532 1.00 0.00 H new ATOM 0 HB3 ASP I 5 46.297 5.989 0.032 1.00 0.00 H new ATOM 1444 N ALA I 6 49.760 6.876 -0.006 1.00 0.00 N ATOM 1445 CA ALA I 6 50.432 8.070 -0.595 1.00 0.00 C ATOM 1446 C ALA I 6 51.538 7.639 -1.563 1.00 0.00 C ATOM 1447 O ALA I 6 51.690 8.194 -2.633 1.00 0.00 O ATOM 1448 CB ALA I 6 51.027 8.818 0.598 1.00 0.00 C ATOM 0 H ALA I 6 50.044 6.644 0.946 1.00 0.00 H new ATOM 0 HA ALA I 6 49.740 8.691 -1.164 1.00 0.00 H new ATOM 0 HB1 ALA I 6 51.541 9.713 0.247 1.00 0.00 H new ATOM 0 HB2 ALA I 6 50.229 9.103 1.283 1.00 0.00 H new ATOM 0 HB3 ALA I 6 51.736 8.172 1.116 1.00 0.00 H new ATOM 1454 N MET I 7 52.314 6.658 -1.195 1.00 0.00 N ATOM 1455 CA MET I 7 53.413 6.199 -2.093 1.00 0.00 C ATOM 1456 C MET I 7 52.879 5.944 -3.507 1.00 0.00 C ATOM 1457 O MET I 7 53.542 6.215 -4.488 1.00 0.00 O ATOM 1458 CB MET I 7 53.918 4.898 -1.468 1.00 0.00 C ATOM 1459 CG MET I 7 55.439 4.959 -1.325 1.00 0.00 C ATOM 1460 SD MET I 7 56.177 5.442 -2.906 1.00 0.00 S ATOM 1461 CE MET I 7 56.658 3.784 -3.449 1.00 0.00 C ATOM 0 H MET I 7 52.236 6.154 -0.312 1.00 0.00 H new ATOM 0 HA MET I 7 54.204 6.943 -2.186 1.00 0.00 H new ATOM 0 HB2 MET I 7 53.456 4.747 -0.492 1.00 0.00 H new ATOM 0 HB3 MET I 7 53.634 4.049 -2.090 1.00 0.00 H new ATOM 0 HG2 MET I 7 55.713 5.675 -0.550 1.00 0.00 H new ATOM 0 HG3 MET I 7 55.825 3.988 -1.013 1.00 0.00 H new ATOM 0 HE1 MET I 7 57.431 3.862 -4.214 1.00 0.00 H new ATOM 0 HE2 MET I 7 57.044 3.220 -2.599 1.00 0.00 H new ATOM 0 HE3 MET I 7 55.790 3.270 -3.861 1.00 0.00 H new ATOM 1471 N MET I 8 51.689 5.420 -3.618 1.00 0.00 N ATOM 1472 CA MET I 8 51.119 5.142 -4.970 1.00 0.00 C ATOM 1473 C MET I 8 50.497 6.410 -5.564 1.00 0.00 C ATOM 1474 O MET I 8 50.047 6.420 -6.692 1.00 0.00 O ATOM 1475 CB MET I 8 50.043 4.083 -4.734 1.00 0.00 C ATOM 1476 CG MET I 8 50.472 2.766 -5.381 1.00 0.00 C ATOM 1477 SD MET I 8 51.128 1.657 -4.110 1.00 0.00 S ATOM 1478 CE MET I 8 52.775 2.399 -3.991 1.00 0.00 C ATOM 0 H MET I 8 51.086 5.172 -2.833 1.00 0.00 H new ATOM 0 HA MET I 8 51.881 4.806 -5.673 1.00 0.00 H new ATOM 0 HB2 MET I 8 49.886 3.941 -3.665 1.00 0.00 H new ATOM 0 HB3 MET I 8 49.093 4.414 -5.154 1.00 0.00 H new ATOM 0 HG2 MET I 8 49.623 2.301 -5.882 1.00 0.00 H new ATOM 0 HG3 MET I 8 51.229 2.952 -6.143 1.00 0.00 H new ATOM 0 HE1 MET I 8 53.523 1.680 -4.326 1.00 0.00 H new ATOM 0 HE2 MET I 8 52.820 3.289 -4.619 1.00 0.00 H new ATOM 0 HE3 MET I 8 52.976 2.675 -2.956 1.00 0.00 H new ATOM 1488 N GLN I 9 50.463 7.476 -4.814 1.00 0.00 N ATOM 1489 CA GLN I 9 49.862 8.735 -5.340 1.00 0.00 C ATOM 1490 C GLN I 9 50.737 9.330 -6.449 1.00 0.00 C ATOM 1491 O GLN I 9 50.263 9.641 -7.524 1.00 0.00 O ATOM 1492 CB GLN I 9 49.810 9.680 -4.138 1.00 0.00 C ATOM 1493 CG GLN I 9 48.705 10.716 -4.351 1.00 0.00 C ATOM 1494 CD GLN I 9 48.933 11.907 -3.418 1.00 0.00 C ATOM 1495 OE1 GLN I 9 48.756 11.797 -2.221 1.00 0.00 O ATOM 1496 NE2 GLN I 9 49.319 13.047 -3.918 1.00 0.00 N ATOM 0 H GLN I 9 50.824 7.531 -3.862 1.00 0.00 H new ATOM 0 HA GLN I 9 48.877 8.566 -5.775 1.00 0.00 H new ATOM 0 HB2 GLN I 9 49.622 9.115 -3.225 1.00 0.00 H new ATOM 0 HB3 GLN I 9 50.771 10.178 -4.012 1.00 0.00 H new ATOM 0 HG2 GLN I 9 48.700 11.049 -5.389 1.00 0.00 H new ATOM 0 HG3 GLN I 9 47.730 10.269 -4.155 1.00 0.00 H new ATOM 0 HE21 GLN I 9 49.468 13.139 -4.923 1.00 0.00 H new ATOM 0 HE22 GLN I 9 49.473 13.847 -3.304 1.00 0.00 H new ATOM 1505 N ALA I 10 52.006 9.500 -6.197 1.00 0.00 N ATOM 1506 CA ALA I 10 52.902 10.088 -7.236 1.00 0.00 C ATOM 1507 C ALA I 10 53.419 9.007 -8.192 1.00 0.00 C ATOM 1508 O ALA I 10 53.358 9.154 -9.396 1.00 0.00 O ATOM 1509 CB ALA I 10 54.059 10.709 -6.455 1.00 0.00 C ATOM 0 H ALA I 10 52.462 9.258 -5.317 1.00 0.00 H new ATOM 0 HA ALA I 10 52.380 10.820 -7.852 1.00 0.00 H new ATOM 0 HB1 ALA I 10 54.765 11.164 -7.150 1.00 0.00 H new ATOM 0 HB2 ALA I 10 53.673 11.472 -5.778 1.00 0.00 H new ATOM 0 HB3 ALA I 10 54.566 9.935 -5.878 1.00 0.00 H new ATOM 1515 N LEU I 11 53.937 7.925 -7.673 1.00 0.00 N ATOM 1516 CA LEU I 11 54.460 6.854 -8.572 1.00 0.00 C ATOM 1517 C LEU I 11 53.690 5.545 -8.359 1.00 0.00 C ATOM 1518 O LEU I 11 52.676 5.514 -7.691 1.00 0.00 O ATOM 1519 CB LEU I 11 55.938 6.688 -8.201 1.00 0.00 C ATOM 1520 CG LEU I 11 56.107 6.712 -6.680 1.00 0.00 C ATOM 1521 CD1 LEU I 11 57.383 5.956 -6.302 1.00 0.00 C ATOM 1522 CD2 LEU I 11 56.221 8.160 -6.197 1.00 0.00 C ATOM 0 H LEU I 11 54.020 7.737 -6.674 1.00 0.00 H new ATOM 0 HA LEU I 11 54.340 7.115 -9.623 1.00 0.00 H new ATOM 0 HB2 LEU I 11 56.318 5.748 -8.602 1.00 0.00 H new ATOM 0 HB3 LEU I 11 56.526 7.487 -8.652 1.00 0.00 H new ATOM 0 HG LEU I 11 55.243 6.239 -6.213 1.00 0.00 H new ATOM 0 HD11 LEU I 11 57.507 5.971 -5.219 1.00 0.00 H new ATOM 0 HD12 LEU I 11 57.310 4.924 -6.645 1.00 0.00 H new ATOM 0 HD13 LEU I 11 58.242 6.434 -6.772 1.00 0.00 H new ATOM 0 HD21 LEU I 11 56.341 8.174 -5.114 1.00 0.00 H new ATOM 0 HD22 LEU I 11 57.085 8.632 -6.664 1.00 0.00 H new ATOM 0 HD23 LEU I 11 55.318 8.706 -6.469 1.00 0.00 H new ATOM 1534 N LEU I 12 54.158 4.472 -8.939 1.00 0.00 N ATOM 1535 CA LEU I 12 53.454 3.162 -8.793 1.00 0.00 C ATOM 1536 C LEU I 12 52.019 3.276 -9.314 1.00 0.00 C ATOM 1537 O LEU I 12 51.254 4.114 -8.879 1.00 0.00 O ATOM 1538 CB LEU I 12 53.458 2.847 -7.291 1.00 0.00 C ATOM 1539 CG LEU I 12 54.875 2.499 -6.814 1.00 0.00 C ATOM 1540 CD1 LEU I 12 55.610 1.669 -7.872 1.00 0.00 C ATOM 1541 CD2 LEU I 12 55.652 3.788 -6.553 1.00 0.00 C ATOM 0 H LEU I 12 55.002 4.445 -9.511 1.00 0.00 H new ATOM 0 HA LEU I 12 53.944 2.374 -9.364 1.00 0.00 H new ATOM 0 HB2 LEU I 12 53.081 3.705 -6.733 1.00 0.00 H new ATOM 0 HB3 LEU I 12 52.785 2.014 -7.087 1.00 0.00 H new ATOM 0 HG LEU I 12 54.803 1.915 -5.897 1.00 0.00 H new ATOM 0 HD11 LEU I 12 56.613 1.432 -7.516 1.00 0.00 H new ATOM 0 HD12 LEU I 12 55.062 0.745 -8.055 1.00 0.00 H new ATOM 0 HD13 LEU I 12 55.679 2.239 -8.798 1.00 0.00 H new ATOM 0 HD21 LEU I 12 56.659 3.544 -6.214 1.00 0.00 H new ATOM 0 HD22 LEU I 12 55.710 4.370 -7.473 1.00 0.00 H new ATOM 0 HD23 LEU I 12 55.142 4.371 -5.786 1.00 0.00 H new ATOM 1553 N GLY I 13 51.647 2.441 -10.244 1.00 0.00 N ATOM 1554 CA GLY I 13 50.262 2.503 -10.790 1.00 0.00 C ATOM 1555 C GLY I 13 50.234 3.428 -12.008 1.00 0.00 C ATOM 1556 O GLY I 13 51.119 3.404 -12.839 1.00 0.00 O ATOM 0 H GLY I 13 52.242 1.718 -10.650 1.00 0.00 H new ATOM 0 HA2 GLY I 13 49.925 1.505 -11.070 1.00 0.00 H new ATOM 0 HA3 GLY I 13 49.575 2.868 -10.027 1.00 0.00 H new ATOM 1560 N ALA I 14 49.222 4.245 -12.120 1.00 0.00 N ATOM 1561 CA ALA I 14 49.137 5.172 -13.284 1.00 0.00 C ATOM 1562 C ALA I 14 48.127 6.288 -12.996 1.00 0.00 C ATOM 1563 O ALA I 14 47.783 6.546 -11.859 1.00 0.00 O ATOM 1564 CB ALA I 14 48.661 4.302 -14.448 1.00 0.00 C ATOM 0 H ALA I 14 48.451 4.310 -11.456 1.00 0.00 H new ATOM 0 HA ALA I 14 50.090 5.655 -13.501 1.00 0.00 H new ATOM 0 HB1 ALA I 14 48.573 4.913 -15.346 1.00 0.00 H new ATOM 0 HB2 ALA I 14 49.381 3.502 -14.622 1.00 0.00 H new ATOM 0 HB3 ALA I 14 47.690 3.870 -14.206 1.00 0.00 H new ATOM 1570 N ARG I 15 47.652 6.950 -14.014 1.00 0.00 N ATOM 1571 CA ARG I 15 46.666 8.048 -13.795 1.00 0.00 C ATOM 1572 C ARG I 15 45.270 7.466 -13.562 1.00 0.00 C ATOM 1573 O ARG I 15 45.116 6.303 -13.249 1.00 0.00 O ATOM 1574 CB ARG I 15 46.696 8.871 -15.083 1.00 0.00 C ATOM 1575 CG ARG I 15 47.166 10.293 -14.770 1.00 0.00 C ATOM 1576 CD ARG I 15 48.612 10.469 -15.242 1.00 0.00 C ATOM 1577 NE ARG I 15 48.531 10.477 -16.729 1.00 0.00 N ATOM 1578 CZ ARG I 15 49.598 10.724 -17.439 1.00 0.00 C ATOM 1579 NH1 ARG I 15 50.558 11.452 -16.940 1.00 0.00 N ATOM 1580 NH2 ARG I 15 49.704 10.243 -18.648 1.00 0.00 N ATOM 0 H ARG I 15 47.903 6.779 -14.988 1.00 0.00 H new ATOM 0 HA ARG I 15 46.908 8.652 -12.920 1.00 0.00 H new ATOM 0 HB2 ARG I 15 47.365 8.407 -15.808 1.00 0.00 H new ATOM 0 HB3 ARG I 15 45.704 8.896 -15.534 1.00 0.00 H new ATOM 0 HG2 ARG I 15 46.520 11.018 -15.265 1.00 0.00 H new ATOM 0 HG3 ARG I 15 47.096 10.483 -13.699 1.00 0.00 H new ATOM 0 HD2 ARG I 15 49.041 11.397 -14.865 1.00 0.00 H new ATOM 0 HD3 ARG I 15 49.246 9.657 -14.885 1.00 0.00 H new ATOM 0 HE ARG I 15 47.642 10.290 -17.192 1.00 0.00 H new ATOM 0 HH11 ARG I 15 50.475 11.828 -15.995 1.00 0.00 H new ATOM 0 HH12 ARG I 15 51.392 11.645 -17.494 1.00 0.00 H new ATOM 0 HH21 ARG I 15 48.953 9.674 -19.038 1.00 0.00 H new ATOM 0 HH22 ARG I 15 50.538 10.436 -19.202 1.00 0.00 H new ATOM 1594 N ALA I 16 44.251 8.268 -13.712 1.00 0.00 N ATOM 1595 CA ALA I 16 42.866 7.761 -13.498 1.00 0.00 C ATOM 1596 C ALA I 16 42.369 7.036 -14.753 1.00 0.00 C ATOM 1597 O ALA I 16 42.093 7.647 -15.766 1.00 0.00 O ATOM 1598 CB ALA I 16 42.025 9.010 -13.230 1.00 0.00 C ATOM 0 H ALA I 16 44.318 9.252 -13.973 1.00 0.00 H new ATOM 0 HA ALA I 16 42.809 7.047 -12.676 1.00 0.00 H new ATOM 0 HB1 ALA I 16 40.988 8.721 -13.062 1.00 0.00 H new ATOM 0 HB2 ALA I 16 42.407 9.523 -12.347 1.00 0.00 H new ATOM 0 HB3 ALA I 16 42.081 9.678 -14.090 1.00 0.00 H new ATOM 1604 N LYS I 17 42.256 5.737 -14.693 1.00 0.00 N ATOM 1605 CA LYS I 17 41.780 4.973 -15.883 1.00 0.00 C ATOM 1606 C LYS I 17 41.180 3.634 -15.444 1.00 0.00 C ATOM 1607 O LYS I 17 41.643 3.097 -14.452 1.00 0.00 O ATOM 1608 CB LYS I 17 43.029 4.745 -16.733 1.00 0.00 C ATOM 1609 CG LYS I 17 42.712 5.046 -18.199 1.00 0.00 C ATOM 1610 CD LYS I 17 41.918 3.885 -18.800 1.00 0.00 C ATOM 1611 CE LYS I 17 40.543 4.386 -19.250 1.00 0.00 C ATOM 1612 NZ LYS I 17 40.108 3.423 -20.300 1.00 0.00 N ATOM 1613 OXT LYS I 17 40.267 3.171 -16.108 1.00 0.00 O ATOM 0 H LYS I 17 42.472 5.171 -13.872 1.00 0.00 H new ATOM 0 HA LYS I 17 41.004 5.506 -16.433 1.00 0.00 H new ATOM 0 HB2 LYS I 17 43.839 5.386 -16.386 1.00 0.00 H new ATOM 0 HB3 LYS I 17 43.370 3.715 -16.628 1.00 0.00 H new ATOM 0 HG2 LYS I 17 42.139 5.970 -18.276 1.00 0.00 H new ATOM 0 HG3 LYS I 17 43.636 5.196 -18.758 1.00 0.00 H new ATOM 0 HD2 LYS I 17 42.458 3.461 -19.647 1.00 0.00 H new ATOM 0 HD3 LYS I 17 41.804 3.089 -18.064 1.00 0.00 H new ATOM 0 HE2 LYS I 17 39.839 4.408 -18.418 1.00 0.00 H new ATOM 0 HE3 LYS I 17 40.602 5.400 -19.644 1.00 0.00 H new ATOM 0 HZ1 LYS I 17 39.172 3.700 -20.658 1.00 0.00 H new ATOM 0 HZ2 LYS I 17 40.794 3.429 -21.082 1.00 0.00 H new ATOM 0 HZ3 LYS I 17 40.054 2.467 -19.894 1.00 0.00 H new TER 1627 LYS I 17 HETATM 1628 CA CA C 90 70.459 -4.620 4.845 1.00 0.00 CA