USER MOD reduce.3.24.130724 H: found=0, std=0, add=802, rem=0, adj=21 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 60 MET CE :methyl 161:sc= -7.34! (180deg=-7.35!) USER MOD Set 1.2: I 1 ARG N :NH3+ 152:sc= -0.256 (180deg=-1.28) USER MOD Set 2.1: C 17 LYS NZ :NH3+ 146:sc= 0.764 (180deg=-0.0112) USER MOD Set 2.2: C 18 ASN : amide:sc= 0.412 K(o=1.2,f=-4.9!) USER MOD Single : C 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 1 MET N :NH3+ 180:sc= 0 (180deg=0) 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= 0.596 K(o=0.6,f=-0.12) USER MOD Single : C 13 THR OG1 : rot 180:sc= 0 USER MOD Single : C 16 GLN : amide:sc= -7.2! C(o=-7.2!,f=-9.7!) USER MOD Single : C 21 LYS NZ :NH3+ -151:sc= 0.641 (180deg=0.221) USER MOD Single : C 35 CYS SG : rot 180:sc= 0.00262 USER MOD Single : C 37 SER OG : rot 180:sc= -0.232 USER MOD Single : C 38 THR OG1 : rot -84:sc= -0.08! 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 155:sc= -8.55! (180deg=-12.3!) USER MOD Single : C 47 MET CE :methyl 179:sc= -12.8! (180deg=-12.8!) USER MOD Single : C 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 51 ASN : amide:sc= -1.63 K(o=-1.6,f=-4.4!) USER MOD Single : C 53 THR OG1 : rot 146:sc= -0.0223 USER MOD Single : C 58 GLN : amide:sc= -1.97 K(o=-2,f=-4.2!) USER MOD Single : C 71 THR OG1 : rot 180:sc= 0 USER MOD Single : C 80 MET CE :methyl -175:sc= -0.0163 (180deg=-0.0481) USER MOD Single : C 81 MET CE :methyl 133:sc= -1.61 (180deg=-2.15!) USER MOD Single : C 84 CYS SG : rot 180:sc= 0 USER MOD Single : C 85 MET CE :methyl -159:sc= -3.55! (180deg=-3.8!) 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 3 SER OG : rot 180:sc= 0.0365 USER MOD Single : I 7 MET CE :methyl 173:sc= -2.48! (180deg=-2.66!) USER MOD Single : I 8 MET CE :methyl 145:sc= -9.45! (180deg=-11.2!) USER MOD Single : I 9 GLN : amide:sc= -0.444 K(o=-0.44,f=-3.5!) USER MOD Single : I 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 60.508 -8.324 20.004 1.00 0.00 N ATOM 2 CA MET C 1 60.927 -9.256 18.918 1.00 0.00 C ATOM 3 C MET C 1 60.161 -8.947 17.630 1.00 0.00 C ATOM 4 O MET C 1 59.101 -8.353 17.653 1.00 0.00 O ATOM 5 CB MET C 1 60.570 -10.651 19.433 1.00 0.00 C ATOM 6 CG MET C 1 61.797 -11.560 19.335 1.00 0.00 C ATOM 7 SD MET C 1 62.467 -11.850 20.992 1.00 0.00 S ATOM 8 CE MET C 1 63.945 -12.761 20.481 1.00 0.00 C ATOM 0 H1 MET C 1 61.035 -8.544 20.873 1.00 0.00 H new ATOM 0 H2 MET C 1 60.707 -7.344 19.717 1.00 0.00 H new ATOM 0 H3 MET C 1 59.489 -8.432 20.181 1.00 0.00 H new ATOM 0 HA MET C 1 61.988 -9.167 18.685 1.00 0.00 H new ATOM 0 HB2 MET C 1 60.229 -10.593 20.467 1.00 0.00 H new ATOM 0 HB3 MET C 1 59.749 -11.067 18.849 1.00 0.00 H new ATOM 0 HG2 MET C 1 61.525 -12.508 18.870 1.00 0.00 H new ATOM 0 HG3 MET C 1 62.554 -11.100 18.700 1.00 0.00 H new ATOM 0 HE1 MET C 1 64.520 -13.045 21.362 1.00 0.00 H new ATOM 0 HE2 MET C 1 63.650 -13.657 19.936 1.00 0.00 H new ATOM 0 HE3 MET C 1 64.557 -12.130 19.837 1.00 0.00 H new ATOM 20 N ASP C 2 60.690 -9.345 16.504 1.00 0.00 N ATOM 21 CA ASP C 2 59.991 -9.072 15.215 1.00 0.00 C ATOM 22 C ASP C 2 59.599 -10.387 14.535 1.00 0.00 C ATOM 23 O ASP C 2 60.108 -10.728 13.485 1.00 0.00 O ATOM 24 CB ASP C 2 61.008 -8.313 14.364 1.00 0.00 C ATOM 25 CG ASP C 2 61.582 -7.147 15.171 1.00 0.00 C ATOM 26 OD1 ASP C 2 60.941 -6.110 15.216 1.00 0.00 O ATOM 27 OD2 ASP C 2 62.654 -7.311 15.732 1.00 0.00 O ATOM 0 H ASP C 2 61.574 -9.846 16.421 1.00 0.00 H new ATOM 0 HA ASP C 2 59.073 -8.502 15.358 1.00 0.00 H new ATOM 0 HB2 ASP C 2 61.810 -8.983 14.053 1.00 0.00 H new ATOM 0 HB3 ASP C 2 60.533 -7.941 13.456 1.00 0.00 H new ATOM 32 N ASP C 3 58.700 -11.128 15.123 1.00 0.00 N ATOM 33 CA ASP C 3 58.280 -12.420 14.505 1.00 0.00 C ATOM 34 C ASP C 3 56.807 -12.356 14.091 1.00 0.00 C ATOM 35 O ASP C 3 56.254 -13.310 13.583 1.00 0.00 O ATOM 36 CB ASP C 3 58.484 -13.469 15.599 1.00 0.00 C ATOM 37 CG ASP C 3 59.977 -13.778 15.738 1.00 0.00 C ATOM 38 OD1 ASP C 3 60.770 -12.875 15.527 1.00 0.00 O ATOM 39 OD2 ASP C 3 60.301 -14.911 16.053 1.00 0.00 O ATOM 0 H ASP C 3 58.238 -10.896 16.003 1.00 0.00 H new ATOM 0 HA ASP C 3 58.852 -12.652 13.607 1.00 0.00 H new ATOM 0 HB2 ASP C 3 58.088 -13.104 16.546 1.00 0.00 H new ATOM 0 HB3 ASP C 3 57.935 -14.378 15.353 1.00 0.00 H new ATOM 44 N ILE C 4 56.167 -11.239 14.306 1.00 0.00 N ATOM 45 CA ILE C 4 54.729 -11.118 13.926 1.00 0.00 C ATOM 46 C ILE C 4 54.603 -10.621 12.482 1.00 0.00 C ATOM 47 O ILE C 4 53.526 -10.581 11.921 1.00 0.00 O ATOM 48 CB ILE C 4 54.143 -10.092 14.896 1.00 0.00 C ATOM 49 CG1 ILE C 4 54.642 -10.381 16.313 1.00 0.00 C ATOM 50 CG2 ILE C 4 52.616 -10.180 14.870 1.00 0.00 C ATOM 51 CD1 ILE C 4 53.986 -9.409 17.295 1.00 0.00 C ATOM 0 H ILE C 4 56.576 -10.405 14.728 1.00 0.00 H new ATOM 0 HA ILE C 4 54.208 -12.074 13.982 1.00 0.00 H new ATOM 0 HB ILE C 4 54.458 -9.092 14.597 1.00 0.00 H new ATOM 0 HG12 ILE C 4 54.406 -11.408 16.590 1.00 0.00 H new ATOM 0 HG13 ILE C 4 55.727 -10.280 16.355 1.00 0.00 H new ATOM 0 HG21 ILE C 4 52.198 -9.449 15.561 1.00 0.00 H new ATOM 0 HG22 ILE C 4 52.257 -9.973 13.862 1.00 0.00 H new ATOM 0 HG23 ILE C 4 52.304 -11.181 15.168 1.00 0.00 H new ATOM 0 HD11 ILE C 4 54.342 -9.616 18.304 1.00 0.00 H new ATOM 0 HD12 ILE C 4 54.244 -8.386 17.022 1.00 0.00 H new ATOM 0 HD13 ILE C 4 52.903 -9.532 17.260 1.00 0.00 H new ATOM 63 N TYR C 5 55.695 -10.240 11.878 1.00 0.00 N ATOM 64 CA TYR C 5 55.635 -9.745 10.472 1.00 0.00 C ATOM 65 C TYR C 5 56.100 -10.836 9.505 1.00 0.00 C ATOM 66 O TYR C 5 55.480 -11.083 8.490 1.00 0.00 O ATOM 67 CB TYR C 5 56.590 -8.552 10.432 1.00 0.00 C ATOM 68 CG TYR C 5 56.049 -7.445 11.305 1.00 0.00 C ATOM 69 CD1 TYR C 5 55.152 -6.511 10.773 1.00 0.00 C ATOM 70 CD2 TYR C 5 56.442 -7.354 12.645 1.00 0.00 C ATOM 71 CE1 TYR C 5 54.651 -5.484 11.581 1.00 0.00 C ATOM 72 CE2 TYR C 5 55.939 -6.328 13.454 1.00 0.00 C ATOM 73 CZ TYR C 5 55.044 -5.393 12.922 1.00 0.00 C ATOM 74 OH TYR C 5 54.549 -4.381 13.719 1.00 0.00 O ATOM 0 H TYR C 5 56.625 -10.250 12.296 1.00 0.00 H new ATOM 0 HA TYR C 5 54.623 -9.469 10.175 1.00 0.00 H new ATOM 0 HB2 TYR C 5 57.579 -8.852 10.778 1.00 0.00 H new ATOM 0 HB3 TYR C 5 56.705 -8.199 9.407 1.00 0.00 H new ATOM 0 HD1 TYR C 5 54.847 -6.583 9.740 1.00 0.00 H new ATOM 0 HD2 TYR C 5 57.133 -8.075 13.055 1.00 0.00 H new ATOM 0 HE1 TYR C 5 53.961 -4.762 11.170 1.00 0.00 H new ATOM 0 HE2 TYR C 5 56.242 -6.258 14.488 1.00 0.00 H new ATOM 0 HH TYR C 5 54.922 -4.464 14.622 1.00 0.00 H new ATOM 84 N LYS C 6 57.186 -11.491 9.811 1.00 0.00 N ATOM 85 CA LYS C 6 57.687 -12.564 8.907 1.00 0.00 C ATOM 86 C LYS C 6 56.521 -13.434 8.431 1.00 0.00 C ATOM 87 O LYS C 6 56.564 -14.024 7.370 1.00 0.00 O ATOM 88 CB LYS C 6 58.657 -13.383 9.759 1.00 0.00 C ATOM 89 CG LYS C 6 58.022 -13.676 11.119 1.00 0.00 C ATOM 90 CD LYS C 6 58.327 -15.119 11.524 1.00 0.00 C ATOM 91 CE LYS C 6 57.305 -16.057 10.878 1.00 0.00 C ATOM 92 NZ LYS C 6 56.337 -16.376 11.964 1.00 0.00 N ATOM 0 H LYS C 6 57.748 -11.330 10.647 1.00 0.00 H new ATOM 0 HA LYS C 6 58.171 -12.163 8.016 1.00 0.00 H new ATOM 0 HB2 LYS C 6 58.903 -14.316 9.252 1.00 0.00 H new ATOM 0 HB3 LYS C 6 59.591 -12.837 9.892 1.00 0.00 H new ATOM 0 HG2 LYS C 6 58.410 -12.987 11.869 1.00 0.00 H new ATOM 0 HG3 LYS C 6 56.944 -13.521 11.070 1.00 0.00 H new ATOM 0 HD2 LYS C 6 59.335 -15.391 11.210 1.00 0.00 H new ATOM 0 HD3 LYS C 6 58.293 -15.218 12.609 1.00 0.00 H new ATOM 0 HE2 LYS C 6 56.808 -15.579 10.034 1.00 0.00 H new ATOM 0 HE3 LYS C 6 57.783 -16.960 10.497 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 55.604 -17.016 11.598 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 56.837 -16.836 12.751 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 55.893 -15.498 12.302 1.00 0.00 H new ATOM 106 N ALA C 7 55.476 -13.512 9.209 1.00 0.00 N ATOM 107 CA ALA C 7 54.303 -14.338 8.803 1.00 0.00 C ATOM 108 C ALA C 7 53.427 -13.561 7.817 1.00 0.00 C ATOM 109 O ALA C 7 52.792 -14.131 6.952 1.00 0.00 O ATOM 110 CB ALA C 7 53.542 -14.611 10.100 1.00 0.00 C ATOM 0 H ALA C 7 55.384 -13.040 10.108 1.00 0.00 H new ATOM 0 HA ALA C 7 54.599 -15.261 8.305 1.00 0.00 H new ATOM 0 HB1 ALA C 7 52.661 -15.216 9.885 1.00 0.00 H new ATOM 0 HB2 ALA C 7 54.189 -15.146 10.796 1.00 0.00 H new ATOM 0 HB3 ALA C 7 53.233 -13.666 10.546 1.00 0.00 H new ATOM 116 N ALA C 8 53.387 -12.262 7.942 1.00 0.00 N ATOM 117 CA ALA C 8 52.552 -11.447 7.013 1.00 0.00 C ATOM 118 C ALA C 8 53.202 -11.391 5.628 1.00 0.00 C ATOM 119 O ALA C 8 52.529 -11.351 4.617 1.00 0.00 O ATOM 120 CB ALA C 8 52.505 -10.054 7.641 1.00 0.00 C ATOM 0 H ALA C 8 53.896 -11.730 8.647 1.00 0.00 H new ATOM 0 HA ALA C 8 51.555 -11.867 6.878 1.00 0.00 H new ATOM 0 HB1 ALA C 8 51.907 -9.392 7.014 1.00 0.00 H new ATOM 0 HB2 ALA C 8 52.058 -10.117 8.633 1.00 0.00 H new ATOM 0 HB3 ALA C 8 53.517 -9.658 7.724 1.00 0.00 H new ATOM 126 N VAL C 9 54.505 -11.388 5.575 1.00 0.00 N ATOM 127 CA VAL C 9 55.198 -11.335 4.255 1.00 0.00 C ATOM 128 C VAL C 9 54.857 -12.578 3.430 1.00 0.00 C ATOM 129 O VAL C 9 54.403 -12.485 2.307 1.00 0.00 O ATOM 130 CB VAL C 9 56.687 -11.305 4.592 1.00 0.00 C ATOM 131 CG1 VAL C 9 57.494 -11.053 3.316 1.00 0.00 C ATOM 132 CG2 VAL C 9 56.958 -10.184 5.596 1.00 0.00 C ATOM 0 H VAL C 9 55.121 -11.420 6.388 1.00 0.00 H new ATOM 0 HA VAL C 9 54.897 -10.470 3.663 1.00 0.00 H new ATOM 0 HB VAL C 9 56.982 -12.261 5.025 1.00 0.00 H new ATOM 0 HG11 VAL C 9 58.557 -11.031 3.556 1.00 0.00 H new ATOM 0 HG12 VAL C 9 57.300 -11.851 2.599 1.00 0.00 H new ATOM 0 HG13 VAL C 9 57.200 -10.097 2.883 1.00 0.00 H new ATOM 0 HG21 VAL C 9 58.021 -10.161 5.838 1.00 0.00 H new ATOM 0 HG22 VAL C 9 56.664 -9.228 5.162 1.00 0.00 H new ATOM 0 HG23 VAL C 9 56.383 -10.362 6.505 1.00 0.00 H new ATOM 142 N GLU C 10 55.074 -13.741 3.979 1.00 0.00 N ATOM 143 CA GLU C 10 54.763 -14.990 3.227 1.00 0.00 C ATOM 144 C GLU C 10 53.303 -14.978 2.766 1.00 0.00 C ATOM 145 O GLU C 10 52.919 -15.702 1.869 1.00 0.00 O ATOM 146 CB GLU C 10 55.005 -16.122 4.226 1.00 0.00 C ATOM 147 CG GLU C 10 56.437 -16.640 4.075 1.00 0.00 C ATOM 148 CD GLU C 10 56.722 -17.680 5.160 1.00 0.00 C ATOM 149 OE1 GLU C 10 55.940 -18.609 5.282 1.00 0.00 O ATOM 150 OE2 GLU C 10 57.717 -17.530 5.850 1.00 0.00 O ATOM 0 H GLU C 10 55.453 -13.881 4.916 1.00 0.00 H new ATOM 0 HA GLU C 10 55.376 -15.100 2.332 1.00 0.00 H new ATOM 0 HB2 GLU C 10 54.842 -15.765 5.243 1.00 0.00 H new ATOM 0 HB3 GLU C 10 54.295 -16.931 4.054 1.00 0.00 H new ATOM 0 HG2 GLU C 10 56.573 -17.082 3.088 1.00 0.00 H new ATOM 0 HG3 GLU C 10 57.144 -15.814 4.154 1.00 0.00 H new ATOM 157 N GLN C 11 52.486 -14.162 3.374 1.00 0.00 N ATOM 158 CA GLN C 11 51.051 -14.105 2.971 1.00 0.00 C ATOM 159 C GLN C 11 50.831 -12.988 1.948 1.00 0.00 C ATOM 160 O GLN C 11 49.884 -12.231 2.034 1.00 0.00 O ATOM 161 CB GLN C 11 50.290 -13.804 4.262 1.00 0.00 C ATOM 162 CG GLN C 11 49.486 -15.037 4.680 1.00 0.00 C ATOM 163 CD GLN C 11 50.416 -16.248 4.762 1.00 0.00 C ATOM 164 OE1 GLN C 11 50.109 -17.302 4.239 1.00 0.00 O ATOM 165 NE2 GLN C 11 51.549 -16.144 5.404 1.00 0.00 N ATOM 0 H GLN C 11 52.749 -13.532 4.132 1.00 0.00 H new ATOM 0 HA GLN C 11 50.717 -15.032 2.505 1.00 0.00 H new ATOM 0 HB2 GLN C 11 50.988 -13.527 5.052 1.00 0.00 H new ATOM 0 HB3 GLN C 11 49.623 -12.955 4.114 1.00 0.00 H new ATOM 0 HG2 GLN C 11 49.010 -14.864 5.645 1.00 0.00 H new ATOM 0 HG3 GLN C 11 48.689 -15.225 3.961 1.00 0.00 H new ATOM 0 HE21 GLN C 11 51.807 -15.260 5.843 1.00 0.00 H new ATOM 0 HE22 GLN C 11 52.175 -16.947 5.466 1.00 0.00 H new ATOM 174 N LEU C 12 51.697 -12.880 0.979 1.00 0.00 N ATOM 175 CA LEU C 12 51.537 -11.812 -0.048 1.00 0.00 C ATOM 176 C LEU C 12 51.175 -12.430 -1.402 1.00 0.00 C ATOM 177 O LEU C 12 52.036 -12.749 -2.198 1.00 0.00 O ATOM 178 CB LEU C 12 52.900 -11.127 -0.125 1.00 0.00 C ATOM 179 CG LEU C 12 53.109 -10.258 1.116 1.00 0.00 C ATOM 180 CD1 LEU C 12 54.552 -9.746 1.142 1.00 0.00 C ATOM 181 CD2 LEU C 12 52.148 -9.068 1.072 1.00 0.00 C ATOM 0 H LEU C 12 52.509 -13.485 0.854 1.00 0.00 H new ATOM 0 HA LEU C 12 50.741 -11.112 0.208 1.00 0.00 H new ATOM 0 HB2 LEU C 12 53.690 -11.874 -0.195 1.00 0.00 H new ATOM 0 HB3 LEU C 12 52.960 -10.514 -1.025 1.00 0.00 H new ATOM 0 HG LEU C 12 52.916 -10.849 2.011 1.00 0.00 H new ATOM 0 HD11 LEU C 12 54.702 -9.126 2.026 1.00 0.00 H new ATOM 0 HD12 LEU C 12 55.238 -10.593 1.171 1.00 0.00 H new ATOM 0 HD13 LEU C 12 54.744 -9.154 0.247 1.00 0.00 H new ATOM 0 HD21 LEU C 12 52.296 -8.448 1.956 1.00 0.00 H new ATOM 0 HD22 LEU C 12 52.342 -8.477 0.177 1.00 0.00 H new ATOM 0 HD23 LEU C 12 51.120 -9.431 1.051 1.00 0.00 H new ATOM 193 N THR C 13 49.909 -12.597 -1.673 1.00 0.00 N ATOM 194 CA THR C 13 49.502 -13.192 -2.978 1.00 0.00 C ATOM 195 C THR C 13 50.230 -12.486 -4.126 1.00 0.00 C ATOM 196 O THR C 13 50.447 -11.291 -4.093 1.00 0.00 O ATOM 197 CB THR C 13 47.994 -12.957 -3.069 1.00 0.00 C ATOM 198 OG1 THR C 13 47.724 -11.569 -2.940 1.00 0.00 O ATOM 199 CG2 THR C 13 47.287 -13.722 -1.950 1.00 0.00 C ATOM 0 H THR C 13 49.141 -12.348 -1.049 1.00 0.00 H new ATOM 0 HA THR C 13 49.751 -14.251 -3.047 1.00 0.00 H new ATOM 0 HB THR C 13 47.629 -13.311 -4.033 1.00 0.00 H new ATOM 0 HG1 THR C 13 46.758 -11.417 -3.000 1.00 0.00 H new ATOM 0 HG21 THR C 13 46.212 -13.553 -2.017 1.00 0.00 H new ATOM 0 HG22 THR C 13 47.494 -14.787 -2.051 1.00 0.00 H new ATOM 0 HG23 THR C 13 47.650 -13.372 -0.984 1.00 0.00 H new ATOM 207 N GLU C 14 50.611 -13.216 -5.139 1.00 0.00 N ATOM 208 CA GLU C 14 51.328 -12.582 -6.283 1.00 0.00 C ATOM 209 C GLU C 14 50.663 -11.254 -6.657 1.00 0.00 C ATOM 210 O GLU C 14 51.324 -10.279 -6.955 1.00 0.00 O ATOM 211 CB GLU C 14 51.214 -13.585 -7.432 1.00 0.00 C ATOM 212 CG GLU C 14 49.741 -13.912 -7.684 1.00 0.00 C ATOM 213 CD GLU C 14 49.633 -14.934 -8.819 1.00 0.00 C ATOM 214 OE1 GLU C 14 50.240 -14.708 -9.853 1.00 0.00 O ATOM 215 OE2 GLU C 14 48.946 -15.924 -8.633 1.00 0.00 O ATOM 0 H GLU C 14 50.458 -14.221 -5.224 1.00 0.00 H new ATOM 0 HA GLU C 14 52.367 -12.357 -6.043 1.00 0.00 H new ATOM 0 HB2 GLU C 14 51.665 -13.172 -8.334 1.00 0.00 H new ATOM 0 HB3 GLU C 14 51.763 -14.495 -7.189 1.00 0.00 H new ATOM 0 HG2 GLU C 14 49.285 -14.310 -6.777 1.00 0.00 H new ATOM 0 HG3 GLU C 14 49.195 -13.005 -7.944 1.00 0.00 H new ATOM 222 N GLU C 15 49.358 -11.207 -6.640 1.00 0.00 N ATOM 223 CA GLU C 15 48.654 -9.940 -6.991 1.00 0.00 C ATOM 224 C GLU C 15 49.133 -8.805 -6.082 1.00 0.00 C ATOM 225 O GLU C 15 49.453 -7.724 -6.534 1.00 0.00 O ATOM 226 CB GLU C 15 47.172 -10.230 -6.753 1.00 0.00 C ATOM 227 CG GLU C 15 46.372 -8.930 -6.857 1.00 0.00 C ATOM 228 CD GLU C 15 45.458 -8.990 -8.082 1.00 0.00 C ATOM 229 OE1 GLU C 15 45.977 -8.998 -9.185 1.00 0.00 O ATOM 230 OE2 GLU C 15 44.252 -9.026 -7.895 1.00 0.00 O ATOM 0 H GLU C 15 48.750 -11.990 -6.399 1.00 0.00 H new ATOM 0 HA GLU C 15 48.846 -9.629 -8.018 1.00 0.00 H new ATOM 0 HB2 GLU C 15 46.810 -10.951 -7.486 1.00 0.00 H new ATOM 0 HB3 GLU C 15 47.032 -10.677 -5.769 1.00 0.00 H new ATOM 0 HG2 GLU C 15 45.779 -8.782 -5.954 1.00 0.00 H new ATOM 0 HG3 GLU C 15 47.049 -8.079 -6.936 1.00 0.00 H new ATOM 237 N GLN C 16 49.186 -9.046 -4.801 1.00 0.00 N ATOM 238 CA GLN C 16 49.645 -7.987 -3.858 1.00 0.00 C ATOM 239 C GLN C 16 51.171 -7.855 -3.927 1.00 0.00 C ATOM 240 O GLN C 16 51.725 -6.801 -3.681 1.00 0.00 O ATOM 241 CB GLN C 16 49.197 -8.477 -2.479 1.00 0.00 C ATOM 242 CG GLN C 16 50.040 -7.815 -1.387 1.00 0.00 C ATOM 243 CD GLN C 16 49.546 -8.277 -0.014 1.00 0.00 C ATOM 244 OE1 GLN C 16 49.374 -9.458 0.215 1.00 0.00 O ATOM 245 NE2 GLN C 16 49.309 -7.391 0.914 1.00 0.00 N ATOM 0 H GLN C 16 48.931 -9.932 -4.366 1.00 0.00 H new ATOM 0 HA GLN C 16 49.235 -7.004 -4.090 1.00 0.00 H new ATOM 0 HB2 GLN C 16 48.143 -8.245 -2.327 1.00 0.00 H new ATOM 0 HB3 GLN C 16 49.297 -9.561 -2.419 1.00 0.00 H new ATOM 0 HG2 GLN C 16 51.091 -8.076 -1.515 1.00 0.00 H new ATOM 0 HG3 GLN C 16 49.969 -6.730 -1.465 1.00 0.00 H new ATOM 0 HE21 GLN C 16 49.453 -6.400 0.722 1.00 0.00 H new ATOM 0 HE22 GLN C 16 48.979 -7.690 1.832 1.00 0.00 H new ATOM 254 N LYS C 17 51.851 -8.916 -4.262 1.00 0.00 N ATOM 255 CA LYS C 17 53.339 -8.859 -4.351 1.00 0.00 C ATOM 256 C LYS C 17 53.761 -8.081 -5.603 1.00 0.00 C ATOM 257 O LYS C 17 54.843 -7.532 -5.669 1.00 0.00 O ATOM 258 CB LYS C 17 53.776 -10.328 -4.435 1.00 0.00 C ATOM 259 CG LYS C 17 55.113 -10.444 -5.174 1.00 0.00 C ATOM 260 CD LYS C 17 54.852 -10.561 -6.677 1.00 0.00 C ATOM 261 CE LYS C 17 55.397 -11.896 -7.190 1.00 0.00 C ATOM 262 NZ LYS C 17 54.590 -12.203 -8.404 1.00 0.00 N ATOM 0 H LYS C 17 51.440 -9.824 -4.479 1.00 0.00 H new ATOM 0 HA LYS C 17 53.796 -8.349 -3.503 1.00 0.00 H new ATOM 0 HB2 LYS C 17 53.870 -10.744 -3.432 1.00 0.00 H new ATOM 0 HB3 LYS C 17 53.015 -10.912 -4.953 1.00 0.00 H new ATOM 0 HG2 LYS C 17 55.732 -9.571 -4.968 1.00 0.00 H new ATOM 0 HG3 LYS C 17 55.663 -11.316 -4.820 1.00 0.00 H new ATOM 0 HD2 LYS C 17 53.783 -10.492 -6.877 1.00 0.00 H new ATOM 0 HD3 LYS C 17 55.329 -9.735 -7.205 1.00 0.00 H new ATOM 0 HE2 LYS C 17 56.458 -11.823 -7.430 1.00 0.00 H new ATOM 0 HE3 LYS C 17 55.293 -12.679 -6.439 1.00 0.00 H new ATOM 0 HZ1 LYS C 17 55.185 -12.696 -9.101 1.00 0.00 H new ATOM 0 HZ2 LYS C 17 53.787 -12.810 -8.143 1.00 0.00 H new ATOM 0 HZ3 LYS C 17 54.234 -11.318 -8.817 1.00 0.00 H new ATOM 276 N ASN C 18 52.918 -8.030 -6.598 1.00 0.00 N ATOM 277 CA ASN C 18 53.278 -7.290 -7.842 1.00 0.00 C ATOM 278 C ASN C 18 53.184 -5.779 -7.608 1.00 0.00 C ATOM 279 O ASN C 18 53.820 -4.998 -8.286 1.00 0.00 O ATOM 280 CB ASN C 18 52.252 -7.739 -8.883 1.00 0.00 C ATOM 281 CG ASN C 18 52.605 -9.143 -9.374 1.00 0.00 C ATOM 282 OD1 ASN C 18 53.755 -9.538 -9.346 1.00 0.00 O ATOM 283 ND2 ASN C 18 51.660 -9.920 -9.827 1.00 0.00 N ATOM 0 H ASN C 18 51.997 -8.468 -6.604 1.00 0.00 H new ATOM 0 HA ASN C 18 54.299 -7.496 -8.163 1.00 0.00 H new ATOM 0 HB2 ASN C 18 51.252 -7.735 -8.449 1.00 0.00 H new ATOM 0 HB3 ASN C 18 52.239 -7.042 -9.721 1.00 0.00 H new ATOM 0 HD21 ASN C 18 51.886 -10.858 -10.157 1.00 0.00 H new ATOM 0 HD22 ASN C 18 50.695 -9.589 -9.851 1.00 0.00 H new ATOM 290 N GLU C 19 52.397 -5.363 -6.655 1.00 0.00 N ATOM 291 CA GLU C 19 52.269 -3.902 -6.383 1.00 0.00 C ATOM 292 C GLU C 19 53.498 -3.396 -5.622 1.00 0.00 C ATOM 293 O GLU C 19 54.171 -2.481 -6.051 1.00 0.00 O ATOM 294 CB GLU C 19 51.012 -3.765 -5.524 1.00 0.00 C ATOM 295 CG GLU C 19 50.173 -2.594 -6.036 1.00 0.00 C ATOM 296 CD GLU C 19 48.811 -2.597 -5.341 1.00 0.00 C ATOM 297 OE1 GLU C 19 48.345 -3.672 -4.999 1.00 0.00 O ATOM 298 OE2 GLU C 19 48.256 -1.525 -5.163 1.00 0.00 O ATOM 0 H GLU C 19 51.838 -5.969 -6.054 1.00 0.00 H new ATOM 0 HA GLU C 19 52.200 -3.317 -7.300 1.00 0.00 H new ATOM 0 HB2 GLU C 19 50.431 -4.686 -5.560 1.00 0.00 H new ATOM 0 HB3 GLU C 19 51.286 -3.602 -4.482 1.00 0.00 H new ATOM 0 HG2 GLU C 19 50.688 -1.653 -5.844 1.00 0.00 H new ATOM 0 HG3 GLU C 19 50.042 -2.672 -7.115 1.00 0.00 H new ATOM 305 N PHE C 20 53.796 -3.985 -4.497 1.00 0.00 N ATOM 306 CA PHE C 20 54.983 -3.536 -3.714 1.00 0.00 C ATOM 307 C PHE C 20 56.206 -3.436 -4.627 1.00 0.00 C ATOM 308 O PHE C 20 56.927 -2.458 -4.611 1.00 0.00 O ATOM 309 CB PHE C 20 55.191 -4.616 -2.654 1.00 0.00 C ATOM 310 CG PHE C 20 54.224 -4.396 -1.515 1.00 0.00 C ATOM 311 CD1 PHE C 20 54.372 -3.283 -0.679 1.00 0.00 C ATOM 312 CD2 PHE C 20 53.180 -5.304 -1.294 1.00 0.00 C ATOM 313 CE1 PHE C 20 53.477 -3.077 0.377 1.00 0.00 C ATOM 314 CE2 PHE C 20 52.286 -5.097 -0.238 1.00 0.00 C ATOM 315 CZ PHE C 20 52.434 -3.983 0.598 1.00 0.00 C ATOM 0 H PHE C 20 53.270 -4.757 -4.086 1.00 0.00 H new ATOM 0 HA PHE C 20 54.837 -2.552 -3.267 1.00 0.00 H new ATOM 0 HB2 PHE C 20 55.037 -5.603 -3.090 1.00 0.00 H new ATOM 0 HB3 PHE C 20 56.216 -4.586 -2.286 1.00 0.00 H new ATOM 0 HD1 PHE C 20 55.177 -2.583 -0.849 1.00 0.00 H new ATOM 0 HD2 PHE C 20 53.066 -6.163 -1.938 1.00 0.00 H new ATOM 0 HE1 PHE C 20 53.592 -2.218 1.022 1.00 0.00 H new ATOM 0 HE2 PHE C 20 51.481 -5.797 -0.067 1.00 0.00 H new ATOM 0 HZ PHE C 20 51.743 -3.823 1.413 1.00 0.00 H new ATOM 325 N LYS C 21 56.443 -4.439 -5.428 1.00 0.00 N ATOM 326 CA LYS C 21 57.617 -4.397 -6.344 1.00 0.00 C ATOM 327 C LYS C 21 57.645 -3.066 -7.097 1.00 0.00 C ATOM 328 O LYS C 21 58.694 -2.554 -7.435 1.00 0.00 O ATOM 329 CB LYS C 21 57.406 -5.559 -7.316 1.00 0.00 C ATOM 330 CG LYS C 21 58.460 -6.638 -7.059 1.00 0.00 C ATOM 331 CD LYS C 21 59.750 -6.277 -7.798 1.00 0.00 C ATOM 332 CE LYS C 21 60.939 -6.956 -7.113 1.00 0.00 C ATOM 333 NZ LYS C 21 62.137 -6.456 -7.841 1.00 0.00 N ATOM 0 H LYS C 21 55.875 -5.284 -5.487 1.00 0.00 H new ATOM 0 HA LYS C 21 58.563 -4.483 -5.809 1.00 0.00 H new ATOM 0 HB2 LYS C 21 56.406 -5.975 -7.190 1.00 0.00 H new ATOM 0 HB3 LYS C 21 57.477 -5.204 -8.344 1.00 0.00 H new ATOM 0 HG2 LYS C 21 58.653 -6.726 -5.990 1.00 0.00 H new ATOM 0 HG3 LYS C 21 58.094 -7.607 -7.397 1.00 0.00 H new ATOM 0 HD2 LYS C 21 59.686 -6.595 -8.839 1.00 0.00 H new ATOM 0 HD3 LYS C 21 59.888 -5.196 -7.803 1.00 0.00 H new ATOM 0 HE2 LYS C 21 60.984 -6.700 -6.055 1.00 0.00 H new ATOM 0 HE3 LYS C 21 60.864 -8.042 -7.175 1.00 0.00 H new ATOM 0 HZ1 LYS C 21 62.889 -7.174 -7.806 1.00 0.00 H new ATOM 0 HZ2 LYS C 21 61.886 -6.265 -8.832 1.00 0.00 H new ATOM 0 HZ3 LYS C 21 62.474 -5.579 -7.394 1.00 0.00 H new ATOM 347 N ALA C 22 56.499 -2.499 -7.358 1.00 0.00 N ATOM 348 CA ALA C 22 56.457 -1.200 -8.087 1.00 0.00 C ATOM 349 C ALA C 22 57.243 -0.139 -7.312 1.00 0.00 C ATOM 350 O ALA C 22 58.233 0.383 -7.786 1.00 0.00 O ATOM 351 CB ALA C 22 54.976 -0.829 -8.153 1.00 0.00 C ATOM 0 H ALA C 22 55.589 -2.880 -7.098 1.00 0.00 H new ATOM 0 HA ALA C 22 56.903 -1.267 -9.079 1.00 0.00 H new ATOM 0 HB1 ALA C 22 54.862 0.120 -8.677 1.00 0.00 H new ATOM 0 HB2 ALA C 22 54.430 -1.607 -8.687 1.00 0.00 H new ATOM 0 HB3 ALA C 22 54.579 -0.735 -7.142 1.00 0.00 H new ATOM 357 N ALA C 23 56.814 0.180 -6.122 1.00 0.00 N ATOM 358 CA ALA C 23 57.543 1.206 -5.321 1.00 0.00 C ATOM 359 C ALA C 23 59.015 0.813 -5.188 1.00 0.00 C ATOM 360 O ALA C 23 59.898 1.647 -5.224 1.00 0.00 O ATOM 361 CB ALA C 23 56.859 1.201 -3.953 1.00 0.00 C ATOM 0 H ALA C 23 55.993 -0.223 -5.670 1.00 0.00 H new ATOM 0 HA ALA C 23 57.515 2.193 -5.784 1.00 0.00 H new ATOM 0 HB1 ALA C 23 57.340 1.932 -3.303 1.00 0.00 H new ATOM 0 HB2 ALA C 23 55.806 1.457 -4.072 1.00 0.00 H new ATOM 0 HB3 ALA C 23 56.943 0.210 -3.508 1.00 0.00 H new ATOM 367 N PHE C 24 59.286 -0.455 -5.036 1.00 0.00 N ATOM 368 CA PHE C 24 60.701 -0.906 -4.902 1.00 0.00 C ATOM 369 C PHE C 24 61.508 -0.501 -6.141 1.00 0.00 C ATOM 370 O PHE C 24 62.656 -0.114 -6.046 1.00 0.00 O ATOM 371 CB PHE C 24 60.617 -2.430 -4.790 1.00 0.00 C ATOM 372 CG PHE C 24 61.970 -3.040 -5.078 1.00 0.00 C ATOM 373 CD1 PHE C 24 62.421 -3.145 -6.400 1.00 0.00 C ATOM 374 CD2 PHE C 24 62.771 -3.495 -4.026 1.00 0.00 C ATOM 375 CE1 PHE C 24 63.675 -3.708 -6.668 1.00 0.00 C ATOM 376 CE2 PHE C 24 64.025 -4.058 -4.294 1.00 0.00 C ATOM 377 CZ PHE C 24 64.477 -4.165 -5.616 1.00 0.00 C ATOM 0 H PHE C 24 58.589 -1.198 -4.999 1.00 0.00 H new ATOM 0 HA PHE C 24 61.199 -0.458 -4.042 1.00 0.00 H new ATOM 0 HB2 PHE C 24 60.286 -2.713 -3.791 1.00 0.00 H new ATOM 0 HB3 PHE C 24 59.877 -2.815 -5.492 1.00 0.00 H new ATOM 0 HD1 PHE C 24 61.802 -2.792 -7.212 1.00 0.00 H new ATOM 0 HD2 PHE C 24 62.423 -3.412 -3.007 1.00 0.00 H new ATOM 0 HE1 PHE C 24 64.023 -3.790 -7.687 1.00 0.00 H new ATOM 0 HE2 PHE C 24 64.644 -4.410 -3.482 1.00 0.00 H new ATOM 0 HZ PHE C 24 65.444 -4.600 -5.823 1.00 0.00 H new ATOM 387 N ASP C 25 60.919 -0.599 -7.301 1.00 0.00 N ATOM 388 CA ASP C 25 61.656 -0.229 -8.544 1.00 0.00 C ATOM 389 C ASP C 25 62.020 1.259 -8.528 1.00 0.00 C ATOM 390 O ASP C 25 63.170 1.626 -8.670 1.00 0.00 O ATOM 391 CB ASP C 25 60.686 -0.534 -9.685 1.00 0.00 C ATOM 392 CG ASP C 25 61.472 -0.744 -10.981 1.00 0.00 C ATOM 393 OD1 ASP C 25 62.087 -1.789 -11.113 1.00 0.00 O ATOM 394 OD2 ASP C 25 61.444 0.142 -11.818 1.00 0.00 O ATOM 0 H ASP C 25 59.961 -0.919 -7.443 1.00 0.00 H new ATOM 0 HA ASP C 25 62.592 -0.779 -8.646 1.00 0.00 H new ATOM 0 HB2 ASP C 25 60.103 -1.425 -9.452 1.00 0.00 H new ATOM 0 HB3 ASP C 25 59.979 0.287 -9.805 1.00 0.00 H new ATOM 399 N ILE C 26 61.054 2.119 -8.355 1.00 0.00 N ATOM 400 CA ILE C 26 61.356 3.579 -8.330 1.00 0.00 C ATOM 401 C ILE C 26 62.378 3.879 -7.230 1.00 0.00 C ATOM 402 O ILE C 26 63.110 4.848 -7.295 1.00 0.00 O ATOM 403 CB ILE C 26 60.020 4.264 -8.028 1.00 0.00 C ATOM 404 CG1 ILE C 26 59.101 4.147 -9.248 1.00 0.00 C ATOM 405 CG2 ILE C 26 60.252 5.746 -7.717 1.00 0.00 C ATOM 406 CD1 ILE C 26 58.273 2.866 -9.144 1.00 0.00 C ATOM 0 H ILE C 26 60.071 1.875 -8.230 1.00 0.00 H new ATOM 0 HA ILE C 26 61.782 3.930 -9.270 1.00 0.00 H new ATOM 0 HB ILE C 26 59.558 3.781 -7.167 1.00 0.00 H new ATOM 0 HG12 ILE C 26 58.443 5.014 -9.305 1.00 0.00 H new ATOM 0 HG13 ILE C 26 59.694 4.136 -10.163 1.00 0.00 H new ATOM 0 HG21 ILE C 26 59.297 6.227 -7.503 1.00 0.00 H new ATOM 0 HG22 ILE C 26 60.907 5.838 -6.850 1.00 0.00 H new ATOM 0 HG23 ILE C 26 60.717 6.230 -8.576 1.00 0.00 H new ATOM 0 HD11 ILE C 26 57.619 2.784 -10.012 1.00 0.00 H new ATOM 0 HD12 ILE C 26 58.939 2.004 -9.108 1.00 0.00 H new ATOM 0 HD13 ILE C 26 57.669 2.896 -8.237 1.00 0.00 H new ATOM 418 N PHE C 27 62.432 3.055 -6.221 1.00 0.00 N ATOM 419 CA PHE C 27 63.404 3.293 -5.116 1.00 0.00 C ATOM 420 C PHE C 27 64.833 3.059 -5.611 1.00 0.00 C ATOM 421 O PHE C 27 65.675 3.932 -5.538 1.00 0.00 O ATOM 422 CB PHE C 27 63.037 2.273 -4.037 1.00 0.00 C ATOM 423 CG PHE C 27 61.894 2.806 -3.204 1.00 0.00 C ATOM 424 CD1 PHE C 27 60.964 3.688 -3.768 1.00 0.00 C ATOM 425 CD2 PHE C 27 61.765 2.414 -1.866 1.00 0.00 C ATOM 426 CE1 PHE C 27 59.906 4.179 -2.994 1.00 0.00 C ATOM 427 CE2 PHE C 27 60.707 2.905 -1.092 1.00 0.00 C ATOM 428 CZ PHE C 27 59.777 3.787 -1.656 1.00 0.00 C ATOM 0 H PHE C 27 61.846 2.227 -6.113 1.00 0.00 H new ATOM 0 HA PHE C 27 63.360 4.316 -4.741 1.00 0.00 H new ATOM 0 HB2 PHE C 27 62.754 1.327 -4.498 1.00 0.00 H new ATOM 0 HB3 PHE C 27 63.900 2.073 -3.403 1.00 0.00 H new ATOM 0 HD1 PHE C 27 61.063 3.989 -4.800 1.00 0.00 H new ATOM 0 HD2 PHE C 27 62.482 1.733 -1.431 1.00 0.00 H new ATOM 0 HE1 PHE C 27 59.189 4.860 -3.429 1.00 0.00 H new ATOM 0 HE2 PHE C 27 60.608 2.604 -0.060 1.00 0.00 H new ATOM 0 HZ PHE C 27 58.960 4.165 -1.059 1.00 0.00 H new ATOM 438 N VAL C 28 65.113 1.889 -6.116 1.00 0.00 N ATOM 439 CA VAL C 28 66.488 1.601 -6.617 1.00 0.00 C ATOM 440 C VAL C 28 66.633 2.062 -8.067 1.00 0.00 C ATOM 441 O VAL C 28 67.702 2.442 -8.504 1.00 0.00 O ATOM 442 CB VAL C 28 66.634 0.082 -6.529 1.00 0.00 C ATOM 443 CG1 VAL C 28 66.274 -0.387 -5.121 1.00 0.00 C ATOM 444 CG2 VAL C 28 65.692 -0.577 -7.540 1.00 0.00 C ATOM 0 H VAL C 28 64.449 1.119 -6.204 1.00 0.00 H new ATOM 0 HA VAL C 28 67.251 2.121 -6.038 1.00 0.00 H new ATOM 0 HB VAL C 28 67.664 -0.197 -6.751 1.00 0.00 H new ATOM 0 HG11 VAL C 28 66.379 -1.470 -5.060 1.00 0.00 H new ATOM 0 HG12 VAL C 28 66.942 0.083 -4.399 1.00 0.00 H new ATOM 0 HG13 VAL C 28 65.244 -0.109 -4.897 1.00 0.00 H new ATOM 0 HG21 VAL C 28 65.794 -1.661 -7.480 1.00 0.00 H new ATOM 0 HG22 VAL C 28 64.663 -0.296 -7.315 1.00 0.00 H new ATOM 0 HG23 VAL C 28 65.947 -0.244 -8.546 1.00 0.00 H new ATOM 454 N LEU C 29 65.570 2.024 -8.822 1.00 0.00 N ATOM 455 CA LEU C 29 65.660 2.452 -10.246 1.00 0.00 C ATOM 456 C LEU C 29 66.782 1.677 -10.938 1.00 0.00 C ATOM 457 O LEU C 29 66.970 0.500 -10.698 1.00 0.00 O ATOM 458 CB LEU C 29 65.977 3.948 -10.189 1.00 0.00 C ATOM 459 CG LEU C 29 65.168 4.683 -11.260 1.00 0.00 C ATOM 460 CD1 LEU C 29 64.119 5.570 -10.587 1.00 0.00 C ATOM 461 CD2 LEU C 29 66.105 5.553 -12.099 1.00 0.00 C ATOM 0 H LEU C 29 64.647 1.716 -8.516 1.00 0.00 H new ATOM 0 HA LEU C 29 64.745 2.261 -10.808 1.00 0.00 H new ATOM 0 HB2 LEU C 29 65.738 4.344 -9.202 1.00 0.00 H new ATOM 0 HB3 LEU C 29 67.043 4.111 -10.348 1.00 0.00 H new ATOM 0 HG LEU C 29 64.672 3.956 -11.903 1.00 0.00 H new ATOM 0 HD11 LEU C 29 63.542 6.094 -11.349 1.00 0.00 H new ATOM 0 HD12 LEU C 29 63.451 4.952 -9.987 1.00 0.00 H new ATOM 0 HD13 LEU C 29 64.615 6.297 -9.944 1.00 0.00 H new ATOM 0 HD21 LEU C 29 65.529 6.077 -12.862 1.00 0.00 H new ATOM 0 HD22 LEU C 29 66.600 6.280 -11.455 1.00 0.00 H new ATOM 0 HD23 LEU C 29 66.854 4.923 -12.578 1.00 0.00 H new ATOM 473 N GLY C 30 67.537 2.315 -11.789 1.00 0.00 N ATOM 474 CA GLY C 30 68.647 1.596 -12.475 1.00 0.00 C ATOM 475 C GLY C 30 69.833 1.456 -11.516 1.00 0.00 C ATOM 476 O GLY C 30 70.955 1.777 -11.853 1.00 0.00 O ATOM 0 H GLY C 30 67.434 3.299 -12.038 1.00 0.00 H new ATOM 0 HA2 GLY C 30 68.311 0.612 -12.801 1.00 0.00 H new ATOM 0 HA3 GLY C 30 68.950 2.141 -13.369 1.00 0.00 H new ATOM 480 N ALA C 31 69.596 0.982 -10.320 1.00 0.00 N ATOM 481 CA ALA C 31 70.712 0.826 -9.342 1.00 0.00 C ATOM 482 C ALA C 31 71.798 -0.090 -9.911 1.00 0.00 C ATOM 483 O ALA C 31 71.760 -0.473 -11.064 1.00 0.00 O ATOM 484 CB ALA C 31 70.068 0.193 -8.108 1.00 0.00 C ATOM 0 H ALA C 31 68.678 0.697 -9.979 1.00 0.00 H new ATOM 0 HA ALA C 31 71.193 1.777 -9.111 1.00 0.00 H new ATOM 0 HB1 ALA C 31 70.825 0.044 -7.338 1.00 0.00 H new ATOM 0 HB2 ALA C 31 69.287 0.851 -7.727 1.00 0.00 H new ATOM 0 HB3 ALA C 31 69.632 -0.769 -8.378 1.00 0.00 H new ATOM 490 N GLU C 32 72.766 -0.444 -9.110 1.00 0.00 N ATOM 491 CA GLU C 32 73.856 -1.337 -9.600 1.00 0.00 C ATOM 492 C GLU C 32 73.734 -2.723 -8.960 1.00 0.00 C ATOM 493 O GLU C 32 74.024 -3.730 -9.576 1.00 0.00 O ATOM 494 CB GLU C 32 75.154 -0.655 -9.160 1.00 0.00 C ATOM 495 CG GLU C 32 75.285 -0.739 -7.638 1.00 0.00 C ATOM 496 CD GLU C 32 76.393 0.206 -7.168 1.00 0.00 C ATOM 497 OE1 GLU C 32 77.213 0.578 -7.989 1.00 0.00 O ATOM 498 OE2 GLU C 32 76.401 0.540 -5.995 1.00 0.00 O ATOM 0 H GLU C 32 72.850 -0.153 -8.136 1.00 0.00 H new ATOM 0 HA GLU C 32 73.817 -1.482 -10.680 1.00 0.00 H new ATOM 0 HB2 GLU C 32 76.009 -1.135 -9.636 1.00 0.00 H new ATOM 0 HB3 GLU C 32 75.156 0.387 -9.479 1.00 0.00 H new ATOM 0 HG2 GLU C 32 74.340 -0.472 -7.166 1.00 0.00 H new ATOM 0 HG3 GLU C 32 75.513 -1.762 -7.338 1.00 0.00 H new ATOM 505 N ASP C 33 73.304 -2.783 -7.729 1.00 0.00 N ATOM 506 CA ASP C 33 73.162 -4.106 -7.052 1.00 0.00 C ATOM 507 C ASP C 33 71.684 -4.420 -6.805 1.00 0.00 C ATOM 508 O ASP C 33 71.319 -5.540 -6.506 1.00 0.00 O ATOM 509 CB ASP C 33 73.906 -3.954 -5.725 1.00 0.00 C ATOM 510 CG ASP C 33 75.415 -4.007 -5.976 1.00 0.00 C ATOM 511 OD1 ASP C 33 75.842 -4.886 -6.706 1.00 0.00 O ATOM 512 OD2 ASP C 33 76.116 -3.169 -5.435 1.00 0.00 O ATOM 0 H ASP C 33 73.045 -1.975 -7.163 1.00 0.00 H new ATOM 0 HA ASP C 33 73.563 -4.922 -7.654 1.00 0.00 H new ATOM 0 HB2 ASP C 33 73.638 -3.009 -5.252 1.00 0.00 H new ATOM 0 HB3 ASP C 33 73.613 -4.748 -5.039 1.00 0.00 H new ATOM 517 N GLY C 34 70.831 -3.440 -6.927 1.00 0.00 N ATOM 518 CA GLY C 34 69.378 -3.684 -6.700 1.00 0.00 C ATOM 519 C GLY C 34 69.038 -3.418 -5.232 1.00 0.00 C ATOM 520 O GLY C 34 68.238 -4.110 -4.635 1.00 0.00 O ATOM 0 H GLY C 34 71.077 -2.481 -7.174 1.00 0.00 H new ATOM 0 HA2 GLY C 34 68.785 -3.036 -7.345 1.00 0.00 H new ATOM 0 HA3 GLY C 34 69.126 -4.712 -6.962 1.00 0.00 H new ATOM 524 N CYS C 35 69.640 -2.420 -4.646 1.00 0.00 N ATOM 525 CA CYS C 35 69.350 -2.112 -3.215 1.00 0.00 C ATOM 526 C CYS C 35 69.053 -0.620 -3.045 1.00 0.00 C ATOM 527 O CYS C 35 69.017 0.129 -4.001 1.00 0.00 O ATOM 528 CB CYS C 35 70.623 -2.495 -2.462 1.00 0.00 C ATOM 529 SG CYS C 35 71.962 -1.372 -2.930 1.00 0.00 S ATOM 0 H CYS C 35 70.319 -1.805 -5.094 1.00 0.00 H new ATOM 0 HA CYS C 35 68.479 -2.653 -2.844 1.00 0.00 H new ATOM 0 HB2 CYS C 35 70.451 -2.445 -1.387 1.00 0.00 H new ATOM 0 HB3 CYS C 35 70.899 -3.524 -2.693 1.00 0.00 H new ATOM 0 HG CYS C 35 73.045 -1.696 -2.288 1.00 0.00 H new ATOM 535 N ILE C 36 68.840 -0.184 -1.834 1.00 0.00 N ATOM 536 CA ILE C 36 68.546 1.259 -1.600 1.00 0.00 C ATOM 537 C ILE C 36 69.564 1.854 -0.622 1.00 0.00 C ATOM 538 O ILE C 36 70.171 1.152 0.164 1.00 0.00 O ATOM 539 CB ILE C 36 67.140 1.279 -0.996 1.00 0.00 C ATOM 540 CG1 ILE C 36 66.142 0.726 -2.016 1.00 0.00 C ATOM 541 CG2 ILE C 36 66.755 2.716 -0.637 1.00 0.00 C ATOM 542 CD1 ILE C 36 64.743 0.693 -1.394 1.00 0.00 C ATOM 0 H ILE C 36 68.857 -0.765 -0.996 1.00 0.00 H new ATOM 0 HA ILE C 36 68.606 1.850 -2.514 1.00 0.00 H new ATOM 0 HB ILE C 36 67.124 0.664 -0.096 1.00 0.00 H new ATOM 0 HG12 ILE C 36 66.139 1.347 -2.912 1.00 0.00 H new ATOM 0 HG13 ILE C 36 66.438 -0.277 -2.324 1.00 0.00 H new ATOM 0 HG21 ILE C 36 65.753 2.728 -0.207 1.00 0.00 H new ATOM 0 HG22 ILE C 36 67.466 3.113 0.088 1.00 0.00 H new ATOM 0 HG23 ILE C 36 66.771 3.332 -1.536 1.00 0.00 H new ATOM 0 HD11 ILE C 36 64.031 0.299 -2.120 1.00 0.00 H new ATOM 0 HD12 ILE C 36 64.752 0.054 -0.511 1.00 0.00 H new ATOM 0 HD13 ILE C 36 64.448 1.703 -1.108 1.00 0.00 H new ATOM 554 N SER C 37 69.758 3.142 -0.670 1.00 0.00 N ATOM 555 CA SER C 37 70.738 3.792 0.248 1.00 0.00 C ATOM 556 C SER C 37 70.407 5.275 0.388 1.00 0.00 C ATOM 557 O SER C 37 71.272 6.124 0.340 1.00 0.00 O ATOM 558 CB SER C 37 72.078 3.628 -0.444 1.00 0.00 C ATOM 559 OG SER C 37 73.050 3.200 0.501 1.00 0.00 O ATOM 0 H SER C 37 69.278 3.777 -1.308 1.00 0.00 H new ATOM 0 HA SER C 37 70.728 3.356 1.247 1.00 0.00 H new ATOM 0 HB2 SER C 37 71.996 2.901 -1.252 1.00 0.00 H new ATOM 0 HB3 SER C 37 72.384 4.572 -0.895 1.00 0.00 H new ATOM 0 HG SER C 37 73.915 3.092 0.054 1.00 0.00 H new ATOM 565 N THR C 38 69.155 5.574 0.539 1.00 0.00 N ATOM 566 CA THR C 38 68.701 6.996 0.665 1.00 0.00 C ATOM 567 C THR C 38 68.824 7.692 -0.691 1.00 0.00 C ATOM 568 O THR C 38 67.840 8.086 -1.284 1.00 0.00 O ATOM 569 CB THR C 38 69.605 7.670 1.712 1.00 0.00 C ATOM 570 OG1 THR C 38 70.756 8.208 1.079 1.00 0.00 O ATOM 571 CG2 THR C 38 70.027 6.658 2.781 1.00 0.00 C ATOM 0 H THR C 38 68.404 4.885 0.582 1.00 0.00 H new ATOM 0 HA THR C 38 67.658 7.056 0.977 1.00 0.00 H new ATOM 0 HB THR C 38 69.047 8.475 2.191 1.00 0.00 H new ATOM 0 HG1 THR C 38 71.432 7.506 0.979 1.00 0.00 H new ATOM 0 HG21 THR C 38 70.666 7.149 3.515 1.00 0.00 H new ATOM 0 HG22 THR C 38 69.141 6.263 3.278 1.00 0.00 H new ATOM 0 HG23 THR C 38 70.575 5.841 2.312 1.00 0.00 H new ATOM 579 N LYS C 39 70.018 7.831 -1.201 1.00 0.00 N ATOM 580 CA LYS C 39 70.172 8.484 -2.530 1.00 0.00 C ATOM 581 C LYS C 39 69.170 7.861 -3.504 1.00 0.00 C ATOM 582 O LYS C 39 68.638 8.518 -4.376 1.00 0.00 O ATOM 583 CB LYS C 39 71.610 8.189 -2.961 1.00 0.00 C ATOM 584 CG LYS C 39 72.535 9.289 -2.435 1.00 0.00 C ATOM 585 CD LYS C 39 72.853 10.275 -3.561 1.00 0.00 C ATOM 586 CE LYS C 39 72.958 11.691 -2.988 1.00 0.00 C ATOM 587 NZ LYS C 39 71.653 12.333 -3.306 1.00 0.00 N ATOM 0 H LYS C 39 70.885 7.524 -0.759 1.00 0.00 H new ATOM 0 HA LYS C 39 69.984 9.557 -2.504 1.00 0.00 H new ATOM 0 HB2 LYS C 39 71.925 7.219 -2.576 1.00 0.00 H new ATOM 0 HB3 LYS C 39 71.672 8.136 -4.048 1.00 0.00 H new ATOM 0 HG2 LYS C 39 72.060 9.811 -1.604 1.00 0.00 H new ATOM 0 HG3 LYS C 39 73.456 8.851 -2.051 1.00 0.00 H new ATOM 0 HD2 LYS C 39 73.788 9.998 -4.047 1.00 0.00 H new ATOM 0 HD3 LYS C 39 72.074 10.237 -4.323 1.00 0.00 H new ATOM 0 HE2 LYS C 39 73.136 11.670 -1.913 1.00 0.00 H new ATOM 0 HE3 LYS C 39 73.787 12.238 -3.437 1.00 0.00 H new ATOM 0 HZ1 LYS C 39 71.648 13.308 -2.944 1.00 0.00 H new ATOM 0 HZ2 LYS C 39 71.514 12.345 -4.337 1.00 0.00 H new ATOM 0 HZ3 LYS C 39 70.883 11.795 -2.860 1.00 0.00 H new ATOM 601 N GLU C 40 68.899 6.593 -3.341 1.00 0.00 N ATOM 602 CA GLU C 40 67.919 5.911 -4.230 1.00 0.00 C ATOM 603 C GLU C 40 66.515 6.048 -3.636 1.00 0.00 C ATOM 604 O GLU C 40 65.529 6.112 -4.343 1.00 0.00 O ATOM 605 CB GLU C 40 68.344 4.442 -4.236 1.00 0.00 C ATOM 606 CG GLU C 40 69.744 4.310 -4.833 1.00 0.00 C ATOM 607 CD GLU C 40 70.785 4.358 -3.714 1.00 0.00 C ATOM 608 OE1 GLU C 40 70.747 3.489 -2.859 1.00 0.00 O ATOM 609 OE2 GLU C 40 71.606 5.262 -3.732 1.00 0.00 O ATOM 0 H GLU C 40 69.318 5.999 -2.626 1.00 0.00 H new ATOM 0 HA GLU C 40 67.900 6.334 -5.235 1.00 0.00 H new ATOM 0 HB2 GLU C 40 68.333 4.047 -3.220 1.00 0.00 H new ATOM 0 HB3 GLU C 40 67.635 3.851 -4.815 1.00 0.00 H new ATOM 0 HG2 GLU C 40 69.829 3.373 -5.383 1.00 0.00 H new ATOM 0 HG3 GLU C 40 69.924 5.115 -5.546 1.00 0.00 H new ATOM 616 N LEU C 41 66.427 6.088 -2.335 1.00 0.00 N ATOM 617 CA LEU C 41 65.101 6.214 -1.669 1.00 0.00 C ATOM 618 C LEU C 41 64.599 7.659 -1.754 1.00 0.00 C ATOM 619 O LEU C 41 63.494 7.917 -2.188 1.00 0.00 O ATOM 620 CB LEU C 41 65.367 5.821 -0.215 1.00 0.00 C ATOM 621 CG LEU C 41 64.056 5.432 0.465 1.00 0.00 C ATOM 622 CD1 LEU C 41 63.047 6.571 0.317 1.00 0.00 C ATOM 623 CD2 LEU C 41 63.498 4.165 -0.190 1.00 0.00 C ATOM 0 H LEU C 41 67.224 6.038 -1.700 1.00 0.00 H new ATOM 0 HA LEU C 41 64.337 5.590 -2.133 1.00 0.00 H new ATOM 0 HB2 LEU C 41 66.068 4.987 -0.177 1.00 0.00 H new ATOM 0 HB3 LEU C 41 65.830 6.652 0.317 1.00 0.00 H new ATOM 0 HG LEU C 41 64.237 5.244 1.523 1.00 0.00 H new ATOM 0 HD11 LEU C 41 62.111 6.293 0.802 1.00 0.00 H new ATOM 0 HD12 LEU C 41 63.445 7.472 0.784 1.00 0.00 H new ATOM 0 HD13 LEU C 41 62.865 6.761 -0.741 1.00 0.00 H new ATOM 0 HD21 LEU C 41 62.562 3.887 0.295 1.00 0.00 H new ATOM 0 HD22 LEU C 41 63.317 4.352 -1.248 1.00 0.00 H new ATOM 0 HD23 LEU C 41 64.217 3.353 -0.083 1.00 0.00 H new ATOM 635 N GLY C 42 65.401 8.601 -1.338 1.00 0.00 N ATOM 636 CA GLY C 42 64.970 10.027 -1.390 1.00 0.00 C ATOM 637 C GLY C 42 64.362 10.336 -2.761 1.00 0.00 C ATOM 638 O GLY C 42 63.435 11.111 -2.878 1.00 0.00 O ATOM 0 H GLY C 42 66.337 8.444 -0.964 1.00 0.00 H new ATOM 0 HA2 GLY C 42 64.240 10.224 -0.605 1.00 0.00 H new ATOM 0 HA3 GLY C 42 65.822 10.681 -1.204 1.00 0.00 H new ATOM 642 N LYS C 43 64.881 9.739 -3.799 1.00 0.00 N ATOM 643 CA LYS C 43 64.335 10.003 -5.163 1.00 0.00 C ATOM 644 C LYS C 43 62.804 9.978 -5.141 1.00 0.00 C ATOM 645 O LYS C 43 62.154 10.772 -5.792 1.00 0.00 O ATOM 646 CB LYS C 43 64.877 8.868 -6.031 1.00 0.00 C ATOM 647 CG LYS C 43 66.404 8.948 -6.080 1.00 0.00 C ATOM 648 CD LYS C 43 66.842 9.534 -7.422 1.00 0.00 C ATOM 649 CE LYS C 43 66.869 8.428 -8.479 1.00 0.00 C ATOM 650 NZ LYS C 43 67.495 9.054 -9.678 1.00 0.00 N ATOM 0 H LYS C 43 65.659 9.080 -3.763 1.00 0.00 H new ATOM 0 HA LYS C 43 64.627 10.983 -5.540 1.00 0.00 H new ATOM 0 HB2 LYS C 43 64.565 7.905 -5.626 1.00 0.00 H new ATOM 0 HB3 LYS C 43 64.466 8.938 -7.038 1.00 0.00 H new ATOM 0 HG2 LYS C 43 66.772 9.568 -5.263 1.00 0.00 H new ATOM 0 HG3 LYS C 43 66.835 7.956 -5.947 1.00 0.00 H new ATOM 0 HD2 LYS C 43 66.157 10.325 -7.726 1.00 0.00 H new ATOM 0 HD3 LYS C 43 67.829 9.986 -7.328 1.00 0.00 H new ATOM 0 HE2 LYS C 43 67.446 7.569 -8.136 1.00 0.00 H new ATOM 0 HE3 LYS C 43 65.864 8.069 -8.701 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 67.548 8.355 -10.447 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 66.921 9.865 -9.986 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 68.453 9.379 -9.439 1.00 0.00 H new ATOM 664 N VAL C 44 62.222 9.075 -4.400 1.00 0.00 N ATOM 665 CA VAL C 44 60.734 9.005 -4.344 1.00 0.00 C ATOM 666 C VAL C 44 60.186 10.086 -3.408 1.00 0.00 C ATOM 667 O VAL C 44 59.120 10.627 -3.626 1.00 0.00 O ATOM 668 CB VAL C 44 60.423 7.612 -3.795 1.00 0.00 C ATOM 669 CG1 VAL C 44 58.960 7.551 -3.353 1.00 0.00 C ATOM 670 CG2 VAL C 44 60.667 6.568 -4.887 1.00 0.00 C ATOM 0 H VAL C 44 62.711 8.384 -3.832 1.00 0.00 H new ATOM 0 HA VAL C 44 60.277 9.170 -5.320 1.00 0.00 H new ATOM 0 HB VAL C 44 61.069 7.406 -2.942 1.00 0.00 H new ATOM 0 HG11 VAL C 44 58.739 6.558 -2.962 1.00 0.00 H new ATOM 0 HG12 VAL C 44 58.783 8.295 -2.576 1.00 0.00 H new ATOM 0 HG13 VAL C 44 58.313 7.757 -4.206 1.00 0.00 H new ATOM 0 HG21 VAL C 44 60.446 5.575 -4.497 1.00 0.00 H new ATOM 0 HG22 VAL C 44 60.020 6.775 -5.740 1.00 0.00 H new ATOM 0 HG23 VAL C 44 61.709 6.609 -5.204 1.00 0.00 H new ATOM 680 N MET C 45 60.905 10.403 -2.366 1.00 0.00 N ATOM 681 CA MET C 45 60.422 11.449 -1.419 1.00 0.00 C ATOM 682 C MET C 45 59.993 12.701 -2.189 1.00 0.00 C ATOM 683 O MET C 45 58.897 13.196 -2.021 1.00 0.00 O ATOM 684 CB MET C 45 61.619 11.752 -0.517 1.00 0.00 C ATOM 685 CG MET C 45 61.986 10.499 0.280 1.00 0.00 C ATOM 686 SD MET C 45 60.534 9.910 1.188 1.00 0.00 S ATOM 687 CE MET C 45 59.875 8.833 -0.108 1.00 0.00 C ATOM 0 H MET C 45 61.804 9.984 -2.129 1.00 0.00 H new ATOM 0 HA MET C 45 59.556 11.120 -0.845 1.00 0.00 H new ATOM 0 HB2 MET C 45 62.469 12.075 -1.118 1.00 0.00 H new ATOM 0 HB3 MET C 45 61.379 12.570 0.162 1.00 0.00 H new ATOM 0 HG2 MET C 45 62.347 9.721 -0.392 1.00 0.00 H new ATOM 0 HG3 MET C 45 62.796 10.722 0.974 1.00 0.00 H new ATOM 0 HE1 MET C 45 59.266 8.050 0.344 1.00 0.00 H new ATOM 0 HE2 MET C 45 59.262 9.420 -0.792 1.00 0.00 H new ATOM 0 HE3 MET C 45 60.699 8.379 -0.658 1.00 0.00 H new ATOM 697 N ARG C 46 60.844 13.214 -3.036 1.00 0.00 N ATOM 698 CA ARG C 46 60.471 14.428 -3.815 1.00 0.00 C ATOM 699 C ARG C 46 59.182 14.166 -4.596 1.00 0.00 C ATOM 700 O ARG C 46 58.349 15.037 -4.751 1.00 0.00 O ATOM 701 CB ARG C 46 61.640 14.667 -4.771 1.00 0.00 C ATOM 702 CG ARG C 46 62.476 15.845 -4.268 1.00 0.00 C ATOM 703 CD ARG C 46 62.788 16.787 -5.434 1.00 0.00 C ATOM 704 NE ARG C 46 63.305 18.029 -4.794 1.00 0.00 N ATOM 705 CZ ARG C 46 62.912 19.196 -5.226 1.00 0.00 C ATOM 706 NH1 ARG C 46 63.254 19.599 -6.420 1.00 0.00 N ATOM 707 NH2 ARG C 46 62.177 19.959 -4.465 1.00 0.00 N ATOM 0 H ARG C 46 61.777 12.846 -3.221 1.00 0.00 H new ATOM 0 HA ARG C 46 60.291 15.293 -3.176 1.00 0.00 H new ATOM 0 HB2 ARG C 46 62.258 13.771 -4.839 1.00 0.00 H new ATOM 0 HB3 ARG C 46 61.267 14.874 -5.774 1.00 0.00 H new ATOM 0 HG2 ARG C 46 61.935 16.381 -3.488 1.00 0.00 H new ATOM 0 HG3 ARG C 46 63.402 15.483 -3.822 1.00 0.00 H new ATOM 0 HD2 ARG C 46 63.527 16.352 -6.107 1.00 0.00 H new ATOM 0 HD3 ARG C 46 61.897 16.990 -6.028 1.00 0.00 H new ATOM 0 HE ARG C 46 63.965 17.967 -4.019 1.00 0.00 H new ATOM 0 HH11 ARG C 46 63.828 19.002 -7.015 1.00 0.00 H new ATOM 0 HH12 ARG C 46 62.947 20.511 -6.758 1.00 0.00 H new ATOM 0 HH21 ARG C 46 61.910 19.643 -3.533 1.00 0.00 H new ATOM 0 HH22 ARG C 46 61.870 20.871 -4.802 1.00 0.00 H new ATOM 721 N MET C 47 59.009 12.967 -5.083 1.00 0.00 N ATOM 722 CA MET C 47 57.771 12.643 -5.849 1.00 0.00 C ATOM 723 C MET C 47 56.573 12.573 -4.898 1.00 0.00 C ATOM 724 O MET C 47 55.478 12.978 -5.232 1.00 0.00 O ATOM 725 CB MET C 47 58.038 11.276 -6.479 1.00 0.00 C ATOM 726 CG MET C 47 59.351 11.318 -7.263 1.00 0.00 C ATOM 727 SD MET C 47 59.174 10.364 -8.791 1.00 0.00 S ATOM 728 CE MET C 47 58.699 8.793 -8.026 1.00 0.00 C ATOM 0 H MET C 47 59.671 12.198 -4.984 1.00 0.00 H new ATOM 0 HA MET C 47 57.539 13.396 -6.602 1.00 0.00 H new ATOM 0 HB2 MET C 47 58.090 10.511 -5.704 1.00 0.00 H new ATOM 0 HB3 MET C 47 57.216 11.003 -7.141 1.00 0.00 H new ATOM 0 HG2 MET C 47 59.615 12.350 -7.495 1.00 0.00 H new ATOM 0 HG3 MET C 47 60.161 10.909 -6.659 1.00 0.00 H new ATOM 0 HE1 MET C 47 58.519 8.050 -8.803 1.00 0.00 H new ATOM 0 HE2 MET C 47 59.501 8.449 -7.373 1.00 0.00 H new ATOM 0 HE3 MET C 47 57.790 8.933 -7.441 1.00 0.00 H new ATOM 738 N LEU C 48 56.776 12.065 -3.712 1.00 0.00 N ATOM 739 CA LEU C 48 55.651 11.972 -2.737 1.00 0.00 C ATOM 740 C LEU C 48 55.233 13.373 -2.283 1.00 0.00 C ATOM 741 O LEU C 48 54.080 13.627 -1.997 1.00 0.00 O ATOM 742 CB LEU C 48 56.209 11.176 -1.555 1.00 0.00 C ATOM 743 CG LEU C 48 56.438 9.720 -1.967 1.00 0.00 C ATOM 744 CD1 LEU C 48 56.671 8.870 -0.717 1.00 0.00 C ATOM 745 CD2 LEU C 48 55.208 9.198 -2.713 1.00 0.00 C ATOM 0 H LEU C 48 57.672 11.711 -3.376 1.00 0.00 H new ATOM 0 HA LEU C 48 54.771 11.496 -3.169 1.00 0.00 H new ATOM 0 HB2 LEU C 48 57.146 11.619 -1.217 1.00 0.00 H new ATOM 0 HB3 LEU C 48 55.515 11.220 -0.716 1.00 0.00 H new ATOM 0 HG LEU C 48 57.310 9.661 -2.619 1.00 0.00 H new ATOM 0 HD11 LEU C 48 56.834 7.832 -1.008 1.00 0.00 H new ATOM 0 HD12 LEU C 48 57.547 9.240 -0.184 1.00 0.00 H new ATOM 0 HD13 LEU C 48 55.798 8.932 -0.067 1.00 0.00 H new ATOM 0 HD21 LEU C 48 55.373 8.161 -3.006 1.00 0.00 H new ATOM 0 HD22 LEU C 48 54.336 9.257 -2.062 1.00 0.00 H new ATOM 0 HD23 LEU C 48 55.038 9.804 -3.603 1.00 0.00 H new ATOM 757 N GLY C 49 56.164 14.285 -2.217 1.00 0.00 N ATOM 758 CA GLY C 49 55.824 15.670 -1.784 1.00 0.00 C ATOM 759 C GLY C 49 56.736 16.097 -0.629 1.00 0.00 C ATOM 760 O GLY C 49 56.430 17.014 0.107 1.00 0.00 O ATOM 0 H GLY C 49 57.146 14.131 -2.444 1.00 0.00 H new ATOM 0 HA2 GLY C 49 55.936 16.359 -2.621 1.00 0.00 H new ATOM 0 HA3 GLY C 49 54.781 15.716 -1.471 1.00 0.00 H new ATOM 764 N GLN C 50 57.856 15.446 -0.464 1.00 0.00 N ATOM 765 CA GLN C 50 58.784 15.824 0.643 1.00 0.00 C ATOM 766 C GLN C 50 60.238 15.700 0.177 1.00 0.00 C ATOM 767 O GLN C 50 60.514 15.615 -1.003 1.00 0.00 O ATOM 768 CB GLN C 50 58.491 14.830 1.767 1.00 0.00 C ATOM 769 CG GLN C 50 58.704 15.513 3.120 1.00 0.00 C ATOM 770 CD GLN C 50 57.681 14.984 4.127 1.00 0.00 C ATOM 771 OE1 GLN C 50 58.006 14.176 4.973 1.00 0.00 O ATOM 772 NE2 GLN C 50 56.448 15.410 4.070 1.00 0.00 N ATOM 0 H GLN C 50 58.169 14.670 -1.047 1.00 0.00 H new ATOM 0 HA GLN C 50 58.642 16.855 0.968 1.00 0.00 H new ATOM 0 HB2 GLN C 50 57.466 14.467 1.688 1.00 0.00 H new ATOM 0 HB3 GLN C 50 59.144 13.962 1.679 1.00 0.00 H new ATOM 0 HG2 GLN C 50 59.715 15.323 3.480 1.00 0.00 H new ATOM 0 HG3 GLN C 50 58.601 16.593 3.014 1.00 0.00 H new ATOM 0 HE21 GLN C 50 56.175 16.089 3.359 1.00 0.00 H new ATOM 0 HE22 GLN C 50 55.758 15.064 4.736 1.00 0.00 H new ATOM 781 N ASN C 51 61.170 15.689 1.091 1.00 0.00 N ATOM 782 CA ASN C 51 62.602 15.571 0.692 1.00 0.00 C ATOM 783 C ASN C 51 63.495 15.462 1.933 1.00 0.00 C ATOM 784 O ASN C 51 64.092 16.432 2.356 1.00 0.00 O ATOM 785 CB ASN C 51 62.904 16.859 -0.074 1.00 0.00 C ATOM 786 CG ASN C 51 62.354 18.057 0.701 1.00 0.00 C ATOM 787 OD1 ASN C 51 61.172 18.334 0.655 1.00 0.00 O ATOM 788 ND2 ASN C 51 63.166 18.783 1.418 1.00 0.00 N ATOM 0 H ASN C 51 61.002 15.756 2.095 1.00 0.00 H new ATOM 0 HA ASN C 51 62.790 14.682 0.090 1.00 0.00 H new ATOM 0 HB2 ASN C 51 63.979 16.967 -0.215 1.00 0.00 H new ATOM 0 HB3 ASN C 51 62.455 16.818 -1.066 1.00 0.00 H new ATOM 0 HD21 ASN C 51 62.809 19.583 1.940 1.00 0.00 H new ATOM 0 HD22 ASN C 51 64.158 18.551 1.457 1.00 0.00 H new ATOM 795 N PRO C 52 63.554 14.274 2.471 1.00 0.00 N ATOM 796 CA PRO C 52 64.383 14.024 3.676 1.00 0.00 C ATOM 797 C PRO C 52 65.872 13.996 3.311 1.00 0.00 C ATOM 798 O PRO C 52 66.258 13.486 2.279 1.00 0.00 O ATOM 799 CB PRO C 52 63.916 12.651 4.151 1.00 0.00 C ATOM 800 CG PRO C 52 63.369 11.981 2.930 1.00 0.00 C ATOM 801 CD PRO C 52 62.862 13.065 2.013 1.00 0.00 C ATOM 0 HA PRO C 52 64.273 14.796 4.437 1.00 0.00 H new ATOM 0 HB2 PRO C 52 64.741 12.080 4.578 1.00 0.00 H new ATOM 0 HB3 PRO C 52 63.155 12.740 4.926 1.00 0.00 H new ATOM 0 HG2 PRO C 52 64.141 11.391 2.437 1.00 0.00 H new ATOM 0 HG3 PRO C 52 62.565 11.295 3.196 1.00 0.00 H new ATOM 0 HD2 PRO C 52 63.092 12.845 0.970 1.00 0.00 H new ATOM 0 HD3 PRO C 52 61.780 13.174 2.085 1.00 0.00 H new ATOM 809 N THR C 53 66.708 14.540 4.153 1.00 0.00 N ATOM 810 CA THR C 53 68.172 14.545 3.857 1.00 0.00 C ATOM 811 C THR C 53 68.717 13.114 3.867 1.00 0.00 C ATOM 812 O THR C 53 68.074 12.209 4.362 1.00 0.00 O ATOM 813 CB THR C 53 68.798 15.368 4.985 1.00 0.00 C ATOM 814 OG1 THR C 53 68.596 14.702 6.223 1.00 0.00 O ATOM 815 CG2 THR C 53 68.146 16.750 5.035 1.00 0.00 C ATOM 0 H THR C 53 66.442 14.981 5.033 1.00 0.00 H new ATOM 0 HA THR C 53 68.396 14.962 2.875 1.00 0.00 H new ATOM 0 HB THR C 53 69.867 15.480 4.802 1.00 0.00 H new ATOM 0 HG1 THR C 53 69.364 14.862 6.810 1.00 0.00 H new ATOM 0 HG21 THR C 53 68.593 17.334 5.839 1.00 0.00 H new ATOM 0 HG22 THR C 53 68.302 17.261 4.085 1.00 0.00 H new ATOM 0 HG23 THR C 53 67.077 16.641 5.217 1.00 0.00 H new ATOM 823 N PRO C 54 69.892 12.958 3.319 1.00 0.00 N ATOM 824 CA PRO C 54 70.537 11.622 3.265 1.00 0.00 C ATOM 825 C PRO C 54 70.980 11.185 4.663 1.00 0.00 C ATOM 826 O PRO C 54 71.232 10.022 4.909 1.00 0.00 O ATOM 827 CB PRO C 54 71.741 11.842 2.351 1.00 0.00 C ATOM 828 CG PRO C 54 72.039 13.303 2.455 1.00 0.00 C ATOM 829 CD PRO C 54 70.726 13.998 2.708 1.00 0.00 C ATOM 0 HA PRO C 54 69.872 10.838 2.902 1.00 0.00 H new ATOM 0 HB2 PRO C 54 72.593 11.241 2.668 1.00 0.00 H new ATOM 0 HB3 PRO C 54 71.515 11.557 1.324 1.00 0.00 H new ATOM 0 HG2 PRO C 54 72.742 13.498 3.265 1.00 0.00 H new ATOM 0 HG3 PRO C 54 72.500 13.670 1.538 1.00 0.00 H new ATOM 0 HD2 PRO C 54 70.848 14.854 3.371 1.00 0.00 H new ATOM 0 HD3 PRO C 54 70.286 14.371 1.783 1.00 0.00 H new ATOM 837 N GLU C 55 71.071 12.106 5.582 1.00 0.00 N ATOM 838 CA GLU C 55 71.489 11.740 6.965 1.00 0.00 C ATOM 839 C GLU C 55 70.293 11.181 7.738 1.00 0.00 C ATOM 840 O GLU C 55 70.426 10.290 8.553 1.00 0.00 O ATOM 841 CB GLU C 55 71.972 13.047 7.595 1.00 0.00 C ATOM 842 CG GLU C 55 73.038 13.684 6.700 1.00 0.00 C ATOM 843 CD GLU C 55 74.384 13.683 7.428 1.00 0.00 C ATOM 844 OE1 GLU C 55 74.865 12.605 7.737 1.00 0.00 O ATOM 845 OE2 GLU C 55 74.909 14.757 7.663 1.00 0.00 O ATOM 0 H GLU C 55 70.874 13.096 5.436 1.00 0.00 H new ATOM 0 HA GLU C 55 72.266 10.975 6.976 1.00 0.00 H new ATOM 0 HB2 GLU C 55 71.134 13.732 7.724 1.00 0.00 H new ATOM 0 HB3 GLU C 55 72.382 12.855 8.586 1.00 0.00 H new ATOM 0 HG2 GLU C 55 73.119 13.132 5.764 1.00 0.00 H new ATOM 0 HG3 GLU C 55 72.751 14.704 6.445 1.00 0.00 H new ATOM 852 N GLU C 56 69.121 11.699 7.483 1.00 0.00 N ATOM 853 CA GLU C 56 67.910 11.202 8.195 1.00 0.00 C ATOM 854 C GLU C 56 67.261 10.063 7.404 1.00 0.00 C ATOM 855 O GLU C 56 66.470 9.305 7.926 1.00 0.00 O ATOM 856 CB GLU C 56 66.970 12.407 8.267 1.00 0.00 C ATOM 857 CG GLU C 56 67.152 13.117 9.609 1.00 0.00 C ATOM 858 CD GLU C 56 68.321 14.099 9.512 1.00 0.00 C ATOM 859 OE1 GLU C 56 69.264 13.797 8.801 1.00 0.00 O ATOM 860 OE2 GLU C 56 68.251 15.136 10.150 1.00 0.00 O ATOM 0 H GLU C 56 68.951 12.447 6.810 1.00 0.00 H new ATOM 0 HA GLU C 56 68.145 10.808 9.184 1.00 0.00 H new ATOM 0 HB2 GLU C 56 67.180 13.095 7.448 1.00 0.00 H new ATOM 0 HB3 GLU C 56 65.936 12.082 8.153 1.00 0.00 H new ATOM 0 HG2 GLU C 56 66.239 13.648 9.879 1.00 0.00 H new ATOM 0 HG3 GLU C 56 67.341 12.387 10.396 1.00 0.00 H new ATOM 867 N LEU C 57 67.589 9.938 6.148 1.00 0.00 N ATOM 868 CA LEU C 57 66.988 8.848 5.327 1.00 0.00 C ATOM 869 C LEU C 57 67.357 7.483 5.914 1.00 0.00 C ATOM 870 O LEU C 57 66.549 6.576 5.957 1.00 0.00 O ATOM 871 CB LEU C 57 67.602 9.014 3.938 1.00 0.00 C ATOM 872 CG LEU C 57 66.624 9.761 3.030 1.00 0.00 C ATOM 873 CD1 LEU C 57 67.315 10.092 1.707 1.00 0.00 C ATOM 874 CD2 LEU C 57 65.402 8.881 2.761 1.00 0.00 C ATOM 0 H LEU C 57 68.246 10.542 5.654 1.00 0.00 H new ATOM 0 HA LEU C 57 65.900 8.902 5.301 1.00 0.00 H new ATOM 0 HB2 LEU C 57 68.541 9.563 4.008 1.00 0.00 H new ATOM 0 HB3 LEU C 57 67.835 8.038 3.513 1.00 0.00 H new ATOM 0 HG LEU C 57 66.306 10.683 3.517 1.00 0.00 H new ATOM 0 HD11 LEU C 57 66.621 10.625 1.057 1.00 0.00 H new ATOM 0 HD12 LEU C 57 68.186 10.719 1.898 1.00 0.00 H new ATOM 0 HD13 LEU C 57 67.632 9.169 1.221 1.00 0.00 H new ATOM 0 HD21 LEU C 57 64.705 9.414 2.114 1.00 0.00 H new ATOM 0 HD22 LEU C 57 65.718 7.959 2.273 1.00 0.00 H new ATOM 0 HD23 LEU C 57 64.911 8.642 3.704 1.00 0.00 H new ATOM 886 N GLN C 58 68.571 7.330 6.365 1.00 0.00 N ATOM 887 CA GLN C 58 68.991 6.023 6.945 1.00 0.00 C ATOM 888 C GLN C 58 67.891 5.469 7.853 1.00 0.00 C ATOM 889 O GLN C 58 67.672 4.275 7.919 1.00 0.00 O ATOM 890 CB GLN C 58 70.249 6.335 7.755 1.00 0.00 C ATOM 891 CG GLN C 58 71.366 5.370 7.353 1.00 0.00 C ATOM 892 CD GLN C 58 70.874 3.928 7.503 1.00 0.00 C ATOM 893 OE1 GLN C 58 70.181 3.606 8.448 1.00 0.00 O ATOM 894 NE2 GLN C 58 71.206 3.040 6.605 1.00 0.00 N ATOM 0 H GLN C 58 69.290 8.053 6.357 1.00 0.00 H new ATOM 0 HA GLN C 58 69.177 5.271 6.178 1.00 0.00 H new ATOM 0 HB2 GLN C 58 70.562 7.364 7.579 1.00 0.00 H new ATOM 0 HB3 GLN C 58 70.040 6.243 8.821 1.00 0.00 H new ATOM 0 HG2 GLN C 58 71.669 5.557 6.323 1.00 0.00 H new ATOM 0 HG3 GLN C 58 72.244 5.533 7.978 1.00 0.00 H new ATOM 0 HE21 GLN C 58 71.788 3.310 5.812 1.00 0.00 H new ATOM 0 HE22 GLN C 58 70.884 2.077 6.697 1.00 0.00 H new ATOM 903 N GLU C 59 67.197 6.322 8.554 1.00 0.00 N ATOM 904 CA GLU C 59 66.113 5.835 9.454 1.00 0.00 C ATOM 905 C GLU C 59 65.264 4.788 8.732 1.00 0.00 C ATOM 906 O GLU C 59 65.100 3.678 9.199 1.00 0.00 O ATOM 907 CB GLU C 59 65.277 7.074 9.779 1.00 0.00 C ATOM 908 CG GLU C 59 65.237 7.278 11.295 1.00 0.00 C ATOM 909 CD GLU C 59 63.868 7.829 11.699 1.00 0.00 C ATOM 910 OE1 GLU C 59 63.496 8.871 11.187 1.00 0.00 O ATOM 911 OE2 GLU C 59 63.216 7.198 12.515 1.00 0.00 O ATOM 0 H GLU C 59 67.333 7.333 8.543 1.00 0.00 H new ATOM 0 HA GLU C 59 66.504 5.363 10.355 1.00 0.00 H new ATOM 0 HB2 GLU C 59 65.704 7.952 9.294 1.00 0.00 H new ATOM 0 HB3 GLU C 59 64.266 6.956 9.390 1.00 0.00 H new ATOM 0 HG2 GLU C 59 65.426 6.333 11.805 1.00 0.00 H new ATOM 0 HG3 GLU C 59 66.023 7.968 11.601 1.00 0.00 H new ATOM 918 N MET C 60 64.728 5.129 7.593 1.00 0.00 N ATOM 919 CA MET C 60 63.894 4.149 6.840 1.00 0.00 C ATOM 920 C MET C 60 64.713 2.893 6.533 1.00 0.00 C ATOM 921 O MET C 60 64.187 1.802 6.443 1.00 0.00 O ATOM 922 CB MET C 60 63.506 4.869 5.547 1.00 0.00 C ATOM 923 CG MET C 60 62.021 5.228 5.589 1.00 0.00 C ATOM 924 SD MET C 60 61.649 6.423 4.280 1.00 0.00 S ATOM 925 CE MET C 60 60.937 7.705 5.339 1.00 0.00 C ATOM 0 H MET C 60 64.831 6.042 7.151 1.00 0.00 H new ATOM 0 HA MET C 60 63.018 3.829 7.403 1.00 0.00 H new ATOM 0 HB2 MET C 60 64.106 5.771 5.427 1.00 0.00 H new ATOM 0 HB3 MET C 60 63.713 4.232 4.687 1.00 0.00 H new ATOM 0 HG2 MET C 60 61.416 4.331 5.459 1.00 0.00 H new ATOM 0 HG3 MET C 60 61.765 5.647 6.562 1.00 0.00 H new ATOM 0 HE1 MET C 60 60.944 8.658 4.811 1.00 0.00 H new ATOM 0 HE2 MET C 60 59.911 7.439 5.593 1.00 0.00 H new ATOM 0 HE3 MET C 60 61.526 7.792 6.252 1.00 0.00 H new ATOM 935 N ILE C 61 65.999 3.041 6.369 1.00 0.00 N ATOM 936 CA ILE C 61 66.858 1.861 6.065 1.00 0.00 C ATOM 937 C ILE C 61 67.133 1.056 7.339 1.00 0.00 C ATOM 938 O ILE C 61 66.971 -0.148 7.369 1.00 0.00 O ATOM 939 CB ILE C 61 68.156 2.452 5.518 1.00 0.00 C ATOM 940 CG1 ILE C 61 67.806 3.557 4.495 1.00 0.00 C ATOM 941 CG2 ILE C 61 68.984 1.331 4.875 1.00 0.00 C ATOM 942 CD1 ILE C 61 68.503 3.319 3.150 1.00 0.00 C ATOM 0 H ILE C 61 66.493 3.931 6.433 1.00 0.00 H new ATOM 0 HA ILE C 61 66.385 1.180 5.358 1.00 0.00 H new ATOM 0 HB ILE C 61 68.749 2.897 6.317 1.00 0.00 H new ATOM 0 HG12 ILE C 61 66.727 3.588 4.346 1.00 0.00 H new ATOM 0 HG13 ILE C 61 68.101 4.528 4.892 1.00 0.00 H new ATOM 0 HG21 ILE C 61 69.913 1.744 4.482 1.00 0.00 H new ATOM 0 HG22 ILE C 61 69.213 0.572 5.624 1.00 0.00 H new ATOM 0 HG23 ILE C 61 68.415 0.879 4.062 1.00 0.00 H new ATOM 0 HD11 ILE C 61 68.234 4.115 2.455 1.00 0.00 H new ATOM 0 HD12 ILE C 61 69.583 3.314 3.296 1.00 0.00 H new ATOM 0 HD13 ILE C 61 68.188 2.359 2.742 1.00 0.00 H new ATOM 954 N ASP C 62 67.552 1.710 8.387 1.00 0.00 N ATOM 955 CA ASP C 62 67.843 0.978 9.654 1.00 0.00 C ATOM 956 C ASP C 62 66.549 0.422 10.257 1.00 0.00 C ATOM 957 O ASP C 62 66.575 -0.404 11.149 1.00 0.00 O ATOM 958 CB ASP C 62 68.461 2.023 10.583 1.00 0.00 C ATOM 959 CG ASP C 62 69.780 1.489 11.145 1.00 0.00 C ATOM 960 OD1 ASP C 62 70.586 1.012 10.362 1.00 0.00 O ATOM 961 OD2 ASP C 62 69.964 1.567 12.348 1.00 0.00 O ATOM 0 H ASP C 62 67.706 2.718 8.422 1.00 0.00 H new ATOM 0 HA ASP C 62 68.508 0.129 9.495 1.00 0.00 H new ATOM 0 HB2 ASP C 62 68.634 2.952 10.039 1.00 0.00 H new ATOM 0 HB3 ASP C 62 67.773 2.254 11.397 1.00 0.00 H new ATOM 966 N GLU C 63 65.418 0.864 9.778 1.00 0.00 N ATOM 967 CA GLU C 63 64.129 0.355 10.329 1.00 0.00 C ATOM 968 C GLU C 63 63.941 -1.117 9.948 1.00 0.00 C ATOM 969 O GLU C 63 63.332 -1.881 10.670 1.00 0.00 O ATOM 970 CB GLU C 63 63.048 1.220 9.682 1.00 0.00 C ATOM 971 CG GLU C 63 62.044 1.664 10.747 1.00 0.00 C ATOM 972 CD GLU C 63 60.702 1.984 10.086 1.00 0.00 C ATOM 973 OE1 GLU C 63 60.677 2.857 9.234 1.00 0.00 O ATOM 974 OE2 GLU C 63 59.722 1.352 10.443 1.00 0.00 O ATOM 0 H GLU C 63 65.330 1.553 9.031 1.00 0.00 H new ATOM 0 HA GLU C 63 64.093 0.411 11.417 1.00 0.00 H new ATOM 0 HB2 GLU C 63 63.500 2.091 9.208 1.00 0.00 H new ATOM 0 HB3 GLU C 63 62.539 0.659 8.899 1.00 0.00 H new ATOM 0 HG2 GLU C 63 61.916 0.878 11.491 1.00 0.00 H new ATOM 0 HG3 GLU C 63 62.420 2.542 11.273 1.00 0.00 H new ATOM 981 N VAL C 64 64.462 -1.519 8.822 1.00 0.00 N ATOM 982 CA VAL C 64 64.315 -2.942 8.397 1.00 0.00 C ATOM 983 C VAL C 64 65.678 -3.518 8.002 1.00 0.00 C ATOM 984 O VAL C 64 65.766 -4.563 7.389 1.00 0.00 O ATOM 985 CB VAL C 64 63.377 -2.902 7.191 1.00 0.00 C ATOM 986 CG1 VAL C 64 61.969 -2.522 7.649 1.00 0.00 C ATOM 987 CG2 VAL C 64 63.883 -1.864 6.187 1.00 0.00 C ATOM 0 H VAL C 64 64.983 -0.925 8.177 1.00 0.00 H new ATOM 0 HA VAL C 64 63.923 -3.573 9.194 1.00 0.00 H new ATOM 0 HB VAL C 64 63.352 -3.884 6.719 1.00 0.00 H new ATOM 0 HG11 VAL C 64 61.301 -2.494 6.788 1.00 0.00 H new ATOM 0 HG12 VAL C 64 61.607 -3.261 8.364 1.00 0.00 H new ATOM 0 HG13 VAL C 64 61.993 -1.540 8.122 1.00 0.00 H new ATOM 0 HG21 VAL C 64 63.215 -1.834 5.326 1.00 0.00 H new ATOM 0 HG22 VAL C 64 63.909 -0.882 6.660 1.00 0.00 H new ATOM 0 HG23 VAL C 64 64.886 -2.135 5.858 1.00 0.00 H new ATOM 997 N ASP C 65 66.741 -2.845 8.349 1.00 0.00 N ATOM 998 CA ASP C 65 68.096 -3.356 7.993 1.00 0.00 C ATOM 999 C ASP C 65 68.723 -4.070 9.193 1.00 0.00 C ATOM 1000 O ASP C 65 69.407 -3.469 9.998 1.00 0.00 O ATOM 1001 CB ASP C 65 68.906 -2.113 7.623 1.00 0.00 C ATOM 1002 CG ASP C 65 70.396 -2.460 7.603 1.00 0.00 C ATOM 1003 OD1 ASP C 65 70.753 -3.412 6.930 1.00 0.00 O ATOM 1004 OD2 ASP C 65 71.153 -1.767 8.262 1.00 0.00 O ATOM 0 H ASP C 65 66.730 -1.964 8.863 1.00 0.00 H new ATOM 0 HA ASP C 65 68.064 -4.077 7.176 1.00 0.00 H new ATOM 0 HB2 ASP C 65 68.595 -1.741 6.646 1.00 0.00 H new ATOM 0 HB3 ASP C 65 68.717 -1.316 8.342 1.00 0.00 H new ATOM 1009 N GLU C 66 68.493 -5.348 9.321 1.00 0.00 N ATOM 1010 CA GLU C 66 69.072 -6.101 10.470 1.00 0.00 C ATOM 1011 C GLU C 66 70.288 -6.912 10.009 1.00 0.00 C ATOM 1012 O GLU C 66 70.432 -8.072 10.340 1.00 0.00 O ATOM 1013 CB GLU C 66 67.953 -7.031 10.937 1.00 0.00 C ATOM 1014 CG GLU C 66 67.609 -6.724 12.397 1.00 0.00 C ATOM 1015 CD GLU C 66 67.195 -8.015 13.105 1.00 0.00 C ATOM 1016 OE1 GLU C 66 67.989 -8.940 13.121 1.00 0.00 O ATOM 1017 OE2 GLU C 66 66.090 -8.056 13.620 1.00 0.00 O ATOM 0 H GLU C 66 67.928 -5.904 8.679 1.00 0.00 H new ATOM 0 HA GLU C 66 69.413 -5.442 11.268 1.00 0.00 H new ATOM 0 HB2 GLU C 66 67.071 -6.900 10.309 1.00 0.00 H new ATOM 0 HB3 GLU C 66 68.264 -8.071 10.837 1.00 0.00 H new ATOM 0 HG2 GLU C 66 68.469 -6.281 12.899 1.00 0.00 H new ATOM 0 HG3 GLU C 66 66.801 -5.994 12.446 1.00 0.00 H new ATOM 1024 N ASP C 67 71.160 -6.310 9.250 1.00 0.00 N ATOM 1025 CA ASP C 67 72.365 -7.046 8.770 1.00 0.00 C ATOM 1026 C ASP C 67 73.554 -6.089 8.647 1.00 0.00 C ATOM 1027 O ASP C 67 74.560 -6.407 8.044 1.00 0.00 O ATOM 1028 CB ASP C 67 71.971 -7.594 7.398 1.00 0.00 C ATOM 1029 CG ASP C 67 71.494 -6.446 6.507 1.00 0.00 C ATOM 1030 OD1 ASP C 67 72.031 -5.358 6.638 1.00 0.00 O ATOM 1031 OD2 ASP C 67 70.600 -6.673 5.708 1.00 0.00 O ATOM 0 H ASP C 67 71.092 -5.340 8.941 1.00 0.00 H new ATOM 0 HA ASP C 67 72.667 -7.839 9.454 1.00 0.00 H new ATOM 0 HB2 ASP C 67 72.822 -8.096 6.937 1.00 0.00 H new ATOM 0 HB3 ASP C 67 71.181 -8.338 7.505 1.00 0.00 H new ATOM 1036 N GLY C 68 73.447 -4.920 9.215 1.00 0.00 N ATOM 1037 CA GLY C 68 74.570 -3.944 9.133 1.00 0.00 C ATOM 1038 C GLY C 68 74.959 -3.728 7.668 1.00 0.00 C ATOM 1039 O GLY C 68 76.124 -3.720 7.321 1.00 0.00 O ATOM 0 H GLY C 68 72.630 -4.598 9.733 1.00 0.00 H new ATOM 0 HA2 GLY C 68 74.275 -2.997 9.585 1.00 0.00 H new ATOM 0 HA3 GLY C 68 75.427 -4.313 9.696 1.00 0.00 H new ATOM 1043 N SER C 69 73.996 -3.550 6.806 1.00 0.00 N ATOM 1044 CA SER C 69 74.316 -3.333 5.366 1.00 0.00 C ATOM 1045 C SER C 69 74.206 -1.845 5.019 1.00 0.00 C ATOM 1046 O SER C 69 74.995 -1.315 4.262 1.00 0.00 O ATOM 1047 CB SER C 69 73.268 -4.140 4.602 1.00 0.00 C ATOM 1048 OG SER C 69 71.987 -3.563 4.812 1.00 0.00 O ATOM 0 H SER C 69 73.002 -3.545 7.036 1.00 0.00 H new ATOM 0 HA SER C 69 75.331 -3.643 5.117 1.00 0.00 H new ATOM 0 HB2 SER C 69 73.505 -4.151 3.538 1.00 0.00 H new ATOM 0 HB3 SER C 69 73.273 -5.176 4.940 1.00 0.00 H new ATOM 1054 N GLY C 70 73.234 -1.169 5.567 1.00 0.00 N ATOM 1055 CA GLY C 70 73.074 0.282 5.267 1.00 0.00 C ATOM 1056 C GLY C 70 72.106 0.462 4.096 1.00 0.00 C ATOM 1057 O GLY C 70 71.820 1.568 3.679 1.00 0.00 O ATOM 0 H GLY C 70 72.544 -1.558 6.209 1.00 0.00 H new ATOM 0 HA2 GLY C 70 72.698 0.806 6.146 1.00 0.00 H new ATOM 0 HA3 GLY C 70 74.041 0.722 5.023 1.00 0.00 H new ATOM 1061 N THR C 71 71.597 -0.614 3.561 1.00 0.00 N ATOM 1062 CA THR C 71 70.646 -0.502 2.418 1.00 0.00 C ATOM 1063 C THR C 71 69.418 -1.384 2.665 1.00 0.00 C ATOM 1064 O THR C 71 69.325 -2.066 3.666 1.00 0.00 O ATOM 1065 CB THR C 71 71.429 -0.999 1.201 1.00 0.00 C ATOM 1066 OG1 THR C 71 71.870 -2.330 1.435 1.00 0.00 O ATOM 1067 CG2 THR C 71 72.639 -0.092 0.967 1.00 0.00 C ATOM 0 H THR C 71 71.798 -1.566 3.866 1.00 0.00 H new ATOM 0 HA THR C 71 70.283 0.516 2.280 1.00 0.00 H new ATOM 0 HB THR C 71 70.786 -0.979 0.321 1.00 0.00 H new ATOM 0 HG1 THR C 71 72.370 -2.651 0.656 1.00 0.00 H new ATOM 0 HG21 THR C 71 73.197 -0.446 0.100 1.00 0.00 H new ATOM 0 HG22 THR C 71 72.300 0.928 0.788 1.00 0.00 H new ATOM 0 HG23 THR C 71 73.284 -0.111 1.846 1.00 0.00 H new ATOM 1075 N VAL C 72 68.476 -1.373 1.762 1.00 0.00 N ATOM 1076 CA VAL C 72 67.257 -2.210 1.951 1.00 0.00 C ATOM 1077 C VAL C 72 67.047 -3.121 0.740 1.00 0.00 C ATOM 1078 O VAL C 72 67.341 -2.757 -0.382 1.00 0.00 O ATOM 1079 CB VAL C 72 66.106 -1.214 2.079 1.00 0.00 C ATOM 1080 CG1 VAL C 72 64.771 -1.955 1.968 1.00 0.00 C ATOM 1081 CG2 VAL C 72 66.187 -0.514 3.437 1.00 0.00 C ATOM 0 H VAL C 72 68.497 -0.822 0.904 1.00 0.00 H new ATOM 0 HA VAL C 72 67.334 -2.857 2.825 1.00 0.00 H new ATOM 0 HB VAL C 72 66.177 -0.474 1.282 1.00 0.00 H new ATOM 0 HG11 VAL C 72 63.951 -1.243 2.060 1.00 0.00 H new ATOM 0 HG12 VAL C 72 64.711 -2.455 1.001 1.00 0.00 H new ATOM 0 HG13 VAL C 72 64.699 -2.696 2.764 1.00 0.00 H new ATOM 0 HG21 VAL C 72 65.366 0.197 3.529 1.00 0.00 H new ATOM 0 HG22 VAL C 72 66.116 -1.255 4.233 1.00 0.00 H new ATOM 0 HG23 VAL C 72 67.136 0.016 3.517 1.00 0.00 H new ATOM 1091 N ASP C 73 66.537 -4.302 0.956 1.00 0.00 N ATOM 1092 CA ASP C 73 66.305 -5.235 -0.184 1.00 0.00 C ATOM 1093 C ASP C 73 64.832 -5.642 -0.238 1.00 0.00 C ATOM 1094 O ASP C 73 64.037 -5.246 0.591 1.00 0.00 O ATOM 1095 CB ASP C 73 67.186 -6.449 0.112 1.00 0.00 C ATOM 1096 CG ASP C 73 68.446 -6.388 -0.754 1.00 0.00 C ATOM 1097 OD1 ASP C 73 68.463 -5.602 -1.686 1.00 0.00 O ATOM 1098 OD2 ASP C 73 69.371 -7.130 -0.469 1.00 0.00 O ATOM 0 H ASP C 73 66.271 -4.662 1.872 1.00 0.00 H new ATOM 0 HA ASP C 73 66.546 -4.782 -1.146 1.00 0.00 H new ATOM 0 HB2 ASP C 73 67.458 -6.466 1.167 1.00 0.00 H new ATOM 0 HB3 ASP C 73 66.637 -7.368 -0.091 1.00 0.00 H new ATOM 1103 N PHE C 74 64.459 -6.434 -1.207 1.00 0.00 N ATOM 1104 CA PHE C 74 63.037 -6.867 -1.308 1.00 0.00 C ATOM 1105 C PHE C 74 62.628 -7.627 -0.046 1.00 0.00 C ATOM 1106 O PHE C 74 61.461 -7.856 0.203 1.00 0.00 O ATOM 1107 CB PHE C 74 62.985 -7.785 -2.530 1.00 0.00 C ATOM 1108 CG PHE C 74 61.569 -8.267 -2.738 1.00 0.00 C ATOM 1109 CD1 PHE C 74 60.565 -7.358 -3.088 1.00 0.00 C ATOM 1110 CD2 PHE C 74 61.260 -9.624 -2.579 1.00 0.00 C ATOM 1111 CE1 PHE C 74 59.253 -7.803 -3.280 1.00 0.00 C ATOM 1112 CE2 PHE C 74 59.948 -10.069 -2.770 1.00 0.00 C ATOM 1113 CZ PHE C 74 58.944 -9.160 -3.121 1.00 0.00 C ATOM 0 H PHE C 74 65.077 -6.799 -1.932 1.00 0.00 H new ATOM 0 HA PHE C 74 62.354 -6.023 -1.406 1.00 0.00 H new ATOM 0 HB2 PHE C 74 63.332 -7.251 -3.414 1.00 0.00 H new ATOM 0 HB3 PHE C 74 63.653 -8.635 -2.388 1.00 0.00 H new ATOM 0 HD1 PHE C 74 60.803 -6.312 -3.210 1.00 0.00 H new ATOM 0 HD2 PHE C 74 62.035 -10.326 -2.309 1.00 0.00 H new ATOM 0 HE1 PHE C 74 58.478 -7.101 -3.551 1.00 0.00 H new ATOM 0 HE2 PHE C 74 59.710 -11.115 -2.646 1.00 0.00 H new ATOM 0 HZ PHE C 74 57.931 -9.504 -3.269 1.00 0.00 H new ATOM 1123 N ASP C 75 63.581 -8.021 0.755 1.00 0.00 N ATOM 1124 CA ASP C 75 63.248 -8.766 2.003 1.00 0.00 C ATOM 1125 C ASP C 75 62.965 -7.785 3.145 1.00 0.00 C ATOM 1126 O ASP C 75 62.022 -7.947 3.894 1.00 0.00 O ATOM 1127 CB ASP C 75 64.492 -9.600 2.309 1.00 0.00 C ATOM 1128 CG ASP C 75 64.075 -10.916 2.968 1.00 0.00 C ATOM 1129 OD1 ASP C 75 63.399 -10.859 3.982 1.00 0.00 O ATOM 1130 OD2 ASP C 75 64.438 -11.958 2.448 1.00 0.00 O ATOM 0 H ASP C 75 64.576 -7.859 0.599 1.00 0.00 H new ATOM 0 HA ASP C 75 62.359 -9.386 1.890 1.00 0.00 H new ATOM 0 HB2 ASP C 75 65.044 -9.800 1.390 1.00 0.00 H new ATOM 0 HB3 ASP C 75 65.161 -9.047 2.968 1.00 0.00 H new ATOM 1135 N GLU C 76 63.771 -6.768 3.281 1.00 0.00 N ATOM 1136 CA GLU C 76 63.542 -5.778 4.373 1.00 0.00 C ATOM 1137 C GLU C 76 62.523 -4.728 3.926 1.00 0.00 C ATOM 1138 O GLU C 76 61.860 -4.107 4.733 1.00 0.00 O ATOM 1139 CB GLU C 76 64.905 -5.130 4.615 1.00 0.00 C ATOM 1140 CG GLU C 76 65.937 -6.214 4.931 1.00 0.00 C ATOM 1141 CD GLU C 76 67.333 -5.592 4.975 1.00 0.00 C ATOM 1142 OE1 GLU C 76 67.699 -4.938 4.012 1.00 0.00 O ATOM 1143 OE2 GLU C 76 68.012 -5.778 5.971 1.00 0.00 O ATOM 0 H GLU C 76 64.577 -6.579 2.685 1.00 0.00 H new ATOM 0 HA GLU C 76 63.147 -6.244 5.276 1.00 0.00 H new ATOM 0 HB2 GLU C 76 65.213 -4.566 3.735 1.00 0.00 H new ATOM 0 HB3 GLU C 76 64.841 -4.422 5.441 1.00 0.00 H new ATOM 0 HG2 GLU C 76 65.706 -6.683 5.887 1.00 0.00 H new ATOM 0 HG3 GLU C 76 65.900 -6.998 4.174 1.00 0.00 H new ATOM 1150 N PHE C 77 62.394 -4.525 2.645 1.00 0.00 N ATOM 1151 CA PHE C 77 61.418 -3.516 2.143 1.00 0.00 C ATOM 1152 C PHE C 77 59.989 -3.973 2.445 1.00 0.00 C ATOM 1153 O PHE C 77 59.199 -3.243 3.010 1.00 0.00 O ATOM 1154 CB PHE C 77 61.658 -3.458 0.634 1.00 0.00 C ATOM 1155 CG PHE C 77 60.615 -2.576 -0.010 1.00 0.00 C ATOM 1156 CD1 PHE C 77 60.783 -1.187 -0.024 1.00 0.00 C ATOM 1157 CD2 PHE C 77 59.479 -3.149 -0.595 1.00 0.00 C ATOM 1158 CE1 PHE C 77 59.817 -0.370 -0.623 1.00 0.00 C ATOM 1159 CE2 PHE C 77 58.512 -2.333 -1.193 1.00 0.00 C ATOM 1160 CZ PHE C 77 58.681 -0.943 -1.207 1.00 0.00 C ATOM 0 H PHE C 77 62.922 -5.014 1.923 1.00 0.00 H new ATOM 0 HA PHE C 77 61.545 -2.541 2.614 1.00 0.00 H new ATOM 0 HB2 PHE C 77 62.655 -3.069 0.429 1.00 0.00 H new ATOM 0 HB3 PHE C 77 61.613 -4.461 0.209 1.00 0.00 H new ATOM 0 HD1 PHE C 77 61.659 -0.745 0.428 1.00 0.00 H new ATOM 0 HD2 PHE C 77 59.349 -4.221 -0.585 1.00 0.00 H new ATOM 0 HE1 PHE C 77 59.948 0.702 -0.635 1.00 0.00 H new ATOM 0 HE2 PHE C 77 57.636 -2.775 -1.644 1.00 0.00 H new ATOM 0 HZ PHE C 77 57.935 -0.313 -1.668 1.00 0.00 H new ATOM 1170 N LEU C 78 59.652 -5.177 2.074 1.00 0.00 N ATOM 1171 CA LEU C 78 58.274 -5.683 2.340 1.00 0.00 C ATOM 1172 C LEU C 78 57.886 -5.420 3.797 1.00 0.00 C ATOM 1173 O LEU C 78 56.806 -4.946 4.087 1.00 0.00 O ATOM 1174 CB LEU C 78 58.347 -7.187 2.068 1.00 0.00 C ATOM 1175 CG LEU C 78 57.898 -7.469 0.635 1.00 0.00 C ATOM 1176 CD1 LEU C 78 58.331 -8.880 0.233 1.00 0.00 C ATOM 1177 CD2 LEU C 78 56.375 -7.360 0.547 1.00 0.00 C ATOM 0 H LEU C 78 60.271 -5.833 1.598 1.00 0.00 H new ATOM 0 HA LEU C 78 57.526 -5.191 1.719 1.00 0.00 H new ATOM 0 HB2 LEU C 78 59.365 -7.545 2.218 1.00 0.00 H new ATOM 0 HB3 LEU C 78 57.712 -7.726 2.772 1.00 0.00 H new ATOM 0 HG LEU C 78 58.354 -6.743 -0.038 1.00 0.00 H new ATOM 0 HD11 LEU C 78 58.011 -9.081 -0.789 1.00 0.00 H new ATOM 0 HD12 LEU C 78 59.416 -8.959 0.296 1.00 0.00 H new ATOM 0 HD13 LEU C 78 57.875 -9.606 0.906 1.00 0.00 H new ATOM 0 HD21 LEU C 78 56.054 -7.561 -0.475 1.00 0.00 H new ATOM 0 HD22 LEU C 78 55.919 -8.086 1.220 1.00 0.00 H new ATOM 0 HD23 LEU C 78 56.065 -6.355 0.833 1.00 0.00 H new ATOM 1189 N VAL C 79 58.759 -5.727 4.717 1.00 0.00 N ATOM 1190 CA VAL C 79 58.442 -5.498 6.156 1.00 0.00 C ATOM 1191 C VAL C 79 58.222 -4.007 6.425 1.00 0.00 C ATOM 1192 O VAL C 79 57.461 -3.629 7.295 1.00 0.00 O ATOM 1193 CB VAL C 79 59.669 -6.002 6.915 1.00 0.00 C ATOM 1194 CG1 VAL C 79 59.527 -5.663 8.399 1.00 0.00 C ATOM 1195 CG2 VAL C 79 59.783 -7.518 6.747 1.00 0.00 C ATOM 0 H VAL C 79 59.679 -6.127 4.534 1.00 0.00 H new ATOM 0 HA VAL C 79 57.530 -6.011 6.462 1.00 0.00 H new ATOM 0 HB VAL C 79 60.564 -5.523 6.518 1.00 0.00 H new ATOM 0 HG11 VAL C 79 60.402 -6.023 8.940 1.00 0.00 H new ATOM 0 HG12 VAL C 79 59.445 -4.583 8.519 1.00 0.00 H new ATOM 0 HG13 VAL C 79 58.632 -6.142 8.798 1.00 0.00 H new ATOM 0 HG21 VAL C 79 60.658 -7.879 7.288 1.00 0.00 H new ATOM 0 HG22 VAL C 79 58.888 -7.996 7.144 1.00 0.00 H new ATOM 0 HG23 VAL C 79 59.885 -7.760 5.689 1.00 0.00 H new ATOM 1205 N MET C 80 58.887 -3.158 5.691 1.00 0.00 N ATOM 1206 CA MET C 80 58.718 -1.691 5.910 1.00 0.00 C ATOM 1207 C MET C 80 57.270 -1.272 5.644 1.00 0.00 C ATOM 1208 O MET C 80 56.808 -0.260 6.134 1.00 0.00 O ATOM 1209 CB MET C 80 59.658 -1.029 4.903 1.00 0.00 C ATOM 1210 CG MET C 80 59.925 0.415 5.330 1.00 0.00 C ATOM 1211 SD MET C 80 59.453 1.536 3.990 1.00 0.00 S ATOM 1212 CE MET C 80 60.829 1.154 2.880 1.00 0.00 C ATOM 0 H MET C 80 59.539 -3.415 4.950 1.00 0.00 H new ATOM 0 HA MET C 80 58.946 -1.402 6.936 1.00 0.00 H new ATOM 0 HB2 MET C 80 60.595 -1.582 4.846 1.00 0.00 H new ATOM 0 HB3 MET C 80 59.215 -1.049 3.907 1.00 0.00 H new ATOM 0 HG2 MET C 80 59.359 0.650 6.231 1.00 0.00 H new ATOM 0 HG3 MET C 80 60.980 0.545 5.573 1.00 0.00 H new ATOM 0 HE1 MET C 80 60.787 1.809 2.010 1.00 0.00 H new ATOM 0 HE2 MET C 80 61.772 1.307 3.404 1.00 0.00 H new ATOM 0 HE3 MET C 80 60.758 0.116 2.556 1.00 0.00 H new ATOM 1222 N MET C 81 56.551 -2.038 4.872 1.00 0.00 N ATOM 1223 CA MET C 81 55.134 -1.673 4.575 1.00 0.00 C ATOM 1224 C MET C 81 54.185 -2.403 5.529 1.00 0.00 C ATOM 1225 O MET C 81 53.218 -1.843 6.006 1.00 0.00 O ATOM 1226 CB MET C 81 54.904 -2.129 3.134 1.00 0.00 C ATOM 1227 CG MET C 81 55.553 -1.130 2.174 1.00 0.00 C ATOM 1228 SD MET C 81 54.357 0.159 1.744 1.00 0.00 S ATOM 1229 CE MET C 81 55.544 1.508 1.523 1.00 0.00 C ATOM 0 H MET C 81 56.880 -2.899 4.434 1.00 0.00 H new ATOM 0 HA MET C 81 54.947 -0.607 4.701 1.00 0.00 H new ATOM 0 HB2 MET C 81 55.327 -3.122 2.983 1.00 0.00 H new ATOM 0 HB3 MET C 81 53.836 -2.204 2.931 1.00 0.00 H new ATOM 0 HG2 MET C 81 56.433 -0.684 2.637 1.00 0.00 H new ATOM 0 HG3 MET C 81 55.891 -1.642 1.273 1.00 0.00 H new ATOM 0 HE1 MET C 81 55.326 2.037 0.595 1.00 0.00 H new ATOM 0 HE2 MET C 81 55.468 2.200 2.361 1.00 0.00 H new ATOM 0 HE3 MET C 81 56.554 1.100 1.479 1.00 0.00 H new ATOM 1239 N VAL C 82 54.451 -3.649 5.808 1.00 0.00 N ATOM 1240 CA VAL C 82 53.562 -4.415 6.728 1.00 0.00 C ATOM 1241 C VAL C 82 53.310 -3.617 8.010 1.00 0.00 C ATOM 1242 O VAL C 82 52.209 -3.574 8.521 1.00 0.00 O ATOM 1243 CB VAL C 82 54.329 -5.699 7.041 1.00 0.00 C ATOM 1244 CG1 VAL C 82 53.421 -6.665 7.803 1.00 0.00 C ATOM 1245 CG2 VAL C 82 54.783 -6.351 5.733 1.00 0.00 C ATOM 0 H VAL C 82 55.246 -4.171 5.439 1.00 0.00 H new ATOM 0 HA VAL C 82 52.587 -4.618 6.284 1.00 0.00 H new ATOM 0 HB VAL C 82 55.200 -5.462 7.652 1.00 0.00 H new ATOM 0 HG11 VAL C 82 53.969 -7.580 8.026 1.00 0.00 H new ATOM 0 HG12 VAL C 82 53.096 -6.201 8.734 1.00 0.00 H new ATOM 0 HG13 VAL C 82 52.550 -6.903 7.193 1.00 0.00 H new ATOM 0 HG21 VAL C 82 55.330 -7.267 5.954 1.00 0.00 H new ATOM 0 HG22 VAL C 82 53.911 -6.587 5.123 1.00 0.00 H new ATOM 0 HG23 VAL C 82 55.431 -5.663 5.189 1.00 0.00 H new ATOM 1255 N ARG C 83 54.325 -2.988 8.534 1.00 0.00 N ATOM 1256 CA ARG C 83 54.149 -2.197 9.787 1.00 0.00 C ATOM 1257 C ARG C 83 52.989 -1.208 9.640 1.00 0.00 C ATOM 1258 O ARG C 83 52.452 -0.722 10.615 1.00 0.00 O ATOM 1259 CB ARG C 83 55.469 -1.449 9.972 1.00 0.00 C ATOM 1260 CG ARG C 83 56.491 -2.372 10.639 1.00 0.00 C ATOM 1261 CD ARG C 83 57.906 -1.909 10.283 1.00 0.00 C ATOM 1262 NE ARG C 83 58.515 -1.511 11.582 1.00 0.00 N ATOM 1263 CZ ARG C 83 59.558 -2.150 12.037 1.00 0.00 C ATOM 1264 NH1 ARG C 83 59.515 -3.447 12.184 1.00 0.00 N ATOM 1265 NH2 ARG C 83 60.644 -1.495 12.345 1.00 0.00 N ATOM 0 H ARG C 83 55.270 -2.987 8.150 1.00 0.00 H new ATOM 0 HA ARG C 83 53.914 -2.832 10.641 1.00 0.00 H new ATOM 0 HB2 ARG C 83 55.845 -1.110 9.007 1.00 0.00 H new ATOM 0 HB3 ARG C 83 55.313 -0.560 10.583 1.00 0.00 H new ATOM 0 HG2 ARG C 83 56.355 -2.362 11.720 1.00 0.00 H new ATOM 0 HG3 ARG C 83 56.339 -3.399 10.308 1.00 0.00 H new ATOM 0 HD2 ARG C 83 58.475 -2.708 9.808 1.00 0.00 H new ATOM 0 HD3 ARG C 83 57.884 -1.073 9.584 1.00 0.00 H new ATOM 0 HE ARG C 83 58.117 -0.739 12.116 1.00 0.00 H new ATOM 0 HH11 ARG C 83 58.667 -3.960 11.943 1.00 0.00 H new ATOM 0 HH12 ARG C 83 60.330 -3.947 12.540 1.00 0.00 H new ATOM 0 HH21 ARG C 83 60.678 -0.482 12.230 1.00 0.00 H new ATOM 0 HH22 ARG C 83 61.458 -1.996 12.701 1.00 0.00 H new ATOM 1279 N CYS C 84 52.599 -0.900 8.433 1.00 0.00 N ATOM 1280 CA CYS C 84 51.476 0.061 8.237 1.00 0.00 C ATOM 1281 C CYS C 84 50.422 -0.531 7.296 1.00 0.00 C ATOM 1282 O CYS C 84 49.961 0.118 6.379 1.00 0.00 O ATOM 1283 CB CYS C 84 52.117 1.300 7.611 1.00 0.00 C ATOM 1284 SG CYS C 84 52.894 2.296 8.908 1.00 0.00 S ATOM 0 H CYS C 84 53.008 -1.271 7.576 1.00 0.00 H new ATOM 0 HA CYS C 84 50.968 0.292 9.173 1.00 0.00 H new ATOM 0 HB2 CYS C 84 52.860 1.004 6.871 1.00 0.00 H new ATOM 0 HB3 CYS C 84 51.363 1.888 7.088 1.00 0.00 H new ATOM 0 HG CYS C 84 53.442 3.349 8.377 1.00 0.00 H new ATOM 1290 N MET C 85 50.035 -1.757 7.519 1.00 0.00 N ATOM 1291 CA MET C 85 49.008 -2.383 6.638 1.00 0.00 C ATOM 1292 C MET C 85 47.798 -1.455 6.502 1.00 0.00 C ATOM 1293 O MET C 85 47.654 -0.497 7.237 1.00 0.00 O ATOM 1294 CB MET C 85 48.612 -3.678 7.347 1.00 0.00 C ATOM 1295 CG MET C 85 49.751 -4.694 7.231 1.00 0.00 C ATOM 1296 SD MET C 85 49.195 -6.112 6.254 1.00 0.00 S ATOM 1297 CE MET C 85 50.704 -6.317 5.277 1.00 0.00 C ATOM 0 H MET C 85 50.384 -2.351 8.271 1.00 0.00 H new ATOM 0 HA MET C 85 49.384 -2.569 5.632 1.00 0.00 H new ATOM 0 HB2 MET C 85 48.394 -3.478 8.396 1.00 0.00 H new ATOM 0 HB3 MET C 85 47.702 -4.084 6.904 1.00 0.00 H new ATOM 0 HG2 MET C 85 50.619 -4.232 6.760 1.00 0.00 H new ATOM 0 HG3 MET C 85 50.063 -5.022 8.223 1.00 0.00 H new ATOM 0 HE1 MET C 85 50.476 -6.873 4.368 1.00 0.00 H new ATOM 0 HE2 MET C 85 51.102 -5.337 5.013 1.00 0.00 H new ATOM 0 HE3 MET C 85 51.444 -6.864 5.861 1.00 0.00 H new ATOM 1307 N LYS C 86 46.927 -1.731 5.572 1.00 0.00 N ATOM 1308 CA LYS C 86 45.728 -0.862 5.395 1.00 0.00 C ATOM 1309 C LYS C 86 44.940 -0.780 6.705 1.00 0.00 C ATOM 1310 O LYS C 86 44.027 -1.548 6.941 1.00 0.00 O ATOM 1311 CB LYS C 86 44.896 -1.550 4.310 1.00 0.00 C ATOM 1312 CG LYS C 86 44.570 -2.980 4.744 1.00 0.00 C ATOM 1313 CD LYS C 86 44.438 -3.872 3.508 1.00 0.00 C ATOM 1314 CE LYS C 86 43.023 -4.454 3.446 1.00 0.00 C ATOM 1315 NZ LYS C 86 42.747 -4.666 1.995 1.00 0.00 N ATOM 0 H LYS C 86 46.992 -2.519 4.927 1.00 0.00 H new ATOM 0 HA LYS C 86 45.993 0.158 5.118 1.00 0.00 H new ATOM 0 HB2 LYS C 86 43.975 -0.993 4.136 1.00 0.00 H new ATOM 0 HB3 LYS C 86 45.445 -1.561 3.368 1.00 0.00 H new ATOM 0 HG2 LYS C 86 45.355 -3.361 5.398 1.00 0.00 H new ATOM 0 HG3 LYS C 86 43.643 -2.995 5.317 1.00 0.00 H new ATOM 0 HD2 LYS C 86 44.645 -3.295 2.607 1.00 0.00 H new ATOM 0 HD3 LYS C 86 45.172 -4.677 3.547 1.00 0.00 H new ATOM 0 HE2 LYS C 86 42.959 -5.391 3.999 1.00 0.00 H new ATOM 0 HE3 LYS C 86 42.297 -3.772 3.889 1.00 0.00 H new ATOM 0 HZ1 LYS C 86 41.793 -5.063 1.878 1.00 0.00 H new ATOM 0 HZ2 LYS C 86 42.807 -3.757 1.494 1.00 0.00 H new ATOM 0 HZ3 LYS C 86 43.448 -5.326 1.601 1.00 0.00 H new ATOM 1329 N ASP C 87 45.286 0.144 7.560 1.00 0.00 N ATOM 1330 CA ASP C 87 44.558 0.273 8.855 1.00 0.00 C ATOM 1331 C ASP C 87 44.494 1.742 9.284 1.00 0.00 C ATOM 1332 O ASP C 87 45.419 2.501 9.074 1.00 0.00 O ATOM 1333 CB ASP C 87 45.383 -0.539 9.854 1.00 0.00 C ATOM 1334 CG ASP C 87 44.817 -0.344 11.262 1.00 0.00 C ATOM 1335 OD1 ASP C 87 43.680 0.087 11.368 1.00 0.00 O ATOM 1336 OD2 ASP C 87 45.530 -0.628 12.210 1.00 0.00 O ATOM 0 H ASP C 87 46.041 0.815 7.418 1.00 0.00 H new ATOM 0 HA ASP C 87 43.530 -0.083 8.787 1.00 0.00 H new ATOM 0 HB2 ASP C 87 45.362 -1.595 9.585 1.00 0.00 H new ATOM 0 HB3 ASP C 87 46.426 -0.223 9.823 1.00 0.00 H new ATOM 1341 N ASP C 88 43.408 2.146 9.884 1.00 0.00 N ATOM 1342 CA ASP C 88 43.282 3.564 10.329 1.00 0.00 C ATOM 1343 C ASP C 88 42.736 3.621 11.758 1.00 0.00 C ATOM 1344 O ASP C 88 42.040 2.729 12.202 1.00 0.00 O ATOM 1345 CB ASP C 88 42.294 4.200 9.351 1.00 0.00 C ATOM 1346 CG ASP C 88 41.894 5.587 9.856 1.00 0.00 C ATOM 1347 OD1 ASP C 88 41.379 5.668 10.959 1.00 0.00 O ATOM 1348 OD2 ASP C 88 42.112 6.545 9.132 1.00 0.00 O ATOM 0 H ASP C 88 42.601 1.555 10.086 1.00 0.00 H new ATOM 0 HA ASP C 88 44.240 4.083 10.334 1.00 0.00 H new ATOM 0 HB2 ASP C 88 42.745 4.278 8.362 1.00 0.00 H new ATOM 0 HB3 ASP C 88 41.410 3.570 9.250 1.00 0.00 H new ATOM 1353 N SER C 89 43.045 4.661 12.483 1.00 0.00 N ATOM 1354 CA SER C 89 42.542 4.770 13.884 1.00 0.00 C ATOM 1355 C SER C 89 42.036 6.189 14.156 1.00 0.00 C ATOM 1356 O SER C 89 41.001 6.316 14.789 1.00 0.00 O ATOM 1357 CB SER C 89 43.750 4.453 14.764 1.00 0.00 C ATOM 1358 OG SER C 89 43.514 4.940 16.078 1.00 0.00 O ATOM 1359 OXT SER C 89 42.693 7.123 13.726 1.00 0.00 O ATOM 0 H SER C 89 43.623 5.440 12.167 1.00 0.00 H new ATOM 0 HA SER C 89 41.709 4.094 14.077 1.00 0.00 H new ATOM 0 HB2 SER C 89 43.925 3.377 14.788 1.00 0.00 H new ATOM 0 HB3 SER C 89 44.647 4.912 14.349 1.00 0.00 H new ATOM 0 HG SER C 89 44.287 4.737 16.646 1.00 0.00 H new TER 1365 SER C 89 ATOM 1366 N ARG I 1 59.197 5.456 7.392 1.00 0.00 N ATOM 1367 CA ARG I 1 58.485 6.725 7.716 1.00 0.00 C ATOM 1368 C ARG I 1 57.789 7.276 6.468 1.00 0.00 C ATOM 1369 O ARG I 1 57.770 8.467 6.229 1.00 0.00 O ATOM 1370 CB ARG I 1 59.578 7.683 8.187 1.00 0.00 C ATOM 1371 CG ARG I 1 59.063 8.497 9.374 1.00 0.00 C ATOM 1372 CD ARG I 1 58.825 9.944 8.936 1.00 0.00 C ATOM 1373 NE ARG I 1 60.161 10.594 9.019 1.00 0.00 N ATOM 1374 CZ ARG I 1 60.746 10.742 10.178 1.00 0.00 C ATOM 1375 NH1 ARG I 1 60.090 10.496 11.279 1.00 0.00 N ATOM 1376 NH2 ARG I 1 61.988 11.137 10.234 1.00 0.00 N ATOM 0 H1 ARG I 1 60.008 5.340 8.032 1.00 0.00 H new ATOM 0 H2 ARG I 1 58.546 4.653 7.509 1.00 0.00 H new ATOM 0 H3 ARG I 1 59.534 5.488 6.409 1.00 0.00 H new ATOM 0 HA ARG I 1 57.713 6.583 8.473 1.00 0.00 H new ATOM 0 HB2 ARG I 1 60.468 7.123 8.474 1.00 0.00 H new ATOM 0 HB3 ARG I 1 59.869 8.349 7.374 1.00 0.00 H new ATOM 0 HG2 ARG I 1 58.137 8.063 9.752 1.00 0.00 H new ATOM 0 HG3 ARG I 1 59.785 8.467 10.190 1.00 0.00 H new ATOM 0 HD2 ARG I 1 58.426 9.989 7.923 1.00 0.00 H new ATOM 0 HD3 ARG I 1 58.103 10.440 9.585 1.00 0.00 H new ATOM 0 HE ARG I 1 60.621 10.924 8.170 1.00 0.00 H new ATOM 0 HH11 ARG I 1 59.119 10.188 11.236 1.00 0.00 H new ATOM 0 HH12 ARG I 1 60.549 10.612 12.183 1.00 0.00 H new ATOM 0 HH21 ARG I 1 62.501 11.330 9.374 1.00 0.00 H new ATOM 0 HH22 ARG I 1 62.446 11.253 11.138 1.00 0.00 H new ATOM 1392 N ILE I 2 57.215 6.417 5.671 1.00 0.00 N ATOM 1393 CA ILE I 2 56.520 6.891 4.441 1.00 0.00 C ATOM 1394 C ILE I 2 55.047 6.472 4.472 1.00 0.00 C ATOM 1395 O ILE I 2 54.722 5.330 4.730 1.00 0.00 O ATOM 1396 CB ILE I 2 57.246 6.202 3.285 1.00 0.00 C ATOM 1397 CG1 ILE I 2 56.894 4.713 3.282 1.00 0.00 C ATOM 1398 CG2 ILE I 2 58.757 6.368 3.459 1.00 0.00 C ATOM 1399 CD1 ILE I 2 57.704 3.996 2.201 1.00 0.00 C ATOM 0 H ILE I 2 57.197 5.408 5.818 1.00 0.00 H new ATOM 0 HA ILE I 2 56.541 7.977 4.348 1.00 0.00 H new ATOM 0 HB ILE I 2 56.939 6.652 2.341 1.00 0.00 H new ATOM 0 HG12 ILE I 2 57.106 4.277 4.258 1.00 0.00 H new ATOM 0 HG13 ILE I 2 55.828 4.582 3.099 1.00 0.00 H new ATOM 0 HG21 ILE I 2 59.274 5.877 2.635 1.00 0.00 H new ATOM 0 HG22 ILE I 2 59.008 7.429 3.464 1.00 0.00 H new ATOM 0 HG23 ILE I 2 59.066 5.917 4.402 1.00 0.00 H new ATOM 0 HD11 ILE I 2 57.452 2.936 2.201 1.00 0.00 H new ATOM 0 HD12 ILE I 2 57.470 4.425 1.227 1.00 0.00 H new ATOM 0 HD13 ILE I 2 58.768 4.116 2.404 1.00 0.00 H new ATOM 1411 N SER I 3 54.153 7.386 4.210 1.00 0.00 N ATOM 1412 CA SER I 3 52.703 7.036 4.225 1.00 0.00 C ATOM 1413 C SER I 3 52.454 5.800 3.359 1.00 0.00 C ATOM 1414 O SER I 3 53.367 5.235 2.790 1.00 0.00 O ATOM 1415 CB SER I 3 51.996 8.256 3.638 1.00 0.00 C ATOM 1416 OG SER I 3 52.439 9.426 4.315 1.00 0.00 O ATOM 0 H SER I 3 54.363 8.359 3.986 1.00 0.00 H new ATOM 0 HA SER I 3 52.342 6.801 5.226 1.00 0.00 H new ATOM 0 HB2 SER I 3 52.209 8.336 2.572 1.00 0.00 H new ATOM 0 HB3 SER I 3 50.916 8.149 3.740 1.00 0.00 H new ATOM 0 HG SER I 3 51.989 10.211 3.940 1.00 0.00 H new ATOM 1422 N ALA I 4 51.225 5.372 3.254 1.00 0.00 N ATOM 1423 CA ALA I 4 50.924 4.169 2.425 1.00 0.00 C ATOM 1424 C ALA I 4 50.093 4.561 1.200 1.00 0.00 C ATOM 1425 O ALA I 4 50.447 4.262 0.076 1.00 0.00 O ATOM 1426 CB ALA I 4 50.123 3.246 3.343 1.00 0.00 C ATOM 0 H ALA I 4 50.418 5.802 3.705 1.00 0.00 H new ATOM 0 HA ALA I 4 51.829 3.689 2.052 1.00 0.00 H new ATOM 0 HB1 ALA I 4 49.862 2.335 2.805 1.00 0.00 H new ATOM 0 HB2 ALA I 4 50.723 2.992 4.217 1.00 0.00 H new ATOM 0 HB3 ALA I 4 49.212 3.752 3.663 1.00 0.00 H new ATOM 1432 N ASP I 5 48.990 5.225 1.408 1.00 0.00 N ATOM 1433 CA ASP I 5 48.134 5.634 0.254 1.00 0.00 C ATOM 1434 C ASP I 5 48.814 6.746 -0.548 1.00 0.00 C ATOM 1435 O ASP I 5 49.006 6.635 -1.742 1.00 0.00 O ATOM 1436 CB ASP I 5 46.840 6.144 0.885 1.00 0.00 C ATOM 1437 CG ASP I 5 45.855 6.538 -0.218 1.00 0.00 C ATOM 1438 OD1 ASP I 5 46.155 7.468 -0.948 1.00 0.00 O ATOM 1439 OD2 ASP I 5 44.819 5.900 -0.315 1.00 0.00 O ATOM 0 H ASP I 5 48.643 5.503 2.326 1.00 0.00 H new ATOM 0 HA ASP I 5 47.956 4.811 -0.438 1.00 0.00 H new ATOM 0 HB2 ASP I 5 46.403 5.372 1.519 1.00 0.00 H new ATOM 0 HB3 ASP I 5 47.048 7.002 1.525 1.00 0.00 H new ATOM 1444 N ALA I 6 49.175 7.822 0.098 1.00 0.00 N ATOM 1445 CA ALA I 6 49.837 8.944 -0.628 1.00 0.00 C ATOM 1446 C ALA I 6 50.982 8.418 -1.497 1.00 0.00 C ATOM 1447 O ALA I 6 51.293 8.972 -2.533 1.00 0.00 O ATOM 1448 CB ALA I 6 50.378 9.861 0.469 1.00 0.00 C ATOM 0 H ALA I 6 49.040 7.973 1.098 1.00 0.00 H new ATOM 0 HA ALA I 6 49.148 9.463 -1.294 1.00 0.00 H new ATOM 0 HB1 ALA I 6 50.881 10.714 0.014 1.00 0.00 H new ATOM 0 HB2 ALA I 6 49.553 10.214 1.088 1.00 0.00 H new ATOM 0 HB3 ALA I 6 51.086 9.310 1.088 1.00 0.00 H new ATOM 1454 N MET I 7 51.615 7.355 -1.083 1.00 0.00 N ATOM 1455 CA MET I 7 52.744 6.800 -1.884 1.00 0.00 C ATOM 1456 C MET I 7 52.239 6.288 -3.236 1.00 0.00 C ATOM 1457 O MET I 7 52.968 6.253 -4.208 1.00 0.00 O ATOM 1458 CB MET I 7 53.293 5.644 -1.046 1.00 0.00 C ATOM 1459 CG MET I 7 54.810 5.559 -1.225 1.00 0.00 C ATOM 1460 SD MET I 7 55.204 4.258 -2.420 1.00 0.00 S ATOM 1461 CE MET I 7 56.573 5.109 -3.245 1.00 0.00 C ATOM 0 H MET I 7 51.400 6.847 -0.225 1.00 0.00 H new ATOM 0 HA MET I 7 53.505 7.551 -2.095 1.00 0.00 H new ATOM 0 HB2 MET I 7 53.048 5.795 0.005 1.00 0.00 H new ATOM 0 HB3 MET I 7 52.827 4.707 -1.351 1.00 0.00 H new ATOM 0 HG2 MET I 7 55.200 6.516 -1.571 1.00 0.00 H new ATOM 0 HG3 MET I 7 55.288 5.347 -0.269 1.00 0.00 H new ATOM 0 HE1 MET I 7 57.053 4.429 -3.948 1.00 0.00 H new ATOM 0 HE2 MET I 7 56.191 5.977 -3.783 1.00 0.00 H new ATOM 0 HE3 MET I 7 57.300 5.435 -2.501 1.00 0.00 H new ATOM 1471 N MET I 8 51.001 5.883 -3.305 1.00 0.00 N ATOM 1472 CA MET I 8 50.457 5.368 -4.594 1.00 0.00 C ATOM 1473 C MET I 8 49.954 6.522 -5.466 1.00 0.00 C ATOM 1474 O MET I 8 50.202 6.568 -6.654 1.00 0.00 O ATOM 1475 CB MET I 8 49.300 4.452 -4.194 1.00 0.00 C ATOM 1476 CG MET I 8 49.815 3.365 -3.248 1.00 0.00 C ATOM 1477 SD MET I 8 50.957 2.282 -4.142 1.00 0.00 S ATOM 1478 CE MET I 8 52.477 3.187 -3.760 1.00 0.00 C ATOM 0 H MET I 8 50.343 5.886 -2.526 1.00 0.00 H new ATOM 0 HA MET I 8 51.213 4.843 -5.178 1.00 0.00 H new ATOM 0 HB2 MET I 8 48.515 5.031 -3.707 1.00 0.00 H new ATOM 0 HB3 MET I 8 48.858 3.998 -5.081 1.00 0.00 H new ATOM 0 HG2 MET I 8 50.319 3.819 -2.395 1.00 0.00 H new ATOM 0 HG3 MET I 8 48.980 2.785 -2.853 1.00 0.00 H new ATOM 0 HE1 MET I 8 53.300 2.482 -3.639 1.00 0.00 H new ATOM 0 HE2 MET I 8 52.705 3.875 -4.574 1.00 0.00 H new ATOM 0 HE3 MET I 8 52.343 3.750 -2.836 1.00 0.00 H new ATOM 1488 N GLN I 9 49.244 7.452 -4.890 1.00 0.00 N ATOM 1489 CA GLN I 9 48.723 8.595 -5.694 1.00 0.00 C ATOM 1490 C GLN I 9 49.834 9.613 -5.966 1.00 0.00 C ATOM 1491 O GLN I 9 49.662 10.543 -6.729 1.00 0.00 O ATOM 1492 CB GLN I 9 47.632 9.220 -4.824 1.00 0.00 C ATOM 1493 CG GLN I 9 46.453 9.639 -5.704 1.00 0.00 C ATOM 1494 CD GLN I 9 46.344 11.165 -5.717 1.00 0.00 C ATOM 1495 OE1 GLN I 9 47.213 11.852 -5.217 1.00 0.00 O ATOM 1496 NE2 GLN I 9 45.305 11.727 -6.270 1.00 0.00 N ATOM 0 H GLN I 9 49.002 7.471 -3.899 1.00 0.00 H new ATOM 0 HA GLN I 9 48.346 8.274 -6.665 1.00 0.00 H new ATOM 0 HB2 GLN I 9 47.301 8.506 -4.070 1.00 0.00 H new ATOM 0 HB3 GLN I 9 48.028 10.085 -4.292 1.00 0.00 H new ATOM 0 HG2 GLN I 9 46.591 9.265 -6.718 1.00 0.00 H new ATOM 0 HG3 GLN I 9 45.529 9.201 -5.326 1.00 0.00 H new ATOM 0 HE21 GLN I 9 44.576 11.150 -6.690 1.00 0.00 H new ATOM 0 HE22 GLN I 9 45.222 12.743 -6.283 1.00 0.00 H new ATOM 1505 N ALA I 10 50.971 9.449 -5.347 1.00 0.00 N ATOM 1506 CA ALA I 10 52.085 10.415 -5.571 1.00 0.00 C ATOM 1507 C ALA I 10 52.897 10.027 -6.809 1.00 0.00 C ATOM 1508 O ALA I 10 53.077 10.815 -7.716 1.00 0.00 O ATOM 1509 CB ALA I 10 52.952 10.317 -4.316 1.00 0.00 C ATOM 0 H ALA I 10 51.177 8.690 -4.697 1.00 0.00 H new ATOM 0 HA ALA I 10 51.717 11.427 -5.741 1.00 0.00 H new ATOM 0 HB1 ALA I 10 53.797 11.000 -4.403 1.00 0.00 H new ATOM 0 HB2 ALA I 10 52.358 10.584 -3.442 1.00 0.00 H new ATOM 0 HB3 ALA I 10 53.320 9.297 -4.207 1.00 0.00 H new ATOM 1515 N LEU I 11 53.393 8.821 -6.855 1.00 0.00 N ATOM 1516 CA LEU I 11 54.196 8.393 -8.036 1.00 0.00 C ATOM 1517 C LEU I 11 53.889 6.936 -8.392 1.00 0.00 C ATOM 1518 O LEU I 11 54.668 6.270 -9.043 1.00 0.00 O ATOM 1519 CB LEU I 11 55.654 8.543 -7.598 1.00 0.00 C ATOM 1520 CG LEU I 11 55.922 7.641 -6.391 1.00 0.00 C ATOM 1521 CD1 LEU I 11 56.794 6.462 -6.820 1.00 0.00 C ATOM 1522 CD2 LEU I 11 56.650 8.442 -5.309 1.00 0.00 C ATOM 0 H LEU I 11 53.278 8.115 -6.128 1.00 0.00 H new ATOM 0 HA LEU I 11 53.972 8.987 -8.922 1.00 0.00 H new ATOM 0 HB2 LEU I 11 56.320 8.277 -8.419 1.00 0.00 H new ATOM 0 HB3 LEU I 11 55.863 9.582 -7.342 1.00 0.00 H new ATOM 0 HG LEU I 11 54.976 7.270 -5.997 1.00 0.00 H new ATOM 0 HD11 LEU I 11 56.985 5.819 -5.961 1.00 0.00 H new ATOM 0 HD12 LEU I 11 56.279 5.891 -7.593 1.00 0.00 H new ATOM 0 HD13 LEU I 11 57.740 6.833 -7.213 1.00 0.00 H new ATOM 0 HD21 LEU I 11 56.842 7.801 -4.449 1.00 0.00 H new ATOM 0 HD22 LEU I 11 57.596 8.811 -5.704 1.00 0.00 H new ATOM 0 HD23 LEU I 11 56.031 9.285 -5.002 1.00 0.00 H new ATOM 1534 N LEU I 12 52.759 6.437 -7.973 1.00 0.00 N ATOM 1535 CA LEU I 12 52.405 5.025 -8.290 1.00 0.00 C ATOM 1536 C LEU I 12 50.889 4.885 -8.460 1.00 0.00 C ATOM 1537 O LEU I 12 50.292 3.922 -8.022 1.00 0.00 O ATOM 1538 CB LEU I 12 52.886 4.217 -7.085 1.00 0.00 C ATOM 1539 CG LEU I 12 54.298 3.692 -7.353 1.00 0.00 C ATOM 1540 CD1 LEU I 12 55.245 4.190 -6.261 1.00 0.00 C ATOM 1541 CD2 LEU I 12 54.279 2.161 -7.349 1.00 0.00 C ATOM 0 H LEU I 12 52.066 6.946 -7.425 1.00 0.00 H new ATOM 0 HA LEU I 12 52.861 4.683 -9.219 1.00 0.00 H new ATOM 0 HB2 LEU I 12 52.882 4.840 -6.191 1.00 0.00 H new ATOM 0 HB3 LEU I 12 52.207 3.385 -6.897 1.00 0.00 H new ATOM 0 HG LEU I 12 54.641 4.052 -8.323 1.00 0.00 H new ATOM 0 HD11 LEU I 12 56.251 3.815 -6.453 1.00 0.00 H new ATOM 0 HD12 LEU I 12 55.258 5.280 -6.260 1.00 0.00 H new ATOM 0 HD13 LEU I 12 54.903 3.830 -5.291 1.00 0.00 H new ATOM 0 HD21 LEU I 12 55.284 1.784 -7.540 1.00 0.00 H new ATOM 0 HD22 LEU I 12 53.936 1.804 -6.378 1.00 0.00 H new ATOM 0 HD23 LEU I 12 53.604 1.803 -8.126 1.00 0.00 H new ATOM 1553 N GLY I 13 50.264 5.841 -9.092 1.00 0.00 N ATOM 1554 CA GLY I 13 48.788 5.764 -9.288 1.00 0.00 C ATOM 1555 C GLY I 13 48.356 6.793 -10.334 1.00 0.00 C ATOM 1556 O GLY I 13 49.116 7.159 -11.210 1.00 0.00 O ATOM 0 H GLY I 13 50.711 6.671 -9.481 1.00 0.00 H new ATOM 0 HA2 GLY I 13 48.505 4.762 -9.610 1.00 0.00 H new ATOM 0 HA3 GLY I 13 48.275 5.952 -8.345 1.00 0.00 H new ATOM 1560 N ALA I 14 47.143 7.263 -10.251 1.00 0.00 N ATOM 1561 CA ALA I 14 46.662 8.269 -11.242 1.00 0.00 C ATOM 1562 C ALA I 14 46.870 7.749 -12.668 1.00 0.00 C ATOM 1563 O ALA I 14 47.718 8.228 -13.395 1.00 0.00 O ATOM 1564 CB ALA I 14 47.519 9.510 -10.993 1.00 0.00 C ATOM 0 H ALA I 14 46.463 6.995 -9.540 1.00 0.00 H new ATOM 0 HA ALA I 14 45.598 8.480 -11.134 1.00 0.00 H new ATOM 0 HB1 ALA I 14 47.226 10.299 -11.685 1.00 0.00 H new ATOM 0 HB2 ALA I 14 47.374 9.853 -9.969 1.00 0.00 H new ATOM 0 HB3 ALA I 14 48.570 9.264 -11.147 1.00 0.00 H new ATOM 1570 N ARG I 15 46.105 6.773 -13.073 1.00 0.00 N ATOM 1571 CA ARG I 15 46.263 6.227 -14.452 1.00 0.00 C ATOM 1572 C ARG I 15 45.086 6.660 -15.330 1.00 0.00 C ATOM 1573 O ARG I 15 43.947 6.333 -15.062 1.00 0.00 O ATOM 1574 CB ARG I 15 46.272 4.707 -14.280 1.00 0.00 C ATOM 1575 CG ARG I 15 47.718 4.204 -14.232 1.00 0.00 C ATOM 1576 CD ARG I 15 47.944 3.189 -15.356 1.00 0.00 C ATOM 1577 NE ARG I 15 49.291 2.610 -15.089 1.00 0.00 N ATOM 1578 CZ ARG I 15 49.886 1.894 -16.004 1.00 0.00 C ATOM 1579 NH1 ARG I 15 49.640 0.616 -16.097 1.00 0.00 N ATOM 1580 NH2 ARG I 15 50.727 2.457 -16.829 1.00 0.00 N ATOM 0 H ARG I 15 45.378 6.330 -12.511 1.00 0.00 H new ATOM 0 HA ARG I 15 47.171 6.587 -14.936 1.00 0.00 H new ATOM 0 HB2 ARG I 15 45.750 4.431 -13.364 1.00 0.00 H new ATOM 0 HB3 ARG I 15 45.739 4.234 -15.105 1.00 0.00 H new ATOM 0 HG2 ARG I 15 48.409 5.040 -14.339 1.00 0.00 H new ATOM 0 HG3 ARG I 15 47.922 3.743 -13.265 1.00 0.00 H new ATOM 0 HD2 ARG I 15 47.175 2.417 -15.351 1.00 0.00 H new ATOM 0 HD3 ARG I 15 47.908 3.669 -16.334 1.00 0.00 H new ATOM 0 HE ARG I 15 49.748 2.773 -14.192 1.00 0.00 H new ATOM 0 HH11 ARG I 15 48.982 0.175 -15.454 1.00 0.00 H new ATOM 0 HH12 ARG I 15 50.106 0.058 -16.812 1.00 0.00 H new ATOM 0 HH21 ARG I 15 50.919 3.456 -16.758 1.00 0.00 H new ATOM 0 HH22 ARG I 15 51.192 1.898 -17.544 1.00 0.00 H new ATOM 1594 N ALA I 16 45.351 7.390 -16.378 1.00 0.00 N ATOM 1595 CA ALA I 16 44.247 7.842 -17.273 1.00 0.00 C ATOM 1596 C ALA I 16 44.820 8.455 -18.554 1.00 0.00 C ATOM 1597 O ALA I 16 44.424 9.525 -18.972 1.00 0.00 O ATOM 1598 CB ALA I 16 43.486 8.896 -16.467 1.00 0.00 C ATOM 0 H ALA I 16 46.285 7.694 -16.654 1.00 0.00 H new ATOM 0 HA ALA I 16 43.601 7.019 -17.577 1.00 0.00 H new ATOM 0 HB1 ALA I 16 42.655 9.278 -17.060 1.00 0.00 H new ATOM 0 HB2 ALA I 16 43.102 8.446 -15.552 1.00 0.00 H new ATOM 0 HB3 ALA I 16 44.158 9.716 -16.214 1.00 0.00 H new ATOM 1604 N LYS I 17 45.748 7.784 -19.179 1.00 0.00 N ATOM 1605 CA LYS I 17 46.346 8.328 -20.434 1.00 0.00 C ATOM 1606 C LYS I 17 45.373 8.148 -21.602 1.00 0.00 C ATOM 1607 O LYS I 17 45.091 7.011 -21.942 1.00 0.00 O ATOM 1608 CB LYS I 17 47.613 7.501 -20.659 1.00 0.00 C ATOM 1609 CG LYS I 17 48.829 8.278 -20.147 1.00 0.00 C ATOM 1610 CD LYS I 17 49.368 7.604 -18.884 1.00 0.00 C ATOM 1611 CE LYS I 17 49.222 8.554 -17.695 1.00 0.00 C ATOM 1612 NZ LYS I 17 50.443 8.327 -16.871 1.00 0.00 N ATOM 1613 OXT LYS I 17 44.928 9.150 -22.136 1.00 0.00 O ATOM 0 H LYS I 17 46.119 6.883 -18.876 1.00 0.00 H new ATOM 0 HA LYS I 17 46.563 9.394 -20.362 1.00 0.00 H new ATOM 0 HB2 LYS I 17 47.533 6.546 -20.140 1.00 0.00 H new ATOM 0 HB3 LYS I 17 47.731 7.278 -21.719 1.00 0.00 H new ATOM 0 HG2 LYS I 17 49.603 8.310 -20.914 1.00 0.00 H new ATOM 0 HG3 LYS I 17 48.551 9.310 -19.931 1.00 0.00 H new ATOM 0 HD2 LYS I 17 48.824 6.679 -18.693 1.00 0.00 H new ATOM 0 HD3 LYS I 17 50.415 7.335 -19.021 1.00 0.00 H new ATOM 0 HE2 LYS I 17 49.154 9.591 -18.024 1.00 0.00 H new ATOM 0 HE3 LYS I 17 48.317 8.340 -17.127 1.00 0.00 H new ATOM 0 HZ1 LYS I 17 50.417 8.944 -16.034 1.00 0.00 H new ATOM 0 HZ2 LYS I 17 50.477 7.333 -16.567 1.00 0.00 H new ATOM 0 HZ3 LYS I 17 51.289 8.545 -17.436 1.00 0.00 H new TER 1627 LYS I 17 HETATM 1628 CA CA C 90 69.635 -4.537 4.916 1.00 0.00 CA