USER MOD reduce.3.24.130724 H: found=0, std=0, add=748, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 747 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 163:sc= -0.107 (180deg=-0.114) USER MOD Single : A 2 SER OG : rot 33:sc= 0.552 USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 ASN : amide:sc= 0.522 K(o=0.52,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 0.79 K(o=0.79,f=-3.7!) USER MOD Single : A 20 SER OG : rot 180:sc= -0.0967 USER MOD Single : A 25 SER OG : rot 180:sc= 0.0246 USER MOD Single : A 28 LYS NZ :NH3+ -161:sc= 0.381 (180deg=-0.443!) USER MOD Single : A 32 MET CE :methyl -131:sc= -0.561 (180deg=-1.29) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 94:sc= 1.27 USER MOD Single : A 40 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 48 CYS SG : rot 60:sc= 0.124 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc=-0.000753 X(o=-0.00075,f=0) USER MOD Single : A 54 GLN : amide:sc= -0.325 X(o=-0.33,f=-0.058) USER MOD Single : A 60 ASN : amide:sc= 0.22 K(o=0.22,f=-1.7!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl 163:sc=-0.00931 (180deg=-0.232) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ 145:sc= 1.22 (180deg=1.05) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot -27:sc= 0.0635 USER MOD Single : A 91 LYS NZ :NH3+ 159:sc= 2.01 (180deg=1.29) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.662 6.214 -1.272 1.00 25.00 N ATOM 2 CA GLY A 1 2.754 5.276 -2.443 1.00 25.00 C ATOM 3 C GLY A 1 4.124 5.162 -3.082 1.00 25.00 C ATOM 4 O GLY A 1 4.353 4.562 -4.104 1.00 25.00 O ATOM 0 H1 GLY A 1 1.664 6.445 -1.090 1.00 25.00 H new ATOM 0 H2 GLY A 1 3.072 5.760 -0.431 1.00 25.00 H new ATOM 0 H3 GLY A 1 3.186 7.087 -1.484 1.00 25.00 H new ATOM 0 HA2 GLY A 1 2.441 4.284 -2.117 1.00 25.00 H new ATOM 0 HA3 GLY A 1 2.044 5.601 -3.203 1.00 25.00 H new ATOM 9 N SER A 2 5.095 5.810 -2.436 1.00 25.00 N ATOM 10 CA SER A 2 6.470 5.814 -2.919 1.00 25.00 C ATOM 11 C SER A 2 7.233 4.615 -2.372 1.00 25.00 C ATOM 12 O SER A 2 7.387 4.474 -1.158 1.00 25.00 O ATOM 13 CB SER A 2 7.166 7.099 -2.480 1.00 25.00 C ATOM 14 OG SER A 2 7.107 7.237 -1.069 1.00 25.00 O ATOM 0 H SER A 2 4.950 6.339 -1.576 1.00 25.00 H new ATOM 0 HA SER A 2 6.455 5.756 -4.007 1.00 25.00 H new ATOM 0 HB2 SER A 2 8.206 7.087 -2.807 1.00 25.00 H new ATOM 0 HB3 SER A 2 6.692 7.958 -2.956 1.00 25.00 H new ATOM 0 HG SER A 2 7.132 6.350 -0.652 1.00 25.00 H new ATOM 20 N MET A 3 7.743 3.783 -3.265 1.00 25.00 N ATOM 21 CA MET A 3 8.545 2.629 -2.873 1.00 25.00 C ATOM 22 C MET A 3 9.904 3.101 -2.359 1.00 25.00 C ATOM 23 O MET A 3 10.779 3.489 -3.133 1.00 25.00 O ATOM 24 CB MET A 3 8.738 1.672 -4.059 1.00 25.00 C ATOM 25 CG MET A 3 7.434 1.164 -4.671 1.00 25.00 C ATOM 26 SD MET A 3 6.766 2.288 -5.935 1.00 25.00 S ATOM 27 CE MET A 3 7.760 1.840 -7.375 1.00 25.00 C ATOM 0 H MET A 3 7.617 3.884 -4.272 1.00 25.00 H new ATOM 0 HA MET A 3 8.022 2.093 -2.081 1.00 25.00 H new ATOM 0 HB2 MET A 3 9.315 2.180 -4.831 1.00 25.00 H new ATOM 0 HB3 MET A 3 9.329 0.817 -3.730 1.00 25.00 H new ATOM 0 HG2 MET A 3 7.604 0.184 -5.116 1.00 25.00 H new ATOM 0 HG3 MET A 3 6.694 1.031 -3.881 1.00 25.00 H new ATOM 0 HE1 MET A 3 7.461 2.449 -8.228 1.00 25.00 H new ATOM 0 HE2 MET A 3 8.814 2.013 -7.158 1.00 25.00 H new ATOM 0 HE3 MET A 3 7.606 0.787 -7.610 1.00 25.00 H new ATOM 37 N LYS A 4 10.068 3.088 -1.046 1.00 25.00 N ATOM 38 CA LYS A 4 11.338 3.438 -0.412 1.00 25.00 C ATOM 39 C LYS A 4 11.809 2.146 0.205 1.00 25.00 C ATOM 40 O LYS A 4 10.990 1.418 0.745 1.00 25.00 O ATOM 41 CB LYS A 4 11.146 4.519 0.662 1.00 25.00 C ATOM 42 CG LYS A 4 10.671 5.875 0.124 1.00 25.00 C ATOM 43 CD LYS A 4 11.696 6.501 -0.823 1.00 25.00 C ATOM 44 CE LYS A 4 11.275 7.903 -1.231 1.00 25.00 C ATOM 45 NZ LYS A 4 12.261 8.490 -2.201 1.00 25.00 N ATOM 0 H LYS A 4 9.330 2.836 -0.388 1.00 25.00 H new ATOM 0 HA LYS A 4 12.055 3.851 -1.122 1.00 25.00 H new ATOM 0 HB2 LYS A 4 10.424 4.160 1.395 1.00 25.00 H new ATOM 0 HB3 LYS A 4 12.090 4.662 1.188 1.00 25.00 H new ATOM 0 HG2 LYS A 4 9.724 5.747 -0.399 1.00 25.00 H new ATOM 0 HG3 LYS A 4 10.485 6.552 0.958 1.00 25.00 H new ATOM 0 HD2 LYS A 4 12.671 6.537 -0.337 1.00 25.00 H new ATOM 0 HD3 LYS A 4 11.805 5.877 -1.710 1.00 25.00 H new ATOM 0 HE2 LYS A 4 10.284 7.874 -1.684 1.00 25.00 H new ATOM 0 HE3 LYS A 4 11.203 8.538 -0.348 1.00 25.00 H new ATOM 0 HZ1 LYS A 4 11.957 9.448 -2.468 1.00 25.00 H new ATOM 0 HZ2 LYS A 4 13.200 8.536 -1.756 1.00 25.00 H new ATOM 0 HZ3 LYS A 4 12.310 7.892 -3.051 1.00 25.00 H new ATOM 59 N TYR A 5 13.108 1.882 0.095 1.00 25.00 N ATOM 60 CA TYR A 5 13.746 0.639 0.525 1.00 25.00 C ATOM 61 C TYR A 5 13.237 -0.617 -0.208 1.00 25.00 C ATOM 62 O TYR A 5 12.239 -0.590 -0.924 1.00 25.00 O ATOM 63 CB TYR A 5 13.632 0.491 2.039 1.00 25.00 C ATOM 64 CG TYR A 5 14.493 1.470 2.808 1.00 25.00 C ATOM 65 CD1 TYR A 5 15.889 1.526 2.600 1.00 25.00 C ATOM 66 CD2 TYR A 5 13.924 2.331 3.765 1.00 25.00 C ATOM 67 CE1 TYR A 5 16.699 2.428 3.332 1.00 25.00 C ATOM 68 CE2 TYR A 5 14.735 3.235 4.504 1.00 25.00 C ATOM 69 CZ TYR A 5 16.118 3.272 4.279 1.00 25.00 C ATOM 70 OH TYR A 5 16.904 4.137 4.995 1.00 25.00 O ATOM 0 H TYR A 5 13.767 2.548 -0.308 1.00 25.00 H new ATOM 0 HA TYR A 5 14.797 0.716 0.247 1.00 25.00 H new ATOM 0 HB2 TYR A 5 12.591 0.627 2.332 1.00 25.00 H new ATOM 0 HB3 TYR A 5 13.912 -0.525 2.319 1.00 25.00 H new ATOM 0 HD1 TYR A 5 16.345 0.871 1.872 1.00 25.00 H new ATOM 0 HD2 TYR A 5 12.859 2.305 3.940 1.00 25.00 H new ATOM 0 HE1 TYR A 5 17.764 2.463 3.158 1.00 25.00 H new ATOM 0 HE2 TYR A 5 14.287 3.891 5.236 1.00 25.00 H new ATOM 0 HH TYR A 5 16.344 4.654 5.611 1.00 25.00 H new ATOM 80 N LEU A 6 13.996 -1.697 -0.080 1.00 25.00 N ATOM 81 CA LEU A 6 13.725 -2.951 -0.787 1.00 25.00 C ATOM 82 C LEU A 6 12.505 -3.678 -0.210 1.00 25.00 C ATOM 83 O LEU A 6 11.696 -4.216 -0.954 1.00 25.00 O ATOM 84 CB LEU A 6 14.946 -3.881 -0.685 1.00 25.00 C ATOM 85 CG LEU A 6 16.307 -3.407 -1.221 1.00 25.00 C ATOM 86 CD1 LEU A 6 17.386 -4.459 -0.878 1.00 25.00 C ATOM 87 CD2 LEU A 6 16.276 -3.182 -2.728 1.00 25.00 C ATOM 0 H LEU A 6 14.821 -1.733 0.518 1.00 25.00 H new ATOM 0 HA LEU A 6 13.519 -2.700 -1.828 1.00 25.00 H new ATOM 0 HB2 LEU A 6 15.079 -4.131 0.368 1.00 25.00 H new ATOM 0 HB3 LEU A 6 14.695 -4.807 -1.203 1.00 25.00 H new ATOM 0 HG LEU A 6 16.542 -2.454 -0.747 1.00 25.00 H new ATOM 0 HD11 LEU A 6 18.352 -4.126 -1.257 1.00 25.00 H new ATOM 0 HD12 LEU A 6 17.443 -4.582 0.203 1.00 25.00 H new ATOM 0 HD13 LEU A 6 17.125 -5.412 -1.339 1.00 25.00 H new ATOM 0 HD21 LEU A 6 17.257 -2.848 -3.066 1.00 25.00 H new ATOM 0 HD22 LEU A 6 16.017 -4.114 -3.230 1.00 25.00 H new ATOM 0 HD23 LEU A 6 15.532 -2.423 -2.967 1.00 25.00 H new ATOM 99 N ASN A 7 12.406 -3.691 1.116 1.00 25.00 N ATOM 100 CA ASN A 7 11.310 -4.343 1.859 1.00 25.00 C ATOM 101 C ASN A 7 11.087 -5.810 1.473 1.00 25.00 C ATOM 102 O ASN A 7 9.970 -6.223 1.169 1.00 25.00 O ATOM 103 CB ASN A 7 10.005 -3.558 1.701 1.00 25.00 C ATOM 104 CG ASN A 7 10.120 -2.159 2.200 1.00 25.00 C ATOM 105 OD1 ASN A 7 10.167 -1.915 3.395 1.00 25.00 O ATOM 106 ND2 ASN A 7 10.187 -1.233 1.298 1.00 25.00 N ATOM 0 H ASN A 7 13.093 -3.243 1.723 1.00 25.00 H new ATOM 0 HA ASN A 7 11.621 -4.340 2.904 1.00 25.00 H new ATOM 0 HB2 ASN A 7 9.718 -3.543 0.650 1.00 25.00 H new ATOM 0 HB3 ASN A 7 9.209 -4.069 2.242 1.00 25.00 H new ATOM 0 HD21 ASN A 7 10.283 -0.256 1.576 1.00 25.00 H new ATOM 0 HD22 ASN A 7 10.144 -1.480 0.309 1.00 25.00 H new ATOM 113 N VAL A 8 12.149 -6.599 1.508 1.00 25.00 N ATOM 114 CA VAL A 8 12.068 -8.024 1.177 1.00 25.00 C ATOM 115 C VAL A 8 12.206 -8.800 2.477 1.00 25.00 C ATOM 116 O VAL A 8 12.730 -8.278 3.443 1.00 25.00 O ATOM 117 CB VAL A 8 13.176 -8.444 0.135 1.00 25.00 C ATOM 118 CG1 VAL A 8 13.664 -7.232 -0.645 1.00 25.00 C ATOM 119 CG2 VAL A 8 14.376 -9.099 0.803 1.00 25.00 C ATOM 0 H VAL A 8 13.084 -6.281 1.763 1.00 25.00 H new ATOM 0 HA VAL A 8 11.112 -8.245 0.703 1.00 25.00 H new ATOM 0 HB VAL A 8 12.711 -9.166 -0.536 1.00 25.00 H new ATOM 0 HG11 VAL A 8 14.428 -7.542 -1.358 1.00 25.00 H new ATOM 0 HG12 VAL A 8 12.828 -6.783 -1.181 1.00 25.00 H new ATOM 0 HG13 VAL A 8 14.087 -6.502 0.045 1.00 25.00 H new ATOM 0 HG21 VAL A 8 15.111 -9.370 0.045 1.00 25.00 H new ATOM 0 HG22 VAL A 8 14.824 -8.401 1.510 1.00 25.00 H new ATOM 0 HG23 VAL A 8 14.053 -9.995 1.333 1.00 25.00 H new ATOM 129 N LEU A 9 11.764 -10.043 2.511 1.00 25.00 N ATOM 130 CA LEU A 9 11.914 -10.857 3.718 1.00 25.00 C ATOM 131 C LEU A 9 13.174 -11.708 3.616 1.00 25.00 C ATOM 132 O LEU A 9 13.498 -12.224 2.545 1.00 25.00 O ATOM 133 CB LEU A 9 10.690 -11.759 3.918 1.00 25.00 C ATOM 134 CG LEU A 9 9.346 -11.036 4.100 1.00 25.00 C ATOM 135 CD1 LEU A 9 8.235 -12.074 4.256 1.00 25.00 C ATOM 136 CD2 LEU A 9 9.352 -10.095 5.314 1.00 25.00 C ATOM 0 H LEU A 9 11.303 -10.513 1.732 1.00 25.00 H new ATOM 0 HA LEU A 9 11.997 -10.191 4.577 1.00 25.00 H new ATOM 0 HB2 LEU A 9 10.609 -12.425 3.059 1.00 25.00 H new ATOM 0 HB3 LEU A 9 10.864 -12.387 4.792 1.00 25.00 H new ATOM 0 HG LEU A 9 9.173 -10.423 3.216 1.00 25.00 H new ATOM 0 HD11 LEU A 9 7.279 -11.567 4.386 1.00 25.00 H new ATOM 0 HD12 LEU A 9 8.195 -12.701 3.365 1.00 25.00 H new ATOM 0 HD13 LEU A 9 8.437 -12.695 5.129 1.00 25.00 H new ATOM 0 HD21 LEU A 9 8.381 -9.607 5.401 1.00 25.00 H new ATOM 0 HD22 LEU A 9 9.552 -10.669 6.219 1.00 25.00 H new ATOM 0 HD23 LEU A 9 10.127 -9.340 5.185 1.00 25.00 H new ATOM 148 N ALA A 10 13.874 -11.876 4.726 1.00 25.00 N ATOM 149 CA ALA A 10 15.064 -12.720 4.769 1.00 25.00 C ATOM 150 C ALA A 10 15.039 -13.581 6.036 1.00 25.00 C ATOM 151 O ALA A 10 14.576 -13.127 7.075 1.00 25.00 O ATOM 152 CB ALA A 10 16.312 -11.848 4.734 1.00 25.00 C ATOM 0 H ALA A 10 13.639 -11.437 5.616 1.00 25.00 H new ATOM 0 HA ALA A 10 15.078 -13.380 3.901 1.00 25.00 H new ATOM 0 HB1 ALA A 10 17.199 -12.481 4.766 1.00 25.00 H new ATOM 0 HB2 ALA A 10 16.319 -11.260 3.816 1.00 25.00 H new ATOM 0 HB3 ALA A 10 16.312 -11.179 5.594 1.00 25.00 H new ATOM 158 N LYS A 11 15.535 -14.811 5.938 1.00 25.00 N ATOM 159 CA LYS A 11 15.582 -15.732 7.082 1.00 25.00 C ATOM 160 C LYS A 11 16.995 -15.862 7.622 1.00 25.00 C ATOM 161 O LYS A 11 17.944 -16.016 6.852 1.00 25.00 O ATOM 162 CB LYS A 11 15.085 -17.123 6.677 1.00 25.00 C ATOM 163 CG LYS A 11 15.229 -18.176 7.790 1.00 25.00 C ATOM 164 CD LYS A 11 14.384 -19.424 7.569 1.00 25.00 C ATOM 165 CE LYS A 11 12.916 -19.152 7.898 1.00 25.00 C ATOM 166 NZ LYS A 11 12.092 -20.398 8.063 1.00 25.00 N ATOM 0 H LYS A 11 15.914 -15.200 5.074 1.00 25.00 H new ATOM 0 HA LYS A 11 14.935 -15.319 7.856 1.00 25.00 H new ATOM 0 HB2 LYS A 11 14.037 -17.055 6.386 1.00 25.00 H new ATOM 0 HB3 LYS A 11 15.638 -17.456 5.799 1.00 25.00 H new ATOM 0 HG2 LYS A 11 16.276 -18.467 7.869 1.00 25.00 H new ATOM 0 HG3 LYS A 11 14.951 -17.725 8.742 1.00 25.00 H new ATOM 0 HD2 LYS A 11 14.474 -19.751 6.533 1.00 25.00 H new ATOM 0 HD3 LYS A 11 14.757 -20.236 8.193 1.00 25.00 H new ATOM 0 HE2 LYS A 11 12.861 -18.567 8.816 1.00 25.00 H new ATOM 0 HE3 LYS A 11 12.482 -18.543 7.105 1.00 25.00 H new ATOM 0 HZ1 LYS A 11 11.110 -20.138 8.284 1.00 25.00 H new ATOM 0 HZ2 LYS A 11 12.114 -20.948 7.181 1.00 25.00 H new ATOM 0 HZ3 LYS A 11 12.481 -20.971 8.838 1.00 25.00 H new ATOM 180 N ALA A 12 17.115 -15.858 8.939 1.00 25.00 N ATOM 181 CA ALA A 12 18.384 -16.073 9.611 1.00 25.00 C ATOM 182 C ALA A 12 18.794 -17.541 9.487 1.00 25.00 C ATOM 183 O ALA A 12 18.019 -18.430 9.835 1.00 25.00 O ATOM 184 CB ALA A 12 18.229 -15.691 11.076 1.00 25.00 C ATOM 0 H ALA A 12 16.332 -15.705 9.574 1.00 25.00 H new ATOM 0 HA ALA A 12 19.159 -15.459 9.152 1.00 25.00 H new ATOM 0 HB1 ALA A 12 19.175 -15.847 11.595 1.00 25.00 H new ATOM 0 HB2 ALA A 12 17.943 -14.642 11.150 1.00 25.00 H new ATOM 0 HB3 ALA A 12 17.458 -16.310 11.534 1.00 25.00 H new ATOM 190 N LEU A 13 20.007 -17.806 9.024 1.00 25.00 N ATOM 191 CA LEU A 13 20.514 -19.180 8.971 1.00 25.00 C ATOM 192 C LEU A 13 21.153 -19.526 10.294 1.00 25.00 C ATOM 193 O LEU A 13 21.358 -20.688 10.596 1.00 25.00 O ATOM 194 CB LEU A 13 21.591 -19.342 7.895 1.00 25.00 C ATOM 195 CG LEU A 13 21.262 -19.204 6.411 1.00 25.00 C ATOM 196 CD1 LEU A 13 19.836 -19.644 6.053 1.00 25.00 C ATOM 197 CD2 LEU A 13 21.508 -17.798 5.948 1.00 25.00 C ATOM 0 H LEU A 13 20.657 -17.099 8.681 1.00 25.00 H new ATOM 0 HA LEU A 13 19.670 -19.831 8.744 1.00 25.00 H new ATOM 0 HB2 LEU A 13 22.371 -18.614 8.116 1.00 25.00 H new ATOM 0 HB3 LEU A 13 22.030 -20.330 8.032 1.00 25.00 H new ATOM 0 HG LEU A 13 21.932 -19.886 5.887 1.00 25.00 H new ATOM 0 HD11 LEU A 13 19.674 -19.518 4.982 1.00 25.00 H new ATOM 0 HD12 LEU A 13 19.701 -20.692 6.319 1.00 25.00 H new ATOM 0 HD13 LEU A 13 19.118 -19.035 6.603 1.00 25.00 H new ATOM 0 HD21 LEU A 13 21.268 -17.717 4.888 1.00 25.00 H new ATOM 0 HD22 LEU A 13 20.879 -17.113 6.516 1.00 25.00 H new ATOM 0 HD23 LEU A 13 22.556 -17.542 6.104 1.00 25.00 H new ATOM 209 N TYR A 14 21.504 -18.500 11.051 1.00 25.00 N ATOM 210 CA TYR A 14 22.222 -18.661 12.307 1.00 25.00 C ATOM 211 C TYR A 14 21.728 -17.650 13.319 1.00 25.00 C ATOM 212 O TYR A 14 21.088 -16.671 12.956 1.00 25.00 O ATOM 213 CB TYR A 14 23.716 -18.424 12.086 1.00 25.00 C ATOM 214 CG TYR A 14 24.323 -19.331 11.045 1.00 25.00 C ATOM 215 CD1 TYR A 14 24.495 -18.885 9.718 1.00 25.00 C ATOM 216 CD2 TYR A 14 24.717 -20.641 11.368 1.00 25.00 C ATOM 217 CE1 TYR A 14 25.046 -19.741 8.731 1.00 25.00 C ATOM 218 CE2 TYR A 14 25.278 -21.492 10.388 1.00 25.00 C ATOM 219 CZ TYR A 14 25.432 -21.038 9.081 1.00 25.00 C ATOM 220 OH TYR A 14 25.977 -21.866 8.134 1.00 25.00 O ATOM 0 H TYR A 14 21.299 -17.530 10.813 1.00 25.00 H new ATOM 0 HA TYR A 14 22.051 -19.673 12.674 1.00 25.00 H new ATOM 0 HB2 TYR A 14 23.871 -17.387 11.787 1.00 25.00 H new ATOM 0 HB3 TYR A 14 24.242 -18.566 13.030 1.00 25.00 H new ATOM 0 HD1 TYR A 14 24.204 -17.880 9.451 1.00 25.00 H new ATOM 0 HD2 TYR A 14 24.590 -21.002 12.378 1.00 25.00 H new ATOM 0 HE1 TYR A 14 25.167 -19.393 7.716 1.00 25.00 H new ATOM 0 HE2 TYR A 14 25.587 -22.493 10.653 1.00 25.00 H new ATOM 0 HH TYR A 14 26.192 -22.731 8.541 1.00 25.00 H new ATOM 230 N ASP A 15 22.081 -17.867 14.574 1.00 25.00 N ATOM 231 CA ASP A 15 21.848 -16.895 15.631 1.00 25.00 C ATOM 232 C ASP A 15 22.761 -15.692 15.412 1.00 25.00 C ATOM 233 O ASP A 15 23.772 -15.779 14.700 1.00 25.00 O ATOM 234 CB ASP A 15 22.178 -17.533 16.975 1.00 25.00 C ATOM 235 CG ASP A 15 21.473 -16.869 18.127 1.00 25.00 C ATOM 236 OD1 ASP A 15 20.404 -17.383 18.512 1.00 25.00 O ATOM 237 OD2 ASP A 15 21.978 -15.865 18.656 1.00 25.00 O ATOM 0 H ASP A 15 22.538 -18.722 14.890 1.00 25.00 H new ATOM 0 HA ASP A 15 20.806 -16.576 15.618 1.00 25.00 H new ATOM 0 HB2 ASP A 15 21.905 -18.588 16.948 1.00 25.00 H new ATOM 0 HB3 ASP A 15 23.255 -17.487 17.139 1.00 25.00 H new ATOM 242 N ASN A 16 22.424 -14.586 16.045 1.00 25.00 N ATOM 243 CA ASN A 16 23.215 -13.377 15.966 1.00 25.00 C ATOM 244 C ASN A 16 22.998 -12.558 17.219 1.00 25.00 C ATOM 245 O ASN A 16 21.977 -11.909 17.380 1.00 25.00 O ATOM 246 CB ASN A 16 22.845 -12.540 14.743 1.00 25.00 C ATOM 247 CG ASN A 16 23.917 -11.558 14.389 1.00 25.00 C ATOM 248 OD1 ASN A 16 25.014 -11.956 14.011 1.00 25.00 O ATOM 249 ND2 ASN A 16 23.645 -10.296 14.542 1.00 25.00 N ATOM 0 H ASN A 16 21.592 -14.502 16.629 1.00 25.00 H new ATOM 0 HA ASN A 16 24.263 -13.662 15.873 1.00 25.00 H new ATOM 0 HB2 ASN A 16 22.663 -13.199 13.894 1.00 25.00 H new ATOM 0 HB3 ASN A 16 21.915 -12.006 14.937 1.00 25.00 H new ATOM 0 HD21 ASN A 16 24.358 -9.593 14.345 1.00 25.00 H new ATOM 0 HD22 ASN A 16 22.719 -10.009 14.859 1.00 25.00 H new ATOM 256 N VAL A 17 23.983 -12.571 18.091 1.00 25.00 N ATOM 257 CA VAL A 17 23.976 -11.756 19.272 1.00 25.00 C ATOM 258 C VAL A 17 24.564 -10.445 18.790 1.00 25.00 C ATOM 259 O VAL A 17 25.634 -10.410 18.173 1.00 25.00 O ATOM 260 CB VAL A 17 24.804 -12.424 20.416 1.00 25.00 C ATOM 261 CG1 VAL A 17 25.931 -13.308 19.845 1.00 25.00 C ATOM 262 CG2 VAL A 17 25.359 -11.376 21.388 1.00 25.00 C ATOM 0 H VAL A 17 24.814 -13.154 17.994 1.00 25.00 H new ATOM 0 HA VAL A 17 22.988 -11.616 19.710 1.00 25.00 H new ATOM 0 HB VAL A 17 24.129 -13.069 20.978 1.00 25.00 H new ATOM 0 HG11 VAL A 17 26.490 -13.759 20.665 1.00 25.00 H new ATOM 0 HG12 VAL A 17 25.499 -14.093 19.225 1.00 25.00 H new ATOM 0 HG13 VAL A 17 26.602 -12.697 19.241 1.00 25.00 H new ATOM 0 HG21 VAL A 17 25.930 -11.873 22.172 1.00 25.00 H new ATOM 0 HG22 VAL A 17 26.008 -10.687 20.848 1.00 25.00 H new ATOM 0 HG23 VAL A 17 24.534 -10.822 21.836 1.00 25.00 H new ATOM 272 N ALA A 18 23.803 -9.389 18.986 1.00 25.00 N ATOM 273 CA ALA A 18 24.208 -8.057 18.577 1.00 25.00 C ATOM 274 C ALA A 18 25.311 -7.582 19.511 1.00 25.00 C ATOM 275 O ALA A 18 25.194 -7.689 20.729 1.00 25.00 O ATOM 276 CB ALA A 18 23.022 -7.105 18.633 1.00 25.00 C ATOM 0 H ALA A 18 22.887 -9.428 19.433 1.00 25.00 H new ATOM 0 HA ALA A 18 24.575 -8.079 17.551 1.00 25.00 H new ATOM 0 HB1 ALA A 18 23.340 -6.109 18.324 1.00 25.00 H new ATOM 0 HB2 ALA A 18 22.238 -7.460 17.964 1.00 25.00 H new ATOM 0 HB3 ALA A 18 22.637 -7.063 19.652 1.00 25.00 H new ATOM 282 N GLU A 19 26.378 -7.071 18.922 1.00 25.00 N ATOM 283 CA GLU A 19 27.531 -6.586 19.685 1.00 25.00 C ATOM 284 C GLU A 19 27.750 -5.104 19.409 1.00 25.00 C ATOM 285 O GLU A 19 28.288 -4.376 20.236 1.00 25.00 O ATOM 286 CB GLU A 19 28.769 -7.402 19.311 1.00 25.00 C ATOM 287 CG GLU A 19 28.614 -8.873 19.677 1.00 25.00 C ATOM 288 CD GLU A 19 29.796 -9.722 19.244 1.00 25.00 C ATOM 289 OE1 GLU A 19 29.860 -10.072 18.036 1.00 25.00 O ATOM 290 OE2 GLU A 19 30.627 -10.091 20.097 1.00 25.00 O ATOM 0 H GLU A 19 26.477 -6.978 17.911 1.00 25.00 H new ATOM 0 HA GLU A 19 27.343 -6.708 20.752 1.00 25.00 H new ATOM 0 HB2 GLU A 19 28.953 -7.312 18.240 1.00 25.00 H new ATOM 0 HB3 GLU A 19 29.641 -6.992 19.820 1.00 25.00 H new ATOM 0 HG2 GLU A 19 28.487 -8.961 20.756 1.00 25.00 H new ATOM 0 HG3 GLU A 19 27.706 -9.262 19.216 1.00 25.00 H new ATOM 297 N SER A 20 27.272 -4.659 18.257 1.00 25.00 N ATOM 298 CA SER A 20 27.301 -3.245 17.900 1.00 25.00 C ATOM 299 C SER A 20 25.941 -2.676 18.283 1.00 25.00 C ATOM 300 O SER A 20 24.932 -3.373 18.184 1.00 25.00 O ATOM 301 CB SER A 20 27.546 -3.088 16.395 1.00 25.00 C ATOM 302 OG SER A 20 27.362 -1.750 15.971 1.00 25.00 O ATOM 0 H SER A 20 26.856 -5.261 17.547 1.00 25.00 H new ATOM 0 HA SER A 20 28.103 -2.719 18.418 1.00 25.00 H new ATOM 0 HB2 SER A 20 28.560 -3.409 16.156 1.00 25.00 H new ATOM 0 HB3 SER A 20 26.867 -3.740 15.846 1.00 25.00 H new ATOM 0 HG SER A 20 27.528 -1.686 15.007 1.00 25.00 H new ATOM 308 N PRO A 21 25.883 -1.404 18.713 1.00 25.00 N ATOM 309 CA PRO A 21 24.588 -0.824 19.095 1.00 25.00 C ATOM 310 C PRO A 21 23.626 -0.636 17.919 1.00 25.00 C ATOM 311 O PRO A 21 22.432 -0.399 18.118 1.00 25.00 O ATOM 312 CB PRO A 21 24.991 0.525 19.700 1.00 25.00 C ATOM 313 CG PRO A 21 26.267 0.863 19.009 1.00 25.00 C ATOM 314 CD PRO A 21 26.980 -0.429 18.888 1.00 25.00 C ATOM 0 HA PRO A 21 24.036 -1.475 19.773 1.00 25.00 H new ATOM 0 HB2 PRO A 21 24.229 1.285 19.525 1.00 25.00 H new ATOM 0 HB3 PRO A 21 25.128 0.454 20.779 1.00 25.00 H new ATOM 0 HG2 PRO A 21 26.082 1.307 18.031 1.00 25.00 H new ATOM 0 HG3 PRO A 21 26.849 1.585 19.582 1.00 25.00 H new ATOM 0 HD2 PRO A 21 27.663 -0.434 18.038 1.00 25.00 H new ATOM 0 HD3 PRO A 21 27.574 -0.646 19.776 1.00 25.00 H new ATOM 322 N ASP A 22 24.144 -0.767 16.705 1.00 25.00 N ATOM 323 CA ASP A 22 23.358 -0.609 15.491 1.00 25.00 C ATOM 324 C ASP A 22 22.967 -1.967 14.932 1.00 25.00 C ATOM 325 O ASP A 22 22.286 -2.045 13.931 1.00 25.00 O ATOM 326 CB ASP A 22 24.189 0.146 14.455 1.00 25.00 C ATOM 327 CG ASP A 22 24.399 1.593 14.841 1.00 25.00 C ATOM 328 OD1 ASP A 22 25.476 1.914 15.385 1.00 25.00 O ATOM 329 OD2 ASP A 22 23.461 2.400 14.653 1.00 25.00 O ATOM 0 H ASP A 22 25.125 -0.987 16.535 1.00 25.00 H new ATOM 0 HA ASP A 22 22.451 -0.052 15.723 1.00 25.00 H new ATOM 0 HB2 ASP A 22 25.157 -0.343 14.341 1.00 25.00 H new ATOM 0 HB3 ASP A 22 23.691 0.098 13.486 1.00 25.00 H new ATOM 334 N GLU A 23 23.432 -3.041 15.553 1.00 25.00 N ATOM 335 CA GLU A 23 23.193 -4.389 15.053 1.00 25.00 C ATOM 336 C GLU A 23 21.931 -5.013 15.652 1.00 25.00 C ATOM 337 O GLU A 23 21.601 -4.793 16.816 1.00 25.00 O ATOM 338 CB GLU A 23 24.413 -5.246 15.384 1.00 25.00 C ATOM 339 CG GLU A 23 24.396 -6.625 14.776 1.00 25.00 C ATOM 340 CD GLU A 23 25.664 -7.394 15.069 1.00 25.00 C ATOM 341 OE1 GLU A 23 25.919 -8.381 14.348 1.00 25.00 O ATOM 342 OE2 GLU A 23 26.389 -7.066 16.044 1.00 25.00 O ATOM 0 H GLU A 23 23.982 -3.005 16.411 1.00 25.00 H new ATOM 0 HA GLU A 23 23.037 -4.339 13.975 1.00 25.00 H new ATOM 0 HB2 GLU A 23 25.309 -4.725 15.046 1.00 25.00 H new ATOM 0 HB3 GLU A 23 24.490 -5.342 16.467 1.00 25.00 H new ATOM 0 HG2 GLU A 23 23.540 -7.179 15.161 1.00 25.00 H new ATOM 0 HG3 GLU A 23 24.264 -6.543 13.697 1.00 25.00 H new ATOM 349 N LEU A 24 21.230 -5.812 14.860 1.00 25.00 N ATOM 350 CA LEU A 24 20.048 -6.520 15.349 1.00 25.00 C ATOM 351 C LEU A 24 20.414 -7.874 15.931 1.00 25.00 C ATOM 352 O LEU A 24 21.284 -8.583 15.420 1.00 25.00 O ATOM 353 CB LEU A 24 19.030 -6.734 14.233 1.00 25.00 C ATOM 354 CG LEU A 24 18.333 -5.465 13.729 1.00 25.00 C ATOM 355 CD1 LEU A 24 17.402 -5.822 12.582 1.00 25.00 C ATOM 356 CD2 LEU A 24 17.549 -4.779 14.858 1.00 25.00 C ATOM 0 H LEU A 24 21.455 -5.988 13.881 1.00 25.00 H new ATOM 0 HA LEU A 24 19.612 -5.895 16.128 1.00 25.00 H new ATOM 0 HB2 LEU A 24 19.533 -7.211 13.392 1.00 25.00 H new ATOM 0 HB3 LEU A 24 18.269 -7.430 14.586 1.00 25.00 H new ATOM 0 HG LEU A 24 19.092 -4.765 13.378 1.00 25.00 H new ATOM 0 HD11 LEU A 24 16.905 -4.921 12.222 1.00 25.00 H new ATOM 0 HD12 LEU A 24 17.978 -6.267 11.771 1.00 25.00 H new ATOM 0 HD13 LEU A 24 16.654 -6.535 12.929 1.00 25.00 H new ATOM 0 HD21 LEU A 24 17.065 -3.882 14.472 1.00 25.00 H new ATOM 0 HD22 LEU A 24 16.792 -5.463 15.243 1.00 25.00 H new ATOM 0 HD23 LEU A 24 18.233 -4.505 15.661 1.00 25.00 H new ATOM 368 N SER A 25 19.701 -8.239 16.985 1.00 25.00 N ATOM 369 CA SER A 25 19.897 -9.509 17.654 1.00 25.00 C ATOM 370 C SER A 25 18.723 -10.419 17.333 1.00 25.00 C ATOM 371 O SER A 25 17.568 -10.042 17.523 1.00 25.00 O ATOM 372 CB SER A 25 20.001 -9.289 19.162 1.00 25.00 C ATOM 373 OG SER A 25 19.653 -7.949 19.489 1.00 25.00 O ATOM 0 H SER A 25 18.970 -7.660 17.399 1.00 25.00 H new ATOM 0 HA SER A 25 20.821 -9.973 17.308 1.00 25.00 H new ATOM 0 HB2 SER A 25 19.341 -9.981 19.684 1.00 25.00 H new ATOM 0 HB3 SER A 25 21.016 -9.501 19.499 1.00 25.00 H new ATOM 0 HG SER A 25 19.722 -7.820 20.458 1.00 25.00 H new ATOM 379 N PHE A 26 19.024 -11.595 16.812 1.00 25.00 N ATOM 380 CA PHE A 26 17.990 -12.556 16.421 1.00 25.00 C ATOM 381 C PHE A 26 18.448 -14.009 16.505 1.00 25.00 C ATOM 382 O PHE A 26 19.632 -14.305 16.651 1.00 25.00 O ATOM 383 CB PHE A 26 17.518 -12.255 14.998 1.00 25.00 C ATOM 384 CG PHE A 26 18.626 -12.199 13.996 1.00 25.00 C ATOM 385 CD1 PHE A 26 19.193 -13.379 13.478 1.00 25.00 C ATOM 386 CD2 PHE A 26 19.094 -10.959 13.541 1.00 25.00 C ATOM 387 CE1 PHE A 26 20.211 -13.321 12.504 1.00 25.00 C ATOM 388 CE2 PHE A 26 20.104 -10.890 12.574 1.00 25.00 C ATOM 389 CZ PHE A 26 20.663 -12.081 12.046 1.00 25.00 C ATOM 0 H PHE A 26 19.978 -11.915 16.647 1.00 25.00 H new ATOM 0 HA PHE A 26 17.173 -12.440 17.134 1.00 25.00 H new ATOM 0 HB2 PHE A 26 16.803 -13.019 14.693 1.00 25.00 H new ATOM 0 HB3 PHE A 26 16.988 -11.302 14.994 1.00 25.00 H new ATOM 0 HD1 PHE A 26 18.845 -14.339 13.830 1.00 25.00 H new ATOM 0 HD2 PHE A 26 18.672 -10.048 13.940 1.00 25.00 H new ATOM 0 HE1 PHE A 26 20.640 -14.232 12.113 1.00 25.00 H new ATOM 0 HE2 PHE A 26 20.457 -9.929 12.230 1.00 25.00 H new ATOM 0 HZ PHE A 26 21.435 -12.030 11.293 1.00 25.00 H new ATOM 399 N ARG A 27 17.481 -14.907 16.395 1.00 25.00 N ATOM 400 CA ARG A 27 17.684 -16.350 16.481 1.00 25.00 C ATOM 401 C ARG A 27 17.690 -16.949 15.081 1.00 25.00 C ATOM 402 O ARG A 27 17.070 -16.426 14.160 1.00 25.00 O ATOM 403 CB ARG A 27 16.499 -16.914 17.295 1.00 25.00 C ATOM 404 CG ARG A 27 16.558 -18.378 17.725 1.00 25.00 C ATOM 405 CD ARG A 27 17.552 -18.591 18.853 1.00 25.00 C ATOM 406 NE ARG A 27 17.190 -19.743 19.696 1.00 25.00 N ATOM 407 CZ ARG A 27 17.606 -20.992 19.515 1.00 25.00 C ATOM 408 NH1 ARG A 27 18.400 -21.336 18.530 1.00 25.00 N ATOM 409 NH2 ARG A 27 17.214 -21.915 20.347 1.00 25.00 N ATOM 0 H ARG A 27 16.507 -14.648 16.239 1.00 25.00 H new ATOM 0 HA ARG A 27 18.635 -16.592 16.956 1.00 25.00 H new ATOM 0 HB2 ARG A 27 16.391 -16.306 18.193 1.00 25.00 H new ATOM 0 HB3 ARG A 27 15.593 -16.775 16.706 1.00 25.00 H new ATOM 0 HG2 ARG A 27 15.568 -18.704 18.045 1.00 25.00 H new ATOM 0 HG3 ARG A 27 16.837 -18.997 16.872 1.00 25.00 H new ATOM 0 HD2 ARG A 27 18.547 -18.746 18.435 1.00 25.00 H new ATOM 0 HD3 ARG A 27 17.601 -17.692 19.468 1.00 25.00 H new ATOM 0 HE ARG A 27 16.568 -19.567 20.485 1.00 25.00 H new ATOM 0 HH11 ARG A 27 18.723 -20.633 17.866 1.00 25.00 H new ATOM 0 HH12 ARG A 27 18.695 -22.307 18.428 1.00 25.00 H new ATOM 0 HH21 ARG A 27 16.597 -21.674 21.123 1.00 25.00 H new ATOM 0 HH22 ARG A 27 17.524 -22.879 20.223 1.00 25.00 H new ATOM 423 N LYS A 28 18.342 -18.092 14.937 1.00 25.00 N ATOM 424 CA LYS A 28 18.286 -18.856 13.691 1.00 25.00 C ATOM 425 C LYS A 28 16.828 -19.154 13.368 1.00 25.00 C ATOM 426 O LYS A 28 16.095 -19.658 14.209 1.00 25.00 O ATOM 427 CB LYS A 28 19.054 -20.174 13.854 1.00 25.00 C ATOM 428 CG LYS A 28 18.890 -21.136 12.683 1.00 25.00 C ATOM 429 CD LYS A 28 19.769 -22.371 12.854 1.00 25.00 C ATOM 430 CE LYS A 28 19.589 -23.335 11.687 1.00 25.00 C ATOM 431 NZ LYS A 28 20.444 -24.546 11.858 1.00 25.00 N ATOM 0 H LYS A 28 18.918 -18.515 15.665 1.00 25.00 H new ATOM 0 HA LYS A 28 18.739 -18.280 12.884 1.00 25.00 H new ATOM 0 HB2 LYS A 28 20.113 -19.952 13.983 1.00 25.00 H new ATOM 0 HB3 LYS A 28 18.719 -20.668 14.766 1.00 25.00 H new ATOM 0 HG2 LYS A 28 17.846 -21.438 12.601 1.00 25.00 H new ATOM 0 HG3 LYS A 28 19.149 -20.629 11.754 1.00 25.00 H new ATOM 0 HD2 LYS A 28 20.814 -22.071 12.924 1.00 25.00 H new ATOM 0 HD3 LYS A 28 19.518 -22.874 13.788 1.00 25.00 H new ATOM 0 HE2 LYS A 28 18.543 -23.631 11.613 1.00 25.00 H new ATOM 0 HE3 LYS A 28 19.845 -22.834 10.754 1.00 25.00 H new ATOM 0 HZ1 LYS A 28 20.559 -25.022 10.940 1.00 25.00 H new ATOM 0 HZ2 LYS A 28 21.377 -24.264 12.221 1.00 25.00 H new ATOM 0 HZ3 LYS A 28 19.993 -25.197 12.531 1.00 25.00 H new ATOM 445 N GLY A 29 16.437 -18.868 12.136 1.00 25.00 N ATOM 446 CA GLY A 29 15.083 -19.121 11.680 1.00 25.00 C ATOM 447 C GLY A 29 14.201 -17.889 11.680 1.00 25.00 C ATOM 448 O GLY A 29 13.119 -17.926 11.093 1.00 25.00 O ATOM 0 H GLY A 29 17.047 -18.456 11.429 1.00 25.00 H new ATOM 0 HA2 GLY A 29 15.119 -19.531 10.671 1.00 25.00 H new ATOM 0 HA3 GLY A 29 14.630 -19.881 12.317 1.00 25.00 H new ATOM 452 N ASP A 30 14.649 -16.809 12.306 1.00 25.00 N ATOM 453 CA ASP A 30 13.847 -15.587 12.405 1.00 25.00 C ATOM 454 C ASP A 30 13.740 -14.923 11.046 1.00 25.00 C ATOM 455 O ASP A 30 14.580 -15.143 10.171 1.00 25.00 O ATOM 456 CB ASP A 30 14.475 -14.596 13.392 1.00 25.00 C ATOM 457 CG ASP A 30 14.266 -15.001 14.845 1.00 25.00 C ATOM 458 OD1 ASP A 30 13.561 -16.000 15.101 1.00 25.00 O ATOM 459 OD2 ASP A 30 14.807 -14.312 15.735 1.00 25.00 O ATOM 0 H ASP A 30 15.563 -16.750 12.754 1.00 25.00 H new ATOM 0 HA ASP A 30 12.856 -15.867 12.763 1.00 25.00 H new ATOM 0 HB2 ASP A 30 15.543 -14.517 13.191 1.00 25.00 H new ATOM 0 HB3 ASP A 30 14.047 -13.607 13.230 1.00 25.00 H new ATOM 464 N ILE A 31 12.709 -14.104 10.880 1.00 25.00 N ATOM 465 CA ILE A 31 12.480 -13.382 9.634 1.00 25.00 C ATOM 466 C ILE A 31 12.574 -11.891 9.902 1.00 25.00 C ATOM 467 O ILE A 31 11.894 -11.377 10.782 1.00 25.00 O ATOM 468 CB ILE A 31 11.065 -13.670 9.041 1.00 25.00 C ATOM 469 CG1 ILE A 31 10.879 -15.174 8.762 1.00 25.00 C ATOM 470 CG2 ILE A 31 10.843 -12.858 7.735 1.00 25.00 C ATOM 471 CD1 ILE A 31 11.907 -15.793 7.832 1.00 25.00 C ATOM 0 H ILE A 31 12.011 -13.922 11.601 1.00 25.00 H new ATOM 0 HA ILE A 31 13.234 -13.714 8.920 1.00 25.00 H new ATOM 0 HB ILE A 31 10.325 -13.361 9.779 1.00 25.00 H new ATOM 0 HG12 ILE A 31 10.904 -15.709 9.712 1.00 25.00 H new ATOM 0 HG13 ILE A 31 9.888 -15.328 8.335 1.00 25.00 H new ATOM 0 HG21 ILE A 31 9.851 -13.073 7.337 1.00 25.00 H new ATOM 0 HG22 ILE A 31 10.925 -11.793 7.951 1.00 25.00 H new ATOM 0 HG23 ILE A 31 11.597 -13.138 7.000 1.00 25.00 H new ATOM 0 HD11 ILE A 31 11.688 -16.853 7.701 1.00 25.00 H new ATOM 0 HD12 ILE A 31 11.871 -15.292 6.864 1.00 25.00 H new ATOM 0 HD13 ILE A 31 12.902 -15.679 8.262 1.00 25.00 H new ATOM 483 N MET A 32 13.381 -11.201 9.112 1.00 25.00 N ATOM 484 CA MET A 32 13.495 -9.750 9.200 1.00 25.00 C ATOM 485 C MET A 32 13.280 -9.147 7.829 1.00 25.00 C ATOM 486 O MET A 32 13.487 -9.806 6.801 1.00 25.00 O ATOM 487 CB MET A 32 14.858 -9.342 9.754 1.00 25.00 C ATOM 488 CG MET A 32 16.039 -9.913 9.007 1.00 25.00 C ATOM 489 SD MET A 32 17.331 -10.364 10.173 1.00 25.00 S ATOM 490 CE MET A 32 16.632 -11.906 10.899 1.00 25.00 C ATOM 0 H MET A 32 13.972 -11.625 8.397 1.00 25.00 H new ATOM 0 HA MET A 32 12.733 -9.377 9.884 1.00 25.00 H new ATOM 0 HB2 MET A 32 14.929 -8.254 9.742 1.00 25.00 H new ATOM 0 HB3 MET A 32 14.919 -9.654 10.797 1.00 25.00 H new ATOM 0 HG2 MET A 32 15.731 -10.788 8.434 1.00 25.00 H new ATOM 0 HG3 MET A 32 16.419 -9.182 8.293 1.00 25.00 H new ATOM 0 HE1 MET A 32 16.687 -11.854 11.986 1.00 25.00 H new ATOM 0 HE2 MET A 32 15.591 -12.013 10.593 1.00 25.00 H new ATOM 0 HE3 MET A 32 17.204 -12.765 10.548 1.00 25.00 H new ATOM 500 N THR A 33 12.837 -7.906 7.829 1.00 25.00 N ATOM 501 CA THR A 33 12.560 -7.174 6.596 1.00 25.00 C ATOM 502 C THR A 33 13.814 -6.440 6.155 1.00 25.00 C ATOM 503 O THR A 33 14.242 -5.522 6.826 1.00 25.00 O ATOM 504 CB THR A 33 11.438 -6.140 6.822 1.00 25.00 C ATOM 505 OG1 THR A 33 10.245 -6.822 7.223 1.00 25.00 O ATOM 506 CG2 THR A 33 11.143 -5.359 5.561 1.00 25.00 C ATOM 0 H THR A 33 12.657 -7.372 8.679 1.00 25.00 H new ATOM 0 HA THR A 33 12.246 -7.886 5.832 1.00 25.00 H new ATOM 0 HB THR A 33 11.770 -5.445 7.594 1.00 25.00 H new ATOM 0 HG1 THR A 33 9.529 -6.169 7.370 1.00 25.00 H new ATOM 0 HG21 THR A 33 10.348 -4.640 5.756 1.00 25.00 H new ATOM 0 HG22 THR A 33 12.041 -4.830 5.242 1.00 25.00 H new ATOM 0 HG23 THR A 33 10.827 -6.044 4.774 1.00 25.00 H new ATOM 514 N VAL A 34 14.404 -6.843 5.041 1.00 25.00 N ATOM 515 CA VAL A 34 15.608 -6.195 4.522 1.00 25.00 C ATOM 516 C VAL A 34 15.204 -4.918 3.823 1.00 25.00 C ATOM 517 O VAL A 34 14.395 -4.931 2.895 1.00 25.00 O ATOM 518 CB VAL A 34 16.364 -7.085 3.523 1.00 25.00 C ATOM 519 CG1 VAL A 34 17.687 -6.440 3.092 1.00 25.00 C ATOM 520 CG2 VAL A 34 16.624 -8.445 4.139 1.00 25.00 C ATOM 0 H VAL A 34 14.069 -7.621 4.472 1.00 25.00 H new ATOM 0 HA VAL A 34 16.273 -5.999 5.363 1.00 25.00 H new ATOM 0 HB VAL A 34 15.743 -7.202 2.635 1.00 25.00 H new ATOM 0 HG11 VAL A 34 18.198 -7.094 2.385 1.00 25.00 H new ATOM 0 HG12 VAL A 34 17.486 -5.480 2.617 1.00 25.00 H new ATOM 0 HG13 VAL A 34 18.319 -6.287 3.967 1.00 25.00 H new ATOM 0 HG21 VAL A 34 17.160 -9.071 3.426 1.00 25.00 H new ATOM 0 HG22 VAL A 34 17.224 -8.327 5.041 1.00 25.00 H new ATOM 0 HG23 VAL A 34 15.675 -8.916 4.394 1.00 25.00 H new ATOM 530 N LEU A 35 15.754 -3.815 4.288 1.00 25.00 N ATOM 531 CA LEU A 35 15.448 -2.506 3.757 1.00 25.00 C ATOM 532 C LEU A 35 16.486 -2.128 2.724 1.00 25.00 C ATOM 533 O LEU A 35 16.142 -1.681 1.644 1.00 25.00 O ATOM 534 CB LEU A 35 15.437 -1.496 4.892 1.00 25.00 C ATOM 535 CG LEU A 35 14.409 -1.810 5.987 1.00 25.00 C ATOM 536 CD1 LEU A 35 14.644 -0.883 7.130 1.00 25.00 C ATOM 537 CD2 LEU A 35 12.977 -1.680 5.484 1.00 25.00 C ATOM 0 H LEU A 35 16.431 -3.804 5.051 1.00 25.00 H new ATOM 0 HA LEU A 35 14.467 -2.516 3.282 1.00 25.00 H new ATOM 0 HB2 LEU A 35 16.430 -1.455 5.339 1.00 25.00 H new ATOM 0 HB3 LEU A 35 15.230 -0.507 4.484 1.00 25.00 H new ATOM 0 HG LEU A 35 14.537 -2.846 6.301 1.00 25.00 H new ATOM 0 HD11 LEU A 35 13.923 -1.090 7.920 1.00 25.00 H new ATOM 0 HD12 LEU A 35 15.654 -1.027 7.514 1.00 25.00 H new ATOM 0 HD13 LEU A 35 14.528 0.147 6.793 1.00 25.00 H new ATOM 0 HD21 LEU A 35 12.285 -1.912 6.293 1.00 25.00 H new ATOM 0 HD22 LEU A 35 12.804 -0.661 5.139 1.00 25.00 H new ATOM 0 HD23 LEU A 35 12.817 -2.375 4.659 1.00 25.00 H new ATOM 549 N GLU A 36 17.749 -2.386 3.014 1.00 25.00 N ATOM 550 CA GLU A 36 18.798 -2.213 2.011 1.00 25.00 C ATOM 551 C GLU A 36 19.963 -3.117 2.353 1.00 25.00 C ATOM 552 O GLU A 36 19.974 -3.747 3.405 1.00 25.00 O ATOM 553 CB GLU A 36 19.227 -0.740 1.871 1.00 25.00 C ATOM 554 CG GLU A 36 20.100 -0.179 2.920 1.00 25.00 C ATOM 555 CD GLU A 36 20.286 1.328 2.753 1.00 25.00 C ATOM 556 OE1 GLU A 36 19.831 1.883 1.729 1.00 25.00 O ATOM 557 OE2 GLU A 36 20.851 1.959 3.668 1.00 25.00 O ATOM 0 H GLU A 36 18.076 -2.713 3.923 1.00 25.00 H new ATOM 0 HA GLU A 36 18.405 -2.499 1.035 1.00 25.00 H new ATOM 0 HB2 GLU A 36 19.737 -0.628 0.914 1.00 25.00 H new ATOM 0 HB3 GLU A 36 18.325 -0.131 1.824 1.00 25.00 H new ATOM 0 HG2 GLU A 36 19.671 -0.386 3.900 1.00 25.00 H new ATOM 0 HG3 GLU A 36 21.072 -0.672 2.887 1.00 25.00 H new ATOM 564 N ARG A 37 20.935 -3.198 1.463 1.00 25.00 N ATOM 565 CA ARG A 37 22.117 -4.010 1.690 1.00 25.00 C ATOM 566 C ARG A 37 23.280 -3.083 1.547 1.00 25.00 C ATOM 567 O ARG A 37 23.167 -2.108 0.813 1.00 25.00 O ATOM 568 CB ARG A 37 22.267 -5.081 0.630 1.00 25.00 C ATOM 569 CG ARG A 37 21.108 -6.054 0.502 1.00 25.00 C ATOM 570 CD ARG A 37 21.513 -7.202 -0.423 1.00 25.00 C ATOM 571 NE ARG A 37 22.420 -6.728 -1.485 1.00 25.00 N ATOM 572 CZ ARG A 37 22.053 -6.213 -2.651 1.00 25.00 C ATOM 573 NH1 ARG A 37 20.796 -6.131 -3.025 1.00 25.00 N ATOM 574 NH2 ARG A 37 22.974 -5.754 -3.448 1.00 25.00 N ATOM 0 H ARG A 37 20.929 -2.707 0.569 1.00 25.00 H new ATOM 0 HA ARG A 37 22.052 -4.494 2.665 1.00 25.00 H new ATOM 0 HB2 ARG A 37 22.415 -4.593 -0.334 1.00 25.00 H new ATOM 0 HB3 ARG A 37 23.172 -5.650 0.841 1.00 25.00 H new ATOM 0 HG2 ARG A 37 20.833 -6.442 1.483 1.00 25.00 H new ATOM 0 HG3 ARG A 37 20.231 -5.543 0.104 1.00 25.00 H new ATOM 0 HD2 ARG A 37 22.002 -7.985 0.156 1.00 25.00 H new ATOM 0 HD3 ARG A 37 20.623 -7.645 -0.870 1.00 25.00 H new ATOM 0 HE ARG A 37 23.421 -6.803 -1.306 1.00 25.00 H new ATOM 0 HH11 ARG A 37 20.057 -6.471 -2.409 1.00 25.00 H new ATOM 0 HH12 ARG A 37 20.559 -5.727 -3.931 1.00 25.00 H new ATOM 0 HH21 ARG A 37 23.955 -5.795 -3.171 1.00 25.00 H new ATOM 0 HH22 ARG A 37 22.715 -5.354 -4.350 1.00 25.00 H new ATOM 588 N ASP A 38 24.382 -3.418 2.200 1.00 25.00 N ATOM 589 CA ASP A 38 25.645 -2.697 2.070 1.00 25.00 C ATOM 590 C ASP A 38 25.392 -1.234 2.469 1.00 25.00 C ATOM 591 O ASP A 38 25.899 -0.273 1.889 1.00 25.00 O ATOM 592 CB ASP A 38 26.196 -2.921 0.652 1.00 25.00 C ATOM 593 CG ASP A 38 26.130 -4.410 0.243 1.00 25.00 C ATOM 594 OD1 ASP A 38 25.439 -4.742 -0.764 1.00 25.00 O ATOM 595 OD2 ASP A 38 26.632 -5.268 1.020 1.00 25.00 O ATOM 0 H ASP A 38 24.428 -4.208 2.844 1.00 25.00 H new ATOM 0 HA ASP A 38 26.426 -3.060 2.738 1.00 25.00 H new ATOM 0 HB2 ASP A 38 25.626 -2.323 -0.059 1.00 25.00 H new ATOM 0 HB3 ASP A 38 27.229 -2.576 0.604 1.00 25.00 H new ATOM 600 N THR A 39 24.524 -1.114 3.468 1.00 25.00 N ATOM 601 CA THR A 39 24.037 0.165 3.982 1.00 25.00 C ATOM 602 C THR A 39 25.169 0.954 4.608 1.00 25.00 C ATOM 603 O THR A 39 26.073 0.373 5.173 1.00 25.00 O ATOM 604 CB THR A 39 22.923 -0.076 5.037 1.00 25.00 C ATOM 605 OG1 THR A 39 22.497 1.162 5.606 1.00 25.00 O ATOM 606 CG2 THR A 39 23.367 -1.000 6.138 1.00 25.00 C ATOM 0 H THR A 39 24.130 -1.919 3.955 1.00 25.00 H new ATOM 0 HA THR A 39 23.629 0.738 3.149 1.00 25.00 H new ATOM 0 HB THR A 39 22.093 -0.550 4.513 1.00 25.00 H new ATOM 0 HG1 THR A 39 21.722 1.500 5.111 1.00 25.00 H new ATOM 0 HG21 THR A 39 22.552 -1.136 6.849 1.00 25.00 H new ATOM 0 HG22 THR A 39 23.643 -1.965 5.714 1.00 25.00 H new ATOM 0 HG23 THR A 39 24.228 -0.569 6.650 1.00 25.00 H new ATOM 614 N GLN A 40 25.119 2.278 4.482 1.00 25.00 N ATOM 615 CA GLN A 40 26.153 3.194 5.006 1.00 25.00 C ATOM 616 C GLN A 40 27.549 2.926 4.421 1.00 25.00 C ATOM 617 O GLN A 40 28.545 3.446 4.902 1.00 25.00 O ATOM 618 CB GLN A 40 26.219 3.150 6.542 1.00 25.00 C ATOM 619 CG GLN A 40 24.870 3.004 7.224 1.00 25.00 C ATOM 620 CD GLN A 40 24.957 3.155 8.729 1.00 25.00 C ATOM 621 OE1 GLN A 40 26.028 3.194 9.300 1.00 25.00 O ATOM 622 NE2 GLN A 40 23.824 3.216 9.375 1.00 25.00 N ATOM 0 H GLN A 40 24.354 2.760 4.009 1.00 25.00 H new ATOM 0 HA GLN A 40 25.849 4.191 4.687 1.00 25.00 H new ATOM 0 HB2 GLN A 40 26.856 2.318 6.842 1.00 25.00 H new ATOM 0 HB3 GLN A 40 26.696 4.063 6.899 1.00 25.00 H new ATOM 0 HG2 GLN A 40 24.184 3.752 6.827 1.00 25.00 H new ATOM 0 HG3 GLN A 40 24.450 2.027 6.985 1.00 25.00 H new ATOM 0 HE21 GLN A 40 22.942 3.180 8.863 1.00 25.00 H new ATOM 0 HE22 GLN A 40 23.820 3.299 10.392 1.00 25.00 H new ATOM 631 N GLY A 41 27.604 2.095 3.389 1.00 25.00 N ATOM 632 CA GLY A 41 28.874 1.700 2.798 1.00 25.00 C ATOM 633 C GLY A 41 29.519 0.572 3.586 1.00 25.00 C ATOM 634 O GLY A 41 30.700 0.278 3.419 1.00 25.00 O ATOM 0 H GLY A 41 26.784 1.682 2.944 1.00 25.00 H new ATOM 0 HA2 GLY A 41 28.716 1.383 1.767 1.00 25.00 H new ATOM 0 HA3 GLY A 41 29.547 2.557 2.768 1.00 25.00 H new ATOM 638 N LEU A 42 28.747 -0.058 4.459 1.00 25.00 N ATOM 639 CA LEU A 42 29.230 -1.155 5.270 1.00 25.00 C ATOM 640 C LEU A 42 29.021 -2.430 4.470 1.00 25.00 C ATOM 641 O LEU A 42 27.968 -3.057 4.539 1.00 25.00 O ATOM 642 CB LEU A 42 28.451 -1.207 6.584 1.00 25.00 C ATOM 643 CG LEU A 42 28.503 0.055 7.447 1.00 25.00 C ATOM 644 CD1 LEU A 42 27.440 -0.036 8.524 1.00 25.00 C ATOM 645 CD2 LEU A 42 29.855 0.226 8.082 1.00 25.00 C ATOM 0 H LEU A 42 27.769 0.180 4.622 1.00 25.00 H new ATOM 0 HA LEU A 42 30.285 -1.031 5.514 1.00 25.00 H new ATOM 0 HB2 LEU A 42 27.407 -1.424 6.356 1.00 25.00 H new ATOM 0 HB3 LEU A 42 28.829 -2.042 7.174 1.00 25.00 H new ATOM 0 HG LEU A 42 28.319 0.920 6.809 1.00 25.00 H new ATOM 0 HD11 LEU A 42 27.472 0.861 9.143 1.00 25.00 H new ATOM 0 HD12 LEU A 42 26.458 -0.122 8.059 1.00 25.00 H new ATOM 0 HD13 LEU A 42 27.625 -0.912 9.145 1.00 25.00 H new ATOM 0 HD21 LEU A 42 29.860 1.131 8.689 1.00 25.00 H new ATOM 0 HD22 LEU A 42 30.072 -0.635 8.714 1.00 25.00 H new ATOM 0 HD23 LEU A 42 30.615 0.306 7.304 1.00 25.00 H new ATOM 657 N ASP A 43 30.010 -2.780 3.669 1.00 25.00 N ATOM 658 CA ASP A 43 29.909 -3.950 2.797 1.00 25.00 C ATOM 659 C ASP A 43 29.572 -5.197 3.600 1.00 25.00 C ATOM 660 O ASP A 43 30.216 -5.512 4.605 1.00 25.00 O ATOM 661 CB ASP A 43 31.217 -4.191 2.047 1.00 25.00 C ATOM 662 CG ASP A 43 31.365 -3.313 0.816 1.00 25.00 C ATOM 663 OD1 ASP A 43 32.471 -2.782 0.591 1.00 25.00 O ATOM 664 OD2 ASP A 43 30.391 -3.210 0.037 1.00 25.00 O ATOM 0 H ASP A 43 30.894 -2.276 3.599 1.00 25.00 H new ATOM 0 HA ASP A 43 29.112 -3.749 2.081 1.00 25.00 H new ATOM 0 HB2 ASP A 43 32.055 -4.008 2.720 1.00 25.00 H new ATOM 0 HB3 ASP A 43 31.271 -5.238 1.749 1.00 25.00 H new ATOM 669 N GLY A 44 28.544 -5.909 3.161 1.00 25.00 N ATOM 670 CA GLY A 44 28.138 -7.127 3.836 1.00 25.00 C ATOM 671 C GLY A 44 27.139 -6.914 4.957 1.00 25.00 C ATOM 672 O GLY A 44 26.506 -7.877 5.385 1.00 25.00 O ATOM 0 H GLY A 44 27.981 -5.664 2.346 1.00 25.00 H new ATOM 0 HA2 GLY A 44 27.705 -7.808 3.103 1.00 25.00 H new ATOM 0 HA3 GLY A 44 29.023 -7.616 4.242 1.00 25.00 H new ATOM 676 N TRP A 45 26.961 -5.688 5.428 1.00 25.00 N ATOM 677 CA TRP A 45 25.977 -5.399 6.455 1.00 25.00 C ATOM 678 C TRP A 45 24.670 -5.035 5.765 1.00 25.00 C ATOM 679 O TRP A 45 24.646 -4.222 4.854 1.00 25.00 O ATOM 680 CB TRP A 45 26.483 -4.231 7.288 1.00 25.00 C ATOM 681 CG TRP A 45 27.562 -4.635 8.253 1.00 25.00 C ATOM 682 CD1 TRP A 45 28.891 -4.382 8.161 1.00 25.00 C ATOM 683 CD2 TRP A 45 27.399 -5.376 9.474 1.00 25.00 C ATOM 684 NE1 TRP A 45 29.574 -4.875 9.229 1.00 25.00 N ATOM 685 CE2 TRP A 45 28.690 -5.505 10.063 1.00 25.00 C ATOM 686 CE3 TRP A 45 26.293 -5.932 10.137 1.00 25.00 C ATOM 687 CZ2 TRP A 45 28.893 -6.172 11.288 1.00 25.00 C ATOM 688 CZ3 TRP A 45 26.488 -6.588 11.372 1.00 25.00 C ATOM 689 CH2 TRP A 45 27.786 -6.707 11.932 1.00 25.00 C ATOM 0 H TRP A 45 27.490 -4.875 5.112 1.00 25.00 H new ATOM 0 HA TRP A 45 25.816 -6.258 7.107 1.00 25.00 H new ATOM 0 HB2 TRP A 45 26.865 -3.455 6.625 1.00 25.00 H new ATOM 0 HB3 TRP A 45 25.650 -3.796 7.841 1.00 25.00 H new ATOM 0 HD1 TRP A 45 29.351 -3.853 7.339 1.00 25.00 H new ATOM 0 HE1 TRP A 45 30.579 -4.789 9.383 1.00 25.00 H new ATOM 0 HE3 TRP A 45 25.305 -5.859 9.707 1.00 25.00 H new ATOM 0 HZ2 TRP A 45 29.881 -6.264 11.713 1.00 25.00 H new ATOM 0 HZ3 TRP A 45 25.640 -7.004 11.896 1.00 25.00 H new ATOM 0 HH2 TRP A 45 27.915 -7.221 12.873 1.00 25.00 H new ATOM 700 N TRP A 46 23.577 -5.655 6.170 1.00 25.00 N ATOM 701 CA TRP A 46 22.280 -5.413 5.538 1.00 25.00 C ATOM 702 C TRP A 46 21.367 -4.725 6.535 1.00 25.00 C ATOM 703 O TRP A 46 21.204 -5.196 7.653 1.00 25.00 O ATOM 704 CB TRP A 46 21.653 -6.736 5.065 1.00 25.00 C ATOM 705 CG TRP A 46 22.453 -7.446 3.978 1.00 25.00 C ATOM 706 CD1 TRP A 46 23.609 -7.027 3.394 1.00 25.00 C ATOM 707 CD2 TRP A 46 22.154 -8.713 3.350 1.00 25.00 C ATOM 708 NE1 TRP A 46 24.060 -7.912 2.466 1.00 25.00 N ATOM 709 CE2 TRP A 46 23.199 -8.971 2.409 1.00 25.00 C ATOM 710 CE3 TRP A 46 21.114 -9.661 3.484 1.00 25.00 C ATOM 711 CZ2 TRP A 46 23.224 -10.132 1.611 1.00 25.00 C ATOM 712 CZ3 TRP A 46 21.154 -10.839 2.699 1.00 25.00 C ATOM 713 CH2 TRP A 46 22.203 -11.055 1.763 1.00 25.00 C ATOM 0 H TRP A 46 23.555 -6.331 6.933 1.00 25.00 H new ATOM 0 HA TRP A 46 22.417 -4.775 4.665 1.00 25.00 H new ATOM 0 HB2 TRP A 46 21.549 -7.404 5.920 1.00 25.00 H new ATOM 0 HB3 TRP A 46 20.648 -6.537 4.692 1.00 25.00 H new ATOM 0 HD1 TRP A 46 24.109 -6.101 3.639 1.00 25.00 H new ATOM 0 HE1 TRP A 46 24.904 -7.803 1.904 1.00 25.00 H new ATOM 0 HE3 TRP A 46 20.301 -9.490 4.174 1.00 25.00 H new ATOM 0 HZ2 TRP A 46 24.019 -10.298 0.899 1.00 25.00 H new ATOM 0 HZ3 TRP A 46 20.379 -11.582 2.812 1.00 25.00 H new ATOM 0 HH2 TRP A 46 22.203 -11.952 1.162 1.00 25.00 H new ATOM 724 N LEU A 47 20.784 -3.607 6.133 1.00 25.00 N ATOM 725 CA LEU A 47 19.856 -2.879 6.984 1.00 25.00 C ATOM 726 C LEU A 47 18.565 -3.647 6.980 1.00 25.00 C ATOM 727 O LEU A 47 17.961 -3.833 5.929 1.00 25.00 O ATOM 728 CB LEU A 47 19.600 -1.480 6.427 1.00 25.00 C ATOM 729 CG LEU A 47 18.603 -0.604 7.198 1.00 25.00 C ATOM 730 CD1 LEU A 47 19.040 -0.381 8.635 1.00 25.00 C ATOM 731 CD2 LEU A 47 18.439 0.733 6.483 1.00 25.00 C ATOM 0 H LEU A 47 20.938 -3.182 5.218 1.00 25.00 H new ATOM 0 HA LEU A 47 20.266 -2.778 7.989 1.00 25.00 H new ATOM 0 HB2 LEU A 47 20.553 -0.952 6.381 1.00 25.00 H new ATOM 0 HB3 LEU A 47 19.242 -1.582 5.402 1.00 25.00 H new ATOM 0 HG LEU A 47 17.647 -1.126 7.227 1.00 25.00 H new ATOM 0 HD11 LEU A 47 18.307 0.244 9.145 1.00 25.00 H new ATOM 0 HD12 LEU A 47 19.117 -1.341 9.145 1.00 25.00 H new ATOM 0 HD13 LEU A 47 20.011 0.115 8.647 1.00 25.00 H new ATOM 0 HD21 LEU A 47 17.731 1.354 7.031 1.00 25.00 H new ATOM 0 HD22 LEU A 47 19.403 1.239 6.433 1.00 25.00 H new ATOM 0 HD23 LEU A 47 18.066 0.562 5.473 1.00 25.00 H new ATOM 743 N CYS A 48 18.137 -4.106 8.138 1.00 25.00 N ATOM 744 CA CYS A 48 16.893 -4.837 8.245 1.00 25.00 C ATOM 745 C CYS A 48 16.076 -4.298 9.392 1.00 25.00 C ATOM 746 O CYS A 48 16.561 -3.506 10.196 1.00 25.00 O ATOM 747 CB CYS A 48 17.162 -6.335 8.442 1.00 25.00 C ATOM 748 SG CYS A 48 18.384 -7.012 7.292 1.00 25.00 S ATOM 0 H CYS A 48 18.634 -3.985 9.020 1.00 25.00 H new ATOM 0 HA CYS A 48 16.333 -4.708 7.319 1.00 25.00 H new ATOM 0 HB2 CYS A 48 17.505 -6.502 9.463 1.00 25.00 H new ATOM 0 HB3 CYS A 48 16.226 -6.881 8.327 1.00 25.00 H new ATOM 0 HG CYS A 48 19.518 -6.397 7.452 1.00 25.00 H new ATOM 754 N SER A 49 14.835 -4.742 9.463 1.00 25.00 N ATOM 755 CA SER A 49 13.945 -4.381 10.544 1.00 25.00 C ATOM 756 C SER A 49 13.381 -5.670 11.127 1.00 25.00 C ATOM 757 O SER A 49 12.946 -6.565 10.394 1.00 25.00 O ATOM 758 CB SER A 49 12.856 -3.441 10.028 1.00 25.00 C ATOM 759 OG SER A 49 11.577 -4.049 10.022 1.00 25.00 O ATOM 0 H SER A 49 14.418 -5.364 8.770 1.00 25.00 H new ATOM 0 HA SER A 49 14.470 -3.841 11.332 1.00 25.00 H new ATOM 0 HB2 SER A 49 12.827 -2.546 10.650 1.00 25.00 H new ATOM 0 HB3 SER A 49 13.107 -3.119 9.017 1.00 25.00 H new ATOM 0 HG SER A 49 10.913 -3.411 9.686 1.00 25.00 H new ATOM 765 N LEU A 50 13.473 -5.796 12.440 1.00 25.00 N ATOM 766 CA LEU A 50 13.043 -6.987 13.165 1.00 25.00 C ATOM 767 C LEU A 50 12.438 -6.509 14.470 1.00 25.00 C ATOM 768 O LEU A 50 13.005 -5.638 15.118 1.00 25.00 O ATOM 769 CB LEU A 50 14.251 -7.879 13.460 1.00 25.00 C ATOM 770 CG LEU A 50 13.937 -9.177 14.213 1.00 25.00 C ATOM 771 CD1 LEU A 50 13.984 -10.352 13.291 1.00 25.00 C ATOM 772 CD2 LEU A 50 14.920 -9.349 15.352 1.00 25.00 C ATOM 0 H LEU A 50 13.853 -5.066 13.043 1.00 25.00 H new ATOM 0 HA LEU A 50 12.325 -7.562 12.581 1.00 25.00 H new ATOM 0 HB2 LEU A 50 14.734 -8.133 12.516 1.00 25.00 H new ATOM 0 HB3 LEU A 50 14.972 -7.305 14.042 1.00 25.00 H new ATOM 0 HG LEU A 50 12.927 -9.116 14.619 1.00 25.00 H new ATOM 0 HD11 LEU A 50 13.758 -11.261 13.848 1.00 25.00 H new ATOM 0 HD12 LEU A 50 13.249 -10.221 12.497 1.00 25.00 H new ATOM 0 HD13 LEU A 50 14.979 -10.432 12.854 1.00 25.00 H new ATOM 0 HD21 LEU A 50 14.698 -10.272 15.888 1.00 25.00 H new ATOM 0 HD22 LEU A 50 15.934 -9.396 14.954 1.00 25.00 H new ATOM 0 HD23 LEU A 50 14.837 -8.504 16.035 1.00 25.00 H new ATOM 784 N HIS A 51 11.264 -7.030 14.816 1.00 25.00 N ATOM 785 CA HIS A 51 10.538 -6.635 16.038 1.00 25.00 C ATOM 786 C HIS A 51 10.282 -5.116 16.093 1.00 25.00 C ATOM 787 O HIS A 51 10.174 -4.535 17.163 1.00 25.00 O ATOM 788 CB HIS A 51 11.309 -7.069 17.303 1.00 25.00 C ATOM 789 CG HIS A 51 11.635 -8.531 17.348 1.00 25.00 C ATOM 790 ND1 HIS A 51 12.662 -9.070 18.082 1.00 25.00 N ATOM 791 CD2 HIS A 51 11.047 -9.597 16.735 1.00 25.00 C ATOM 792 CE1 HIS A 51 12.662 -10.387 17.899 1.00 25.00 C ATOM 793 NE2 HIS A 51 11.696 -10.763 17.087 1.00 25.00 N ATOM 0 H HIS A 51 10.782 -7.739 14.263 1.00 25.00 H new ATOM 0 HA HIS A 51 9.575 -7.144 16.007 1.00 25.00 H new ATOM 0 HB2 HIS A 51 12.236 -6.499 17.364 1.00 25.00 H new ATOM 0 HB3 HIS A 51 10.718 -6.812 18.182 1.00 25.00 H new ATOM 0 HD2 HIS A 51 10.197 -9.538 16.071 1.00 25.00 H new ATOM 0 HE1 HIS A 51 13.367 -11.064 18.359 1.00 25.00 H new ATOM 0 HE2 HIS A 51 11.475 -11.711 16.784 1.00 25.00 H new ATOM 801 N GLY A 52 10.200 -4.479 14.930 1.00 25.00 N ATOM 802 CA GLY A 52 9.979 -3.038 14.876 1.00 25.00 C ATOM 803 C GLY A 52 11.226 -2.201 15.142 1.00 25.00 C ATOM 804 O GLY A 52 11.144 -0.980 15.241 1.00 25.00 O ATOM 0 H GLY A 52 10.282 -4.932 14.020 1.00 25.00 H new ATOM 0 HA2 GLY A 52 9.585 -2.779 13.893 1.00 25.00 H new ATOM 0 HA3 GLY A 52 9.215 -2.772 15.606 1.00 25.00 H new ATOM 808 N ARG A 53 12.384 -2.842 15.245 1.00 25.00 N ATOM 809 CA ARG A 53 13.646 -2.155 15.478 1.00 25.00 C ATOM 810 C ARG A 53 14.441 -2.312 14.199 1.00 25.00 C ATOM 811 O ARG A 53 14.457 -3.381 13.611 1.00 25.00 O ATOM 812 CB ARG A 53 14.395 -2.806 16.658 1.00 25.00 C ATOM 813 CG ARG A 53 15.160 -1.833 17.577 1.00 25.00 C ATOM 814 CD ARG A 53 16.311 -1.135 16.846 1.00 25.00 C ATOM 815 NE ARG A 53 17.226 -0.404 17.741 1.00 25.00 N ATOM 816 CZ ARG A 53 17.067 0.849 18.158 1.00 25.00 C ATOM 817 NH1 ARG A 53 16.017 1.571 17.844 1.00 25.00 N ATOM 818 NH2 ARG A 53 17.989 1.388 18.904 1.00 25.00 N ATOM 0 H ARG A 53 12.473 -3.855 15.169 1.00 25.00 H new ATOM 0 HA ARG A 53 13.495 -1.105 15.730 1.00 25.00 H new ATOM 0 HB2 ARG A 53 13.675 -3.358 17.262 1.00 25.00 H new ATOM 0 HB3 ARG A 53 15.102 -3.534 16.260 1.00 25.00 H new ATOM 0 HG2 ARG A 53 14.470 -1.084 17.965 1.00 25.00 H new ATOM 0 HG3 ARG A 53 15.554 -2.379 18.435 1.00 25.00 H new ATOM 0 HD2 ARG A 53 16.880 -1.879 16.289 1.00 25.00 H new ATOM 0 HD3 ARG A 53 15.897 -0.439 16.117 1.00 25.00 H new ATOM 0 HE ARG A 53 18.053 -0.902 18.069 1.00 25.00 H new ATOM 0 HH11 ARG A 53 15.282 1.175 17.258 1.00 25.00 H new ATOM 0 HH12 ARG A 53 15.936 2.529 18.186 1.00 25.00 H new ATOM 0 HH21 ARG A 53 18.817 0.850 19.160 1.00 25.00 H new ATOM 0 HH22 ARG A 53 17.883 2.348 19.232 1.00 25.00 H new ATOM 832 N GLN A 54 15.080 -1.245 13.769 1.00 25.00 N ATOM 833 CA GLN A 54 15.910 -1.267 12.577 1.00 25.00 C ATOM 834 C GLN A 54 17.370 -1.359 12.982 1.00 25.00 C ATOM 835 O GLN A 54 17.754 -0.808 14.008 1.00 25.00 O ATOM 836 CB GLN A 54 15.692 0.017 11.785 1.00 25.00 C ATOM 837 CG GLN A 54 14.910 -0.185 10.530 1.00 25.00 C ATOM 838 CD GLN A 54 14.662 1.117 9.796 1.00 25.00 C ATOM 839 OE1 GLN A 54 13.542 1.587 9.719 1.00 25.00 O ATOM 840 NE2 GLN A 54 15.705 1.706 9.268 1.00 25.00 N ATOM 0 H GLN A 54 15.041 -0.338 14.233 1.00 25.00 H new ATOM 0 HA GLN A 54 15.643 -2.128 11.964 1.00 25.00 H new ATOM 0 HB2 GLN A 54 15.173 0.740 12.415 1.00 25.00 H new ATOM 0 HB3 GLN A 54 16.661 0.449 11.535 1.00 25.00 H new ATOM 0 HG2 GLN A 54 15.446 -0.873 9.876 1.00 25.00 H new ATOM 0 HG3 GLN A 54 13.955 -0.653 10.770 1.00 25.00 H new ATOM 0 HE21 GLN A 54 16.628 1.281 9.353 1.00 25.00 H new ATOM 0 HE22 GLN A 54 15.594 2.590 8.771 1.00 25.00 H new ATOM 849 N GLY A 55 18.175 -2.029 12.173 1.00 25.00 N ATOM 850 CA GLY A 55 19.597 -2.137 12.449 1.00 25.00 C ATOM 851 C GLY A 55 20.304 -2.954 11.387 1.00 25.00 C ATOM 852 O GLY A 55 19.652 -3.501 10.493 1.00 25.00 O ATOM 0 H GLY A 55 17.869 -2.504 11.324 1.00 25.00 H new ATOM 0 HA2 GLY A 55 20.037 -1.141 12.497 1.00 25.00 H new ATOM 0 HA3 GLY A 55 19.746 -2.599 13.425 1.00 25.00 H new ATOM 856 N ILE A 56 21.625 -3.024 11.461 1.00 25.00 N ATOM 857 CA ILE A 56 22.417 -3.775 10.491 1.00 25.00 C ATOM 858 C ILE A 56 22.506 -5.238 10.911 1.00 25.00 C ATOM 859 O ILE A 56 22.332 -5.586 12.080 1.00 25.00 O ATOM 860 CB ILE A 56 23.842 -3.163 10.317 1.00 25.00 C ATOM 861 CG1 ILE A 56 24.645 -3.279 11.632 1.00 25.00 C ATOM 862 CG2 ILE A 56 23.709 -1.686 9.907 1.00 25.00 C ATOM 863 CD1 ILE A 56 26.049 -2.699 11.572 1.00 25.00 C ATOM 0 H ILE A 56 22.177 -2.567 12.187 1.00 25.00 H new ATOM 0 HA ILE A 56 21.916 -3.713 9.525 1.00 25.00 H new ATOM 0 HB ILE A 56 24.377 -3.712 9.542 1.00 25.00 H new ATOM 0 HG12 ILE A 56 24.092 -2.776 12.425 1.00 25.00 H new ATOM 0 HG13 ILE A 56 24.713 -4.331 11.909 1.00 25.00 H new ATOM 0 HG21 ILE A 56 24.701 -1.252 9.784 1.00 25.00 H new ATOM 0 HG22 ILE A 56 23.163 -1.617 8.966 1.00 25.00 H new ATOM 0 HG23 ILE A 56 23.168 -1.141 10.681 1.00 25.00 H new ATOM 0 HD11 ILE A 56 26.536 -2.825 12.539 1.00 25.00 H new ATOM 0 HD12 ILE A 56 26.624 -3.217 10.805 1.00 25.00 H new ATOM 0 HD13 ILE A 56 25.994 -1.638 11.329 1.00 25.00 H new ATOM 875 N VAL A 57 22.724 -6.096 9.929 1.00 25.00 N ATOM 876 CA VAL A 57 22.815 -7.541 10.138 1.00 25.00 C ATOM 877 C VAL A 57 23.902 -8.088 9.225 1.00 25.00 C ATOM 878 O VAL A 57 23.989 -7.678 8.068 1.00 25.00 O ATOM 879 CB VAL A 57 21.484 -8.235 9.742 1.00 25.00 C ATOM 880 CG1 VAL A 57 21.576 -9.728 9.866 1.00 25.00 C ATOM 881 CG2 VAL A 57 20.327 -7.689 10.572 1.00 25.00 C ATOM 0 H VAL A 57 22.844 -5.813 8.956 1.00 25.00 H new ATOM 0 HA VAL A 57 23.031 -7.732 11.189 1.00 25.00 H new ATOM 0 HB VAL A 57 21.294 -8.009 8.693 1.00 25.00 H new ATOM 0 HG11 VAL A 57 20.624 -10.176 9.580 1.00 25.00 H new ATOM 0 HG12 VAL A 57 22.364 -10.100 9.211 1.00 25.00 H new ATOM 0 HG13 VAL A 57 21.807 -9.994 10.898 1.00 25.00 H new ATOM 0 HG21 VAL A 57 19.403 -8.188 10.280 1.00 25.00 H new ATOM 0 HG22 VAL A 57 20.520 -7.872 11.629 1.00 25.00 H new ATOM 0 HG23 VAL A 57 20.231 -6.617 10.401 1.00 25.00 H new ATOM 891 N PRO A 58 24.726 -9.032 9.703 1.00 25.00 N ATOM 892 CA PRO A 58 25.703 -9.606 8.776 1.00 25.00 C ATOM 893 C PRO A 58 25.013 -10.469 7.711 1.00 25.00 C ATOM 894 O PRO A 58 24.358 -11.469 8.025 1.00 25.00 O ATOM 895 CB PRO A 58 26.598 -10.439 9.702 1.00 25.00 C ATOM 896 CG PRO A 58 25.706 -10.829 10.829 1.00 25.00 C ATOM 897 CD PRO A 58 24.801 -9.652 11.036 1.00 25.00 C ATOM 0 HA PRO A 58 26.260 -8.861 8.209 1.00 25.00 H new ATOM 0 HB2 PRO A 58 26.995 -11.315 9.188 1.00 25.00 H new ATOM 0 HB3 PRO A 58 27.453 -9.861 10.054 1.00 25.00 H new ATOM 0 HG2 PRO A 58 25.136 -11.727 10.589 1.00 25.00 H new ATOM 0 HG3 PRO A 58 26.281 -11.048 11.729 1.00 25.00 H new ATOM 0 HD2 PRO A 58 23.817 -9.960 11.390 1.00 25.00 H new ATOM 0 HD3 PRO A 58 25.205 -8.962 11.777 1.00 25.00 H new ATOM 905 N GLY A 59 25.169 -10.094 6.449 1.00 25.00 N ATOM 906 CA GLY A 59 24.547 -10.824 5.350 1.00 25.00 C ATOM 907 C GLY A 59 25.041 -12.251 5.264 1.00 25.00 C ATOM 908 O GLY A 59 24.358 -13.134 4.761 1.00 25.00 O ATOM 0 H GLY A 59 25.722 -9.287 6.159 1.00 25.00 H new ATOM 0 HA2 GLY A 59 23.465 -10.823 5.481 1.00 25.00 H new ATOM 0 HA3 GLY A 59 24.755 -10.311 4.411 1.00 25.00 H new ATOM 912 N ASN A 60 26.212 -12.487 5.839 1.00 25.00 N ATOM 913 CA ASN A 60 26.814 -13.821 5.910 1.00 25.00 C ATOM 914 C ASN A 60 25.944 -14.818 6.702 1.00 25.00 C ATOM 915 O ASN A 60 26.114 -16.027 6.599 1.00 25.00 O ATOM 916 CB ASN A 60 28.192 -13.695 6.579 1.00 25.00 C ATOM 917 CG ASN A 60 29.180 -14.731 6.089 1.00 25.00 C ATOM 918 OD1 ASN A 60 28.883 -15.544 5.234 1.00 25.00 O ATOM 919 ND2 ASN A 60 30.374 -14.679 6.610 1.00 25.00 N ATOM 0 H ASN A 60 26.778 -11.758 6.273 1.00 25.00 H new ATOM 0 HA ASN A 60 26.902 -14.211 4.896 1.00 25.00 H new ATOM 0 HB2 ASN A 60 28.593 -12.699 6.389 1.00 25.00 H new ATOM 0 HB3 ASN A 60 28.077 -13.792 7.659 1.00 25.00 H new ATOM 0 HD21 ASN A 60 31.094 -15.333 6.302 1.00 25.00 H new ATOM 0 HD22 ASN A 60 30.589 -13.984 7.325 1.00 25.00 H new ATOM 926 N ARG A 61 25.012 -14.304 7.501 1.00 25.00 N ATOM 927 CA ARG A 61 24.126 -15.147 8.309 1.00 25.00 C ATOM 928 C ARG A 61 22.670 -15.022 7.871 1.00 25.00 C ATOM 929 O ARG A 61 21.769 -15.523 8.552 1.00 25.00 O ATOM 930 CB ARG A 61 24.263 -14.768 9.790 1.00 25.00 C ATOM 931 CG ARG A 61 25.680 -14.949 10.330 1.00 25.00 C ATOM 932 CD ARG A 61 25.738 -14.693 11.820 1.00 25.00 C ATOM 933 NE ARG A 61 27.102 -14.897 12.339 1.00 25.00 N ATOM 934 CZ ARG A 61 27.454 -14.831 13.618 1.00 25.00 C ATOM 935 NH1 ARG A 61 26.601 -14.572 14.573 1.00 25.00 N ATOM 936 NH2 ARG A 61 28.701 -15.042 13.933 1.00 25.00 N ATOM 0 H ARG A 61 24.848 -13.303 7.608 1.00 25.00 H new ATOM 0 HA ARG A 61 24.425 -16.185 8.164 1.00 25.00 H new ATOM 0 HB2 ARG A 61 23.961 -13.729 9.922 1.00 25.00 H new ATOM 0 HB3 ARG A 61 23.577 -15.376 10.379 1.00 25.00 H new ATOM 0 HG2 ARG A 61 26.025 -15.961 10.119 1.00 25.00 H new ATOM 0 HG3 ARG A 61 26.357 -14.268 9.815 1.00 25.00 H new ATOM 0 HD2 ARG A 61 25.414 -13.674 12.030 1.00 25.00 H new ATOM 0 HD3 ARG A 61 25.046 -15.360 12.334 1.00 25.00 H new ATOM 0 HE ARG A 61 27.835 -15.106 11.661 1.00 25.00 H new ATOM 0 HH11 ARG A 61 25.619 -14.411 14.350 1.00 25.00 H new ATOM 0 HH12 ARG A 61 26.917 -14.531 15.542 1.00 25.00 H new ATOM 0 HH21 ARG A 61 29.383 -15.252 13.204 1.00 25.00 H new ATOM 0 HH22 ARG A 61 28.995 -14.997 14.909 1.00 25.00 H new ATOM 950 N LEU A 62 22.435 -14.377 6.734 1.00 25.00 N ATOM 951 CA LEU A 62 21.078 -14.181 6.224 1.00 25.00 C ATOM 952 C LEU A 62 20.860 -14.758 4.845 1.00 25.00 C ATOM 953 O LEU A 62 21.757 -14.813 4.015 1.00 25.00 O ATOM 954 CB LEU A 62 20.751 -12.692 6.137 1.00 25.00 C ATOM 955 CG LEU A 62 19.992 -12.096 7.320 1.00 25.00 C ATOM 956 CD1 LEU A 62 19.738 -10.632 7.016 1.00 25.00 C ATOM 957 CD2 LEU A 62 18.669 -12.793 7.605 1.00 25.00 C ATOM 0 H LEU A 62 23.167 -13.979 6.145 1.00 25.00 H new ATOM 0 HA LEU A 62 20.431 -14.703 6.930 1.00 25.00 H new ATOM 0 HB2 LEU A 62 21.685 -12.143 6.018 1.00 25.00 H new ATOM 0 HB3 LEU A 62 20.165 -12.523 5.234 1.00 25.00 H new ATOM 0 HG LEU A 62 20.603 -12.229 8.213 1.00 25.00 H new ATOM 0 HD11 LEU A 62 19.196 -10.177 7.845 1.00 25.00 H new ATOM 0 HD12 LEU A 62 20.690 -10.118 6.879 1.00 25.00 H new ATOM 0 HD13 LEU A 62 19.146 -10.547 6.105 1.00 25.00 H new ATOM 0 HD21 LEU A 62 18.184 -12.318 8.458 1.00 25.00 H new ATOM 0 HD22 LEU A 62 18.022 -12.717 6.731 1.00 25.00 H new ATOM 0 HD23 LEU A 62 18.852 -13.843 7.831 1.00 25.00 H new ATOM 969 N LYS A 63 19.618 -15.136 4.594 1.00 25.00 N ATOM 970 CA LYS A 63 19.205 -15.608 3.273 1.00 25.00 C ATOM 971 C LYS A 63 17.972 -14.874 2.818 1.00 25.00 C ATOM 972 O LYS A 63 16.926 -14.958 3.449 1.00 25.00 O ATOM 973 CB LYS A 63 18.919 -17.111 3.294 1.00 25.00 C ATOM 974 CG LYS A 63 18.368 -17.648 1.967 1.00 25.00 C ATOM 975 CD LYS A 63 18.362 -19.172 1.910 1.00 25.00 C ATOM 976 CE LYS A 63 17.378 -19.794 2.902 1.00 25.00 C ATOM 977 NZ LYS A 63 17.481 -21.301 2.871 1.00 25.00 N ATOM 0 H LYS A 63 18.871 -15.127 5.288 1.00 25.00 H new ATOM 0 HA LYS A 63 20.022 -15.414 2.578 1.00 25.00 H new ATOM 0 HB2 LYS A 63 19.838 -17.644 3.539 1.00 25.00 H new ATOM 0 HB3 LYS A 63 18.204 -17.326 4.088 1.00 25.00 H new ATOM 0 HG2 LYS A 63 17.353 -17.278 1.823 1.00 25.00 H new ATOM 0 HG3 LYS A 63 18.968 -17.259 1.144 1.00 25.00 H new ATOM 0 HD2 LYS A 63 18.106 -19.493 0.900 1.00 25.00 H new ATOM 0 HD3 LYS A 63 19.365 -19.544 2.118 1.00 25.00 H new ATOM 0 HE2 LYS A 63 17.586 -19.429 3.908 1.00 25.00 H new ATOM 0 HE3 LYS A 63 16.361 -19.487 2.656 1.00 25.00 H new ATOM 0 HZ1 LYS A 63 16.807 -21.709 3.550 1.00 25.00 H new ATOM 0 HZ2 LYS A 63 17.260 -21.644 1.915 1.00 25.00 H new ATOM 0 HZ3 LYS A 63 18.447 -21.588 3.127 1.00 25.00 H new ATOM 991 N ILE A 64 18.096 -14.186 1.696 1.00 25.00 N ATOM 992 CA ILE A 64 16.977 -13.468 1.105 1.00 25.00 C ATOM 993 C ILE A 64 15.959 -14.482 0.600 1.00 25.00 C ATOM 994 O ILE A 64 16.296 -15.398 -0.155 1.00 25.00 O ATOM 995 CB ILE A 64 17.437 -12.595 -0.095 1.00 25.00 C ATOM 996 CG1 ILE A 64 18.559 -11.618 0.312 1.00 25.00 C ATOM 997 CG2 ILE A 64 16.266 -11.809 -0.656 1.00 25.00 C ATOM 998 CD1 ILE A 64 18.162 -10.521 1.326 1.00 25.00 C ATOM 0 H ILE A 64 18.967 -14.109 1.172 1.00 25.00 H new ATOM 0 HA ILE A 64 16.545 -12.817 1.865 1.00 25.00 H new ATOM 0 HB ILE A 64 17.826 -13.269 -0.858 1.00 25.00 H new ATOM 0 HG12 ILE A 64 19.382 -12.195 0.734 1.00 25.00 H new ATOM 0 HG13 ILE A 64 18.938 -11.134 -0.588 1.00 25.00 H new ATOM 0 HG21 ILE A 64 16.604 -11.202 -1.496 1.00 25.00 H new ATOM 0 HG22 ILE A 64 15.493 -12.499 -0.995 1.00 25.00 H new ATOM 0 HG23 ILE A 64 15.858 -11.160 0.119 1.00 25.00 H new ATOM 0 HD11 ILE A 64 19.027 -9.893 1.540 1.00 25.00 H new ATOM 0 HD12 ILE A 64 17.364 -9.909 0.906 1.00 25.00 H new ATOM 0 HD13 ILE A 64 17.815 -10.987 2.249 1.00 25.00 H new ATOM 1010 N LEU A 65 14.716 -14.329 1.021 1.00 25.00 N ATOM 1011 CA LEU A 65 13.657 -15.253 0.630 1.00 25.00 C ATOM 1012 C LEU A 65 12.910 -14.750 -0.597 1.00 25.00 C ATOM 1013 O LEU A 65 11.751 -14.375 -0.520 1.00 25.00 O ATOM 1014 CB LEU A 65 12.678 -15.456 1.787 1.00 25.00 C ATOM 1015 CG LEU A 65 13.286 -15.979 3.095 1.00 25.00 C ATOM 1016 CD1 LEU A 65 12.174 -16.091 4.126 1.00 25.00 C ATOM 1017 CD2 LEU A 65 13.983 -17.339 2.901 1.00 25.00 C ATOM 0 H LEU A 65 14.411 -13.573 1.635 1.00 25.00 H new ATOM 0 HA LEU A 65 14.122 -16.207 0.379 1.00 25.00 H new ATOM 0 HB2 LEU A 65 12.186 -14.505 1.992 1.00 25.00 H new ATOM 0 HB3 LEU A 65 11.904 -16.152 1.465 1.00 25.00 H new ATOM 0 HG LEU A 65 14.051 -15.281 3.435 1.00 25.00 H new ATOM 0 HD11 LEU A 65 12.585 -16.462 5.065 1.00 25.00 H new ATOM 0 HD12 LEU A 65 11.727 -15.110 4.287 1.00 25.00 H new ATOM 0 HD13 LEU A 65 11.412 -16.782 3.766 1.00 25.00 H new ATOM 0 HD21 LEU A 65 14.400 -17.673 3.851 1.00 25.00 H new ATOM 0 HD22 LEU A 65 13.259 -18.072 2.545 1.00 25.00 H new ATOM 0 HD23 LEU A 65 14.785 -17.236 2.170 1.00 25.00 H new ATOM 1029 N VAL A 66 13.581 -14.773 -1.741 1.00 25.00 N ATOM 1030 CA VAL A 66 12.946 -14.382 -3.007 1.00 25.00 C ATOM 1031 C VAL A 66 11.831 -15.389 -3.322 1.00 25.00 C ATOM 1032 O VAL A 66 10.803 -15.049 -3.890 1.00 25.00 O ATOM 1033 CB VAL A 66 13.979 -14.359 -4.181 1.00 25.00 C ATOM 1034 CG1 VAL A 66 13.331 -13.882 -5.492 1.00 25.00 C ATOM 1035 CG2 VAL A 66 15.172 -13.458 -3.837 1.00 25.00 C ATOM 0 H VAL A 66 14.558 -15.055 -1.826 1.00 25.00 H new ATOM 0 HA VAL A 66 12.540 -13.376 -2.903 1.00 25.00 H new ATOM 0 HB VAL A 66 14.331 -15.381 -4.323 1.00 25.00 H new ATOM 0 HG11 VAL A 66 14.077 -13.878 -6.286 1.00 25.00 H new ATOM 0 HG12 VAL A 66 12.517 -14.555 -5.762 1.00 25.00 H new ATOM 0 HG13 VAL A 66 12.939 -12.874 -5.358 1.00 25.00 H new ATOM 0 HG21 VAL A 66 15.878 -13.457 -4.667 1.00 25.00 H new ATOM 0 HG22 VAL A 66 14.821 -12.442 -3.658 1.00 25.00 H new ATOM 0 HG23 VAL A 66 15.666 -13.835 -2.941 1.00 25.00 H new ATOM 1045 N GLY A 67 12.054 -16.640 -2.934 1.00 25.00 N ATOM 1046 CA GLY A 67 11.067 -17.694 -3.128 1.00 25.00 C ATOM 1047 C GLY A 67 11.014 -18.230 -4.545 1.00 25.00 C ATOM 1048 O GLY A 67 10.277 -19.163 -4.830 1.00 25.00 O ATOM 0 H GLY A 67 12.914 -16.949 -2.481 1.00 25.00 H new ATOM 0 HA2 GLY A 67 11.288 -18.516 -2.447 1.00 25.00 H new ATOM 0 HA3 GLY A 67 10.083 -17.312 -2.857 1.00 25.00 H new ATOM 1052 N MET A 68 11.800 -17.640 -5.435 1.00 25.00 N ATOM 1053 CA MET A 68 11.797 -18.017 -6.846 1.00 25.00 C ATOM 1054 C MET A 68 13.222 -18.155 -7.380 1.00 25.00 C ATOM 1055 O MET A 68 13.732 -17.287 -8.090 1.00 25.00 O ATOM 1056 CB MET A 68 11.022 -16.965 -7.645 1.00 25.00 C ATOM 1057 CG MET A 68 10.737 -17.364 -9.090 1.00 25.00 C ATOM 1058 SD MET A 68 10.092 -15.977 -10.046 1.00 25.00 S ATOM 1059 CE MET A 68 11.597 -14.982 -10.277 1.00 25.00 C ATOM 0 H MET A 68 12.454 -16.892 -5.204 1.00 25.00 H new ATOM 0 HA MET A 68 11.311 -18.987 -6.954 1.00 25.00 H new ATOM 0 HB2 MET A 68 10.076 -16.766 -7.141 1.00 25.00 H new ATOM 0 HB3 MET A 68 11.587 -16.033 -7.642 1.00 25.00 H new ATOM 0 HG2 MET A 68 11.652 -17.732 -9.554 1.00 25.00 H new ATOM 0 HG3 MET A 68 10.019 -18.184 -9.107 1.00 25.00 H new ATOM 0 HE1 MET A 68 11.440 -14.266 -11.084 1.00 25.00 H new ATOM 0 HE2 MET A 68 11.824 -14.446 -9.356 1.00 25.00 H new ATOM 0 HE3 MET A 68 12.431 -15.637 -10.530 1.00 25.00 H new ATOM 1069 N TYR A 69 13.877 -19.247 -7.021 1.00 25.00 N ATOM 1070 CA TYR A 69 15.214 -19.549 -7.525 1.00 25.00 C ATOM 1071 C TYR A 69 15.459 -21.028 -7.310 1.00 25.00 C ATOM 1072 O TYR A 69 14.992 -21.594 -6.333 1.00 25.00 O ATOM 1073 CB TYR A 69 16.296 -18.732 -6.799 1.00 25.00 C ATOM 1074 CG TYR A 69 16.213 -18.809 -5.290 1.00 25.00 C ATOM 1075 CD1 TYR A 69 16.907 -19.804 -4.569 1.00 25.00 C ATOM 1076 CD2 TYR A 69 15.434 -17.881 -4.571 1.00 25.00 C ATOM 1077 CE1 TYR A 69 16.813 -19.874 -3.154 1.00 25.00 C ATOM 1078 CE2 TYR A 69 15.344 -17.942 -3.154 1.00 25.00 C ATOM 1079 CZ TYR A 69 16.029 -18.943 -2.463 1.00 25.00 C ATOM 1080 OH TYR A 69 15.936 -19.021 -1.097 1.00 25.00 O ATOM 0 H TYR A 69 13.504 -19.946 -6.378 1.00 25.00 H new ATOM 0 HA TYR A 69 15.269 -19.286 -8.581 1.00 25.00 H new ATOM 0 HB2 TYR A 69 17.277 -19.083 -7.118 1.00 25.00 H new ATOM 0 HB3 TYR A 69 16.216 -17.689 -7.105 1.00 25.00 H new ATOM 0 HD1 TYR A 69 17.517 -20.520 -5.100 1.00 25.00 H new ATOM 0 HD2 TYR A 69 14.897 -17.111 -5.105 1.00 25.00 H new ATOM 0 HE1 TYR A 69 17.345 -20.643 -2.613 1.00 25.00 H new ATOM 0 HE2 TYR A 69 14.750 -17.219 -2.615 1.00 25.00 H new ATOM 0 HH TYR A 69 15.356 -18.303 -0.767 1.00 25.00 H new ATOM 1090 N ASP A 70 16.193 -21.645 -8.224 1.00 25.00 N ATOM 1091 CA ASP A 70 16.520 -23.068 -8.114 1.00 25.00 C ATOM 1092 C ASP A 70 17.690 -23.395 -9.025 1.00 25.00 C ATOM 1093 O ASP A 70 18.710 -23.908 -8.575 1.00 25.00 O ATOM 1094 CB ASP A 70 15.315 -23.927 -8.502 1.00 25.00 C ATOM 1095 CG ASP A 70 14.829 -24.776 -7.354 1.00 25.00 C ATOM 1096 OD1 ASP A 70 13.656 -24.668 -6.979 1.00 25.00 O ATOM 1097 OD2 ASP A 70 15.624 -25.590 -6.844 1.00 25.00 O ATOM 0 H ASP A 70 16.576 -21.187 -9.051 1.00 25.00 H new ATOM 0 HA ASP A 70 16.788 -23.285 -7.080 1.00 25.00 H new ATOM 0 HB2 ASP A 70 14.505 -23.282 -8.843 1.00 25.00 H new ATOM 0 HB3 ASP A 70 15.584 -24.571 -9.340 1.00 25.00 H new ATOM 1102 N LYS A 71 17.530 -23.040 -10.300 1.00 25.00 N ATOM 1103 CA LYS A 71 18.569 -23.201 -11.335 1.00 25.00 C ATOM 1104 C LYS A 71 19.074 -24.644 -11.466 1.00 25.00 C ATOM 1105 O LYS A 71 20.257 -24.879 -11.677 1.00 25.00 O ATOM 1106 CB LYS A 71 19.746 -22.244 -11.080 1.00 25.00 C ATOM 1107 CG LYS A 71 19.347 -20.767 -11.059 1.00 25.00 C ATOM 1108 CD LYS A 71 20.585 -19.874 -11.057 1.00 25.00 C ATOM 1109 CE LYS A 71 20.200 -18.393 -11.032 1.00 25.00 C ATOM 1110 NZ LYS A 71 21.423 -17.512 -11.091 1.00 25.00 N ATOM 0 H LYS A 71 16.667 -22.627 -10.654 1.00 25.00 H new ATOM 0 HA LYS A 71 18.096 -22.947 -12.284 1.00 25.00 H new ATOM 0 HB2 LYS A 71 20.210 -22.499 -10.127 1.00 25.00 H new ATOM 0 HB3 LYS A 71 20.500 -22.396 -11.852 1.00 25.00 H new ATOM 0 HG2 LYS A 71 18.730 -20.539 -11.928 1.00 25.00 H new ATOM 0 HG3 LYS A 71 18.742 -20.561 -10.176 1.00 25.00 H new ATOM 0 HD2 LYS A 71 21.203 -20.106 -10.190 1.00 25.00 H new ATOM 0 HD3 LYS A 71 21.187 -20.081 -11.942 1.00 25.00 H new ATOM 0 HE2 LYS A 71 19.546 -18.170 -11.875 1.00 25.00 H new ATOM 0 HE3 LYS A 71 19.635 -18.176 -10.125 1.00 25.00 H new ATOM 0 HZ1 LYS A 71 21.133 -16.513 -11.073 1.00 25.00 H new ATOM 0 HZ2 LYS A 71 22.033 -17.710 -10.273 1.00 25.00 H new ATOM 0 HZ3 LYS A 71 21.947 -17.704 -11.968 1.00 25.00 H new ATOM 1124 N LYS A 72 18.157 -25.599 -11.378 1.00 25.00 N ATOM 1125 CA LYS A 72 18.492 -27.018 -11.554 1.00 25.00 C ATOM 1126 C LYS A 72 17.843 -27.474 -12.855 1.00 25.00 C ATOM 1127 O LYS A 72 16.782 -26.960 -13.224 1.00 25.00 O ATOM 1128 CB LYS A 72 17.959 -27.840 -10.372 1.00 25.00 C ATOM 1129 CG LYS A 72 18.559 -27.429 -9.032 1.00 25.00 C ATOM 1130 CD LYS A 72 17.877 -28.143 -7.879 1.00 25.00 C ATOM 1131 CE LYS A 72 18.451 -27.700 -6.529 1.00 25.00 C ATOM 1132 NZ LYS A 72 18.193 -26.249 -6.243 1.00 25.00 N ATOM 0 H LYS A 72 17.171 -25.422 -11.185 1.00 25.00 H new ATOM 0 HA LYS A 72 19.572 -27.160 -11.593 1.00 25.00 H new ATOM 0 HB2 LYS A 72 16.875 -27.734 -10.325 1.00 25.00 H new ATOM 0 HB3 LYS A 72 18.169 -28.895 -10.548 1.00 25.00 H new ATOM 0 HG2 LYS A 72 19.625 -27.656 -9.024 1.00 25.00 H new ATOM 0 HG3 LYS A 72 18.462 -26.351 -8.903 1.00 25.00 H new ATOM 0 HD2 LYS A 72 16.806 -27.940 -7.905 1.00 25.00 H new ATOM 0 HD3 LYS A 72 18.000 -29.220 -7.992 1.00 25.00 H new ATOM 0 HE2 LYS A 72 18.014 -28.307 -5.736 1.00 25.00 H new ATOM 0 HE3 LYS A 72 19.525 -27.884 -6.517 1.00 25.00 H new ATOM 0 HZ1 LYS A 72 18.031 -26.119 -5.224 1.00 25.00 H new ATOM 0 HZ2 LYS A 72 19.016 -25.685 -6.537 1.00 25.00 H new ATOM 0 HZ3 LYS A 72 17.353 -25.936 -6.769 1.00 25.00 H new ATOM 1146 N PRO A 73 18.475 -28.404 -13.591 1.00 25.00 N ATOM 1147 CA PRO A 73 17.831 -28.779 -14.853 1.00 25.00 C ATOM 1148 C PRO A 73 16.570 -29.617 -14.645 1.00 25.00 C ATOM 1149 O PRO A 73 16.610 -30.654 -13.995 1.00 25.00 O ATOM 1150 CB PRO A 73 18.927 -29.575 -15.573 1.00 25.00 C ATOM 1151 CG PRO A 73 19.733 -30.178 -14.474 1.00 25.00 C ATOM 1152 CD PRO A 73 19.742 -29.135 -13.381 1.00 25.00 C ATOM 0 HA PRO A 73 17.480 -27.914 -15.416 1.00 25.00 H new ATOM 0 HB2 PRO A 73 18.501 -30.342 -16.220 1.00 25.00 H new ATOM 0 HB3 PRO A 73 19.537 -28.929 -16.204 1.00 25.00 H new ATOM 0 HG2 PRO A 73 19.290 -31.111 -14.126 1.00 25.00 H new ATOM 0 HG3 PRO A 73 20.745 -30.410 -14.807 1.00 25.00 H new ATOM 0 HD2 PRO A 73 19.783 -29.591 -12.392 1.00 25.00 H new ATOM 0 HD3 PRO A 73 20.605 -28.474 -13.464 1.00 25.00 H new ATOM 1160 N ALA A 74 15.460 -29.137 -15.199 1.00 25.00 N ATOM 1161 CA ALA A 74 14.158 -29.815 -15.137 1.00 25.00 C ATOM 1162 C ALA A 74 13.742 -30.264 -13.720 1.00 25.00 C ATOM 1163 O ALA A 74 13.095 -31.295 -13.560 1.00 25.00 O ATOM 1164 CB ALA A 74 14.150 -31.016 -16.108 1.00 25.00 C ATOM 0 H ALA A 74 15.434 -28.255 -15.711 1.00 25.00 H new ATOM 0 HA ALA A 74 13.414 -29.077 -15.437 1.00 25.00 H new ATOM 0 HB1 ALA A 74 13.183 -31.517 -16.060 1.00 25.00 H new ATOM 0 HB2 ALA A 74 14.326 -30.663 -17.124 1.00 25.00 H new ATOM 0 HB3 ALA A 74 14.936 -31.717 -15.826 1.00 25.00 H new ATOM 1170 N GLY A 75 14.103 -29.499 -12.699 1.00 25.00 N ATOM 1171 CA GLY A 75 13.757 -29.876 -11.341 1.00 25.00 C ATOM 1172 C GLY A 75 13.946 -28.750 -10.349 1.00 25.00 C ATOM 1173 O GLY A 75 14.408 -27.663 -10.703 1.00 25.00 O ATOM 0 H GLY A 75 14.627 -28.628 -12.785 1.00 25.00 H new ATOM 0 HA2 GLY A 75 12.718 -30.206 -11.315 1.00 25.00 H new ATOM 0 HA3 GLY A 75 14.369 -30.726 -11.039 1.00 25.00 H new ATOM 1177 N SER A 76 13.578 -29.016 -9.108 1.00 25.00 N ATOM 1178 CA SER A 76 13.654 -28.043 -8.029 1.00 25.00 C ATOM 1179 C SER A 76 14.028 -28.804 -6.768 1.00 25.00 C ATOM 1180 O SER A 76 13.909 -30.031 -6.738 1.00 25.00 O ATOM 1181 CB SER A 76 12.294 -27.362 -7.852 1.00 25.00 C ATOM 1182 OG SER A 76 11.270 -28.323 -7.660 1.00 25.00 O ATOM 0 H SER A 76 13.214 -29.923 -8.817 1.00 25.00 H new ATOM 0 HA SER A 76 14.393 -27.272 -8.246 1.00 25.00 H new ATOM 0 HB2 SER A 76 12.329 -26.686 -6.997 1.00 25.00 H new ATOM 0 HB3 SER A 76 12.069 -26.755 -8.729 1.00 25.00 H new ATOM 0 HG SER A 76 10.410 -27.867 -7.547 1.00 25.00 H new ATOM 1188 N GLY A 77 14.496 -28.118 -5.738 1.00 25.00 N ATOM 1189 CA GLY A 77 14.841 -28.812 -4.510 1.00 25.00 C ATOM 1190 C GLY A 77 15.311 -27.931 -3.372 1.00 25.00 C ATOM 1191 O GLY A 77 15.863 -26.852 -3.588 1.00 25.00 O ATOM 0 H GLY A 77 14.643 -27.109 -5.726 1.00 25.00 H new ATOM 0 HA2 GLY A 77 13.970 -29.375 -4.174 1.00 25.00 H new ATOM 0 HA3 GLY A 77 15.624 -29.538 -4.731 1.00 25.00 H new ATOM 1195 N GLY A 78 15.102 -28.417 -2.155 1.00 25.00 N ATOM 1196 CA GLY A 78 15.522 -27.711 -0.952 1.00 25.00 C ATOM 1197 C GLY A 78 16.782 -28.335 -0.379 1.00 25.00 C ATOM 1198 O GLY A 78 17.547 -28.963 -1.104 1.00 25.00 O ATOM 0 H GLY A 78 14.639 -29.308 -1.975 1.00 25.00 H new ATOM 0 HA2 GLY A 78 15.703 -26.661 -1.184 1.00 25.00 H new ATOM 0 HA3 GLY A 78 14.725 -27.741 -0.209 1.00 25.00 H new ATOM 1202 N SER A 79 16.988 -28.193 0.923 1.00 25.00 N ATOM 1203 CA SER A 79 18.141 -28.786 1.597 1.00 25.00 C ATOM 1204 C SER A 79 17.668 -29.433 2.889 1.00 25.00 C ATOM 1205 O SER A 79 16.649 -29.024 3.448 1.00 25.00 O ATOM 1206 CB SER A 79 19.177 -27.706 1.911 1.00 25.00 C ATOM 1207 OG SER A 79 18.618 -26.712 2.756 1.00 25.00 O ATOM 0 H SER A 79 16.368 -27.668 1.540 1.00 25.00 H new ATOM 0 HA SER A 79 18.601 -29.533 0.951 1.00 25.00 H new ATOM 0 HB2 SER A 79 20.045 -28.156 2.393 1.00 25.00 H new ATOM 0 HB3 SER A 79 19.527 -27.250 0.985 1.00 25.00 H new ATOM 0 HG SER A 79 19.294 -26.029 2.949 1.00 25.00 H new ATOM 1213 N GLY A 80 18.409 -30.429 3.358 1.00 25.00 N ATOM 1214 CA GLY A 80 18.080 -31.094 4.608 1.00 25.00 C ATOM 1215 C GLY A 80 18.828 -30.465 5.766 1.00 25.00 C ATOM 1216 O GLY A 80 19.418 -29.395 5.614 1.00 25.00 O ATOM 0 H GLY A 80 19.240 -30.792 2.891 1.00 25.00 H new ATOM 0 HA2 GLY A 80 17.006 -31.032 4.786 1.00 25.00 H new ATOM 0 HA3 GLY A 80 18.331 -32.152 4.539 1.00 25.00 H new ATOM 1220 N SER A 81 18.835 -31.139 6.906 1.00 25.00 N ATOM 1221 CA SER A 81 19.556 -30.682 8.089 1.00 25.00 C ATOM 1222 C SER A 81 19.995 -31.924 8.848 1.00 25.00 C ATOM 1223 O SER A 81 19.413 -32.992 8.658 1.00 25.00 O ATOM 1224 CB SER A 81 18.639 -29.828 8.969 1.00 25.00 C ATOM 1225 OG SER A 81 17.460 -30.547 9.313 1.00 25.00 O ATOM 0 H SER A 81 18.340 -32.021 7.039 1.00 25.00 H new ATOM 0 HA SER A 81 20.414 -30.071 7.808 1.00 25.00 H new ATOM 0 HB2 SER A 81 19.168 -29.532 9.875 1.00 25.00 H new ATOM 0 HB3 SER A 81 18.372 -28.912 8.443 1.00 25.00 H new ATOM 0 HG SER A 81 16.887 -29.986 9.877 1.00 25.00 H new ATOM 1231 N GLY A 82 20.993 -31.795 9.707 1.00 25.00 N ATOM 1232 CA GLY A 82 21.463 -32.916 10.500 1.00 25.00 C ATOM 1233 C GLY A 82 22.343 -32.364 11.595 1.00 25.00 C ATOM 1234 O GLY A 82 22.635 -31.167 11.559 1.00 25.00 O ATOM 0 H GLY A 82 21.494 -30.922 9.872 1.00 25.00 H new ATOM 0 HA2 GLY A 82 20.622 -33.464 10.925 1.00 25.00 H new ATOM 0 HA3 GLY A 82 22.020 -33.618 9.879 1.00 25.00 H new ATOM 1238 N LEU A 83 22.745 -33.217 12.538 1.00 25.00 N ATOM 1239 CA LEU A 83 23.535 -32.829 13.723 1.00 25.00 C ATOM 1240 C LEU A 83 22.810 -31.789 14.595 1.00 25.00 C ATOM 1241 O LEU A 83 21.710 -31.349 14.281 1.00 25.00 O ATOM 1242 CB LEU A 83 24.931 -32.317 13.309 1.00 25.00 C ATOM 1243 CG LEU A 83 26.119 -33.227 13.661 1.00 25.00 C ATOM 1244 CD1 LEU A 83 27.376 -32.678 12.996 1.00 25.00 C ATOM 1245 CD2 LEU A 83 26.346 -33.337 15.173 1.00 25.00 C ATOM 0 H LEU A 83 22.531 -34.214 12.506 1.00 25.00 H new ATOM 0 HA LEU A 83 23.658 -33.726 14.330 1.00 25.00 H new ATOM 0 HB2 LEU A 83 24.931 -32.155 12.231 1.00 25.00 H new ATOM 0 HB3 LEU A 83 25.093 -31.346 13.777 1.00 25.00 H new ATOM 0 HG LEU A 83 25.892 -34.228 13.296 1.00 25.00 H new ATOM 0 HD11 LEU A 83 28.225 -33.317 13.240 1.00 25.00 H new ATOM 0 HD12 LEU A 83 27.236 -32.657 11.915 1.00 25.00 H new ATOM 0 HD13 LEU A 83 27.567 -31.667 13.357 1.00 25.00 H new ATOM 0 HD21 LEU A 83 27.196 -33.991 15.367 1.00 25.00 H new ATOM 0 HD22 LEU A 83 26.548 -32.348 15.583 1.00 25.00 H new ATOM 0 HD23 LEU A 83 25.455 -33.751 15.646 1.00 25.00 H new ATOM 1257 N THR A 84 23.421 -31.438 15.718 1.00 25.00 N ATOM 1258 CA THR A 84 22.871 -30.418 16.617 1.00 25.00 C ATOM 1259 C THR A 84 23.905 -29.317 16.805 1.00 25.00 C ATOM 1260 O THR A 84 23.613 -28.238 17.316 1.00 25.00 O ATOM 1261 CB THR A 84 22.467 -31.022 17.983 1.00 25.00 C ATOM 1262 OG1 THR A 84 21.847 -30.019 18.789 1.00 25.00 O ATOM 1263 CG2 THR A 84 23.660 -31.583 18.738 1.00 25.00 C ATOM 0 H THR A 84 24.302 -31.843 16.034 1.00 25.00 H new ATOM 0 HA THR A 84 21.967 -30.005 16.169 1.00 25.00 H new ATOM 0 HB THR A 84 21.775 -31.840 17.781 1.00 25.00 H new ATOM 0 HG1 THR A 84 22.176 -29.135 18.522 1.00 25.00 H new ATOM 0 HG21 THR A 84 23.327 -31.996 19.690 1.00 25.00 H new ATOM 0 HG22 THR A 84 24.128 -32.369 18.146 1.00 25.00 H new ATOM 0 HG23 THR A 84 24.382 -30.787 18.920 1.00 25.00 H new ATOM 1271 N ASP A 85 25.118 -29.607 16.369 1.00 25.00 N ATOM 1272 CA ASP A 85 26.230 -28.679 16.463 1.00 25.00 C ATOM 1273 C ASP A 85 26.395 -28.018 15.107 1.00 25.00 C ATOM 1274 O ASP A 85 26.645 -28.690 14.109 1.00 25.00 O ATOM 1275 CB ASP A 85 27.502 -29.434 16.841 1.00 25.00 C ATOM 1276 CG ASP A 85 27.380 -30.123 18.178 1.00 25.00 C ATOM 1277 OD1 ASP A 85 27.047 -31.332 18.190 1.00 25.00 O ATOM 1278 OD2 ASP A 85 27.555 -29.454 19.216 1.00 25.00 O ATOM 0 H ASP A 85 25.360 -30.499 15.937 1.00 25.00 H new ATOM 0 HA ASP A 85 26.041 -27.927 17.229 1.00 25.00 H new ATOM 0 HB2 ASP A 85 27.726 -30.174 16.072 1.00 25.00 H new ATOM 0 HB3 ASP A 85 28.341 -28.739 16.868 1.00 25.00 H new ATOM 1283 N GLU A 86 26.209 -26.711 15.062 1.00 25.00 N ATOM 1284 CA GLU A 86 26.301 -25.953 13.830 1.00 25.00 C ATOM 1285 C GLU A 86 26.881 -24.605 14.219 1.00 25.00 C ATOM 1286 O GLU A 86 26.403 -23.964 15.154 1.00 25.00 O ATOM 1287 CB GLU A 86 24.914 -25.784 13.205 1.00 25.00 C ATOM 1288 CG GLU A 86 24.937 -25.150 11.824 1.00 25.00 C ATOM 1289 CD GLU A 86 23.549 -24.731 11.379 1.00 25.00 C ATOM 1290 OE1 GLU A 86 23.082 -23.665 11.836 1.00 25.00 O ATOM 1291 OE2 GLU A 86 22.880 -25.489 10.644 1.00 25.00 O ATOM 0 H GLU A 86 25.989 -26.145 15.882 1.00 25.00 H new ATOM 0 HA GLU A 86 26.924 -26.457 13.091 1.00 25.00 H new ATOM 0 HB2 GLU A 86 24.434 -26.760 13.138 1.00 25.00 H new ATOM 0 HB3 GLU A 86 24.300 -25.172 13.866 1.00 25.00 H new ATOM 0 HG2 GLU A 86 25.595 -24.281 11.833 1.00 25.00 H new ATOM 0 HG3 GLU A 86 25.352 -25.857 11.105 1.00 25.00 H new ATOM 1298 N LEU A 87 27.953 -24.212 13.552 1.00 25.00 N ATOM 1299 CA LEU A 87 28.660 -22.977 13.882 1.00 25.00 C ATOM 1300 C LEU A 87 28.389 -21.903 12.842 1.00 25.00 C ATOM 1301 O LEU A 87 28.284 -22.185 11.649 1.00 25.00 O ATOM 1302 CB LEU A 87 30.166 -23.252 13.979 1.00 25.00 C ATOM 1303 CG LEU A 87 30.577 -24.305 15.028 1.00 25.00 C ATOM 1304 CD1 LEU A 87 32.083 -24.551 14.939 1.00 25.00 C ATOM 1305 CD2 LEU A 87 30.209 -23.871 16.455 1.00 25.00 C ATOM 0 H LEU A 87 28.358 -24.731 12.773 1.00 25.00 H new ATOM 0 HA LEU A 87 28.297 -22.616 14.844 1.00 25.00 H new ATOM 0 HB2 LEU A 87 30.523 -23.578 13.002 1.00 25.00 H new ATOM 0 HB3 LEU A 87 30.676 -22.316 14.209 1.00 25.00 H new ATOM 0 HG LEU A 87 30.030 -25.223 14.811 1.00 25.00 H new ATOM 0 HD11 LEU A 87 32.375 -25.295 15.680 1.00 25.00 H new ATOM 0 HD12 LEU A 87 32.334 -24.914 13.942 1.00 25.00 H new ATOM 0 HD13 LEU A 87 32.616 -23.620 15.131 1.00 25.00 H new ATOM 0 HD21 LEU A 87 30.517 -24.643 17.161 1.00 25.00 H new ATOM 0 HD22 LEU A 87 30.718 -22.937 16.694 1.00 25.00 H new ATOM 0 HD23 LEU A 87 29.131 -23.725 16.524 1.00 25.00 H new ATOM 1317 N ALA A 88 28.260 -20.669 13.309 1.00 25.00 N ATOM 1318 CA ALA A 88 27.950 -19.539 12.442 1.00 25.00 C ATOM 1319 C ALA A 88 29.225 -18.916 11.844 1.00 25.00 C ATOM 1320 O ALA A 88 30.263 -18.859 12.509 1.00 25.00 O ATOM 1321 CB ALA A 88 27.177 -18.492 13.247 1.00 25.00 C ATOM 0 H ALA A 88 28.366 -20.423 14.293 1.00 25.00 H new ATOM 0 HA ALA A 88 27.342 -19.895 11.610 1.00 25.00 H new ATOM 0 HB1 ALA A 88 26.941 -17.642 12.606 1.00 25.00 H new ATOM 0 HB2 ALA A 88 26.253 -18.931 13.623 1.00 25.00 H new ATOM 0 HB3 ALA A 88 27.786 -18.155 14.086 1.00 25.00 H new ATOM 1327 N PRO A 89 29.152 -18.405 10.600 1.00 25.00 N ATOM 1328 CA PRO A 89 30.325 -17.755 10.008 1.00 25.00 C ATOM 1329 C PRO A 89 30.585 -16.359 10.598 1.00 25.00 C ATOM 1330 O PRO A 89 29.718 -15.791 11.282 1.00 25.00 O ATOM 1331 CB PRO A 89 29.944 -17.679 8.530 1.00 25.00 C ATOM 1332 CG PRO A 89 28.486 -17.497 8.549 1.00 25.00 C ATOM 1333 CD PRO A 89 28.012 -18.391 9.662 1.00 25.00 C ATOM 0 HA PRO A 89 31.252 -18.296 10.197 1.00 25.00 H new ATOM 0 HB2 PRO A 89 30.444 -16.849 8.031 1.00 25.00 H new ATOM 0 HB3 PRO A 89 30.226 -18.587 7.998 1.00 25.00 H new ATOM 0 HG2 PRO A 89 28.218 -16.457 8.733 1.00 25.00 H new ATOM 0 HG3 PRO A 89 28.038 -17.778 7.596 1.00 25.00 H new ATOM 0 HD2 PRO A 89 27.109 -18.002 10.133 1.00 25.00 H new ATOM 0 HD3 PRO A 89 27.777 -19.392 9.301 1.00 25.00 H new ATOM 1341 N PRO A 90 31.783 -15.789 10.365 1.00 25.00 N ATOM 1342 CA PRO A 90 32.087 -14.489 10.977 1.00 25.00 C ATOM 1343 C PRO A 90 31.335 -13.299 10.382 1.00 25.00 C ATOM 1344 O PRO A 90 30.821 -13.351 9.261 1.00 25.00 O ATOM 1345 CB PRO A 90 33.593 -14.348 10.738 1.00 25.00 C ATOM 1346 CG PRO A 90 33.822 -15.074 9.475 1.00 25.00 C ATOM 1347 CD PRO A 90 32.930 -16.285 9.577 1.00 25.00 C ATOM 0 HA PRO A 90 31.778 -14.473 12.022 1.00 25.00 H new ATOM 0 HB2 PRO A 90 33.888 -13.302 10.657 1.00 25.00 H new ATOM 0 HB3 PRO A 90 34.169 -14.779 11.557 1.00 25.00 H new ATOM 0 HG2 PRO A 90 33.564 -14.461 8.611 1.00 25.00 H new ATOM 0 HG3 PRO A 90 34.868 -15.358 9.363 1.00 25.00 H new ATOM 0 HD2 PRO A 90 32.620 -16.642 8.595 1.00 25.00 H new ATOM 0 HD3 PRO A 90 33.432 -17.115 10.074 1.00 25.00 H new ATOM 1355 N LYS A 91 31.297 -12.220 11.154 1.00 25.00 N ATOM 1356 CA LYS A 91 30.661 -10.969 10.740 1.00 25.00 C ATOM 1357 C LYS A 91 31.659 -10.154 9.909 1.00 25.00 C ATOM 1358 O LYS A 91 32.864 -10.225 10.161 1.00 25.00 O ATOM 1359 CB LYS A 91 30.287 -10.141 11.984 1.00 25.00 C ATOM 1360 CG LYS A 91 29.315 -10.828 12.946 1.00 25.00 C ATOM 1361 CD LYS A 91 29.020 -9.934 14.148 1.00 25.00 C ATOM 1362 CE LYS A 91 28.054 -10.601 15.120 1.00 25.00 C ATOM 1363 NZ LYS A 91 27.721 -9.678 16.252 1.00 25.00 N ATOM 0 H LYS A 91 31.706 -12.185 12.088 1.00 25.00 H new ATOM 0 HA LYS A 91 29.767 -11.196 10.158 1.00 25.00 H new ATOM 0 HB2 LYS A 91 31.200 -9.895 12.527 1.00 25.00 H new ATOM 0 HB3 LYS A 91 29.847 -9.199 11.657 1.00 25.00 H new ATOM 0 HG2 LYS A 91 28.387 -11.064 12.426 1.00 25.00 H new ATOM 0 HG3 LYS A 91 29.739 -11.773 13.285 1.00 25.00 H new ATOM 0 HD2 LYS A 91 29.951 -9.698 14.664 1.00 25.00 H new ATOM 0 HD3 LYS A 91 28.597 -8.990 13.805 1.00 25.00 H new ATOM 0 HE2 LYS A 91 27.142 -10.886 14.596 1.00 25.00 H new ATOM 0 HE3 LYS A 91 28.497 -11.517 15.510 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 26.829 -9.978 16.694 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 28.484 -9.706 16.958 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 27.619 -8.708 15.891 1.00 25.00 H new ATOM 1377 N PRO A 92 31.177 -9.340 8.953 1.00 25.00 N ATOM 1378 CA PRO A 92 32.115 -8.410 8.309 1.00 25.00 C ATOM 1379 C PRO A 92 32.538 -7.312 9.306 1.00 25.00 C ATOM 1380 O PRO A 92 31.901 -7.142 10.348 1.00 25.00 O ATOM 1381 CB PRO A 92 31.304 -7.864 7.125 1.00 25.00 C ATOM 1382 CG PRO A 92 29.901 -7.974 7.539 1.00 25.00 C ATOM 1383 CD PRO A 92 29.796 -9.146 8.468 1.00 25.00 C ATOM 0 HA PRO A 92 33.049 -8.865 7.981 1.00 25.00 H new ATOM 0 HB2 PRO A 92 31.571 -6.830 6.908 1.00 25.00 H new ATOM 0 HB3 PRO A 92 31.494 -8.439 6.219 1.00 25.00 H new ATOM 0 HG2 PRO A 92 29.575 -7.060 8.036 1.00 25.00 H new ATOM 0 HG3 PRO A 92 29.255 -8.113 6.672 1.00 25.00 H new ATOM 0 HD2 PRO A 92 29.109 -8.944 9.290 1.00 25.00 H new ATOM 0 HD3 PRO A 92 29.425 -10.032 7.953 1.00 25.00 H new ATOM 1391 N PRO A 93 33.643 -6.591 9.028 1.00 25.00 N ATOM 1392 CA PRO A 93 34.116 -5.600 10.005 1.00 25.00 C ATOM 1393 C PRO A 93 33.288 -4.318 10.034 1.00 25.00 C ATOM 1394 O PRO A 93 32.422 -4.104 9.187 1.00 25.00 O ATOM 1395 CB PRO A 93 35.537 -5.310 9.518 1.00 25.00 C ATOM 1396 CG PRO A 93 35.443 -5.461 8.055 1.00 25.00 C ATOM 1397 CD PRO A 93 34.533 -6.641 7.852 1.00 25.00 C ATOM 0 HA PRO A 93 34.048 -5.976 11.026 1.00 25.00 H new ATOM 0 HB2 PRO A 93 35.859 -4.307 9.797 1.00 25.00 H new ATOM 0 HB3 PRO A 93 36.257 -6.007 9.947 1.00 25.00 H new ATOM 0 HG2 PRO A 93 35.037 -4.563 7.589 1.00 25.00 H new ATOM 0 HG3 PRO A 93 36.423 -5.635 7.611 1.00 25.00 H new ATOM 0 HD2 PRO A 93 33.973 -6.561 6.920 1.00 25.00 H new ATOM 0 HD3 PRO A 93 35.091 -7.576 7.809 1.00 25.00 H new ATOM 1405 N LEU A 94 33.579 -3.465 11.008 1.00 25.00 N ATOM 1406 CA LEU A 94 32.917 -2.170 11.157 1.00 25.00 C ATOM 1407 C LEU A 94 33.946 -1.060 11.421 1.00 25.00 C ATOM 1408 O LEU A 94 35.019 -1.334 11.964 1.00 25.00 O ATOM 1409 CB LEU A 94 31.928 -2.206 12.332 1.00 25.00 C ATOM 1410 CG LEU A 94 30.560 -2.849 12.072 1.00 25.00 C ATOM 1411 CD1 LEU A 94 29.727 -2.746 13.315 1.00 25.00 C ATOM 1412 CD2 LEU A 94 29.815 -2.152 10.951 1.00 25.00 C ATOM 0 H LEU A 94 34.284 -3.651 11.722 1.00 25.00 H new ATOM 0 HA LEU A 94 32.385 -1.962 10.229 1.00 25.00 H new ATOM 0 HB2 LEU A 94 32.401 -2.739 13.157 1.00 25.00 H new ATOM 0 HB3 LEU A 94 31.763 -1.182 12.667 1.00 25.00 H new ATOM 0 HG LEU A 94 30.730 -3.888 11.788 1.00 25.00 H new ATOM 0 HD11 LEU A 94 28.752 -3.201 13.139 1.00 25.00 H new ATOM 0 HD12 LEU A 94 30.227 -3.265 14.132 1.00 25.00 H new ATOM 0 HD13 LEU A 94 29.595 -1.697 13.579 1.00 25.00 H new ATOM 0 HD21 LEU A 94 28.851 -2.637 10.798 1.00 25.00 H new ATOM 0 HD22 LEU A 94 29.657 -1.106 11.214 1.00 25.00 H new ATOM 0 HD23 LEU A 94 30.400 -2.211 10.033 1.00 25.00 H new ATOM 1424 N PRO A 95 33.626 0.195 11.050 1.00 25.00 N ATOM 1425 CA PRO A 95 34.484 1.361 11.301 1.00 25.00 C ATOM 1426 C PRO A 95 34.356 1.933 12.714 1.00 25.00 C ATOM 1427 O PRO A 95 33.463 1.568 13.474 1.00 25.00 O ATOM 1428 CB PRO A 95 33.949 2.381 10.300 1.00 25.00 C ATOM 1429 CG PRO A 95 32.486 2.103 10.275 1.00 25.00 C ATOM 1430 CD PRO A 95 32.387 0.595 10.352 1.00 25.00 C ATOM 0 HA PRO A 95 35.538 1.103 11.201 1.00 25.00 H new ATOM 0 HB2 PRO A 95 34.159 3.403 10.616 1.00 25.00 H new ATOM 0 HB3 PRO A 95 34.400 2.253 9.316 1.00 25.00 H new ATOM 0 HG2 PRO A 95 31.977 2.578 11.114 1.00 25.00 H new ATOM 0 HG3 PRO A 95 32.025 2.485 9.365 1.00 25.00 H new ATOM 0 HD2 PRO A 95 31.499 0.280 10.901 1.00 25.00 H new ATOM 0 HD3 PRO A 95 32.324 0.147 9.360 1.00 25.00 H new ATOM 1438 N GLU A 96 35.211 2.896 13.025 1.00 25.00 N ATOM 1439 CA GLU A 96 35.157 3.622 14.302 1.00 25.00 C ATOM 1440 C GLU A 96 34.191 4.816 14.200 1.00 25.00 C ATOM 1441 O GLU A 96 34.568 5.966 14.413 1.00 25.00 O ATOM 1442 CB GLU A 96 36.555 4.110 14.703 1.00 25.00 C ATOM 1443 CG GLU A 96 37.506 2.985 15.095 1.00 25.00 C ATOM 1444 CD GLU A 96 38.035 3.146 16.517 1.00 25.00 C ATOM 1445 OE1 GLU A 96 39.263 3.343 16.679 1.00 25.00 O ATOM 1446 OE2 GLU A 96 37.232 3.068 17.471 1.00 25.00 O ATOM 0 H GLU A 96 35.963 3.201 12.407 1.00 25.00 H new ATOM 0 HA GLU A 96 34.792 2.939 15.069 1.00 25.00 H new ATOM 0 HB2 GLU A 96 36.988 4.667 13.872 1.00 25.00 H new ATOM 0 HB3 GLU A 96 36.463 4.804 15.539 1.00 25.00 H new ATOM 0 HG2 GLU A 96 36.990 2.029 15.007 1.00 25.00 H new ATOM 0 HG3 GLU A 96 38.344 2.961 14.398 1.00 25.00 H new ATOM 1453 N GLY A 97 32.942 4.531 13.857 1.00 25.00 N ATOM 1454 CA GLY A 97 31.931 5.576 13.757 1.00 25.00 C ATOM 1455 C GLY A 97 31.984 6.387 12.472 1.00 25.00 C ATOM 1456 O GLY A 97 32.571 5.965 11.476 1.00 25.00 O ATOM 0 H GLY A 97 32.606 3.592 13.645 1.00 25.00 H new ATOM 0 HA2 GLY A 97 30.945 5.119 13.842 1.00 25.00 H new ATOM 0 HA3 GLY A 97 32.043 6.253 14.604 1.00 25.00 H new ATOM 1460 N GLU A 98 31.349 7.553 12.503 1.00 25.00 N ATOM 1461 CA GLU A 98 31.283 8.459 11.355 1.00 25.00 C ATOM 1462 C GLU A 98 31.852 9.816 11.772 1.00 25.00 C ATOM 1463 O GLU A 98 31.639 10.279 12.892 1.00 25.00 O ATOM 1464 CB GLU A 98 29.822 8.629 10.904 1.00 25.00 C ATOM 1465 CG GLU A 98 29.663 9.424 9.597 1.00 25.00 C ATOM 1466 CD GLU A 98 28.203 9.688 9.226 1.00 25.00 C ATOM 1467 OE1 GLU A 98 27.964 10.215 8.116 1.00 25.00 O ATOM 1468 OE2 GLU A 98 27.304 9.417 10.050 1.00 25.00 O ATOM 0 H GLU A 98 30.862 7.901 13.329 1.00 25.00 H new ATOM 0 HA GLU A 98 31.860 8.048 10.527 1.00 25.00 H new ATOM 0 HB2 GLU A 98 29.375 7.643 10.775 1.00 25.00 H new ATOM 0 HB3 GLU A 98 29.264 9.132 11.694 1.00 25.00 H new ATOM 0 HG2 GLU A 98 30.185 10.376 9.693 1.00 25.00 H new ATOM 0 HG3 GLU A 98 30.144 8.877 8.786 1.00 25.00 H new ATOM 1475 N VAL A 99 32.590 10.467 10.866 1.00 25.00 N ATOM 1476 CA VAL A 99 33.158 11.791 11.124 1.00 25.00 C ATOM 1477 C VAL A 99 32.184 12.892 10.686 1.00 25.00 C ATOM 1478 O VAL A 99 31.928 13.186 9.538 1.00 25.00 O ATOM 1479 CB VAL A 99 34.560 11.939 10.457 1.00 25.00 C ATOM 1480 CG1 VAL A 99 35.186 13.318 10.783 1.00 25.00 C ATOM 1481 CG2 VAL A 99 35.510 10.808 10.937 1.00 25.00 C ATOM 1482 OXT VAL A 99 31.635 13.526 11.669 1.00 25.00 O ATOM 0 H VAL A 99 32.808 10.094 9.942 1.00 25.00 H new ATOM 0 HA VAL A 99 33.308 11.902 12.198 1.00 25.00 H new ATOM 0 HB VAL A 99 34.427 11.863 9.378 1.00 25.00 H new ATOM 0 HG11 VAL A 99 36.163 13.396 10.306 1.00 25.00 H new ATOM 0 HG12 VAL A 99 34.536 14.110 10.410 1.00 25.00 H new ATOM 0 HG13 VAL A 99 35.300 13.420 11.862 1.00 25.00 H new ATOM 0 HG21 VAL A 99 36.484 10.925 10.462 1.00 25.00 H new ATOM 0 HG22 VAL A 99 35.625 10.864 12.020 1.00 25.00 H new ATOM 0 HG23 VAL A 99 35.089 9.840 10.666 1.00 25.00 H new TER 1493 VAL A 99