USER MOD reduce.3.24.130724 H: found=0, std=0, add=900, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 900 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 106 LYS NZ :NH3+ -169:sc= 1.08 (180deg=0) USER MOD Set 1.2: A 110 SER OG : rot -100:sc= 0.924 USER MOD Set 2.1: A 12 TYR OH : rot 165:sc= 0 USER MOD Set 2.2: A 102 LYS NZ :NH3+ -160:sc= 0.253 (180deg=0.0703) USER MOD Set 3.1: A 9 SER OG : rot 41:sc= 0.93 USER MOD Set 3.2: A 42 SER OG : rot -11:sc= 0.205 USER MOD Set 4.1: A 33 GLN : amide:sc= -0.774 K(o=-4.2,f=-5.1) USER MOD Set 4.2: A 36 ASN : amide:sc= -3.43 K(o=-4.2,f=-5.2) USER MOD Set 5.1: A 30 GLN : amide:sc= -0.141 K(o=-0.17,f=-1.6) USER MOD Set 5.2: A 32 ASN : amide:sc= -0.0279 K(o=-0.17,f=-0.77) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 165:sc=-0.00807 (180deg=-0.118) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 HIS : no HD1:sc=-0.00173 X(o=-0.0017,f=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 89:sc= -0.664 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.172) USER MOD Single : A 57 MET CE :methyl 169:sc= 0 (180deg=-0.181) USER MOD Single : A 60 GLN : amide:sc= -0.927 K(o=-0.93,f=-5.1!) USER MOD Single : A 61 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 67 HIS : no HD1:sc= -1.98 X(o=-2,f=-2.3!) USER MOD Single : A 68 TYR OH : rot 180:sc= -0.394 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 GLN : amide:sc= -0.251 K(o=-0.25,f=-2.2!) USER MOD Single : A 75 GLN : amide:sc= -0.513 K(o=-0.51,f=-3.1!) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 MET CE :methyl -176:sc= -0.53 (180deg=-0.565) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -0.693 X(o=-0.69,f=-1) USER MOD Single : A 93 ASN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : A 100 ASN : amide:sc= -0.132 K(o=-0.13,f=-2!) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 TYR OH : rot 58:sc= 0.267 USER MOD Single : A 107 SER OG : rot 180:sc= -0.327 USER MOD Single : A 111 SER OG : rot 180:sc= 0.00419 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.539 16.204 17.693 1.00 0.00 N ATOM 2 CA GLY A 1 8.445 16.592 16.577 1.00 0.00 C ATOM 3 C GLY A 1 9.792 17.085 17.068 1.00 0.00 C ATOM 4 O GLY A 1 9.934 18.247 17.451 1.00 0.00 O ATOM 0 H1 GLY A 1 6.632 15.874 17.305 1.00 0.00 H new ATOM 0 H2 GLY A 1 7.977 15.440 18.246 1.00 0.00 H new ATOM 0 H3 GLY A 1 7.374 17.026 18.308 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.593 15.736 15.919 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.970 17.373 15.983 1.00 0.00 H new ATOM 10 N SER A 2 10.783 16.200 17.056 1.00 0.00 N ATOM 11 CA SER A 2 12.127 16.550 17.503 1.00 0.00 C ATOM 12 C SER A 2 13.137 16.380 16.373 1.00 0.00 C ATOM 13 O SER A 2 14.300 16.054 16.611 1.00 0.00 O ATOM 14 CB SER A 2 12.531 15.686 18.699 1.00 0.00 C ATOM 15 OG SER A 2 11.953 14.394 18.612 1.00 0.00 O ATOM 0 H SER A 2 10.681 15.235 16.742 1.00 0.00 H new ATOM 0 HA SER A 2 12.121 17.597 17.806 1.00 0.00 H new ATOM 0 HB2 SER A 2 13.617 15.600 18.740 1.00 0.00 H new ATOM 0 HB3 SER A 2 12.214 16.168 19.624 1.00 0.00 H new ATOM 0 HG SER A 2 12.227 13.860 19.387 1.00 0.00 H new ATOM 21 N SER A 3 12.686 16.604 15.143 1.00 0.00 N ATOM 22 CA SER A 3 13.551 16.476 13.976 1.00 0.00 C ATOM 23 C SER A 3 13.062 17.363 12.837 1.00 0.00 C ATOM 24 O SER A 3 13.831 18.136 12.264 1.00 0.00 O ATOM 25 CB SER A 3 13.607 15.018 13.515 1.00 0.00 C ATOM 26 OG SER A 3 14.857 14.719 12.920 1.00 0.00 O ATOM 0 H SER A 3 11.726 16.875 14.929 1.00 0.00 H new ATOM 0 HA SER A 3 14.553 16.799 14.259 1.00 0.00 H new ATOM 0 HB2 SER A 3 13.438 14.358 14.366 1.00 0.00 H new ATOM 0 HB3 SER A 3 12.806 14.828 12.801 1.00 0.00 H new ATOM 0 HG SER A 3 14.868 13.781 12.636 1.00 0.00 H new ATOM 32 N GLY A 4 11.778 17.247 12.511 1.00 0.00 N ATOM 33 CA GLY A 4 11.210 18.044 11.440 1.00 0.00 C ATOM 34 C GLY A 4 11.191 17.308 10.115 1.00 0.00 C ATOM 35 O GLY A 4 10.677 16.193 10.024 1.00 0.00 O ATOM 0 H GLY A 4 11.121 16.615 12.970 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.193 18.332 11.706 1.00 0.00 H new ATOM 0 HA3 GLY A 4 11.784 18.964 11.332 1.00 0.00 H new ATOM 39 N SER A 5 11.751 17.933 9.085 1.00 0.00 N ATOM 40 CA SER A 5 11.797 17.330 7.757 1.00 0.00 C ATOM 41 C SER A 5 10.391 17.065 7.232 1.00 0.00 C ATOM 42 O SER A 5 9.402 17.301 7.926 1.00 0.00 O ATOM 43 CB SER A 5 12.595 16.025 7.795 1.00 0.00 C ATOM 44 OG SER A 5 13.367 15.865 6.617 1.00 0.00 O ATOM 0 H SER A 5 12.179 18.857 9.144 1.00 0.00 H new ATOM 0 HA SER A 5 12.291 18.030 7.083 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.250 16.021 8.666 1.00 0.00 H new ATOM 0 HB3 SER A 5 11.914 15.181 7.904 1.00 0.00 H new ATOM 0 HG SER A 5 13.869 15.025 6.666 1.00 0.00 H new ATOM 50 N SER A 6 10.309 16.572 6.000 1.00 0.00 N ATOM 51 CA SER A 6 9.023 16.273 5.380 1.00 0.00 C ATOM 52 C SER A 6 9.091 14.972 4.587 1.00 0.00 C ATOM 53 O SER A 6 10.165 14.549 4.158 1.00 0.00 O ATOM 54 CB SER A 6 8.597 17.421 4.463 1.00 0.00 C ATOM 55 OG SER A 6 7.742 18.325 5.141 1.00 0.00 O ATOM 0 H SER A 6 11.118 16.371 5.412 1.00 0.00 H new ATOM 0 HA SER A 6 8.284 16.156 6.172 1.00 0.00 H new ATOM 0 HB2 SER A 6 9.480 17.950 4.104 1.00 0.00 H new ATOM 0 HB3 SER A 6 8.087 17.021 3.587 1.00 0.00 H new ATOM 0 HG SER A 6 7.485 19.050 4.534 1.00 0.00 H new ATOM 61 N GLY A 7 7.938 14.339 4.397 1.00 0.00 N ATOM 62 CA GLY A 7 7.890 13.092 3.658 1.00 0.00 C ATOM 63 C GLY A 7 8.177 11.888 4.531 1.00 0.00 C ATOM 64 O GLY A 7 9.236 11.803 5.154 1.00 0.00 O ATOM 0 H GLY A 7 7.036 14.668 4.742 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.906 12.981 3.204 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.615 13.128 2.844 1.00 0.00 H new ATOM 68 N ILE A 8 7.232 10.955 4.580 1.00 0.00 N ATOM 69 CA ILE A 8 7.388 9.750 5.385 1.00 0.00 C ATOM 70 C ILE A 8 6.975 8.508 4.603 1.00 0.00 C ATOM 71 O ILE A 8 6.215 8.595 3.637 1.00 0.00 O ATOM 72 CB ILE A 8 6.558 9.828 6.680 1.00 0.00 C ATOM 73 CG1 ILE A 8 6.803 11.161 7.389 1.00 0.00 C ATOM 74 CG2 ILE A 8 6.895 8.662 7.598 1.00 0.00 C ATOM 75 CD1 ILE A 8 5.766 11.484 8.443 1.00 0.00 C ATOM 0 H ILE A 8 6.350 11.011 4.071 1.00 0.00 H new ATOM 0 HA ILE A 8 8.444 9.678 5.644 1.00 0.00 H new ATOM 0 HB ILE A 8 5.501 9.765 6.421 1.00 0.00 H new ATOM 0 HG12 ILE A 8 7.788 11.140 7.855 1.00 0.00 H new ATOM 0 HG13 ILE A 8 6.818 11.960 6.648 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.300 8.732 8.509 1.00 0.00 H new ATOM 0 HG22 ILE A 8 6.673 7.723 7.091 1.00 0.00 H new ATOM 0 HG23 ILE A 8 7.954 8.694 7.853 1.00 0.00 H new ATOM 0 HD11 ILE A 8 6.003 12.443 8.904 1.00 0.00 H new ATOM 0 HD12 ILE A 8 4.781 11.538 7.980 1.00 0.00 H new ATOM 0 HD13 ILE A 8 5.767 10.705 9.205 1.00 0.00 H new ATOM 87 N SER A 9 7.479 7.353 5.025 1.00 0.00 N ATOM 88 CA SER A 9 7.162 6.093 4.363 1.00 0.00 C ATOM 89 C SER A 9 7.535 4.906 5.245 1.00 0.00 C ATOM 90 O SER A 9 8.529 4.945 5.969 1.00 0.00 O ATOM 91 CB SER A 9 7.896 5.998 3.024 1.00 0.00 C ATOM 92 OG SER A 9 7.098 6.502 1.968 1.00 0.00 O ATOM 0 H SER A 9 8.109 7.264 5.822 1.00 0.00 H new ATOM 0 HA SER A 9 6.087 6.066 4.184 1.00 0.00 H new ATOM 0 HB2 SER A 9 8.830 6.558 3.077 1.00 0.00 H new ATOM 0 HB3 SER A 9 8.158 4.959 2.822 1.00 0.00 H new ATOM 0 HG SER A 9 6.635 7.313 2.266 1.00 0.00 H new ATOM 98 N LEU A 10 6.729 3.851 5.179 1.00 0.00 N ATOM 99 CA LEU A 10 6.973 2.651 5.971 1.00 0.00 C ATOM 100 C LEU A 10 7.861 1.671 5.213 1.00 0.00 C ATOM 101 O LEU A 10 7.457 1.112 4.193 1.00 0.00 O ATOM 102 CB LEU A 10 5.649 1.979 6.340 1.00 0.00 C ATOM 103 CG LEU A 10 5.024 2.458 7.652 1.00 0.00 C ATOM 104 CD1 LEU A 10 3.515 2.269 7.623 1.00 0.00 C ATOM 105 CD2 LEU A 10 5.633 1.718 8.833 1.00 0.00 C ATOM 0 H LEU A 10 5.901 3.803 4.585 1.00 0.00 H new ATOM 0 HA LEU A 10 7.488 2.948 6.885 1.00 0.00 H new ATOM 0 HB2 LEU A 10 4.936 2.147 5.533 1.00 0.00 H new ATOM 0 HB3 LEU A 10 5.810 0.903 6.404 1.00 0.00 H new ATOM 0 HG LEU A 10 5.235 3.521 7.767 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.087 2.615 8.564 1.00 0.00 H new ATOM 0 HD12 LEU A 10 3.092 2.844 6.799 1.00 0.00 H new ATOM 0 HD13 LEU A 10 3.283 1.213 7.485 1.00 0.00 H new ATOM 0 HD21 LEU A 10 5.177 2.071 9.758 1.00 0.00 H new ATOM 0 HD22 LEU A 10 5.452 0.649 8.725 1.00 0.00 H new ATOM 0 HD23 LEU A 10 6.707 1.903 8.864 1.00 0.00 H new ATOM 117 N LYS A 11 9.074 1.467 5.717 1.00 0.00 N ATOM 118 CA LYS A 11 10.020 0.553 5.086 1.00 0.00 C ATOM 119 C LYS A 11 10.097 -0.764 5.852 1.00 0.00 C ATOM 120 O LYS A 11 10.616 -0.816 6.967 1.00 0.00 O ATOM 121 CB LYS A 11 11.407 1.194 5.011 1.00 0.00 C ATOM 122 CG LYS A 11 11.476 2.385 4.068 1.00 0.00 C ATOM 123 CD LYS A 11 12.132 2.015 2.748 1.00 0.00 C ATOM 124 CE LYS A 11 12.826 3.210 2.116 1.00 0.00 C ATOM 125 NZ LYS A 11 14.081 3.568 2.835 1.00 0.00 N ATOM 0 H LYS A 11 9.425 1.922 6.560 1.00 0.00 H new ATOM 0 HA LYS A 11 9.668 0.345 4.076 1.00 0.00 H new ATOM 0 HB2 LYS A 11 11.705 1.514 6.010 1.00 0.00 H new ATOM 0 HB3 LYS A 11 12.128 0.443 4.688 1.00 0.00 H new ATOM 0 HG2 LYS A 11 10.470 2.762 3.882 1.00 0.00 H new ATOM 0 HG3 LYS A 11 12.036 3.192 4.540 1.00 0.00 H new ATOM 0 HD2 LYS A 11 12.856 1.217 2.912 1.00 0.00 H new ATOM 0 HD3 LYS A 11 11.379 1.626 2.063 1.00 0.00 H new ATOM 0 HE2 LYS A 11 13.056 2.987 1.074 1.00 0.00 H new ATOM 0 HE3 LYS A 11 12.150 4.065 2.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 14.650 4.206 2.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 13.845 4.043 3.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 14.625 2.704 3.035 1.00 0.00 H new ATOM 139 N TYR A 12 9.575 -1.826 5.247 1.00 0.00 N ATOM 140 CA TYR A 12 9.584 -3.142 5.872 1.00 0.00 C ATOM 141 C TYR A 12 9.956 -4.222 4.860 1.00 0.00 C ATOM 142 O TYR A 12 9.237 -4.448 3.886 1.00 0.00 O ATOM 143 CB TYR A 12 8.216 -3.449 6.484 1.00 0.00 C ATOM 144 CG TYR A 12 8.050 -2.924 7.892 1.00 0.00 C ATOM 145 CD1 TYR A 12 8.829 -3.415 8.933 1.00 0.00 C ATOM 146 CD2 TYR A 12 7.116 -1.937 8.181 1.00 0.00 C ATOM 147 CE1 TYR A 12 8.680 -2.938 10.222 1.00 0.00 C ATOM 148 CE2 TYR A 12 6.961 -1.455 9.467 1.00 0.00 C ATOM 149 CZ TYR A 12 7.745 -1.958 10.483 1.00 0.00 C ATOM 150 OH TYR A 12 7.595 -1.481 11.764 1.00 0.00 O ATOM 0 H TYR A 12 9.141 -1.800 4.325 1.00 0.00 H new ATOM 0 HA TYR A 12 10.334 -3.136 6.663 1.00 0.00 H new ATOM 0 HB2 TYR A 12 7.440 -3.019 5.851 1.00 0.00 H new ATOM 0 HB3 TYR A 12 8.063 -4.528 6.487 1.00 0.00 H new ATOM 0 HD1 TYR A 12 9.563 -4.182 8.732 1.00 0.00 H new ATOM 0 HD2 TYR A 12 6.501 -1.540 7.387 1.00 0.00 H new ATOM 0 HE1 TYR A 12 9.292 -3.331 11.020 1.00 0.00 H new ATOM 0 HE2 TYR A 12 6.229 -0.688 9.675 1.00 0.00 H new ATOM 0 HH TYR A 12 7.083 -0.646 11.744 1.00 0.00 H new ATOM 160 N THR A 13 11.082 -4.888 5.099 1.00 0.00 N ATOM 161 CA THR A 13 11.549 -5.944 4.209 1.00 0.00 C ATOM 162 C THR A 13 10.640 -7.166 4.290 1.00 0.00 C ATOM 163 O THR A 13 9.834 -7.293 5.212 1.00 0.00 O ATOM 164 CB THR A 13 12.984 -6.338 4.558 1.00 0.00 C ATOM 165 OG1 THR A 13 13.036 -6.975 5.823 1.00 0.00 O ATOM 166 CG2 THR A 13 13.935 -5.161 4.598 1.00 0.00 C ATOM 0 H THR A 13 11.687 -4.715 5.902 1.00 0.00 H new ATOM 0 HA THR A 13 11.523 -5.561 3.189 1.00 0.00 H new ATOM 0 HB THR A 13 13.300 -7.013 3.762 1.00 0.00 H new ATOM 0 HG1 THR A 13 13.962 -7.221 6.028 1.00 0.00 H new ATOM 0 HG21 THR A 13 14.936 -5.510 4.851 1.00 0.00 H new ATOM 0 HG22 THR A 13 13.956 -4.677 3.622 1.00 0.00 H new ATOM 0 HG23 THR A 13 13.599 -4.447 5.350 1.00 0.00 H new ATOM 174 N ALA A 14 10.775 -8.064 3.320 1.00 0.00 N ATOM 175 CA ALA A 14 9.965 -9.276 3.282 1.00 0.00 C ATOM 176 C ALA A 14 10.183 -10.120 4.533 1.00 0.00 C ATOM 177 O ALA A 14 9.254 -10.745 5.043 1.00 0.00 O ATOM 178 CB ALA A 14 10.285 -10.085 2.034 1.00 0.00 C ATOM 0 H ALA A 14 11.438 -7.975 2.550 1.00 0.00 H new ATOM 0 HA ALA A 14 8.916 -8.983 3.252 1.00 0.00 H new ATOM 0 HB1 ALA A 14 9.673 -10.987 2.018 1.00 0.00 H new ATOM 0 HB2 ALA A 14 10.072 -9.487 1.148 1.00 0.00 H new ATOM 0 HB3 ALA A 14 11.339 -10.362 2.040 1.00 0.00 H new ATOM 184 N ALA A 15 11.419 -10.135 5.023 1.00 0.00 N ATOM 185 CA ALA A 15 11.759 -10.902 6.215 1.00 0.00 C ATOM 186 C ALA A 15 10.973 -10.414 7.426 1.00 0.00 C ATOM 187 O ALA A 15 10.652 -11.191 8.325 1.00 0.00 O ATOM 188 CB ALA A 15 13.254 -10.820 6.486 1.00 0.00 C ATOM 0 H ALA A 15 12.201 -9.625 4.613 1.00 0.00 H new ATOM 0 HA ALA A 15 11.489 -11.943 6.036 1.00 0.00 H new ATOM 0 HB1 ALA A 15 13.494 -11.397 7.379 1.00 0.00 H new ATOM 0 HB2 ALA A 15 13.801 -11.225 5.634 1.00 0.00 H new ATOM 0 HB3 ALA A 15 13.539 -9.779 6.639 1.00 0.00 H new ATOM 194 N ARG A 16 10.663 -9.121 7.442 1.00 0.00 N ATOM 195 CA ARG A 16 9.913 -8.529 8.545 1.00 0.00 C ATOM 196 C ARG A 16 8.430 -8.871 8.437 1.00 0.00 C ATOM 197 O ARG A 16 7.833 -9.389 9.381 1.00 0.00 O ATOM 198 CB ARG A 16 10.103 -7.009 8.560 1.00 0.00 C ATOM 199 CG ARG A 16 10.862 -6.506 9.777 1.00 0.00 C ATOM 200 CD ARG A 16 10.086 -6.754 11.060 1.00 0.00 C ATOM 201 NE ARG A 16 10.473 -5.829 12.122 1.00 0.00 N ATOM 202 CZ ARG A 16 11.641 -5.877 12.758 1.00 0.00 C ATOM 203 NH1 ARG A 16 12.539 -6.802 12.442 1.00 0.00 N ATOM 204 NH2 ARG A 16 11.912 -4.998 13.712 1.00 0.00 N ATOM 0 H ARG A 16 10.919 -8.464 6.705 1.00 0.00 H new ATOM 0 HA ARG A 16 10.295 -8.943 9.478 1.00 0.00 H new ATOM 0 HB2 ARG A 16 10.637 -6.708 7.659 1.00 0.00 H new ATOM 0 HB3 ARG A 16 9.125 -6.528 8.527 1.00 0.00 H new ATOM 0 HG2 ARG A 16 11.830 -7.004 9.834 1.00 0.00 H new ATOM 0 HG3 ARG A 16 11.058 -5.439 9.670 1.00 0.00 H new ATOM 0 HD2 ARG A 16 9.019 -6.654 10.863 1.00 0.00 H new ATOM 0 HD3 ARG A 16 10.254 -7.778 11.393 1.00 0.00 H new ATOM 0 HE ARG A 16 9.809 -5.103 12.392 1.00 0.00 H new ATOM 0 HH11 ARG A 16 12.335 -7.481 11.708 1.00 0.00 H new ATOM 0 HH12 ARG A 16 13.433 -6.834 12.933 1.00 0.00 H new ATOM 0 HH21 ARG A 16 11.225 -4.285 13.959 1.00 0.00 H new ATOM 0 HH22 ARG A 16 12.807 -5.034 14.200 1.00 0.00 H new ATOM 218 N LEU A 17 7.842 -8.578 7.282 1.00 0.00 N ATOM 219 CA LEU A 17 6.429 -8.854 7.052 1.00 0.00 C ATOM 220 C LEU A 17 6.143 -10.348 7.157 1.00 0.00 C ATOM 221 O LEU A 17 5.085 -10.756 7.637 1.00 0.00 O ATOM 222 CB LEU A 17 6.004 -8.338 5.676 1.00 0.00 C ATOM 223 CG LEU A 17 6.334 -6.869 5.404 1.00 0.00 C ATOM 224 CD1 LEU A 17 6.274 -6.575 3.914 1.00 0.00 C ATOM 225 CD2 LEU A 17 5.382 -5.961 6.168 1.00 0.00 C ATOM 0 H LEU A 17 8.322 -8.149 6.491 1.00 0.00 H new ATOM 0 HA LEU A 17 5.854 -8.337 7.820 1.00 0.00 H new ATOM 0 HB2 LEU A 17 6.483 -8.950 4.912 1.00 0.00 H new ATOM 0 HB3 LEU A 17 4.928 -8.479 5.569 1.00 0.00 H new ATOM 0 HG LEU A 17 7.349 -6.673 5.750 1.00 0.00 H new ATOM 0 HD11 LEU A 17 6.512 -5.525 3.740 1.00 0.00 H new ATOM 0 HD12 LEU A 17 6.996 -7.202 3.390 1.00 0.00 H new ATOM 0 HD13 LEU A 17 5.272 -6.787 3.541 1.00 0.00 H new ATOM 0 HD21 LEU A 17 5.630 -4.919 5.964 1.00 0.00 H new ATOM 0 HD22 LEU A 17 4.358 -6.159 5.852 1.00 0.00 H new ATOM 0 HD23 LEU A 17 5.475 -6.153 7.237 1.00 0.00 H new ATOM 237 N HIS A 18 7.092 -11.161 6.705 1.00 0.00 N ATOM 238 CA HIS A 18 6.942 -12.611 6.747 1.00 0.00 C ATOM 239 C HIS A 18 6.855 -13.107 8.187 1.00 0.00 C ATOM 240 O HIS A 18 6.064 -13.997 8.500 1.00 0.00 O ATOM 241 CB HIS A 18 8.115 -13.287 6.033 1.00 0.00 C ATOM 242 CG HIS A 18 7.947 -14.766 5.877 1.00 0.00 C ATOM 243 ND1 HIS A 18 8.686 -15.687 6.589 1.00 0.00 N ATOM 244 CD2 HIS A 18 7.118 -15.485 5.084 1.00 0.00 C ATOM 245 CE1 HIS A 18 8.320 -16.907 6.240 1.00 0.00 C ATOM 246 NE2 HIS A 18 7.369 -16.813 5.330 1.00 0.00 N ATOM 0 H HIS A 18 7.974 -10.840 6.305 1.00 0.00 H new ATOM 0 HA HIS A 18 6.015 -12.871 6.235 1.00 0.00 H new ATOM 0 HB2 HIS A 18 8.238 -12.837 5.048 1.00 0.00 H new ATOM 0 HB3 HIS A 18 9.031 -13.090 6.590 1.00 0.00 H new ATOM 0 HD2 HIS A 18 6.394 -15.088 4.388 1.00 0.00 H new ATOM 0 HE1 HIS A 18 8.730 -17.826 6.633 1.00 0.00 H new ATOM 0 HE2 HIS A 18 6.897 -17.599 4.882 1.00 0.00 H new ATOM 255 N GLU A 19 7.672 -12.525 9.059 1.00 0.00 N ATOM 256 CA GLU A 19 7.687 -12.907 10.466 1.00 0.00 C ATOM 257 C GLU A 19 6.370 -12.542 11.143 1.00 0.00 C ATOM 258 O GLU A 19 5.897 -13.255 12.028 1.00 0.00 O ATOM 259 CB GLU A 19 8.851 -12.227 11.189 1.00 0.00 C ATOM 260 CG GLU A 19 10.190 -12.907 10.959 1.00 0.00 C ATOM 261 CD GLU A 19 10.199 -14.350 11.425 1.00 0.00 C ATOM 262 OE1 GLU A 19 9.961 -14.586 12.629 1.00 0.00 O ATOM 263 OE2 GLU A 19 10.442 -15.244 10.587 1.00 0.00 O ATOM 0 H GLU A 19 8.332 -11.787 8.816 1.00 0.00 H new ATOM 0 HA GLU A 19 7.816 -13.988 10.521 1.00 0.00 H new ATOM 0 HB2 GLU A 19 8.918 -11.191 10.858 1.00 0.00 H new ATOM 0 HB3 GLU A 19 8.642 -12.207 12.259 1.00 0.00 H new ATOM 0 HG2 GLU A 19 10.434 -12.870 9.897 1.00 0.00 H new ATOM 0 HG3 GLU A 19 10.969 -12.355 11.485 1.00 0.00 H new ATOM 270 N LYS A 20 5.784 -11.426 10.723 1.00 0.00 N ATOM 271 CA LYS A 20 4.522 -10.965 11.290 1.00 0.00 C ATOM 272 C LYS A 20 3.359 -11.825 10.803 1.00 0.00 C ATOM 273 O LYS A 20 2.370 -12.008 11.513 1.00 0.00 O ATOM 274 CB LYS A 20 4.277 -9.500 10.923 1.00 0.00 C ATOM 275 CG LYS A 20 5.446 -8.587 11.258 1.00 0.00 C ATOM 276 CD LYS A 20 5.416 -7.314 10.427 1.00 0.00 C ATOM 277 CE LYS A 20 5.003 -6.113 11.262 1.00 0.00 C ATOM 278 NZ LYS A 20 6.176 -5.451 11.899 1.00 0.00 N ATOM 0 H LYS A 20 6.163 -10.824 9.992 1.00 0.00 H new ATOM 0 HA LYS A 20 4.587 -11.054 12.374 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.067 -9.431 9.856 1.00 0.00 H new ATOM 0 HB3 LYS A 20 3.389 -9.146 11.446 1.00 0.00 H new ATOM 0 HG2 LYS A 20 5.417 -8.332 12.317 1.00 0.00 H new ATOM 0 HG3 LYS A 20 6.383 -9.115 11.082 1.00 0.00 H new ATOM 0 HD2 LYS A 20 6.401 -7.137 9.995 1.00 0.00 H new ATOM 0 HD3 LYS A 20 4.721 -7.437 9.596 1.00 0.00 H new ATOM 0 HE2 LYS A 20 4.479 -5.395 10.631 1.00 0.00 H new ATOM 0 HE3 LYS A 20 4.302 -6.431 12.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 5.853 -4.637 12.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 6.662 -6.129 12.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 6.833 -5.125 11.162 1.00 0.00 H new ATOM 292 N GLY A 21 3.484 -12.348 9.588 1.00 0.00 N ATOM 293 CA GLY A 21 2.435 -13.182 9.028 1.00 0.00 C ATOM 294 C GLY A 21 1.819 -12.587 7.775 1.00 0.00 C ATOM 295 O GLY A 21 1.130 -13.280 7.027 1.00 0.00 O ATOM 0 H GLY A 21 4.292 -12.210 8.981 1.00 0.00 H new ATOM 0 HA2 GLY A 21 2.844 -14.165 8.795 1.00 0.00 H new ATOM 0 HA3 GLY A 21 1.656 -13.330 9.776 1.00 0.00 H new ATOM 299 N VAL A 22 2.064 -11.298 7.545 1.00 0.00 N ATOM 300 CA VAL A 22 1.525 -10.616 6.374 1.00 0.00 C ATOM 301 C VAL A 22 1.948 -11.315 5.086 1.00 0.00 C ATOM 302 O VAL A 22 1.120 -11.884 4.375 1.00 0.00 O ATOM 303 CB VAL A 22 1.981 -9.145 6.322 1.00 0.00 C ATOM 304 CG1 VAL A 22 1.283 -8.408 5.188 1.00 0.00 C ATOM 305 CG2 VAL A 22 1.724 -8.455 7.654 1.00 0.00 C ATOM 0 H VAL A 22 2.631 -10.708 8.154 1.00 0.00 H new ATOM 0 HA VAL A 22 0.439 -10.649 6.461 1.00 0.00 H new ATOM 0 HB VAL A 22 3.054 -9.125 6.132 1.00 0.00 H new ATOM 0 HG11 VAL A 22 1.618 -7.371 5.168 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.526 -8.887 4.239 1.00 0.00 H new ATOM 0 HG13 VAL A 22 0.205 -8.438 5.344 1.00 0.00 H new ATOM 0 HG21 VAL A 22 2.053 -7.418 7.596 1.00 0.00 H new ATOM 0 HG22 VAL A 22 0.658 -8.485 7.880 1.00 0.00 H new ATOM 0 HG23 VAL A 22 2.277 -8.967 8.442 1.00 0.00 H new ATOM 315 N LEU A 23 3.243 -11.267 4.790 1.00 0.00 N ATOM 316 CA LEU A 23 3.776 -11.895 3.587 1.00 0.00 C ATOM 317 C LEU A 23 3.726 -13.416 3.700 1.00 0.00 C ATOM 318 O LEU A 23 3.958 -13.977 4.770 1.00 0.00 O ATOM 319 CB LEU A 23 5.214 -11.438 3.341 1.00 0.00 C ATOM 320 CG LEU A 23 5.733 -11.668 1.920 1.00 0.00 C ATOM 321 CD1 LEU A 23 5.000 -10.772 0.934 1.00 0.00 C ATOM 322 CD2 LEU A 23 7.232 -11.420 1.855 1.00 0.00 C ATOM 0 H LEU A 23 3.942 -10.800 5.367 1.00 0.00 H new ATOM 0 HA LEU A 23 3.157 -11.590 2.744 1.00 0.00 H new ATOM 0 HB2 LEU A 23 5.285 -10.375 3.570 1.00 0.00 H new ATOM 0 HB3 LEU A 23 5.869 -11.959 4.039 1.00 0.00 H new ATOM 0 HG LEU A 23 5.544 -12.706 1.647 1.00 0.00 H new ATOM 0 HD11 LEU A 23 5.382 -10.949 -0.072 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.934 -10.996 0.962 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.158 -9.728 1.204 1.00 0.00 H new ATOM 0 HD21 LEU A 23 7.585 -11.588 0.837 1.00 0.00 H new ATOM 0 HD22 LEU A 23 7.444 -10.391 2.147 1.00 0.00 H new ATOM 0 HD23 LEU A 23 7.743 -12.103 2.534 1.00 0.00 H new ATOM 334 N LEU A 24 3.420 -14.076 2.588 1.00 0.00 N ATOM 335 CA LEU A 24 3.339 -15.532 2.561 1.00 0.00 C ATOM 336 C LEU A 24 4.545 -16.131 1.845 1.00 0.00 C ATOM 337 O LEU A 24 5.388 -16.780 2.464 1.00 0.00 O ATOM 338 CB LEU A 24 2.048 -15.980 1.873 1.00 0.00 C ATOM 339 CG LEU A 24 0.760 -15.441 2.499 1.00 0.00 C ATOM 340 CD1 LEU A 24 -0.439 -15.777 1.626 1.00 0.00 C ATOM 341 CD2 LEU A 24 0.576 -16.001 3.901 1.00 0.00 C ATOM 0 H LEU A 24 3.224 -13.626 1.694 1.00 0.00 H new ATOM 0 HA LEU A 24 3.336 -15.890 3.591 1.00 0.00 H new ATOM 0 HB2 LEU A 24 2.084 -15.669 0.829 1.00 0.00 H new ATOM 0 HB3 LEU A 24 2.009 -17.069 1.880 1.00 0.00 H new ATOM 0 HG LEU A 24 0.838 -14.356 2.570 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.346 -15.386 2.087 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -0.310 -15.328 0.641 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.522 -16.859 1.523 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -0.345 -15.608 4.332 1.00 0.00 H new ATOM 0 HD22 LEU A 24 0.519 -17.088 3.854 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.422 -15.709 4.523 1.00 0.00 H new ATOM 353 N GLU A 25 4.621 -15.909 0.537 1.00 0.00 N ATOM 354 CA GLU A 25 5.723 -16.427 -0.264 1.00 0.00 C ATOM 355 C GLU A 25 5.986 -15.532 -1.471 1.00 0.00 C ATOM 356 O GLU A 25 5.264 -14.564 -1.708 1.00 0.00 O ATOM 357 CB GLU A 25 5.419 -17.852 -0.728 1.00 0.00 C ATOM 358 CG GLU A 25 5.501 -18.884 0.384 1.00 0.00 C ATOM 359 CD GLU A 25 5.053 -20.262 -0.066 1.00 0.00 C ATOM 360 OE1 GLU A 25 3.871 -20.409 -0.440 1.00 0.00 O ATOM 361 OE2 GLU A 25 5.885 -21.194 -0.043 1.00 0.00 O ATOM 0 H GLU A 25 3.932 -15.373 0.009 1.00 0.00 H new ATOM 0 HA GLU A 25 6.617 -16.439 0.359 1.00 0.00 H new ATOM 0 HB2 GLU A 25 4.420 -17.878 -1.164 1.00 0.00 H new ATOM 0 HB3 GLU A 25 6.119 -18.125 -1.518 1.00 0.00 H new ATOM 0 HG2 GLU A 25 6.527 -18.940 0.748 1.00 0.00 H new ATOM 0 HG3 GLU A 25 4.883 -18.560 1.222 1.00 0.00 H new ATOM 368 N ILE A 26 7.024 -15.863 -2.232 1.00 0.00 N ATOM 369 CA ILE A 26 7.382 -15.090 -3.415 1.00 0.00 C ATOM 370 C ILE A 26 7.784 -16.005 -4.567 1.00 0.00 C ATOM 371 O ILE A 26 8.811 -16.680 -4.509 1.00 0.00 O ATOM 372 CB ILE A 26 8.538 -14.116 -3.121 1.00 0.00 C ATOM 373 CG1 ILE A 26 8.254 -13.322 -1.846 1.00 0.00 C ATOM 374 CG2 ILE A 26 8.754 -13.179 -4.299 1.00 0.00 C ATOM 375 CD1 ILE A 26 9.458 -12.573 -1.317 1.00 0.00 C ATOM 0 H ILE A 26 7.632 -16.662 -2.050 1.00 0.00 H new ATOM 0 HA ILE A 26 6.499 -14.518 -3.699 1.00 0.00 H new ATOM 0 HB ILE A 26 9.450 -14.694 -2.970 1.00 0.00 H new ATOM 0 HG12 ILE A 26 7.452 -12.611 -2.042 1.00 0.00 H new ATOM 0 HG13 ILE A 26 7.894 -14.004 -1.076 1.00 0.00 H new ATOM 0 HG21 ILE A 26 9.574 -12.497 -4.076 1.00 0.00 H new ATOM 0 HG22 ILE A 26 8.998 -13.762 -5.187 1.00 0.00 H new ATOM 0 HG23 ILE A 26 7.845 -12.606 -4.480 1.00 0.00 H new ATOM 0 HD11 ILE A 26 9.181 -12.033 -0.412 1.00 0.00 H new ATOM 0 HD12 ILE A 26 10.255 -13.281 -1.088 1.00 0.00 H new ATOM 0 HD13 ILE A 26 9.806 -11.865 -2.070 1.00 0.00 H new ATOM 387 N GLU A 27 6.966 -16.021 -5.615 1.00 0.00 N ATOM 388 CA GLU A 27 7.237 -16.853 -6.782 1.00 0.00 C ATOM 389 C GLU A 27 8.387 -16.278 -7.605 1.00 0.00 C ATOM 390 O GLU A 27 8.201 -15.864 -8.750 1.00 0.00 O ATOM 391 CB GLU A 27 5.981 -16.974 -7.649 1.00 0.00 C ATOM 392 CG GLU A 27 5.131 -18.190 -7.321 1.00 0.00 C ATOM 393 CD GLU A 27 5.614 -19.445 -8.022 1.00 0.00 C ATOM 394 OE1 GLU A 27 5.189 -19.682 -9.173 1.00 0.00 O ATOM 395 OE2 GLU A 27 6.416 -20.189 -7.421 1.00 0.00 O ATOM 0 H GLU A 27 6.111 -15.468 -5.680 1.00 0.00 H new ATOM 0 HA GLU A 27 7.526 -17.844 -6.433 1.00 0.00 H new ATOM 0 HB2 GLU A 27 5.377 -16.075 -7.526 1.00 0.00 H new ATOM 0 HB3 GLU A 27 6.276 -17.019 -8.697 1.00 0.00 H new ATOM 0 HG2 GLU A 27 5.139 -18.354 -6.243 1.00 0.00 H new ATOM 0 HG3 GLU A 27 4.097 -17.994 -7.606 1.00 0.00 H new ATOM 402 N ASP A 28 9.578 -16.257 -7.013 1.00 0.00 N ATOM 403 CA ASP A 28 10.758 -15.733 -7.690 1.00 0.00 C ATOM 404 C ASP A 28 11.997 -15.876 -6.812 1.00 0.00 C ATOM 405 O ASP A 28 13.053 -16.308 -7.275 1.00 0.00 O ATOM 406 CB ASP A 28 10.551 -14.264 -8.063 1.00 0.00 C ATOM 407 CG ASP A 28 11.336 -13.864 -9.296 1.00 0.00 C ATOM 408 OD1 ASP A 28 11.468 -14.701 -10.214 1.00 0.00 O ATOM 409 OD2 ASP A 28 11.821 -12.714 -9.344 1.00 0.00 O ATOM 0 H ASP A 28 9.750 -16.597 -6.067 1.00 0.00 H new ATOM 0 HA ASP A 28 10.909 -16.313 -8.600 1.00 0.00 H new ATOM 0 HB2 ASP A 28 9.490 -14.082 -8.236 1.00 0.00 H new ATOM 0 HB3 ASP A 28 10.850 -13.634 -7.225 1.00 0.00 H new ATOM 414 N LEU A 29 11.860 -15.511 -5.542 1.00 0.00 N ATOM 415 CA LEU A 29 12.969 -15.598 -4.598 1.00 0.00 C ATOM 416 C LEU A 29 12.689 -16.644 -3.524 1.00 0.00 C ATOM 417 O LEU A 29 11.571 -17.145 -3.407 1.00 0.00 O ATOM 418 CB LEU A 29 13.218 -14.236 -3.946 1.00 0.00 C ATOM 419 CG LEU A 29 13.316 -13.060 -4.919 1.00 0.00 C ATOM 420 CD1 LEU A 29 13.257 -11.739 -4.166 1.00 0.00 C ATOM 421 CD2 LEU A 29 14.594 -13.153 -5.738 1.00 0.00 C ATOM 0 H LEU A 29 10.993 -15.152 -5.142 1.00 0.00 H new ATOM 0 HA LEU A 29 13.860 -15.899 -5.149 1.00 0.00 H new ATOM 0 HB2 LEU A 29 12.413 -14.036 -3.239 1.00 0.00 H new ATOM 0 HB3 LEU A 29 14.142 -14.289 -3.370 1.00 0.00 H new ATOM 0 HG LEU A 29 12.467 -13.104 -5.601 1.00 0.00 H new ATOM 0 HD11 LEU A 29 13.328 -10.913 -4.874 1.00 0.00 H new ATOM 0 HD12 LEU A 29 12.314 -11.671 -3.623 1.00 0.00 H new ATOM 0 HD13 LEU A 29 14.086 -11.685 -3.461 1.00 0.00 H new ATOM 0 HD21 LEU A 29 14.648 -12.309 -6.425 1.00 0.00 H new ATOM 0 HD22 LEU A 29 15.456 -13.134 -5.071 1.00 0.00 H new ATOM 0 HD23 LEU A 29 14.595 -14.083 -6.306 1.00 0.00 H new ATOM 433 N GLN A 30 13.713 -16.967 -2.740 1.00 0.00 N ATOM 434 CA GLN A 30 13.577 -17.953 -1.674 1.00 0.00 C ATOM 435 C GLN A 30 13.213 -17.279 -0.355 1.00 0.00 C ATOM 436 O GLN A 30 12.921 -16.084 -0.318 1.00 0.00 O ATOM 437 CB GLN A 30 14.877 -18.745 -1.515 1.00 0.00 C ATOM 438 CG GLN A 30 15.413 -19.303 -2.823 1.00 0.00 C ATOM 439 CD GLN A 30 16.884 -18.994 -3.031 1.00 0.00 C ATOM 440 OE1 GLN A 30 17.631 -18.798 -2.073 1.00 0.00 O ATOM 441 NE2 GLN A 30 17.306 -18.947 -4.289 1.00 0.00 N ATOM 0 H GLN A 30 14.645 -16.561 -2.823 1.00 0.00 H new ATOM 0 HA GLN A 30 12.774 -18.638 -1.945 1.00 0.00 H new ATOM 0 HB2 GLN A 30 15.633 -18.100 -1.068 1.00 0.00 H new ATOM 0 HB3 GLN A 30 14.709 -19.568 -0.820 1.00 0.00 H new ATOM 0 HG2 GLN A 30 15.267 -20.383 -2.840 1.00 0.00 H new ATOM 0 HG3 GLN A 30 14.838 -18.890 -3.652 1.00 0.00 H new ATOM 0 HE21 GLN A 30 16.652 -19.116 -5.053 1.00 0.00 H new ATOM 0 HE22 GLN A 30 18.284 -18.742 -4.491 1.00 0.00 H new ATOM 450 N VAL A 31 13.232 -18.053 0.725 1.00 0.00 N ATOM 451 CA VAL A 31 12.902 -17.530 2.045 1.00 0.00 C ATOM 452 C VAL A 31 14.034 -16.663 2.590 1.00 0.00 C ATOM 453 O VAL A 31 13.793 -15.655 3.253 1.00 0.00 O ATOM 454 CB VAL A 31 12.613 -18.665 3.044 1.00 0.00 C ATOM 455 CG1 VAL A 31 12.119 -18.102 4.368 1.00 0.00 C ATOM 456 CG2 VAL A 31 11.602 -19.645 2.465 1.00 0.00 C ATOM 0 H VAL A 31 13.472 -19.044 0.712 1.00 0.00 H new ATOM 0 HA VAL A 31 12.004 -16.922 1.929 1.00 0.00 H new ATOM 0 HB VAL A 31 13.543 -19.203 3.228 1.00 0.00 H new ATOM 0 HG11 VAL A 31 11.921 -18.920 5.060 1.00 0.00 H new ATOM 0 HG12 VAL A 31 12.880 -17.446 4.791 1.00 0.00 H new ATOM 0 HG13 VAL A 31 11.202 -17.536 4.203 1.00 0.00 H new ATOM 0 HG21 VAL A 31 11.411 -20.440 3.186 1.00 0.00 H new ATOM 0 HG22 VAL A 31 10.671 -19.121 2.247 1.00 0.00 H new ATOM 0 HG23 VAL A 31 11.999 -20.077 1.546 1.00 0.00 H new ATOM 466 N ASN A 32 15.269 -17.065 2.306 1.00 0.00 N ATOM 467 CA ASN A 32 16.439 -16.325 2.767 1.00 0.00 C ATOM 468 C ASN A 32 16.629 -15.040 1.965 1.00 0.00 C ATOM 469 O ASN A 32 17.266 -14.096 2.433 1.00 0.00 O ATOM 470 CB ASN A 32 17.692 -17.197 2.659 1.00 0.00 C ATOM 471 CG ASN A 32 17.849 -17.817 1.285 1.00 0.00 C ATOM 472 OD1 ASN A 32 17.299 -18.881 1.005 1.00 0.00 O ATOM 473 ND2 ASN A 32 18.603 -17.150 0.418 1.00 0.00 N ATOM 0 H ASN A 32 15.485 -17.898 1.759 1.00 0.00 H new ATOM 0 HA ASN A 32 16.277 -16.056 3.811 1.00 0.00 H new ATOM 0 HB2 ASN A 32 18.571 -16.594 2.885 1.00 0.00 H new ATOM 0 HB3 ASN A 32 17.647 -17.988 3.408 1.00 0.00 H new ATOM 0 HD21 ASN A 32 18.745 -17.517 -0.523 1.00 0.00 H new ATOM 0 HD22 ASN A 32 19.040 -16.271 0.693 1.00 0.00 H new ATOM 480 N GLN A 33 16.073 -15.008 0.758 1.00 0.00 N ATOM 481 CA GLN A 33 16.185 -13.836 -0.104 1.00 0.00 C ATOM 482 C GLN A 33 15.286 -12.703 0.386 1.00 0.00 C ATOM 483 O GLN A 33 15.457 -11.550 -0.008 1.00 0.00 O ATOM 484 CB GLN A 33 15.823 -14.202 -1.545 1.00 0.00 C ATOM 485 CG GLN A 33 16.891 -15.020 -2.252 1.00 0.00 C ATOM 486 CD GLN A 33 17.112 -14.578 -3.685 1.00 0.00 C ATOM 487 OE1 GLN A 33 17.609 -13.481 -3.939 1.00 0.00 O ATOM 488 NE2 GLN A 33 16.740 -15.432 -4.631 1.00 0.00 N ATOM 0 H GLN A 33 15.541 -15.779 0.355 1.00 0.00 H new ATOM 0 HA GLN A 33 17.219 -13.492 -0.070 1.00 0.00 H new ATOM 0 HB2 GLN A 33 14.888 -14.763 -1.545 1.00 0.00 H new ATOM 0 HB3 GLN A 33 15.645 -13.287 -2.110 1.00 0.00 H new ATOM 0 HG2 GLN A 33 17.829 -14.939 -1.702 1.00 0.00 H new ATOM 0 HG3 GLN A 33 16.605 -16.072 -2.240 1.00 0.00 H new ATOM 0 HE21 GLN A 33 16.332 -16.331 -4.375 1.00 0.00 H new ATOM 0 HE22 GLN A 33 16.862 -15.189 -5.614 1.00 0.00 H new ATOM 497 N PHE A 34 14.326 -13.037 1.247 1.00 0.00 N ATOM 498 CA PHE A 34 13.401 -12.046 1.790 1.00 0.00 C ATOM 499 C PHE A 34 14.145 -10.820 2.317 1.00 0.00 C ATOM 500 O PHE A 34 13.603 -9.716 2.337 1.00 0.00 O ATOM 501 CB PHE A 34 12.564 -12.666 2.910 1.00 0.00 C ATOM 502 CG PHE A 34 11.316 -13.349 2.426 1.00 0.00 C ATOM 503 CD1 PHE A 34 11.330 -14.113 1.269 1.00 0.00 C ATOM 504 CD2 PHE A 34 10.128 -13.227 3.129 1.00 0.00 C ATOM 505 CE1 PHE A 34 10.182 -14.742 0.823 1.00 0.00 C ATOM 506 CE2 PHE A 34 8.977 -13.854 2.688 1.00 0.00 C ATOM 507 CZ PHE A 34 9.005 -14.612 1.534 1.00 0.00 C ATOM 0 H PHE A 34 14.169 -13.987 1.583 1.00 0.00 H new ATOM 0 HA PHE A 34 12.744 -11.723 0.982 1.00 0.00 H new ATOM 0 HB2 PHE A 34 13.176 -13.388 3.451 1.00 0.00 H new ATOM 0 HB3 PHE A 34 12.288 -11.886 3.620 1.00 0.00 H new ATOM 0 HD1 PHE A 34 12.248 -14.218 0.710 1.00 0.00 H new ATOM 0 HD2 PHE A 34 10.101 -12.635 4.032 1.00 0.00 H new ATOM 0 HE1 PHE A 34 10.206 -15.334 -0.080 1.00 0.00 H new ATOM 0 HE2 PHE A 34 8.058 -13.751 3.245 1.00 0.00 H new ATOM 0 HZ PHE A 34 8.107 -15.103 1.188 1.00 0.00 H new ATOM 517 N LYS A 35 15.387 -11.025 2.744 1.00 0.00 N ATOM 518 CA LYS A 35 16.204 -9.938 3.272 1.00 0.00 C ATOM 519 C LYS A 35 16.353 -8.814 2.249 1.00 0.00 C ATOM 520 O LYS A 35 15.982 -7.669 2.511 1.00 0.00 O ATOM 521 CB LYS A 35 17.584 -10.461 3.680 1.00 0.00 C ATOM 522 CG LYS A 35 17.769 -10.574 5.186 1.00 0.00 C ATOM 523 CD LYS A 35 19.110 -10.008 5.629 1.00 0.00 C ATOM 524 CE LYS A 35 19.771 -10.891 6.677 1.00 0.00 C ATOM 525 NZ LYS A 35 20.899 -11.678 6.108 1.00 0.00 N ATOM 0 H LYS A 35 15.850 -11.934 2.735 1.00 0.00 H new ATOM 0 HA LYS A 35 15.700 -9.535 4.151 1.00 0.00 H new ATOM 0 HB2 LYS A 35 17.741 -11.440 3.228 1.00 0.00 H new ATOM 0 HB3 LYS A 35 18.349 -9.798 3.277 1.00 0.00 H new ATOM 0 HG2 LYS A 35 16.964 -10.043 5.693 1.00 0.00 H new ATOM 0 HG3 LYS A 35 17.698 -11.620 5.485 1.00 0.00 H new ATOM 0 HD2 LYS A 35 19.768 -9.912 4.766 1.00 0.00 H new ATOM 0 HD3 LYS A 35 18.967 -9.006 6.034 1.00 0.00 H new ATOM 0 HE2 LYS A 35 20.137 -10.271 7.495 1.00 0.00 H new ATOM 0 HE3 LYS A 35 19.030 -11.571 7.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 21.323 -12.266 6.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 20.546 -12.289 5.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 21.618 -11.030 5.728 1.00 0.00 H new ATOM 539 N ASN A 36 16.900 -9.148 1.084 1.00 0.00 N ATOM 540 CA ASN A 36 17.099 -8.165 0.024 1.00 0.00 C ATOM 541 C ASN A 36 15.774 -7.535 -0.394 1.00 0.00 C ATOM 542 O ASN A 36 15.715 -6.348 -0.714 1.00 0.00 O ATOM 543 CB ASN A 36 17.771 -8.816 -1.187 1.00 0.00 C ATOM 544 CG ASN A 36 17.038 -10.055 -1.660 1.00 0.00 C ATOM 545 OD1 ASN A 36 15.960 -9.967 -2.248 1.00 0.00 O ATOM 546 ND2 ASN A 36 17.621 -11.222 -1.406 1.00 0.00 N ATOM 0 H ASN A 36 17.213 -10.090 0.850 1.00 0.00 H new ATOM 0 HA ASN A 36 17.747 -7.379 0.412 1.00 0.00 H new ATOM 0 HB2 ASN A 36 17.822 -8.094 -2.002 1.00 0.00 H new ATOM 0 HB3 ASN A 36 18.797 -9.080 -0.931 1.00 0.00 H new ATOM 0 HD21 ASN A 36 17.174 -12.090 -1.701 1.00 0.00 H new ATOM 0 HD22 ASN A 36 18.515 -11.249 -0.916 1.00 0.00 H new ATOM 553 N VAL A 37 14.713 -8.334 -0.387 1.00 0.00 N ATOM 554 CA VAL A 37 13.390 -7.851 -0.765 1.00 0.00 C ATOM 555 C VAL A 37 12.938 -6.718 0.150 1.00 0.00 C ATOM 556 O VAL A 37 13.165 -6.755 1.359 1.00 0.00 O ATOM 557 CB VAL A 37 12.344 -8.981 -0.721 1.00 0.00 C ATOM 558 CG1 VAL A 37 11.007 -8.495 -1.260 1.00 0.00 C ATOM 559 CG2 VAL A 37 12.833 -10.192 -1.501 1.00 0.00 C ATOM 0 H VAL A 37 14.743 -9.319 -0.124 1.00 0.00 H new ATOM 0 HA VAL A 37 13.469 -7.481 -1.787 1.00 0.00 H new ATOM 0 HB VAL A 37 12.203 -9.279 0.318 1.00 0.00 H new ATOM 0 HG11 VAL A 37 10.282 -9.308 -1.221 1.00 0.00 H new ATOM 0 HG12 VAL A 37 10.652 -7.662 -0.654 1.00 0.00 H new ATOM 0 HG13 VAL A 37 11.128 -8.167 -2.292 1.00 0.00 H new ATOM 0 HG21 VAL A 37 12.081 -10.980 -1.459 1.00 0.00 H new ATOM 0 HG22 VAL A 37 13.005 -9.910 -2.540 1.00 0.00 H new ATOM 0 HG23 VAL A 37 13.763 -10.555 -1.064 1.00 0.00 H new ATOM 569 N ILE A 38 12.298 -5.712 -0.436 1.00 0.00 N ATOM 570 CA ILE A 38 11.813 -4.567 0.326 1.00 0.00 C ATOM 571 C ILE A 38 10.568 -3.966 -0.320 1.00 0.00 C ATOM 572 O ILE A 38 10.426 -3.975 -1.543 1.00 0.00 O ATOM 573 CB ILE A 38 12.898 -3.477 0.454 1.00 0.00 C ATOM 574 CG1 ILE A 38 12.397 -2.323 1.326 1.00 0.00 C ATOM 575 CG2 ILE A 38 13.309 -2.971 -0.921 1.00 0.00 C ATOM 576 CD1 ILE A 38 13.482 -1.340 1.708 1.00 0.00 C ATOM 0 H ILE A 38 12.103 -5.666 -1.436 1.00 0.00 H new ATOM 0 HA ILE A 38 11.559 -4.931 1.322 1.00 0.00 H new ATOM 0 HB ILE A 38 13.773 -3.915 0.934 1.00 0.00 H new ATOM 0 HG12 ILE A 38 11.608 -1.792 0.794 1.00 0.00 H new ATOM 0 HG13 ILE A 38 11.951 -2.731 2.233 1.00 0.00 H new ATOM 0 HG21 ILE A 38 14.075 -2.203 -0.812 1.00 0.00 H new ATOM 0 HG22 ILE A 38 13.706 -3.798 -1.509 1.00 0.00 H new ATOM 0 HG23 ILE A 38 12.441 -2.549 -1.428 1.00 0.00 H new ATOM 0 HD11 ILE A 38 13.056 -0.549 2.325 1.00 0.00 H new ATOM 0 HD12 ILE A 38 14.261 -1.857 2.268 1.00 0.00 H new ATOM 0 HD13 ILE A 38 13.912 -0.904 0.806 1.00 0.00 H new ATOM 588 N PHE A 39 9.669 -3.446 0.510 1.00 0.00 N ATOM 589 CA PHE A 39 8.436 -2.842 0.020 1.00 0.00 C ATOM 590 C PHE A 39 8.247 -1.444 0.599 1.00 0.00 C ATOM 591 O PHE A 39 8.102 -1.278 1.811 1.00 0.00 O ATOM 592 CB PHE A 39 7.236 -3.720 0.375 1.00 0.00 C ATOM 593 CG PHE A 39 7.350 -5.127 -0.141 1.00 0.00 C ATOM 594 CD1 PHE A 39 7.975 -6.107 0.613 1.00 0.00 C ATOM 595 CD2 PHE A 39 6.832 -5.469 -1.380 1.00 0.00 C ATOM 596 CE1 PHE A 39 8.081 -7.401 0.141 1.00 0.00 C ATOM 597 CE2 PHE A 39 6.936 -6.761 -1.858 1.00 0.00 C ATOM 598 CZ PHE A 39 7.560 -7.729 -1.096 1.00 0.00 C ATOM 0 H PHE A 39 9.772 -3.431 1.525 1.00 0.00 H new ATOM 0 HA PHE A 39 8.508 -2.760 -1.064 1.00 0.00 H new ATOM 0 HB2 PHE A 39 7.123 -3.747 1.459 1.00 0.00 H new ATOM 0 HB3 PHE A 39 6.331 -3.266 -0.028 1.00 0.00 H new ATOM 0 HD1 PHE A 39 8.384 -5.856 1.581 1.00 0.00 H new ATOM 0 HD2 PHE A 39 6.341 -4.716 -1.979 1.00 0.00 H new ATOM 0 HE1 PHE A 39 8.571 -8.156 0.738 1.00 0.00 H new ATOM 0 HE2 PHE A 39 6.530 -7.014 -2.826 1.00 0.00 H new ATOM 0 HZ PHE A 39 7.641 -8.740 -1.466 1.00 0.00 H new ATOM 608 N GLU A 40 8.250 -0.441 -0.273 1.00 0.00 N ATOM 609 CA GLU A 40 8.077 0.943 0.152 1.00 0.00 C ATOM 610 C GLU A 40 6.632 1.393 -0.037 1.00 0.00 C ATOM 611 O GLU A 40 6.083 1.306 -1.135 1.00 0.00 O ATOM 612 CB GLU A 40 9.018 1.860 -0.634 1.00 0.00 C ATOM 613 CG GLU A 40 9.623 2.974 0.206 1.00 0.00 C ATOM 614 CD GLU A 40 9.218 4.354 -0.275 1.00 0.00 C ATOM 615 OE1 GLU A 40 8.028 4.707 -0.132 1.00 0.00 O ATOM 616 OE2 GLU A 40 10.091 5.082 -0.793 1.00 0.00 O ATOM 0 H GLU A 40 8.370 -0.561 -1.279 1.00 0.00 H new ATOM 0 HA GLU A 40 8.322 1.006 1.212 1.00 0.00 H new ATOM 0 HB2 GLU A 40 9.822 1.261 -1.062 1.00 0.00 H new ATOM 0 HB3 GLU A 40 8.471 2.301 -1.467 1.00 0.00 H new ATOM 0 HG2 GLU A 40 9.314 2.850 1.244 1.00 0.00 H new ATOM 0 HG3 GLU A 40 10.710 2.891 0.185 1.00 0.00 H new ATOM 623 N ILE A 41 6.022 1.876 1.041 1.00 0.00 N ATOM 624 CA ILE A 41 4.642 2.339 0.995 1.00 0.00 C ATOM 625 C ILE A 41 4.547 3.819 1.350 1.00 0.00 C ATOM 626 O ILE A 41 5.180 4.282 2.299 1.00 0.00 O ATOM 627 CB ILE A 41 3.743 1.534 1.953 1.00 0.00 C ATOM 628 CG1 ILE A 41 3.938 0.031 1.732 1.00 0.00 C ATOM 629 CG2 ILE A 41 2.284 1.917 1.761 1.00 0.00 C ATOM 630 CD1 ILE A 41 4.030 -0.762 3.018 1.00 0.00 C ATOM 0 H ILE A 41 6.463 1.956 1.957 1.00 0.00 H new ATOM 0 HA ILE A 41 4.294 2.189 -0.027 1.00 0.00 H new ATOM 0 HB ILE A 41 4.029 1.772 2.978 1.00 0.00 H new ATOM 0 HG12 ILE A 41 3.108 -0.351 1.137 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.846 -0.128 1.151 1.00 0.00 H new ATOM 0 HG21 ILE A 41 1.663 1.339 2.445 1.00 0.00 H new ATOM 0 HG22 ILE A 41 2.157 2.980 1.966 1.00 0.00 H new ATOM 0 HG23 ILE A 41 1.985 1.707 0.734 1.00 0.00 H new ATOM 0 HD11 ILE A 41 4.168 -1.818 2.785 1.00 0.00 H new ATOM 0 HD12 ILE A 41 4.877 -0.406 3.605 1.00 0.00 H new ATOM 0 HD13 ILE A 41 3.112 -0.633 3.591 1.00 0.00 H new ATOM 642 N SER A 42 3.752 4.557 0.582 1.00 0.00 N ATOM 643 CA SER A 42 3.572 5.985 0.816 1.00 0.00 C ATOM 644 C SER A 42 2.137 6.289 1.243 1.00 0.00 C ATOM 645 O SER A 42 1.185 5.848 0.598 1.00 0.00 O ATOM 646 CB SER A 42 3.919 6.776 -0.446 1.00 0.00 C ATOM 647 OG SER A 42 5.307 7.053 -0.509 1.00 0.00 O ATOM 0 H SER A 42 3.222 4.189 -0.208 1.00 0.00 H new ATOM 0 HA SER A 42 4.243 6.285 1.621 1.00 0.00 H new ATOM 0 HB2 SER A 42 3.618 6.210 -1.328 1.00 0.00 H new ATOM 0 HB3 SER A 42 3.358 7.710 -0.459 1.00 0.00 H new ATOM 0 HG SER A 42 5.722 6.842 0.353 1.00 0.00 H new ATOM 653 N PRO A 43 1.957 7.048 2.339 1.00 0.00 N ATOM 654 CA PRO A 43 0.627 7.404 2.841 1.00 0.00 C ATOM 655 C PRO A 43 -0.072 8.429 1.955 1.00 0.00 C ATOM 656 O PRO A 43 0.487 9.482 1.645 1.00 0.00 O ATOM 657 CB PRO A 43 0.917 7.998 4.220 1.00 0.00 C ATOM 658 CG PRO A 43 2.302 8.536 4.115 1.00 0.00 C ATOM 659 CD PRO A 43 3.034 7.620 3.173 1.00 0.00 C ATOM 0 HA PRO A 43 -0.044 6.545 2.864 1.00 0.00 H new ATOM 0 HB2 PRO A 43 0.205 8.784 4.471 1.00 0.00 H new ATOM 0 HB3 PRO A 43 0.844 7.241 5.001 1.00 0.00 H new ATOM 0 HG2 PRO A 43 2.295 9.559 3.738 1.00 0.00 H new ATOM 0 HG3 PRO A 43 2.786 8.559 5.091 1.00 0.00 H new ATOM 0 HD2 PRO A 43 3.762 8.163 2.571 1.00 0.00 H new ATOM 0 HD3 PRO A 43 3.580 6.845 3.711 1.00 0.00 H new ATOM 667 N THR A 44 -1.298 8.115 1.550 1.00 0.00 N ATOM 668 CA THR A 44 -2.074 9.010 0.698 1.00 0.00 C ATOM 669 C THR A 44 -2.735 10.109 1.525 1.00 0.00 C ATOM 670 O THR A 44 -2.579 10.160 2.745 1.00 0.00 O ATOM 671 CB THR A 44 -3.138 8.225 -0.068 1.00 0.00 C ATOM 672 OG1 THR A 44 -4.013 7.559 0.826 1.00 0.00 O ATOM 673 CG2 THR A 44 -2.557 7.184 -1.002 1.00 0.00 C ATOM 0 H THR A 44 -1.776 7.248 1.798 1.00 0.00 H new ATOM 0 HA THR A 44 -1.392 9.474 -0.015 1.00 0.00 H new ATOM 0 HB THR A 44 -3.671 8.967 -0.662 1.00 0.00 H new ATOM 0 HG1 THR A 44 -4.758 8.152 1.057 1.00 0.00 H new ATOM 0 HG21 THR A 44 -3.366 6.663 -1.514 1.00 0.00 H new ATOM 0 HG22 THR A 44 -1.916 7.672 -1.737 1.00 0.00 H new ATOM 0 HG23 THR A 44 -1.970 6.467 -0.428 1.00 0.00 H new ATOM 681 N GLU A 45 -3.472 10.987 0.852 1.00 0.00 N ATOM 682 CA GLU A 45 -4.156 12.085 1.525 1.00 0.00 C ATOM 683 C GLU A 45 -5.541 11.655 1.998 1.00 0.00 C ATOM 684 O GLU A 45 -6.008 12.082 3.052 1.00 0.00 O ATOM 685 CB GLU A 45 -4.272 13.290 0.589 1.00 0.00 C ATOM 686 CG GLU A 45 -3.986 14.618 1.269 1.00 0.00 C ATOM 687 CD GLU A 45 -3.312 15.613 0.344 1.00 0.00 C ATOM 688 OE1 GLU A 45 -2.160 15.355 -0.067 1.00 0.00 O ATOM 689 OE2 GLU A 45 -3.934 16.650 0.032 1.00 0.00 O ATOM 0 H GLU A 45 -3.611 10.959 -0.158 1.00 0.00 H new ATOM 0 HA GLU A 45 -3.567 12.368 2.398 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -3.580 13.161 -0.243 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -5.277 13.316 0.167 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -4.920 15.043 1.635 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -3.351 14.448 2.138 1.00 0.00 H new ATOM 696 N GLU A 46 -6.192 10.806 1.209 1.00 0.00 N ATOM 697 CA GLU A 46 -7.525 10.319 1.547 1.00 0.00 C ATOM 698 C GLU A 46 -7.443 9.019 2.341 1.00 0.00 C ATOM 699 O GLU A 46 -6.520 8.226 2.160 1.00 0.00 O ATOM 700 CB GLU A 46 -8.350 10.103 0.277 1.00 0.00 C ATOM 701 CG GLU A 46 -9.844 10.288 0.483 1.00 0.00 C ATOM 702 CD GLU A 46 -10.293 11.717 0.250 1.00 0.00 C ATOM 703 OE1 GLU A 46 -10.103 12.554 1.156 1.00 0.00 O ATOM 704 OE2 GLU A 46 -10.833 11.999 -0.841 1.00 0.00 O ATOM 0 H GLU A 46 -5.819 10.441 0.332 1.00 0.00 H new ATOM 0 HA GLU A 46 -8.014 11.072 2.165 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -8.009 10.798 -0.490 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -8.165 9.097 -0.099 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -10.385 9.626 -0.194 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -10.107 9.990 1.498 1.00 0.00 H new ATOM 711 N VAL A 47 -8.416 8.809 3.222 1.00 0.00 N ATOM 712 CA VAL A 47 -8.454 7.605 4.043 1.00 0.00 C ATOM 713 C VAL A 47 -8.895 6.395 3.225 1.00 0.00 C ATOM 714 O VAL A 47 -9.838 6.475 2.438 1.00 0.00 O ATOM 715 CB VAL A 47 -9.403 7.777 5.247 1.00 0.00 C ATOM 716 CG1 VAL A 47 -10.827 8.032 4.776 1.00 0.00 C ATOM 717 CG2 VAL A 47 -9.343 6.558 6.156 1.00 0.00 C ATOM 0 H VAL A 47 -9.187 9.456 3.385 1.00 0.00 H new ATOM 0 HA VAL A 47 -7.441 7.439 4.411 1.00 0.00 H new ATOM 0 HB VAL A 47 -9.075 8.644 5.821 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -11.480 8.150 5.640 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -10.854 8.940 4.174 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -11.168 7.188 4.176 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -10.019 6.699 6.999 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -9.641 5.672 5.596 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -8.325 6.429 6.525 1.00 0.00 H new ATOM 727 N GLY A 48 -8.205 5.275 3.415 1.00 0.00 N ATOM 728 CA GLY A 48 -8.540 4.065 2.686 1.00 0.00 C ATOM 729 C GLY A 48 -7.554 3.768 1.573 1.00 0.00 C ATOM 730 O GLY A 48 -7.211 2.611 1.331 1.00 0.00 O ATOM 0 H GLY A 48 -7.420 5.183 4.060 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.567 3.223 3.378 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -9.540 4.163 2.265 1.00 0.00 H new ATOM 734 N ASP A 49 -7.099 4.816 0.893 1.00 0.00 N ATOM 735 CA ASP A 49 -6.148 4.663 -0.201 1.00 0.00 C ATOM 736 C ASP A 49 -4.767 4.285 0.327 1.00 0.00 C ATOM 737 O ASP A 49 -4.391 4.664 1.436 1.00 0.00 O ATOM 738 CB ASP A 49 -6.060 5.956 -1.013 1.00 0.00 C ATOM 739 CG ASP A 49 -7.389 6.338 -1.636 1.00 0.00 C ATOM 740 OD1 ASP A 49 -8.161 5.425 -1.994 1.00 0.00 O ATOM 741 OD2 ASP A 49 -7.656 7.551 -1.764 1.00 0.00 O ATOM 0 H ASP A 49 -7.374 5.780 1.081 1.00 0.00 H new ATOM 0 HA ASP A 49 -6.502 3.860 -0.847 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -5.718 6.765 -0.367 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.314 5.839 -1.799 1.00 0.00 H new ATOM 746 N PHE A 50 -4.018 3.536 -0.475 1.00 0.00 N ATOM 747 CA PHE A 50 -2.678 3.108 -0.088 1.00 0.00 C ATOM 748 C PHE A 50 -1.752 3.056 -1.300 1.00 0.00 C ATOM 749 O PHE A 50 -2.082 2.450 -2.319 1.00 0.00 O ATOM 750 CB PHE A 50 -2.733 1.736 0.586 1.00 0.00 C ATOM 751 CG PHE A 50 -3.646 1.690 1.779 1.00 0.00 C ATOM 752 CD1 PHE A 50 -3.427 2.518 2.867 1.00 0.00 C ATOM 753 CD2 PHE A 50 -4.722 0.817 1.810 1.00 0.00 C ATOM 754 CE1 PHE A 50 -4.265 2.478 3.965 1.00 0.00 C ATOM 755 CE2 PHE A 50 -5.564 0.772 2.906 1.00 0.00 C ATOM 756 CZ PHE A 50 -5.334 1.603 3.985 1.00 0.00 C ATOM 0 H PHE A 50 -4.315 3.213 -1.396 1.00 0.00 H new ATOM 0 HA PHE A 50 -2.281 3.836 0.619 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -3.063 0.995 -0.142 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -1.728 1.452 0.897 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.592 3.203 2.857 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -4.905 0.165 0.969 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -4.084 3.130 4.807 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -6.400 0.088 2.918 1.00 0.00 H new ATOM 0 HZ PHE A 50 -5.989 1.569 4.843 1.00 0.00 H new ATOM 766 N GLU A 51 -0.592 3.693 -1.180 1.00 0.00 N ATOM 767 CA GLU A 51 0.382 3.719 -2.265 1.00 0.00 C ATOM 768 C GLU A 51 1.496 2.707 -2.020 1.00 0.00 C ATOM 769 O GLU A 51 2.370 2.921 -1.180 1.00 0.00 O ATOM 770 CB GLU A 51 0.975 5.122 -2.412 1.00 0.00 C ATOM 771 CG GLU A 51 1.383 5.465 -3.835 1.00 0.00 C ATOM 772 CD GLU A 51 0.555 6.590 -4.426 1.00 0.00 C ATOM 773 OE1 GLU A 51 0.506 7.676 -3.811 1.00 0.00 O ATOM 774 OE2 GLU A 51 -0.043 6.384 -5.503 1.00 0.00 O ATOM 0 H GLU A 51 -0.303 4.198 -0.342 1.00 0.00 H new ATOM 0 HA GLU A 51 -0.132 3.450 -3.188 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.245 5.854 -2.066 1.00 0.00 H new ATOM 0 HB3 GLU A 51 1.846 5.209 -1.762 1.00 0.00 H new ATOM 0 HG2 GLU A 51 2.436 5.748 -3.849 1.00 0.00 H new ATOM 0 HG3 GLU A 51 1.283 4.578 -4.461 1.00 0.00 H new ATOM 781 N VAL A 52 1.458 1.603 -2.760 1.00 0.00 N ATOM 782 CA VAL A 52 2.465 0.557 -2.623 1.00 0.00 C ATOM 783 C VAL A 52 3.507 0.650 -3.734 1.00 0.00 C ATOM 784 O VAL A 52 3.167 0.665 -4.917 1.00 0.00 O ATOM 785 CB VAL A 52 1.827 -0.846 -2.649 1.00 0.00 C ATOM 786 CG1 VAL A 52 2.868 -1.913 -2.349 1.00 0.00 C ATOM 787 CG2 VAL A 52 0.671 -0.927 -1.662 1.00 0.00 C ATOM 0 H VAL A 52 0.741 1.410 -3.460 1.00 0.00 H new ATOM 0 HA VAL A 52 2.950 0.709 -1.659 1.00 0.00 H new ATOM 0 HB VAL A 52 1.434 -1.026 -3.649 1.00 0.00 H new ATOM 0 HG11 VAL A 52 2.398 -2.896 -2.372 1.00 0.00 H new ATOM 0 HG12 VAL A 52 3.659 -1.871 -3.098 1.00 0.00 H new ATOM 0 HG13 VAL A 52 3.295 -1.738 -1.361 1.00 0.00 H new ATOM 0 HG21 VAL A 52 0.234 -1.925 -1.695 1.00 0.00 H new ATOM 0 HG22 VAL A 52 1.037 -0.724 -0.656 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -0.087 -0.190 -1.928 1.00 0.00 H new ATOM 797 N LYS A 53 4.777 0.711 -3.344 1.00 0.00 N ATOM 798 CA LYS A 53 5.867 0.803 -4.307 1.00 0.00 C ATOM 799 C LYS A 53 6.926 -0.261 -4.033 1.00 0.00 C ATOM 800 O LYS A 53 7.152 -0.645 -2.885 1.00 0.00 O ATOM 801 CB LYS A 53 6.502 2.194 -4.260 1.00 0.00 C ATOM 802 CG LYS A 53 7.529 2.433 -5.354 1.00 0.00 C ATOM 803 CD LYS A 53 7.634 3.907 -5.708 1.00 0.00 C ATOM 804 CE LYS A 53 9.075 4.317 -5.968 1.00 0.00 C ATOM 805 NZ LYS A 53 9.393 5.640 -5.362 1.00 0.00 N ATOM 0 H LYS A 53 5.075 0.698 -2.369 1.00 0.00 H new ATOM 0 HA LYS A 53 5.455 0.633 -5.302 1.00 0.00 H new ATOM 0 HB2 LYS A 53 5.716 2.945 -4.341 1.00 0.00 H new ATOM 0 HB3 LYS A 53 6.978 2.334 -3.290 1.00 0.00 H new ATOM 0 HG2 LYS A 53 8.502 2.066 -5.027 1.00 0.00 H new ATOM 0 HG3 LYS A 53 7.255 1.863 -6.242 1.00 0.00 H new ATOM 0 HD2 LYS A 53 7.031 4.114 -6.592 1.00 0.00 H new ATOM 0 HD3 LYS A 53 7.225 4.507 -4.895 1.00 0.00 H new ATOM 0 HE2 LYS A 53 9.747 3.561 -5.562 1.00 0.00 H new ATOM 0 HE3 LYS A 53 9.253 4.358 -7.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 10.384 5.884 -5.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 8.769 6.367 -5.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 9.248 5.594 -4.333 1.00 0.00 H new ATOM 819 N ALA A 54 7.573 -0.733 -5.094 1.00 0.00 N ATOM 820 CA ALA A 54 8.609 -1.751 -4.966 1.00 0.00 C ATOM 821 C ALA A 54 9.994 -1.159 -5.202 1.00 0.00 C ATOM 822 O ALA A 54 10.407 -0.956 -6.344 1.00 0.00 O ATOM 823 CB ALA A 54 8.348 -2.891 -5.940 1.00 0.00 C ATOM 0 H ALA A 54 7.398 -0.427 -6.051 1.00 0.00 H new ATOM 0 HA ALA A 54 8.579 -2.140 -3.948 1.00 0.00 H new ATOM 0 HB1 ALA A 54 9.128 -3.645 -5.835 1.00 0.00 H new ATOM 0 HB2 ALA A 54 7.378 -3.340 -5.724 1.00 0.00 H new ATOM 0 HB3 ALA A 54 8.350 -2.506 -6.960 1.00 0.00 H new ATOM 829 N LYS A 55 10.707 -0.884 -4.115 1.00 0.00 N ATOM 830 CA LYS A 55 12.047 -0.317 -4.204 1.00 0.00 C ATOM 831 C LYS A 55 13.026 -1.324 -4.801 1.00 0.00 C ATOM 832 O LYS A 55 13.272 -2.382 -4.223 1.00 0.00 O ATOM 833 CB LYS A 55 12.528 0.126 -2.819 1.00 0.00 C ATOM 834 CG LYS A 55 12.809 1.618 -2.722 1.00 0.00 C ATOM 835 CD LYS A 55 14.198 1.893 -2.165 1.00 0.00 C ATOM 836 CE LYS A 55 15.180 2.251 -3.270 1.00 0.00 C ATOM 837 NZ LYS A 55 15.430 1.104 -4.185 1.00 0.00 N ATOM 0 H LYS A 55 10.379 -1.045 -3.163 1.00 0.00 H new ATOM 0 HA LYS A 55 12.005 0.552 -4.861 1.00 0.00 H new ATOM 0 HB2 LYS A 55 11.775 -0.143 -2.079 1.00 0.00 H new ATOM 0 HB3 LYS A 55 13.434 -0.424 -2.565 1.00 0.00 H new ATOM 0 HG2 LYS A 55 12.716 2.071 -3.709 1.00 0.00 H new ATOM 0 HG3 LYS A 55 12.061 2.089 -2.084 1.00 0.00 H new ATOM 0 HD2 LYS A 55 14.147 2.709 -1.444 1.00 0.00 H new ATOM 0 HD3 LYS A 55 14.557 1.015 -1.628 1.00 0.00 H new ATOM 0 HE2 LYS A 55 14.791 3.093 -3.842 1.00 0.00 H new ATOM 0 HE3 LYS A 55 16.122 2.574 -2.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 16.338 1.240 -4.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 15.461 0.222 -3.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 14.665 1.047 -4.888 1.00 0.00 H new ATOM 851 N PHE A 56 13.580 -0.987 -5.961 1.00 0.00 N ATOM 852 CA PHE A 56 14.532 -1.862 -6.635 1.00 0.00 C ATOM 853 C PHE A 56 15.310 -1.100 -7.704 1.00 0.00 C ATOM 854 O PHE A 56 16.530 -0.966 -7.620 1.00 0.00 O ATOM 855 CB PHE A 56 13.804 -3.051 -7.266 1.00 0.00 C ATOM 856 CG PHE A 56 14.516 -4.359 -7.078 1.00 0.00 C ATOM 857 CD1 PHE A 56 14.453 -5.031 -5.867 1.00 0.00 C ATOM 858 CD2 PHE A 56 15.251 -4.917 -8.112 1.00 0.00 C ATOM 859 CE1 PHE A 56 15.108 -6.235 -5.693 1.00 0.00 C ATOM 860 CE2 PHE A 56 15.908 -6.121 -7.942 1.00 0.00 C ATOM 861 CZ PHE A 56 15.837 -6.781 -6.730 1.00 0.00 C ATOM 0 H PHE A 56 13.386 -0.115 -6.453 1.00 0.00 H new ATOM 0 HA PHE A 56 15.239 -2.230 -5.892 1.00 0.00 H new ATOM 0 HB2 PHE A 56 12.805 -3.125 -6.836 1.00 0.00 H new ATOM 0 HB3 PHE A 56 13.678 -2.865 -8.333 1.00 0.00 H new ATOM 0 HD1 PHE A 56 13.886 -4.609 -5.051 1.00 0.00 H new ATOM 0 HD2 PHE A 56 15.311 -4.405 -9.061 1.00 0.00 H new ATOM 0 HE1 PHE A 56 15.050 -6.749 -4.745 1.00 0.00 H new ATOM 0 HE2 PHE A 56 16.477 -6.546 -8.756 1.00 0.00 H new ATOM 0 HZ PHE A 56 16.351 -7.721 -6.595 1.00 0.00 H new ATOM 871 N MET A 57 14.595 -0.604 -8.709 1.00 0.00 N ATOM 872 CA MET A 57 15.218 0.144 -9.794 1.00 0.00 C ATOM 873 C MET A 57 14.845 1.621 -9.721 1.00 0.00 C ATOM 874 O MET A 57 15.715 2.487 -9.633 1.00 0.00 O ATOM 875 CB MET A 57 14.799 -0.438 -11.147 1.00 0.00 C ATOM 876 CG MET A 57 15.973 -0.783 -12.049 1.00 0.00 C ATOM 877 SD MET A 57 15.708 -2.303 -12.984 1.00 0.00 S ATOM 878 CE MET A 57 14.168 -1.924 -13.816 1.00 0.00 C ATOM 0 H MET A 57 13.584 -0.707 -8.794 1.00 0.00 H new ATOM 0 HA MET A 57 16.300 0.058 -9.689 1.00 0.00 H new ATOM 0 HB2 MET A 57 14.204 -1.336 -10.979 1.00 0.00 H new ATOM 0 HB3 MET A 57 14.156 0.279 -11.658 1.00 0.00 H new ATOM 0 HG2 MET A 57 16.147 0.040 -12.742 1.00 0.00 H new ATOM 0 HG3 MET A 57 16.873 -0.886 -11.443 1.00 0.00 H new ATOM 0 HE1 MET A 57 13.971 -2.678 -14.578 1.00 0.00 H new ATOM 0 HE2 MET A 57 13.354 -1.920 -13.091 1.00 0.00 H new ATOM 0 HE3 MET A 57 14.240 -0.943 -14.286 1.00 0.00 H new ATOM 888 N GLY A 58 13.546 1.901 -9.759 1.00 0.00 N ATOM 889 CA GLY A 58 13.081 3.274 -9.695 1.00 0.00 C ATOM 890 C GLY A 58 13.091 3.953 -11.050 1.00 0.00 C ATOM 891 O GLY A 58 13.543 5.092 -11.177 1.00 0.00 O ATOM 0 H GLY A 58 12.807 1.201 -9.833 1.00 0.00 H new ATOM 0 HA2 GLY A 58 12.069 3.293 -9.290 1.00 0.00 H new ATOM 0 HA3 GLY A 58 13.711 3.836 -9.006 1.00 0.00 H new ATOM 895 N VAL A 59 12.593 3.256 -12.065 1.00 0.00 N ATOM 896 CA VAL A 59 12.547 3.799 -13.417 1.00 0.00 C ATOM 897 C VAL A 59 11.192 4.438 -13.705 1.00 0.00 C ATOM 898 O VAL A 59 10.155 3.780 -13.628 1.00 0.00 O ATOM 899 CB VAL A 59 12.829 2.710 -14.471 1.00 0.00 C ATOM 900 CG1 VAL A 59 11.769 1.618 -14.416 1.00 0.00 C ATOM 901 CG2 VAL A 59 12.906 3.319 -15.863 1.00 0.00 C ATOM 0 H VAL A 59 12.215 2.313 -11.977 1.00 0.00 H new ATOM 0 HA VAL A 59 13.324 4.561 -13.480 1.00 0.00 H new ATOM 0 HB VAL A 59 13.794 2.256 -14.244 1.00 0.00 H new ATOM 0 HG11 VAL A 59 11.988 0.860 -15.168 1.00 0.00 H new ATOM 0 HG12 VAL A 59 11.770 1.159 -13.427 1.00 0.00 H new ATOM 0 HG13 VAL A 59 10.789 2.052 -14.613 1.00 0.00 H new ATOM 0 HG21 VAL A 59 13.106 2.534 -16.593 1.00 0.00 H new ATOM 0 HG22 VAL A 59 11.959 3.804 -16.101 1.00 0.00 H new ATOM 0 HG23 VAL A 59 13.709 4.056 -15.894 1.00 0.00 H new ATOM 911 N GLN A 60 11.209 5.725 -14.036 1.00 0.00 N ATOM 912 CA GLN A 60 9.982 6.454 -14.335 1.00 0.00 C ATOM 913 C GLN A 60 9.057 6.486 -13.123 1.00 0.00 C ATOM 914 O GLN A 60 9.079 5.580 -12.289 1.00 0.00 O ATOM 915 CB GLN A 60 9.261 5.817 -15.525 1.00 0.00 C ATOM 916 CG GLN A 60 8.192 6.708 -16.136 1.00 0.00 C ATOM 917 CD GLN A 60 8.776 7.857 -16.934 1.00 0.00 C ATOM 918 OE1 GLN A 60 9.836 8.385 -16.599 1.00 0.00 O ATOM 919 NE2 GLN A 60 8.083 8.253 -17.996 1.00 0.00 N ATOM 0 H GLN A 60 12.059 6.285 -14.104 1.00 0.00 H new ATOM 0 HA GLN A 60 10.252 7.479 -14.589 1.00 0.00 H new ATOM 0 HB2 GLN A 60 9.994 5.566 -16.291 1.00 0.00 H new ATOM 0 HB3 GLN A 60 8.803 4.882 -15.203 1.00 0.00 H new ATOM 0 HG2 GLN A 60 7.552 6.109 -16.784 1.00 0.00 H new ATOM 0 HG3 GLN A 60 7.559 7.106 -15.343 1.00 0.00 H new ATOM 0 HE21 GLN A 60 7.209 7.787 -18.237 1.00 0.00 H new ATOM 0 HE22 GLN A 60 8.425 9.023 -18.570 1.00 0.00 H new ATOM 928 N MET A 61 8.244 7.532 -13.032 1.00 0.00 N ATOM 929 CA MET A 61 7.311 7.681 -11.922 1.00 0.00 C ATOM 930 C MET A 61 6.175 6.668 -12.025 1.00 0.00 C ATOM 931 O MET A 61 5.165 6.917 -12.682 1.00 0.00 O ATOM 932 CB MET A 61 6.741 9.101 -11.892 1.00 0.00 C ATOM 933 CG MET A 61 6.255 9.591 -13.248 1.00 0.00 C ATOM 934 SD MET A 61 5.032 10.909 -13.113 1.00 0.00 S ATOM 935 CE MET A 61 4.938 11.458 -14.815 1.00 0.00 C ATOM 0 H MET A 61 8.212 8.290 -13.714 1.00 0.00 H new ATOM 0 HA MET A 61 7.856 7.496 -10.997 1.00 0.00 H new ATOM 0 HB2 MET A 61 5.913 9.136 -11.184 1.00 0.00 H new ATOM 0 HB3 MET A 61 7.506 9.783 -11.521 1.00 0.00 H new ATOM 0 HG2 MET A 61 7.106 9.949 -13.827 1.00 0.00 H new ATOM 0 HG3 MET A 61 5.823 8.755 -13.799 1.00 0.00 H new ATOM 0 HE1 MET A 61 4.220 12.274 -14.895 1.00 0.00 H new ATOM 0 HE2 MET A 61 5.919 11.805 -15.140 1.00 0.00 H new ATOM 0 HE3 MET A 61 4.618 10.630 -15.447 1.00 0.00 H new ATOM 945 N GLU A 62 6.349 5.524 -11.370 1.00 0.00 N ATOM 946 CA GLU A 62 5.339 4.472 -11.387 1.00 0.00 C ATOM 947 C GLU A 62 5.123 3.904 -9.988 1.00 0.00 C ATOM 948 O GLU A 62 6.042 3.354 -9.382 1.00 0.00 O ATOM 949 CB GLU A 62 5.753 3.355 -12.346 1.00 0.00 C ATOM 950 CG GLU A 62 5.568 3.712 -13.812 1.00 0.00 C ATOM 951 CD GLU A 62 4.326 3.083 -14.412 1.00 0.00 C ATOM 952 OE1 GLU A 62 4.195 1.843 -14.345 1.00 0.00 O ATOM 953 OE2 GLU A 62 3.483 3.832 -14.951 1.00 0.00 O ATOM 0 H GLU A 62 7.180 5.302 -10.821 1.00 0.00 H new ATOM 0 HA GLU A 62 4.401 4.907 -11.732 1.00 0.00 H new ATOM 0 HB2 GLU A 62 6.800 3.106 -12.171 1.00 0.00 H new ATOM 0 HB3 GLU A 62 5.171 2.461 -12.122 1.00 0.00 H new ATOM 0 HG2 GLU A 62 5.507 4.796 -13.914 1.00 0.00 H new ATOM 0 HG3 GLU A 62 6.443 3.387 -14.375 1.00 0.00 H new ATOM 960 N THR A 63 3.901 4.040 -9.482 1.00 0.00 N ATOM 961 CA THR A 63 3.564 3.539 -8.154 1.00 0.00 C ATOM 962 C THR A 63 2.304 2.680 -8.201 1.00 0.00 C ATOM 963 O THR A 63 1.314 3.048 -8.833 1.00 0.00 O ATOM 964 CB THR A 63 3.370 4.703 -7.179 1.00 0.00 C ATOM 965 OG1 THR A 63 3.872 5.908 -7.727 1.00 0.00 O ATOM 966 CG2 THR A 63 4.056 4.486 -5.846 1.00 0.00 C ATOM 0 H THR A 63 3.129 4.492 -9.971 1.00 0.00 H new ATOM 0 HA THR A 63 4.390 2.920 -7.806 1.00 0.00 H new ATOM 0 HB THR A 63 2.294 4.763 -7.013 1.00 0.00 H new ATOM 0 HG1 THR A 63 3.736 6.639 -7.089 1.00 0.00 H new ATOM 0 HG21 THR A 63 3.880 5.347 -5.202 1.00 0.00 H new ATOM 0 HG22 THR A 63 3.655 3.590 -5.372 1.00 0.00 H new ATOM 0 HG23 THR A 63 5.128 4.365 -6.004 1.00 0.00 H new ATOM 974 N PHE A 64 2.348 1.536 -7.526 1.00 0.00 N ATOM 975 CA PHE A 64 1.210 0.625 -7.491 1.00 0.00 C ATOM 976 C PHE A 64 0.128 1.143 -6.549 1.00 0.00 C ATOM 977 O PHE A 64 0.402 1.481 -5.398 1.00 0.00 O ATOM 978 CB PHE A 64 1.659 -0.769 -7.052 1.00 0.00 C ATOM 979 CG PHE A 64 0.715 -1.862 -7.466 1.00 0.00 C ATOM 980 CD1 PHE A 64 0.603 -2.231 -8.797 1.00 0.00 C ATOM 981 CD2 PHE A 64 -0.060 -2.519 -6.524 1.00 0.00 C ATOM 982 CE1 PHE A 64 -0.266 -3.235 -9.180 1.00 0.00 C ATOM 983 CE2 PHE A 64 -0.930 -3.524 -6.902 1.00 0.00 C ATOM 984 CZ PHE A 64 -1.033 -3.883 -8.232 1.00 0.00 C ATOM 0 H PHE A 64 3.159 1.218 -6.996 1.00 0.00 H new ATOM 0 HA PHE A 64 0.794 0.565 -8.497 1.00 0.00 H new ATOM 0 HB2 PHE A 64 2.644 -0.973 -7.471 1.00 0.00 H new ATOM 0 HB3 PHE A 64 1.765 -0.783 -5.967 1.00 0.00 H new ATOM 0 HD1 PHE A 64 1.201 -1.729 -9.543 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.017 -2.243 -5.483 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.345 -3.513 -10.221 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -1.529 -4.028 -6.158 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.712 -4.669 -8.530 1.00 0.00 H new ATOM 994 N MET A 65 -1.104 1.201 -7.046 1.00 0.00 N ATOM 995 CA MET A 65 -2.228 1.677 -6.249 1.00 0.00 C ATOM 996 C MET A 65 -2.917 0.517 -5.535 1.00 0.00 C ATOM 997 O MET A 65 -3.191 -0.521 -6.138 1.00 0.00 O ATOM 998 CB MET A 65 -3.232 2.417 -7.135 1.00 0.00 C ATOM 999 CG MET A 65 -3.051 3.927 -7.129 1.00 0.00 C ATOM 1000 SD MET A 65 -4.465 4.799 -6.429 1.00 0.00 S ATOM 1001 CE MET A 65 -3.863 5.151 -4.779 1.00 0.00 C ATOM 0 H MET A 65 -1.348 0.924 -7.997 1.00 0.00 H new ATOM 0 HA MET A 65 -1.843 2.366 -5.497 1.00 0.00 H new ATOM 0 HB2 MET A 65 -3.139 2.052 -8.158 1.00 0.00 H new ATOM 0 HB3 MET A 65 -4.242 2.179 -6.802 1.00 0.00 H new ATOM 0 HG2 MET A 65 -2.157 4.179 -6.559 1.00 0.00 H new ATOM 0 HG3 MET A 65 -2.886 4.272 -8.150 1.00 0.00 H new ATOM 0 HE1 MET A 65 -4.628 5.690 -4.220 1.00 0.00 H new ATOM 0 HE2 MET A 65 -3.632 4.216 -4.269 1.00 0.00 H new ATOM 0 HE3 MET A 65 -2.963 5.762 -4.843 1.00 0.00 H new ATOM 1011 N LEU A 66 -3.193 0.701 -4.249 1.00 0.00 N ATOM 1012 CA LEU A 66 -3.850 -0.330 -3.454 1.00 0.00 C ATOM 1013 C LEU A 66 -5.045 0.243 -2.699 1.00 0.00 C ATOM 1014 O LEU A 66 -4.886 0.900 -1.671 1.00 0.00 O ATOM 1015 CB LEU A 66 -2.859 -0.950 -2.466 1.00 0.00 C ATOM 1016 CG LEU A 66 -3.404 -2.127 -1.656 1.00 0.00 C ATOM 1017 CD1 LEU A 66 -3.615 -3.338 -2.551 1.00 0.00 C ATOM 1018 CD2 LEU A 66 -2.462 -2.465 -0.510 1.00 0.00 C ATOM 0 H LEU A 66 -2.972 1.554 -3.735 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.209 -1.103 -4.133 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -1.980 -1.284 -3.018 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -2.526 -0.176 -1.775 1.00 0.00 H new ATOM 0 HG LEU A 66 -4.368 -1.840 -1.235 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.003 -4.166 -1.958 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.328 -3.090 -3.337 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.665 -3.628 -3.001 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.865 -3.305 0.056 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.484 -2.733 -0.910 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.362 -1.600 0.146 1.00 0.00 H new ATOM 1030 N HIS A 67 -6.242 -0.011 -3.217 1.00 0.00 N ATOM 1031 CA HIS A 67 -7.466 0.480 -2.593 1.00 0.00 C ATOM 1032 C HIS A 67 -7.927 -0.465 -1.486 1.00 0.00 C ATOM 1033 O HIS A 67 -7.343 -1.529 -1.282 1.00 0.00 O ATOM 1034 CB HIS A 67 -8.570 0.637 -3.642 1.00 0.00 C ATOM 1035 CG HIS A 67 -8.851 2.062 -4.004 1.00 0.00 C ATOM 1036 ND1 HIS A 67 -8.928 2.507 -5.307 1.00 0.00 N ATOM 1037 CD2 HIS A 67 -9.076 3.147 -3.225 1.00 0.00 C ATOM 1038 CE1 HIS A 67 -9.187 3.803 -5.314 1.00 0.00 C ATOM 1039 NE2 HIS A 67 -9.283 4.214 -4.064 1.00 0.00 N ATOM 0 H HIS A 67 -6.391 -0.554 -4.067 1.00 0.00 H new ATOM 0 HA HIS A 67 -7.256 1.454 -2.150 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -8.286 0.091 -4.542 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -9.485 0.179 -3.267 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -9.090 3.169 -2.145 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -9.301 4.420 -6.193 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -9.479 5.170 -3.768 1.00 0.00 H new ATOM 1048 N TYR A 68 -8.977 -0.066 -0.777 1.00 0.00 N ATOM 1049 CA TYR A 68 -9.517 -0.876 0.310 1.00 0.00 C ATOM 1050 C TYR A 68 -10.629 -1.790 -0.194 1.00 0.00 C ATOM 1051 O TYR A 68 -10.823 -2.891 0.321 1.00 0.00 O ATOM 1052 CB TYR A 68 -10.046 0.022 1.429 1.00 0.00 C ATOM 1053 CG TYR A 68 -9.877 -0.568 2.811 1.00 0.00 C ATOM 1054 CD1 TYR A 68 -8.681 -1.164 3.190 1.00 0.00 C ATOM 1055 CD2 TYR A 68 -10.913 -0.528 3.735 1.00 0.00 C ATOM 1056 CE1 TYR A 68 -8.523 -1.705 4.452 1.00 0.00 C ATOM 1057 CE2 TYR A 68 -10.761 -1.066 5.000 1.00 0.00 C ATOM 1058 CZ TYR A 68 -9.565 -1.653 5.352 1.00 0.00 C ATOM 1059 OH TYR A 68 -9.411 -2.190 6.610 1.00 0.00 O ATOM 0 H TYR A 68 -9.471 0.812 -0.935 1.00 0.00 H new ATOM 0 HA TYR A 68 -8.711 -1.496 0.703 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -9.531 0.982 1.387 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -11.104 0.220 1.255 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -7.862 -1.205 2.488 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -11.852 -0.070 3.461 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -7.587 -2.166 4.731 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -11.575 -1.026 5.708 1.00 0.00 H new ATOM 0 HH TYR A 68 -10.239 -2.070 7.121 1.00 0.00 H new ATOM 1069 N GLN A 69 -11.358 -1.326 -1.203 1.00 0.00 N ATOM 1070 CA GLN A 69 -12.452 -2.101 -1.777 1.00 0.00 C ATOM 1071 C GLN A 69 -11.943 -3.426 -2.336 1.00 0.00 C ATOM 1072 O GLN A 69 -12.555 -4.475 -2.130 1.00 0.00 O ATOM 1073 CB GLN A 69 -13.150 -1.298 -2.877 1.00 0.00 C ATOM 1074 CG GLN A 69 -14.621 -1.036 -2.597 1.00 0.00 C ATOM 1075 CD GLN A 69 -15.532 -1.610 -3.666 1.00 0.00 C ATOM 1076 OE1 GLN A 69 -15.975 -0.899 -4.568 1.00 0.00 O ATOM 1077 NE2 GLN A 69 -15.817 -2.904 -3.568 1.00 0.00 N ATOM 0 H GLN A 69 -11.211 -0.416 -1.641 1.00 0.00 H new ATOM 0 HA GLN A 69 -13.170 -2.316 -0.986 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -12.637 -0.344 -3.001 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -13.058 -1.835 -3.821 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -14.885 -1.466 -1.631 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -14.787 0.039 -2.523 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -15.427 -3.456 -2.803 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -16.425 -3.346 -4.257 1.00 0.00 H new ATOM 1086 N ASP A 70 -10.820 -3.371 -3.045 1.00 0.00 N ATOM 1087 CA ASP A 70 -10.228 -4.567 -3.634 1.00 0.00 C ATOM 1088 C ASP A 70 -9.839 -5.570 -2.553 1.00 0.00 C ATOM 1089 O ASP A 70 -10.056 -6.773 -2.701 1.00 0.00 O ATOM 1090 CB ASP A 70 -9.002 -4.196 -4.468 1.00 0.00 C ATOM 1091 CG ASP A 70 -9.342 -3.973 -5.929 1.00 0.00 C ATOM 1092 OD1 ASP A 70 -10.128 -4.770 -6.483 1.00 0.00 O ATOM 1093 OD2 ASP A 70 -8.823 -3.001 -6.518 1.00 0.00 O ATOM 0 H ASP A 70 -10.302 -2.511 -3.226 1.00 0.00 H new ATOM 0 HA ASP A 70 -10.972 -5.030 -4.282 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -8.549 -3.292 -4.061 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -8.258 -4.989 -4.388 1.00 0.00 H new ATOM 1098 N LEU A 71 -9.264 -5.068 -1.465 1.00 0.00 N ATOM 1099 CA LEU A 71 -8.845 -5.919 -0.359 1.00 0.00 C ATOM 1100 C LEU A 71 -10.049 -6.568 0.316 1.00 0.00 C ATOM 1101 O LEU A 71 -10.030 -7.756 0.633 1.00 0.00 O ATOM 1102 CB LEU A 71 -8.047 -5.107 0.664 1.00 0.00 C ATOM 1103 CG LEU A 71 -6.837 -4.364 0.098 1.00 0.00 C ATOM 1104 CD1 LEU A 71 -6.163 -3.537 1.182 1.00 0.00 C ATOM 1105 CD2 LEU A 71 -5.849 -5.345 -0.517 1.00 0.00 C ATOM 0 H LEU A 71 -9.078 -4.075 -1.326 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.209 -6.708 -0.762 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -8.714 -4.382 1.130 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -7.706 -5.779 1.452 1.00 0.00 H new ATOM 0 HG LEU A 71 -7.183 -3.688 -0.684 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -5.304 -3.015 0.760 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -6.871 -2.809 1.578 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.830 -4.193 1.986 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -4.994 -4.799 -0.915 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -5.509 -6.045 0.246 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -6.336 -5.894 -1.323 1.00 0.00 H new ATOM 1117 N LEU A 72 -11.096 -5.776 0.532 1.00 0.00 N ATOM 1118 CA LEU A 72 -12.310 -6.273 1.168 1.00 0.00 C ATOM 1119 C LEU A 72 -13.051 -7.238 0.248 1.00 0.00 C ATOM 1120 O LEU A 72 -13.695 -8.180 0.710 1.00 0.00 O ATOM 1121 CB LEU A 72 -13.225 -5.107 1.547 1.00 0.00 C ATOM 1122 CG LEU A 72 -12.632 -4.118 2.553 1.00 0.00 C ATOM 1123 CD1 LEU A 72 -13.506 -2.879 2.662 1.00 0.00 C ATOM 1124 CD2 LEU A 72 -12.466 -4.778 3.913 1.00 0.00 C ATOM 0 H LEU A 72 -11.127 -4.789 0.276 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.023 -6.810 2.072 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -13.490 -4.564 0.640 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.150 -5.510 1.959 1.00 0.00 H new ATOM 0 HG LEU A 72 -11.648 -3.812 2.197 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -13.068 -2.187 3.382 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -13.573 -2.394 1.688 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -14.504 -3.166 2.994 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -12.043 -4.061 4.616 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -13.438 -5.113 4.276 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -11.798 -5.635 3.823 1.00 0.00 H new ATOM 1136 N GLN A 73 -12.954 -6.996 -1.055 1.00 0.00 N ATOM 1137 CA GLN A 73 -13.614 -7.844 -2.041 1.00 0.00 C ATOM 1138 C GLN A 73 -13.111 -9.281 -1.947 1.00 0.00 C ATOM 1139 O GLN A 73 -13.852 -10.227 -2.212 1.00 0.00 O ATOM 1140 CB GLN A 73 -13.381 -7.299 -3.451 1.00 0.00 C ATOM 1141 CG GLN A 73 -14.604 -7.394 -4.350 1.00 0.00 C ATOM 1142 CD GLN A 73 -14.451 -8.444 -5.434 1.00 0.00 C ATOM 1143 OE1 GLN A 73 -13.337 -8.836 -5.783 1.00 0.00 O ATOM 1144 NE2 GLN A 73 -15.573 -8.904 -5.975 1.00 0.00 N ATOM 0 H GLN A 73 -12.425 -6.220 -1.453 1.00 0.00 H new ATOM 0 HA GLN A 73 -14.683 -7.839 -1.830 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -13.071 -6.256 -3.382 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -12.558 -7.846 -3.912 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -15.479 -7.628 -3.743 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -14.787 -6.424 -4.812 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -16.475 -8.551 -5.656 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -15.533 -9.610 -6.710 1.00 0.00 H new ATOM 1153 N LEU A 74 -11.846 -9.436 -1.569 1.00 0.00 N ATOM 1154 CA LEU A 74 -11.244 -10.758 -1.439 1.00 0.00 C ATOM 1155 C LEU A 74 -11.800 -11.492 -0.224 1.00 0.00 C ATOM 1156 O LEU A 74 -12.059 -12.694 -0.277 1.00 0.00 O ATOM 1157 CB LEU A 74 -9.723 -10.639 -1.325 1.00 0.00 C ATOM 1158 CG LEU A 74 -9.034 -9.972 -2.517 1.00 0.00 C ATOM 1159 CD1 LEU A 74 -7.527 -9.942 -2.315 1.00 0.00 C ATOM 1160 CD2 LEU A 74 -9.386 -10.695 -3.809 1.00 0.00 C ATOM 0 H LEU A 74 -11.218 -8.663 -1.348 1.00 0.00 H new ATOM 0 HA LEU A 74 -11.491 -11.332 -2.332 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -9.485 -10.074 -0.424 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -9.305 -11.637 -1.195 1.00 0.00 H new ATOM 0 HG LEU A 74 -9.391 -8.945 -2.590 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -7.054 -9.464 -3.173 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -7.292 -9.380 -1.411 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -7.153 -10.961 -2.216 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -8.887 -10.207 -4.646 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -9.058 -11.733 -3.746 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -10.465 -10.664 -3.961 1.00 0.00 H new ATOM 1172 N GLN A 75 -11.981 -10.761 0.871 1.00 0.00 N ATOM 1173 CA GLN A 75 -12.507 -11.342 2.100 1.00 0.00 C ATOM 1174 C GLN A 75 -13.964 -11.759 1.925 1.00 0.00 C ATOM 1175 O GLN A 75 -14.423 -12.721 2.540 1.00 0.00 O ATOM 1176 CB GLN A 75 -12.385 -10.344 3.254 1.00 0.00 C ATOM 1177 CG GLN A 75 -11.946 -10.981 4.563 1.00 0.00 C ATOM 1178 CD GLN A 75 -10.584 -10.496 5.021 1.00 0.00 C ATOM 1179 OE1 GLN A 75 -9.733 -10.138 4.207 1.00 0.00 O ATOM 1180 NE2 GLN A 75 -10.371 -10.482 6.332 1.00 0.00 N ATOM 0 H GLN A 75 -11.771 -9.765 0.932 1.00 0.00 H new ATOM 0 HA GLN A 75 -11.919 -12.230 2.333 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -11.670 -9.568 2.979 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -13.347 -9.853 3.403 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -12.684 -10.762 5.335 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -11.921 -12.064 4.445 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -11.105 -10.788 6.971 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -9.474 -10.166 6.700 1.00 0.00 H new ATOM 1189 N TYR A 76 -14.685 -11.028 1.080 1.00 0.00 N ATOM 1190 CA TYR A 76 -16.091 -11.321 0.823 1.00 0.00 C ATOM 1191 C TYR A 76 -16.240 -12.600 0.005 1.00 0.00 C ATOM 1192 O TYR A 76 -17.119 -13.420 0.270 1.00 0.00 O ATOM 1193 CB TYR A 76 -16.751 -10.153 0.090 1.00 0.00 C ATOM 1194 CG TYR A 76 -18.253 -10.103 0.257 1.00 0.00 C ATOM 1195 CD1 TYR A 76 -19.058 -11.136 -0.206 1.00 0.00 C ATOM 1196 CD2 TYR A 76 -18.867 -9.022 0.877 1.00 0.00 C ATOM 1197 CE1 TYR A 76 -20.430 -11.095 -0.055 1.00 0.00 C ATOM 1198 CE2 TYR A 76 -20.240 -8.972 1.032 1.00 0.00 C ATOM 1199 CZ TYR A 76 -21.017 -10.011 0.564 1.00 0.00 C ATOM 1200 OH TYR A 76 -22.383 -9.966 0.716 1.00 0.00 O ATOM 0 H TYR A 76 -14.319 -10.229 0.562 1.00 0.00 H new ATOM 0 HA TYR A 76 -16.587 -11.466 1.783 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -16.322 -9.219 0.453 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -16.514 -10.221 -0.972 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -18.603 -11.986 -0.693 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -18.261 -8.207 1.244 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -21.041 -11.908 -0.420 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -20.701 -8.124 1.517 1.00 0.00 H new ATOM 0 HH TYR A 76 -22.634 -9.136 1.173 1.00 0.00 H new ATOM 1210 N GLU A 77 -15.375 -12.763 -0.990 1.00 0.00 N ATOM 1211 CA GLU A 77 -15.410 -13.942 -1.849 1.00 0.00 C ATOM 1212 C GLU A 77 -14.757 -15.136 -1.157 1.00 0.00 C ATOM 1213 O GLU A 77 -15.434 -16.093 -0.780 1.00 0.00 O ATOM 1214 CB GLU A 77 -14.703 -13.656 -3.174 1.00 0.00 C ATOM 1215 CG GLU A 77 -15.635 -13.154 -4.265 1.00 0.00 C ATOM 1216 CD GLU A 77 -15.276 -13.693 -5.635 1.00 0.00 C ATOM 1217 OE1 GLU A 77 -14.374 -13.118 -6.281 1.00 0.00 O ATOM 1218 OE2 GLU A 77 -15.893 -14.691 -6.061 1.00 0.00 O ATOM 0 H GLU A 77 -14.641 -12.094 -1.222 1.00 0.00 H new ATOM 0 HA GLU A 77 -16.454 -14.185 -2.049 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -13.921 -12.915 -3.007 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -14.212 -14.566 -3.518 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -16.658 -13.441 -4.023 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -15.606 -12.065 -4.289 1.00 0.00 H new ATOM 1225 N GLY A 78 -13.441 -15.072 -0.995 1.00 0.00 N ATOM 1226 CA GLY A 78 -12.720 -16.153 -0.349 1.00 0.00 C ATOM 1227 C GLY A 78 -11.288 -16.268 -0.835 1.00 0.00 C ATOM 1228 O GLY A 78 -10.803 -17.368 -1.103 1.00 0.00 O ATOM 0 H GLY A 78 -12.860 -14.291 -1.299 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -12.723 -15.994 0.729 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -13.240 -17.093 -0.534 1.00 0.00 H new ATOM 1232 N VAL A 79 -10.610 -15.131 -0.948 1.00 0.00 N ATOM 1233 CA VAL A 79 -9.226 -15.108 -1.405 1.00 0.00 C ATOM 1234 C VAL A 79 -8.302 -14.558 -0.323 1.00 0.00 C ATOM 1235 O VAL A 79 -8.039 -13.357 -0.270 1.00 0.00 O ATOM 1236 CB VAL A 79 -9.066 -14.260 -2.682 1.00 0.00 C ATOM 1237 CG1 VAL A 79 -7.655 -14.387 -3.236 1.00 0.00 C ATOM 1238 CG2 VAL A 79 -10.097 -14.664 -3.727 1.00 0.00 C ATOM 0 H VAL A 79 -10.997 -14.213 -0.729 1.00 0.00 H new ATOM 0 HA VAL A 79 -8.950 -16.138 -1.629 1.00 0.00 H new ATOM 0 HB VAL A 79 -9.236 -13.215 -2.424 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -7.562 -13.781 -4.137 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -6.939 -14.041 -2.491 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -7.451 -15.430 -3.478 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -9.967 -14.054 -4.621 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -9.963 -15.715 -3.983 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -11.099 -14.513 -3.327 1.00 0.00 H new ATOM 1248 N ALA A 80 -7.814 -15.445 0.538 1.00 0.00 N ATOM 1249 CA ALA A 80 -6.919 -15.047 1.618 1.00 0.00 C ATOM 1250 C ALA A 80 -5.546 -14.659 1.080 1.00 0.00 C ATOM 1251 O ALA A 80 -4.876 -13.789 1.635 1.00 0.00 O ATOM 1252 CB ALA A 80 -6.791 -16.171 2.635 1.00 0.00 C ATOM 0 H ALA A 80 -8.023 -16.443 0.509 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.347 -14.173 2.109 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -6.120 -15.862 3.437 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.772 -16.399 3.051 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -6.389 -17.059 2.147 1.00 0.00 H new ATOM 1258 N VAL A 81 -5.134 -15.311 -0.001 1.00 0.00 N ATOM 1259 CA VAL A 81 -3.840 -15.032 -0.613 1.00 0.00 C ATOM 1260 C VAL A 81 -3.981 -14.057 -1.778 1.00 0.00 C ATOM 1261 O VAL A 81 -4.860 -14.210 -2.625 1.00 0.00 O ATOM 1262 CB VAL A 81 -3.168 -16.322 -1.119 1.00 0.00 C ATOM 1263 CG1 VAL A 81 -1.738 -16.044 -1.556 1.00 0.00 C ATOM 1264 CG2 VAL A 81 -3.205 -17.400 -0.046 1.00 0.00 C ATOM 0 H VAL A 81 -5.676 -16.036 -0.471 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.216 -14.584 0.160 1.00 0.00 H new ATOM 0 HB VAL A 81 -3.724 -16.683 -1.984 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -1.280 -16.967 -1.910 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.740 -15.308 -2.360 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.168 -15.657 -0.711 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -2.726 -18.304 -0.422 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -2.675 -17.050 0.840 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -4.241 -17.620 0.214 1.00 0.00 H new ATOM 1274 N MET A 82 -3.108 -13.056 -1.812 1.00 0.00 N ATOM 1275 CA MET A 82 -3.134 -12.056 -2.873 1.00 0.00 C ATOM 1276 C MET A 82 -1.937 -12.218 -3.803 1.00 0.00 C ATOM 1277 O MET A 82 -0.918 -12.797 -3.424 1.00 0.00 O ATOM 1278 CB MET A 82 -3.143 -10.647 -2.275 1.00 0.00 C ATOM 1279 CG MET A 82 -3.534 -9.567 -3.269 1.00 0.00 C ATOM 1280 SD MET A 82 -4.109 -8.059 -2.466 1.00 0.00 S ATOM 1281 CE MET A 82 -2.738 -6.955 -2.796 1.00 0.00 C ATOM 0 H MET A 82 -2.374 -12.916 -1.118 1.00 0.00 H new ATOM 0 HA MET A 82 -4.045 -12.203 -3.454 1.00 0.00 H new ATOM 0 HB2 MET A 82 -3.836 -10.623 -1.434 1.00 0.00 H new ATOM 0 HB3 MET A 82 -2.153 -10.423 -1.879 1.00 0.00 H new ATOM 0 HG2 MET A 82 -2.677 -9.333 -3.901 1.00 0.00 H new ATOM 0 HG3 MET A 82 -4.319 -9.948 -3.923 1.00 0.00 H new ATOM 0 HE1 MET A 82 -2.912 -6.000 -2.300 1.00 0.00 H new ATOM 0 HE2 MET A 82 -1.816 -7.397 -2.418 1.00 0.00 H new ATOM 0 HE3 MET A 82 -2.650 -6.795 -3.871 1.00 0.00 H new ATOM 1291 N LYS A 83 -2.066 -11.702 -5.021 1.00 0.00 N ATOM 1292 CA LYS A 83 -0.994 -11.789 -6.006 1.00 0.00 C ATOM 1293 C LYS A 83 -0.412 -10.411 -6.300 1.00 0.00 C ATOM 1294 O LYS A 83 -0.957 -9.654 -7.103 1.00 0.00 O ATOM 1295 CB LYS A 83 -1.512 -12.424 -7.299 1.00 0.00 C ATOM 1296 CG LYS A 83 -0.445 -12.578 -8.370 1.00 0.00 C ATOM 1297 CD LYS A 83 0.329 -13.876 -8.204 1.00 0.00 C ATOM 1298 CE LYS A 83 -0.226 -14.975 -9.095 1.00 0.00 C ATOM 1299 NZ LYS A 83 0.857 -15.784 -9.719 1.00 0.00 N ATOM 0 H LYS A 83 -2.902 -11.219 -5.350 1.00 0.00 H new ATOM 0 HA LYS A 83 -0.204 -12.416 -5.592 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -1.930 -13.404 -7.071 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -2.325 -11.815 -7.693 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -0.911 -12.555 -9.355 1.00 0.00 H new ATOM 0 HG3 LYS A 83 0.243 -11.734 -8.323 1.00 0.00 H new ATOM 0 HD2 LYS A 83 1.379 -13.708 -8.444 1.00 0.00 H new ATOM 0 HD3 LYS A 83 0.287 -14.195 -7.163 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -0.873 -15.626 -8.508 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -0.844 -14.532 -9.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 0.437 -16.523 -10.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 1.460 -15.167 -10.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 1.432 -16.228 -8.974 1.00 0.00 H new ATOM 1313 N LEU A 84 0.698 -10.092 -5.644 1.00 0.00 N ATOM 1314 CA LEU A 84 1.357 -8.805 -5.835 1.00 0.00 C ATOM 1315 C LEU A 84 2.517 -8.928 -6.817 1.00 0.00 C ATOM 1316 O LEU A 84 3.406 -9.762 -6.642 1.00 0.00 O ATOM 1317 CB LEU A 84 1.862 -8.263 -4.496 1.00 0.00 C ATOM 1318 CG LEU A 84 0.861 -7.396 -3.729 1.00 0.00 C ATOM 1319 CD1 LEU A 84 1.437 -6.976 -2.386 1.00 0.00 C ATOM 1320 CD2 LEU A 84 0.476 -6.176 -4.552 1.00 0.00 C ATOM 0 H LEU A 84 1.161 -10.707 -4.975 1.00 0.00 H new ATOM 0 HA LEU A 84 0.627 -8.109 -6.249 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.148 -9.105 -3.865 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.764 -7.678 -4.675 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.037 -7.985 -3.546 1.00 0.00 H new ATOM 0 HD11 LEU A 84 0.711 -6.360 -1.855 1.00 0.00 H new ATOM 0 HD12 LEU A 84 1.663 -7.863 -1.794 1.00 0.00 H new ATOM 0 HD13 LEU A 84 2.351 -6.404 -2.545 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.236 -5.570 -3.993 1.00 0.00 H new ATOM 0 HD22 LEU A 84 1.367 -5.585 -4.765 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.021 -6.498 -5.489 1.00 0.00 H new ATOM 1332 N PHE A 85 2.503 -8.094 -7.851 1.00 0.00 N ATOM 1333 CA PHE A 85 3.553 -8.111 -8.862 1.00 0.00 C ATOM 1334 C PHE A 85 3.609 -9.463 -9.566 1.00 0.00 C ATOM 1335 O PHE A 85 4.677 -9.912 -9.982 1.00 0.00 O ATOM 1336 CB PHE A 85 4.909 -7.797 -8.225 1.00 0.00 C ATOM 1337 CG PHE A 85 4.964 -6.450 -7.564 1.00 0.00 C ATOM 1338 CD1 PHE A 85 4.850 -5.291 -8.315 1.00 0.00 C ATOM 1339 CD2 PHE A 85 5.131 -6.342 -6.193 1.00 0.00 C ATOM 1340 CE1 PHE A 85 4.900 -4.048 -7.710 1.00 0.00 C ATOM 1341 CE2 PHE A 85 5.182 -5.103 -5.583 1.00 0.00 C ATOM 1342 CZ PHE A 85 5.067 -3.955 -6.342 1.00 0.00 C ATOM 0 H PHE A 85 1.775 -7.397 -8.011 1.00 0.00 H new ATOM 0 HA PHE A 85 3.322 -7.346 -9.603 1.00 0.00 H new ATOM 0 HB2 PHE A 85 5.141 -8.565 -7.487 1.00 0.00 H new ATOM 0 HB3 PHE A 85 5.682 -7.848 -8.992 1.00 0.00 H new ATOM 0 HD1 PHE A 85 4.721 -5.359 -9.385 1.00 0.00 H new ATOM 0 HD2 PHE A 85 5.222 -7.236 -5.594 1.00 0.00 H new ATOM 0 HE1 PHE A 85 4.809 -3.152 -8.306 1.00 0.00 H new ATOM 0 HE2 PHE A 85 5.312 -5.033 -4.513 1.00 0.00 H new ATOM 0 HZ PHE A 85 5.108 -2.986 -5.867 1.00 0.00 H new ATOM 1352 N ASP A 86 2.450 -10.106 -9.693 1.00 0.00 N ATOM 1353 CA ASP A 86 2.352 -11.412 -10.345 1.00 0.00 C ATOM 1354 C ASP A 86 3.473 -12.346 -9.893 1.00 0.00 C ATOM 1355 O ASP A 86 3.930 -13.198 -10.657 1.00 0.00 O ATOM 1356 CB ASP A 86 2.381 -11.252 -11.867 1.00 0.00 C ATOM 1357 CG ASP A 86 3.703 -10.709 -12.373 1.00 0.00 C ATOM 1358 OD1 ASP A 86 3.856 -9.470 -12.422 1.00 0.00 O ATOM 1359 OD2 ASP A 86 4.585 -11.522 -12.721 1.00 0.00 O ATOM 0 H ASP A 86 1.561 -9.742 -9.351 1.00 0.00 H new ATOM 0 HA ASP A 86 1.402 -11.859 -10.052 1.00 0.00 H new ATOM 0 HB2 ASP A 86 2.187 -12.218 -12.334 1.00 0.00 H new ATOM 0 HB3 ASP A 86 1.577 -10.583 -12.173 1.00 0.00 H new ATOM 1364 N ARG A 87 3.912 -12.179 -8.650 1.00 0.00 N ATOM 1365 CA ARG A 87 4.978 -13.006 -8.098 1.00 0.00 C ATOM 1366 C ARG A 87 4.851 -13.121 -6.583 1.00 0.00 C ATOM 1367 O ARG A 87 4.573 -14.197 -6.054 1.00 0.00 O ATOM 1368 CB ARG A 87 6.345 -12.422 -8.462 1.00 0.00 C ATOM 1369 CG ARG A 87 6.681 -12.538 -9.940 1.00 0.00 C ATOM 1370 CD ARG A 87 7.981 -11.824 -10.273 1.00 0.00 C ATOM 1371 NE ARG A 87 8.579 -12.323 -11.509 1.00 0.00 N ATOM 1372 CZ ARG A 87 9.497 -11.661 -12.209 1.00 0.00 C ATOM 1373 NH1 ARG A 87 9.926 -10.472 -11.799 1.00 0.00 N ATOM 1374 NH2 ARG A 87 9.988 -12.186 -13.323 1.00 0.00 N ATOM 0 H ARG A 87 3.546 -11.478 -8.006 1.00 0.00 H new ATOM 0 HA ARG A 87 4.888 -14.003 -8.529 1.00 0.00 H new ATOM 0 HB2 ARG A 87 6.371 -11.371 -8.173 1.00 0.00 H new ATOM 0 HB3 ARG A 87 7.115 -12.931 -7.882 1.00 0.00 H new ATOM 0 HG2 ARG A 87 6.762 -13.590 -10.214 1.00 0.00 H new ATOM 0 HG3 ARG A 87 5.870 -12.115 -10.533 1.00 0.00 H new ATOM 0 HD2 ARG A 87 7.793 -10.754 -10.367 1.00 0.00 H new ATOM 0 HD3 ARG A 87 8.686 -11.953 -9.452 1.00 0.00 H new ATOM 0 HE ARG A 87 8.275 -13.233 -11.856 1.00 0.00 H new ATOM 0 HH11 ARG A 87 9.552 -10.062 -10.943 1.00 0.00 H new ATOM 0 HH12 ARG A 87 10.630 -9.969 -12.340 1.00 0.00 H new ATOM 0 HH21 ARG A 87 9.662 -13.098 -13.644 1.00 0.00 H new ATOM 0 HH22 ARG A 87 10.692 -11.678 -13.859 1.00 0.00 H new ATOM 1388 N ALA A 88 5.055 -12.005 -5.891 1.00 0.00 N ATOM 1389 CA ALA A 88 4.965 -11.981 -4.436 1.00 0.00 C ATOM 1390 C ALA A 88 3.529 -12.196 -3.970 1.00 0.00 C ATOM 1391 O ALA A 88 2.586 -11.685 -4.574 1.00 0.00 O ATOM 1392 CB ALA A 88 5.504 -10.664 -3.898 1.00 0.00 C ATOM 0 H ALA A 88 5.284 -11.106 -6.314 1.00 0.00 H new ATOM 0 HA ALA A 88 5.571 -12.798 -4.045 1.00 0.00 H new ATOM 0 HB1 ALA A 88 5.431 -10.658 -2.810 1.00 0.00 H new ATOM 0 HB2 ALA A 88 6.547 -10.550 -4.193 1.00 0.00 H new ATOM 0 HB3 ALA A 88 4.920 -9.838 -4.305 1.00 0.00 H new ATOM 1398 N LYS A 89 3.371 -12.957 -2.892 1.00 0.00 N ATOM 1399 CA LYS A 89 2.051 -13.242 -2.342 1.00 0.00 C ATOM 1400 C LYS A 89 1.935 -12.720 -0.914 1.00 0.00 C ATOM 1401 O LYS A 89 2.859 -12.862 -0.113 1.00 0.00 O ATOM 1402 CB LYS A 89 1.777 -14.746 -2.372 1.00 0.00 C ATOM 1403 CG LYS A 89 1.477 -15.283 -3.761 1.00 0.00 C ATOM 1404 CD LYS A 89 1.590 -16.799 -3.809 1.00 0.00 C ATOM 1405 CE LYS A 89 0.719 -17.388 -4.906 1.00 0.00 C ATOM 1406 NZ LYS A 89 1.511 -17.726 -6.121 1.00 0.00 N ATOM 0 H LYS A 89 4.142 -13.388 -2.382 1.00 0.00 H new ATOM 0 HA LYS A 89 1.309 -12.733 -2.958 1.00 0.00 H new ATOM 0 HB2 LYS A 89 2.641 -15.272 -1.967 1.00 0.00 H new ATOM 0 HB3 LYS A 89 0.934 -14.966 -1.717 1.00 0.00 H new ATOM 0 HG2 LYS A 89 0.473 -14.982 -4.059 1.00 0.00 H new ATOM 0 HG3 LYS A 89 2.168 -14.843 -4.480 1.00 0.00 H new ATOM 0 HD2 LYS A 89 2.629 -17.082 -3.977 1.00 0.00 H new ATOM 0 HD3 LYS A 89 1.297 -17.217 -2.846 1.00 0.00 H new ATOM 0 HE2 LYS A 89 0.224 -18.285 -4.534 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -0.064 -16.677 -5.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 0.881 -18.125 -6.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 1.964 -16.866 -6.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 2.242 -18.424 -5.876 1.00 0.00 H new ATOM 1420 N VAL A 90 0.794 -12.115 -0.601 1.00 0.00 N ATOM 1421 CA VAL A 90 0.558 -11.571 0.732 1.00 0.00 C ATOM 1422 C VAL A 90 -0.762 -12.074 1.305 1.00 0.00 C ATOM 1423 O VAL A 90 -1.650 -12.498 0.566 1.00 0.00 O ATOM 1424 CB VAL A 90 0.544 -10.031 0.718 1.00 0.00 C ATOM 1425 CG1 VAL A 90 0.543 -9.484 2.136 1.00 0.00 C ATOM 1426 CG2 VAL A 90 1.729 -9.492 -0.069 1.00 0.00 C ATOM 0 H VAL A 90 0.019 -11.989 -1.252 1.00 0.00 H new ATOM 0 HA VAL A 90 1.379 -11.913 1.362 1.00 0.00 H new ATOM 0 HB VAL A 90 -0.370 -9.699 0.225 1.00 0.00 H new ATOM 0 HG11 VAL A 90 0.533 -8.394 2.106 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -0.342 -9.840 2.663 1.00 0.00 H new ATOM 0 HG13 VAL A 90 1.437 -9.824 2.658 1.00 0.00 H new ATOM 0 HG21 VAL A 90 1.702 -8.402 -0.067 1.00 0.00 H new ATOM 0 HG22 VAL A 90 2.657 -9.832 0.391 1.00 0.00 H new ATOM 0 HG23 VAL A 90 1.679 -9.855 -1.096 1.00 0.00 H new ATOM 1436 N ASN A 91 -0.884 -12.023 2.628 1.00 0.00 N ATOM 1437 CA ASN A 91 -2.096 -12.472 3.302 1.00 0.00 C ATOM 1438 C ASN A 91 -3.069 -11.315 3.497 1.00 0.00 C ATOM 1439 O ASN A 91 -2.775 -10.357 4.213 1.00 0.00 O ATOM 1440 CB ASN A 91 -1.751 -13.097 4.655 1.00 0.00 C ATOM 1441 CG ASN A 91 -2.746 -14.161 5.072 1.00 0.00 C ATOM 1442 OD1 ASN A 91 -3.136 -15.012 4.272 1.00 0.00 O ATOM 1443 ND2 ASN A 91 -3.166 -14.118 6.332 1.00 0.00 N ATOM 0 H ASN A 91 -0.158 -11.675 3.254 1.00 0.00 H new ATOM 0 HA ASN A 91 -2.574 -13.224 2.674 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -0.754 -13.535 4.606 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -1.719 -12.316 5.415 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -3.837 -14.808 6.670 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -2.817 -13.395 6.962 1.00 0.00 H new ATOM 1450 N VAL A 92 -4.230 -11.408 2.856 1.00 0.00 N ATOM 1451 CA VAL A 92 -5.245 -10.368 2.959 1.00 0.00 C ATOM 1452 C VAL A 92 -5.860 -10.330 4.354 1.00 0.00 C ATOM 1453 O VAL A 92 -6.318 -9.284 4.814 1.00 0.00 O ATOM 1454 CB VAL A 92 -6.368 -10.575 1.924 1.00 0.00 C ATOM 1455 CG1 VAL A 92 -7.307 -9.378 1.906 1.00 0.00 C ATOM 1456 CG2 VAL A 92 -5.780 -10.822 0.542 1.00 0.00 C ATOM 0 H VAL A 92 -4.490 -12.194 2.260 1.00 0.00 H new ATOM 0 HA VAL A 92 -4.744 -9.420 2.760 1.00 0.00 H new ATOM 0 HB VAL A 92 -6.945 -11.454 2.212 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -8.093 -9.543 1.169 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -7.755 -9.252 2.892 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -6.747 -8.480 1.644 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -6.587 -10.966 -0.176 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -5.178 -9.964 0.244 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -5.153 -11.713 0.567 1.00 0.00 H new ATOM 1466 N ASN A 93 -5.869 -11.479 5.024 1.00 0.00 N ATOM 1467 CA ASN A 93 -6.430 -11.577 6.367 1.00 0.00 C ATOM 1468 C ASN A 93 -5.609 -10.766 7.365 1.00 0.00 C ATOM 1469 O ASN A 93 -6.138 -10.274 8.363 1.00 0.00 O ATOM 1470 CB ASN A 93 -6.493 -13.040 6.809 1.00 0.00 C ATOM 1471 CG ASN A 93 -7.726 -13.749 6.286 1.00 0.00 C ATOM 1472 OD1 ASN A 93 -8.278 -13.377 5.250 1.00 0.00 O ATOM 1473 ND2 ASN A 93 -8.165 -14.778 7.002 1.00 0.00 N ATOM 0 H ASN A 93 -5.494 -12.354 4.659 1.00 0.00 H new ATOM 0 HA ASN A 93 -7.440 -11.167 6.341 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -5.602 -13.561 6.459 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -6.484 -13.088 7.898 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -8.991 -15.295 6.699 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -7.676 -15.052 7.854 1.00 0.00 H new ATOM 1480 N LEU A 94 -4.314 -10.634 7.094 1.00 0.00 N ATOM 1481 CA LEU A 94 -3.423 -9.885 7.974 1.00 0.00 C ATOM 1482 C LEU A 94 -3.020 -8.554 7.344 1.00 0.00 C ATOM 1483 O LEU A 94 -2.755 -7.579 8.047 1.00 0.00 O ATOM 1484 CB LEU A 94 -2.174 -10.710 8.289 1.00 0.00 C ATOM 1485 CG LEU A 94 -2.405 -11.907 9.212 1.00 0.00 C ATOM 1486 CD1 LEU A 94 -1.121 -12.702 9.387 1.00 0.00 C ATOM 1487 CD2 LEU A 94 -2.936 -11.445 10.560 1.00 0.00 C ATOM 0 H LEU A 94 -3.859 -11.035 6.274 1.00 0.00 H new ATOM 0 HA LEU A 94 -3.960 -9.678 8.900 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -1.749 -11.070 7.352 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.431 -10.056 8.746 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.150 -12.557 8.753 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -1.305 -13.550 10.047 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.782 -13.065 8.416 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.354 -12.062 9.823 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -3.095 -12.310 11.204 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -2.214 -10.774 11.025 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -3.881 -10.920 10.418 1.00 0.00 H new ATOM 1499 N LEU A 95 -2.973 -8.521 6.016 1.00 0.00 N ATOM 1500 CA LEU A 95 -2.601 -7.310 5.293 1.00 0.00 C ATOM 1501 C LEU A 95 -3.527 -6.151 5.647 1.00 0.00 C ATOM 1502 O LEU A 95 -3.082 -5.014 5.806 1.00 0.00 O ATOM 1503 CB LEU A 95 -2.637 -7.562 3.783 1.00 0.00 C ATOM 1504 CG LEU A 95 -2.250 -6.362 2.918 1.00 0.00 C ATOM 1505 CD1 LEU A 95 -0.777 -6.027 3.096 1.00 0.00 C ATOM 1506 CD2 LEU A 95 -2.562 -6.639 1.455 1.00 0.00 C ATOM 0 H LEU A 95 -3.188 -9.319 5.419 1.00 0.00 H new ATOM 0 HA LEU A 95 -1.587 -7.041 5.589 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -1.966 -8.389 3.552 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -3.642 -7.881 3.507 1.00 0.00 H new ATOM 0 HG LEU A 95 -2.838 -5.502 3.239 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -0.521 -5.170 2.472 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -0.582 -5.786 4.141 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -0.171 -6.884 2.802 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -2.281 -5.775 0.853 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -2.000 -7.512 1.122 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -3.629 -6.829 1.340 1.00 0.00 H new ATOM 1518 N ILE A 96 -4.817 -6.446 5.768 1.00 0.00 N ATOM 1519 CA ILE A 96 -5.805 -5.427 6.102 1.00 0.00 C ATOM 1520 C ILE A 96 -5.698 -5.013 7.566 1.00 0.00 C ATOM 1521 O ILE A 96 -5.777 -3.829 7.893 1.00 0.00 O ATOM 1522 CB ILE A 96 -7.238 -5.920 5.824 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -7.342 -6.484 4.406 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -8.237 -4.790 6.024 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -8.605 -7.283 4.164 1.00 0.00 C ATOM 0 H ILE A 96 -5.202 -7.382 5.640 1.00 0.00 H new ATOM 0 HA ILE A 96 -5.595 -4.566 5.468 1.00 0.00 H new ATOM 0 HB ILE A 96 -7.474 -6.716 6.530 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -7.300 -5.661 3.692 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -6.477 -7.119 4.212 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -9.244 -5.155 5.824 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -8.179 -4.431 7.051 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -8.004 -3.973 5.340 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -8.611 -7.652 3.138 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -8.640 -8.127 4.853 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -9.475 -6.646 4.326 1.00 0.00 H new ATOM 1537 N PHE A 97 -5.519 -5.995 8.445 1.00 0.00 N ATOM 1538 CA PHE A 97 -5.404 -5.732 9.875 1.00 0.00 C ATOM 1539 C PHE A 97 -4.251 -4.776 10.166 1.00 0.00 C ATOM 1540 O PHE A 97 -4.400 -3.826 10.937 1.00 0.00 O ATOM 1541 CB PHE A 97 -5.201 -7.041 10.640 1.00 0.00 C ATOM 1542 CG PHE A 97 -5.196 -6.869 12.132 1.00 0.00 C ATOM 1543 CD1 PHE A 97 -6.383 -6.878 12.847 1.00 0.00 C ATOM 1544 CD2 PHE A 97 -4.006 -6.701 12.819 1.00 0.00 C ATOM 1545 CE1 PHE A 97 -6.383 -6.721 14.220 1.00 0.00 C ATOM 1546 CE2 PHE A 97 -3.998 -6.543 14.193 1.00 0.00 C ATOM 1547 CZ PHE A 97 -5.189 -6.553 14.893 1.00 0.00 C ATOM 0 H PHE A 97 -5.450 -6.981 8.191 1.00 0.00 H new ATOM 0 HA PHE A 97 -6.331 -5.263 10.206 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -5.992 -7.739 10.365 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -4.257 -7.490 10.331 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -7.319 -7.009 12.325 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -3.073 -6.693 12.276 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -7.315 -6.730 14.766 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -3.063 -6.412 14.717 1.00 0.00 H new ATOM 0 HZ PHE A 97 -5.186 -6.429 15.966 1.00 0.00 H new ATOM 1557 N LEU A 98 -3.103 -5.033 9.550 1.00 0.00 N ATOM 1558 CA LEU A 98 -1.925 -4.196 9.746 1.00 0.00 C ATOM 1559 C LEU A 98 -2.204 -2.753 9.335 1.00 0.00 C ATOM 1560 O LEU A 98 -2.051 -1.829 10.133 1.00 0.00 O ATOM 1561 CB LEU A 98 -0.743 -4.745 8.945 1.00 0.00 C ATOM 1562 CG LEU A 98 0.629 -4.218 9.370 1.00 0.00 C ATOM 1563 CD1 LEU A 98 1.094 -4.906 10.643 1.00 0.00 C ATOM 1564 CD2 LEU A 98 1.643 -4.414 8.253 1.00 0.00 C ATOM 0 H LEU A 98 -2.963 -5.815 8.910 1.00 0.00 H new ATOM 0 HA LEU A 98 -1.676 -4.211 10.807 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -0.740 -5.832 9.030 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.896 -4.508 7.892 1.00 0.00 H new ATOM 0 HG LEU A 98 0.542 -3.150 9.571 1.00 0.00 H new ATOM 0 HD11 LEU A 98 2.072 -4.518 10.930 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.379 -4.714 11.443 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.166 -5.980 10.471 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.614 -4.034 8.572 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.728 -5.476 8.021 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.315 -3.873 7.365 1.00 0.00 H new ATOM 1576 N LEU A 99 -2.612 -2.568 8.083 1.00 0.00 N ATOM 1577 CA LEU A 99 -2.911 -1.238 7.564 1.00 0.00 C ATOM 1578 C LEU A 99 -4.021 -0.569 8.371 1.00 0.00 C ATOM 1579 O LEU A 99 -4.096 0.658 8.439 1.00 0.00 O ATOM 1580 CB LEU A 99 -3.316 -1.323 6.092 1.00 0.00 C ATOM 1581 CG LEU A 99 -2.312 -2.033 5.183 1.00 0.00 C ATOM 1582 CD1 LEU A 99 -2.887 -2.209 3.786 1.00 0.00 C ATOM 1583 CD2 LEU A 99 -1.003 -1.258 5.129 1.00 0.00 C ATOM 0 H LEU A 99 -2.743 -3.323 7.409 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.010 -0.632 7.654 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -4.273 -1.840 6.024 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -3.472 -0.312 5.715 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.111 -3.021 5.597 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.158 -2.716 3.154 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.798 -2.805 3.840 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -3.118 -1.232 3.362 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.300 -1.777 4.478 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -1.188 -0.257 4.739 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -0.582 -1.184 6.132 1.00 0.00 H new ATOM 1595 N ASN A 100 -4.882 -1.381 8.977 1.00 0.00 N ATOM 1596 CA ASN A 100 -5.988 -0.864 9.775 1.00 0.00 C ATOM 1597 C ASN A 100 -5.483 -0.009 10.935 1.00 0.00 C ATOM 1598 O ASN A 100 -6.189 0.879 11.414 1.00 0.00 O ATOM 1599 CB ASN A 100 -6.836 -2.018 10.314 1.00 0.00 C ATOM 1600 CG ASN A 100 -8.319 -1.696 10.311 1.00 0.00 C ATOM 1601 OD1 ASN A 100 -8.720 -0.569 10.026 1.00 0.00 O ATOM 1602 ND2 ASN A 100 -9.140 -2.690 10.631 1.00 0.00 N ATOM 0 H ASN A 100 -4.835 -2.399 8.931 1.00 0.00 H new ATOM 0 HA ASN A 100 -6.600 -0.236 9.128 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -6.659 -2.908 9.711 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -6.520 -2.254 11.330 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -10.148 -2.534 10.647 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -8.763 -3.609 10.861 1.00 0.00 H new ATOM 1609 N LYS A 101 -4.261 -0.282 11.383 1.00 0.00 N ATOM 1610 CA LYS A 101 -3.673 0.466 12.491 1.00 0.00 C ATOM 1611 C LYS A 101 -2.506 1.328 12.017 1.00 0.00 C ATOM 1612 O LYS A 101 -2.258 2.404 12.561 1.00 0.00 O ATOM 1613 CB LYS A 101 -3.200 -0.494 13.585 1.00 0.00 C ATOM 1614 CG LYS A 101 -4.261 -0.791 14.632 1.00 0.00 C ATOM 1615 CD LYS A 101 -3.912 -2.028 15.443 1.00 0.00 C ATOM 1616 CE LYS A 101 -2.675 -1.805 16.298 1.00 0.00 C ATOM 1617 NZ LYS A 101 -2.835 -2.374 17.665 1.00 0.00 N ATOM 0 H LYS A 101 -3.661 -1.012 10.999 1.00 0.00 H new ATOM 0 HA LYS A 101 -4.441 1.124 12.897 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -2.884 -1.430 13.124 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -2.325 -0.069 14.077 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -4.365 0.065 15.299 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -5.225 -0.935 14.144 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -4.754 -2.294 16.082 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -3.744 -2.869 14.771 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -1.812 -2.261 15.814 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -2.472 -0.737 16.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -1.970 -2.201 18.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -3.643 -1.921 18.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -3.003 -3.398 17.597 1.00 0.00 H new ATOM 1631 N LYS A 102 -1.792 0.849 11.003 1.00 0.00 N ATOM 1632 CA LYS A 102 -0.651 1.580 10.463 1.00 0.00 C ATOM 1633 C LYS A 102 -1.078 2.944 9.927 1.00 0.00 C ATOM 1634 O LYS A 102 -0.845 3.971 10.563 1.00 0.00 O ATOM 1635 CB LYS A 102 0.023 0.770 9.354 1.00 0.00 C ATOM 1636 CG LYS A 102 0.739 -0.473 9.857 1.00 0.00 C ATOM 1637 CD LYS A 102 1.934 -0.114 10.727 1.00 0.00 C ATOM 1638 CE LYS A 102 3.130 -1.003 10.426 1.00 0.00 C ATOM 1639 NZ LYS A 102 4.208 -0.845 11.441 1.00 0.00 N ATOM 0 H LYS A 102 -1.983 -0.040 10.540 1.00 0.00 H new ATOM 0 HA LYS A 102 0.062 1.737 11.273 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -0.729 0.475 8.623 1.00 0.00 H new ATOM 0 HB3 LYS A 102 0.739 1.407 8.835 1.00 0.00 H new ATOM 0 HG2 LYS A 102 0.044 -1.089 10.428 1.00 0.00 H new ATOM 0 HG3 LYS A 102 1.072 -1.071 9.009 1.00 0.00 H new ATOM 0 HD2 LYS A 102 2.204 0.929 10.563 1.00 0.00 H new ATOM 0 HD3 LYS A 102 1.662 -0.211 11.778 1.00 0.00 H new ATOM 0 HE2 LYS A 102 2.810 -2.044 10.395 1.00 0.00 H new ATOM 0 HE3 LYS A 102 3.523 -0.761 9.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 5.109 -1.182 11.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 4.297 0.158 11.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 3.972 -1.401 12.288 1.00 0.00 H new ATOM 1653 N PHE A 103 -1.702 2.945 8.753 1.00 0.00 N ATOM 1654 CA PHE A 103 -2.158 4.184 8.132 1.00 0.00 C ATOM 1655 C PHE A 103 -3.495 4.629 8.716 1.00 0.00 C ATOM 1656 O PHE A 103 -3.682 5.802 9.038 1.00 0.00 O ATOM 1657 CB PHE A 103 -2.284 4.003 6.619 1.00 0.00 C ATOM 1658 CG PHE A 103 -0.966 3.806 5.925 1.00 0.00 C ATOM 1659 CD1 PHE A 103 -0.061 4.849 5.817 1.00 0.00 C ATOM 1660 CD2 PHE A 103 -0.633 2.575 5.383 1.00 0.00 C ATOM 1661 CE1 PHE A 103 1.151 4.669 5.179 1.00 0.00 C ATOM 1662 CE2 PHE A 103 0.579 2.389 4.745 1.00 0.00 C ATOM 1663 CZ PHE A 103 1.472 3.437 4.643 1.00 0.00 C ATOM 0 H PHE A 103 -1.903 2.103 8.213 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.418 4.957 8.339 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -2.924 3.144 6.416 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -2.780 4.877 6.197 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.306 5.814 6.236 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -1.328 1.752 5.460 1.00 0.00 H new ATOM 0 HE1 PHE A 103 1.847 5.491 5.099 1.00 0.00 H new ATOM 0 HE2 PHE A 103 0.827 1.425 4.327 1.00 0.00 H new ATOM 0 HZ PHE A 103 2.420 3.294 4.145 1.00 0.00 H new ATOM 1673 N TYR A 104 -4.421 3.686 8.849 1.00 0.00 N ATOM 1674 CA TYR A 104 -5.742 3.982 9.392 1.00 0.00 C ATOM 1675 C TYR A 104 -5.634 4.572 10.796 1.00 0.00 C ATOM 1676 O TYR A 104 -5.317 3.868 11.755 1.00 0.00 O ATOM 1677 CB TYR A 104 -6.601 2.715 9.421 1.00 0.00 C ATOM 1678 CG TYR A 104 -7.639 2.664 8.323 1.00 0.00 C ATOM 1679 CD1 TYR A 104 -7.303 2.238 7.044 1.00 0.00 C ATOM 1680 CD2 TYR A 104 -8.953 3.039 8.565 1.00 0.00 C ATOM 1681 CE1 TYR A 104 -8.249 2.189 6.037 1.00 0.00 C ATOM 1682 CE2 TYR A 104 -9.905 2.993 7.563 1.00 0.00 C ATOM 1683 CZ TYR A 104 -9.547 2.568 6.302 1.00 0.00 C ATOM 1684 OH TYR A 104 -10.492 2.520 5.302 1.00 0.00 O ATOM 0 H TYR A 104 -4.281 2.710 8.588 1.00 0.00 H new ATOM 0 HA TYR A 104 -6.217 4.719 8.744 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -5.952 1.844 9.337 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -7.102 2.647 10.387 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -6.286 1.940 6.833 1.00 0.00 H new ATOM 0 HD2 TYR A 104 -9.237 3.372 9.552 1.00 0.00 H new ATOM 0 HE1 TYR A 104 -7.972 1.855 5.048 1.00 0.00 H new ATOM 0 HE2 TYR A 104 -10.923 3.289 7.768 1.00 0.00 H new ATOM 0 HH TYR A 104 -10.550 1.607 4.950 1.00 0.00 H new ATOM 1694 N GLY A 105 -5.901 5.869 10.909 1.00 0.00 N ATOM 1695 CA GLY A 105 -5.829 6.533 12.197 1.00 0.00 C ATOM 1696 C GLY A 105 -6.973 7.502 12.414 1.00 0.00 C ATOM 1697 O GLY A 105 -6.835 8.484 13.145 1.00 0.00 O ATOM 0 H GLY A 105 -6.166 6.472 10.131 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -5.836 5.784 12.989 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -4.883 7.069 12.273 1.00 0.00 H new ATOM 1701 N LYS A 106 -8.108 7.228 11.778 1.00 0.00 N ATOM 1702 CA LYS A 106 -9.282 8.083 11.905 1.00 0.00 C ATOM 1703 C LYS A 106 -10.263 7.513 12.924 1.00 0.00 C ATOM 1704 O LYS A 106 -10.727 6.381 12.787 1.00 0.00 O ATOM 1705 CB LYS A 106 -9.972 8.243 10.548 1.00 0.00 C ATOM 1706 CG LYS A 106 -9.379 9.349 9.690 1.00 0.00 C ATOM 1707 CD LYS A 106 -10.332 10.526 9.557 1.00 0.00 C ATOM 1708 CE LYS A 106 -9.580 11.845 9.478 1.00 0.00 C ATOM 1709 NZ LYS A 106 -10.505 13.009 9.414 1.00 0.00 N ATOM 0 H LYS A 106 -8.239 6.420 11.169 1.00 0.00 H new ATOM 0 HA LYS A 106 -8.952 9.061 12.254 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -9.909 7.300 10.005 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -11.030 8.448 10.710 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -8.441 9.688 10.129 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -9.144 8.957 8.701 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -10.944 10.401 8.664 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -11.011 10.544 10.409 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -8.930 11.945 10.348 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -8.937 11.844 8.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -9.968 13.867 9.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -11.227 12.839 8.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -10.967 13.136 10.337 1.00 0.00 H new ATOM 1723 N SER A 107 -10.576 8.304 13.945 1.00 0.00 N ATOM 1724 CA SER A 107 -11.502 7.877 14.986 1.00 0.00 C ATOM 1725 C SER A 107 -12.134 9.080 15.680 1.00 0.00 C ATOM 1726 O SER A 107 -11.491 9.754 16.485 1.00 0.00 O ATOM 1727 CB SER A 107 -10.780 7.003 16.014 1.00 0.00 C ATOM 1728 OG SER A 107 -10.104 5.929 15.384 1.00 0.00 O ATOM 0 H SER A 107 -10.202 9.244 14.073 1.00 0.00 H new ATOM 0 HA SER A 107 -12.294 7.294 14.515 1.00 0.00 H new ATOM 0 HB2 SER A 107 -10.066 7.608 16.573 1.00 0.00 H new ATOM 0 HB3 SER A 107 -11.500 6.612 16.733 1.00 0.00 H new ATOM 0 HG SER A 107 -9.649 5.386 16.062 1.00 0.00 H new ATOM 1734 N GLY A 108 -13.397 9.344 15.360 1.00 0.00 N ATOM 1735 CA GLY A 108 -14.094 10.465 15.961 1.00 0.00 C ATOM 1736 C GLY A 108 -14.182 11.660 15.029 1.00 0.00 C ATOM 1737 O GLY A 108 -13.786 11.573 13.867 1.00 0.00 O ATOM 0 H GLY A 108 -13.949 8.802 14.696 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -15.100 10.154 16.244 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -13.581 10.759 16.877 1.00 0.00 H new ATOM 1741 N PRO A 109 -14.701 12.801 15.516 1.00 0.00 N ATOM 1742 CA PRO A 109 -14.834 14.016 14.706 1.00 0.00 C ATOM 1743 C PRO A 109 -13.484 14.651 14.389 1.00 0.00 C ATOM 1744 O PRO A 109 -12.520 14.491 15.139 1.00 0.00 O ATOM 1745 CB PRO A 109 -15.667 14.945 15.591 1.00 0.00 C ATOM 1746 CG PRO A 109 -15.402 14.482 16.981 1.00 0.00 C ATOM 1747 CD PRO A 109 -15.199 12.995 16.891 1.00 0.00 C ATOM 0 HA PRO A 109 -15.287 13.811 13.736 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -15.374 15.986 15.458 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -16.727 14.879 15.347 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -14.520 14.972 17.394 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -16.238 14.723 17.638 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -14.482 12.642 17.632 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -16.128 12.451 17.062 1.00 0.00 H new ATOM 1755 N SER A 110 -13.422 15.371 13.275 1.00 0.00 N ATOM 1756 CA SER A 110 -12.190 16.031 12.859 1.00 0.00 C ATOM 1757 C SER A 110 -12.491 17.275 12.029 1.00 0.00 C ATOM 1758 O SER A 110 -11.952 18.352 12.288 1.00 0.00 O ATOM 1759 CB SER A 110 -11.317 15.066 12.053 1.00 0.00 C ATOM 1760 OG SER A 110 -12.107 14.090 11.396 1.00 0.00 O ATOM 0 H SER A 110 -14.210 15.513 12.643 1.00 0.00 H new ATOM 0 HA SER A 110 -11.651 16.337 13.756 1.00 0.00 H new ATOM 0 HB2 SER A 110 -10.737 15.624 11.318 1.00 0.00 H new ATOM 0 HB3 SER A 110 -10.604 14.575 12.716 1.00 0.00 H new ATOM 0 HG SER A 110 -12.087 13.254 11.907 1.00 0.00 H new ATOM 1766 N SER A 111 -13.358 17.120 11.033 1.00 0.00 N ATOM 1767 CA SER A 111 -13.732 18.232 10.166 1.00 0.00 C ATOM 1768 C SER A 111 -15.147 18.710 10.474 1.00 0.00 C ATOM 1769 O SER A 111 -15.950 17.973 11.047 1.00 0.00 O ATOM 1770 CB SER A 111 -13.629 17.816 8.697 1.00 0.00 C ATOM 1771 OG SER A 111 -14.148 16.513 8.497 1.00 0.00 O ATOM 0 H SER A 111 -13.814 16.236 10.807 1.00 0.00 H new ATOM 0 HA SER A 111 -13.042 19.055 10.353 1.00 0.00 H new ATOM 0 HB2 SER A 111 -14.174 18.527 8.076 1.00 0.00 H new ATOM 0 HB3 SER A 111 -12.587 17.848 8.379 1.00 0.00 H new ATOM 0 HG SER A 111 -14.072 16.272 7.550 1.00 0.00 H new ATOM 1777 N GLY A 112 -15.445 19.946 10.089 1.00 0.00 N ATOM 1778 CA GLY A 112 -16.764 20.502 10.333 1.00 0.00 C ATOM 1779 C GLY A 112 -17.458 20.929 9.054 1.00 0.00 C ATOM 1780 O GLY A 112 -18.605 21.417 9.136 1.00 0.00 O ATOM 1781 OXT GLY A 112 -16.854 20.776 7.971 1.00 0.00 O ATOM 0 H GLY A 112 -14.797 20.573 9.612 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -17.378 19.762 10.846 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -16.676 21.360 10.999 1.00 0.00 H new TER 1785 GLY A 112