USER MOD reduce.3.24.130724 H: found=0, std=0, add=900, rem=0, adj=19 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 33 GLN : amide:sc= -4.52! K(o=-8.4!,f=-6.8) USER MOD Set 1.2: A 36 ASN : amide:sc= -3.91 K(o=-8.4,f=-6.8) 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 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 TYR OH : rot 150:sc= 0 USER MOD Single : A 13 THR OG1 : rot 180:sc= -0.195 USER MOD Single : A 18 HIS : no HD1:sc= -0.118 X(o=-0.12,f=-0.0062) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 GLN : amide:sc= -0.203 K(o=-0.2,f=-0.83) USER MOD Single : A 32 ASN : amide:sc= -0.808 K(o=-0.81,f=-0.22) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot -118:sc= 0.166 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl -143:sc= -0.24 (180deg=-1.09) USER MOD Single : A 60 GLN : amide:sc= -0.08 X(o=-0.08,f=-0.48) 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= 0 X(o=0,f=0) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.077 X(o=-0.077,f=-0.038) USER MOD Single : A 73 GLN : amide:sc= -0.268 X(o=-0.27,f=0) USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 MET CE :methyl -124:sc= -1.41 (180deg=-2.25!) USER MOD Single : A 83 LYS NZ :NH3+ 172:sc= -1.47 (180deg=-1.54) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -1.12 X(o=-1.1,f=-1!) USER MOD Single : A 93 ASN : amide:sc= -0.26 K(o=-0.26,f=-2.5!) USER MOD Single : A 100 ASN : amide:sc= 0 X(o=0,f=0.072) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0.0484 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 18.092 11.113 15.465 1.00 0.00 N ATOM 2 CA GLY A 1 18.626 11.862 16.636 1.00 0.00 C ATOM 3 C GLY A 1 18.170 13.308 16.657 1.00 0.00 C ATOM 4 O GLY A 1 18.991 14.224 16.721 1.00 0.00 O ATOM 0 H1 GLY A 1 18.432 10.131 15.497 1.00 0.00 H new ATOM 0 H2 GLY A 1 17.052 11.120 15.493 1.00 0.00 H new ATOM 0 H3 GLY A 1 18.418 11.564 14.586 1.00 0.00 H new ATOM 0 HA2 GLY A 1 18.306 11.370 17.555 1.00 0.00 H new ATOM 0 HA3 GLY A 1 19.715 11.828 16.619 1.00 0.00 H new ATOM 10 N SER A 2 16.859 13.514 16.603 1.00 0.00 N ATOM 11 CA SER A 2 16.295 14.859 16.615 1.00 0.00 C ATOM 12 C SER A 2 14.937 14.872 17.309 1.00 0.00 C ATOM 13 O SER A 2 14.287 13.836 17.444 1.00 0.00 O ATOM 14 CB SER A 2 16.156 15.389 15.187 1.00 0.00 C ATOM 15 OG SER A 2 16.467 16.770 15.124 1.00 0.00 O ATOM 0 H SER A 2 16.167 12.767 16.550 1.00 0.00 H new ATOM 0 HA SER A 2 16.974 15.506 17.171 1.00 0.00 H new ATOM 0 HB2 SER A 2 16.818 14.833 14.523 1.00 0.00 H new ATOM 0 HB3 SER A 2 15.138 15.225 14.832 1.00 0.00 H new ATOM 0 HG SER A 2 16.372 17.085 14.201 1.00 0.00 H new ATOM 21 N SER A 3 14.514 16.054 17.749 1.00 0.00 N ATOM 22 CA SER A 3 13.233 16.202 18.429 1.00 0.00 C ATOM 23 C SER A 3 12.074 16.049 17.449 1.00 0.00 C ATOM 24 O SER A 3 11.007 15.552 17.807 1.00 0.00 O ATOM 25 CB SER A 3 13.155 17.565 19.121 1.00 0.00 C ATOM 26 OG SER A 3 12.075 17.611 20.037 1.00 0.00 O ATOM 0 H SER A 3 15.040 16.922 17.646 1.00 0.00 H new ATOM 0 HA SER A 3 13.155 15.415 19.179 1.00 0.00 H new ATOM 0 HB2 SER A 3 14.090 17.764 19.646 1.00 0.00 H new ATOM 0 HB3 SER A 3 13.036 18.349 18.374 1.00 0.00 H new ATOM 0 HG SER A 3 12.048 18.491 20.467 1.00 0.00 H new ATOM 32 N GLY A 4 12.293 16.481 16.211 1.00 0.00 N ATOM 33 CA GLY A 4 11.258 16.383 15.200 1.00 0.00 C ATOM 34 C GLY A 4 11.401 15.143 14.340 1.00 0.00 C ATOM 35 O GLY A 4 11.972 14.141 14.774 1.00 0.00 O ATOM 0 H GLY A 4 13.168 16.897 15.891 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.281 16.375 15.684 1.00 0.00 H new ATOM 0 HA3 GLY A 4 11.291 17.268 14.564 1.00 0.00 H new ATOM 39 N SER A 5 10.883 15.208 13.119 1.00 0.00 N ATOM 40 CA SER A 5 10.955 14.081 12.196 1.00 0.00 C ATOM 41 C SER A 5 11.277 14.555 10.783 1.00 0.00 C ATOM 42 O SER A 5 11.175 15.743 10.478 1.00 0.00 O ATOM 43 CB SER A 5 9.635 13.307 12.198 1.00 0.00 C ATOM 44 OG SER A 5 9.418 12.673 13.446 1.00 0.00 O ATOM 0 H SER A 5 10.408 16.030 12.745 1.00 0.00 H new ATOM 0 HA SER A 5 11.756 13.421 12.530 1.00 0.00 H new ATOM 0 HB2 SER A 5 8.811 13.987 11.984 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.646 12.560 11.404 1.00 0.00 H new ATOM 0 HG SER A 5 8.568 12.187 13.422 1.00 0.00 H new ATOM 50 N SER A 6 11.665 13.618 9.924 1.00 0.00 N ATOM 51 CA SER A 6 12.002 13.940 8.542 1.00 0.00 C ATOM 52 C SER A 6 10.741 14.131 7.705 1.00 0.00 C ATOM 53 O SER A 6 10.401 15.252 7.325 1.00 0.00 O ATOM 54 CB SER A 6 12.868 12.835 7.936 1.00 0.00 C ATOM 55 OG SER A 6 14.214 12.947 8.366 1.00 0.00 O ATOM 0 H SER A 6 11.754 12.630 10.160 1.00 0.00 H new ATOM 0 HA SER A 6 12.563 14.874 8.539 1.00 0.00 H new ATOM 0 HB2 SER A 6 12.472 11.861 8.222 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.825 12.890 6.848 1.00 0.00 H new ATOM 0 HG SER A 6 14.746 12.228 7.966 1.00 0.00 H new ATOM 61 N GLY A 7 10.053 13.030 7.422 1.00 0.00 N ATOM 62 CA GLY A 7 8.837 13.099 6.632 1.00 0.00 C ATOM 63 C GLY A 7 7.872 11.976 6.954 1.00 0.00 C ATOM 64 O GLY A 7 7.518 11.766 8.114 1.00 0.00 O ATOM 0 H GLY A 7 10.315 12.092 7.725 1.00 0.00 H new ATOM 0 HA2 GLY A 7 8.347 14.057 6.808 1.00 0.00 H new ATOM 0 HA3 GLY A 7 9.093 13.062 5.573 1.00 0.00 H new ATOM 68 N ILE A 8 7.445 11.252 5.924 1.00 0.00 N ATOM 69 CA ILE A 8 6.514 10.144 6.103 1.00 0.00 C ATOM 70 C ILE A 8 6.826 9.003 5.139 1.00 0.00 C ATOM 71 O ILE A 8 6.837 9.191 3.922 1.00 0.00 O ATOM 72 CB ILE A 8 5.056 10.594 5.893 1.00 0.00 C ATOM 73 CG1 ILE A 8 4.932 11.424 4.613 1.00 0.00 C ATOM 74 CG2 ILE A 8 4.569 11.388 7.096 1.00 0.00 C ATOM 75 CD1 ILE A 8 3.503 11.760 4.248 1.00 0.00 C ATOM 0 H ILE A 8 7.729 11.413 4.958 1.00 0.00 H new ATOM 0 HA ILE A 8 6.633 9.794 7.128 1.00 0.00 H new ATOM 0 HB ILE A 8 4.430 9.708 5.789 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.495 12.349 4.734 1.00 0.00 H new ATOM 0 HG13 ILE A 8 5.390 10.877 3.789 1.00 0.00 H new ATOM 0 HG21 ILE A 8 3.537 11.699 6.933 1.00 0.00 H new ATOM 0 HG22 ILE A 8 4.624 10.765 7.989 1.00 0.00 H new ATOM 0 HG23 ILE A 8 5.197 12.269 7.229 1.00 0.00 H new ATOM 0 HD11 ILE A 8 3.491 12.349 3.331 1.00 0.00 H new ATOM 0 HD12 ILE A 8 2.940 10.839 4.095 1.00 0.00 H new ATOM 0 HD13 ILE A 8 3.047 12.334 5.054 1.00 0.00 H new ATOM 87 N SER A 9 7.077 7.822 5.691 1.00 0.00 N ATOM 88 CA SER A 9 7.388 6.649 4.881 1.00 0.00 C ATOM 89 C SER A 9 7.556 5.412 5.757 1.00 0.00 C ATOM 90 O SER A 9 8.176 5.470 6.819 1.00 0.00 O ATOM 91 CB SER A 9 8.661 6.889 4.068 1.00 0.00 C ATOM 92 OG SER A 9 9.803 6.929 4.907 1.00 0.00 O ATOM 0 H SER A 9 7.071 7.650 6.696 1.00 0.00 H new ATOM 0 HA SER A 9 6.556 6.478 4.198 1.00 0.00 H new ATOM 0 HB2 SER A 9 8.778 6.098 3.327 1.00 0.00 H new ATOM 0 HB3 SER A 9 8.575 7.828 3.521 1.00 0.00 H new ATOM 0 HG SER A 9 10.604 7.082 4.363 1.00 0.00 H new ATOM 98 N LEU A 10 7.000 4.293 5.304 1.00 0.00 N ATOM 99 CA LEU A 10 7.088 3.041 6.047 1.00 0.00 C ATOM 100 C LEU A 10 7.966 2.033 5.313 1.00 0.00 C ATOM 101 O LEU A 10 7.627 1.578 4.222 1.00 0.00 O ATOM 102 CB LEU A 10 5.692 2.454 6.265 1.00 0.00 C ATOM 103 CG LEU A 10 4.941 3.003 7.479 1.00 0.00 C ATOM 104 CD1 LEU A 10 3.439 2.853 7.291 1.00 0.00 C ATOM 105 CD2 LEU A 10 5.394 2.296 8.747 1.00 0.00 C ATOM 0 H LEU A 10 6.484 4.228 4.427 1.00 0.00 H new ATOM 0 HA LEU A 10 7.541 3.254 7.015 1.00 0.00 H new ATOM 0 HB2 LEU A 10 5.094 2.639 5.373 1.00 0.00 H new ATOM 0 HB3 LEU A 10 5.782 1.373 6.371 1.00 0.00 H new ATOM 0 HG LEU A 10 5.169 4.064 7.575 1.00 0.00 H new ATOM 0 HD11 LEU A 10 2.922 3.249 8.165 1.00 0.00 H new ATOM 0 HD12 LEU A 10 3.127 3.404 6.404 1.00 0.00 H new ATOM 0 HD13 LEU A 10 3.191 1.799 7.170 1.00 0.00 H new ATOM 0 HD21 LEU A 10 4.850 2.698 9.602 1.00 0.00 H new ATOM 0 HD22 LEU A 10 5.194 1.228 8.659 1.00 0.00 H new ATOM 0 HD23 LEU A 10 6.463 2.454 8.890 1.00 0.00 H new ATOM 117 N LYS A 11 9.097 1.690 5.921 1.00 0.00 N ATOM 118 CA LYS A 11 10.026 0.736 5.326 1.00 0.00 C ATOM 119 C LYS A 11 9.976 -0.601 6.058 1.00 0.00 C ATOM 120 O LYS A 11 10.373 -0.699 7.219 1.00 0.00 O ATOM 121 CB LYS A 11 11.450 1.292 5.353 1.00 0.00 C ATOM 122 CG LYS A 11 11.558 2.712 4.824 1.00 0.00 C ATOM 123 CD LYS A 11 11.490 2.748 3.306 1.00 0.00 C ATOM 124 CE LYS A 11 12.875 2.851 2.688 1.00 0.00 C ATOM 125 NZ LYS A 11 13.335 4.263 2.587 1.00 0.00 N ATOM 0 H LYS A 11 9.392 2.058 6.825 1.00 0.00 H new ATOM 0 HA LYS A 11 9.727 0.575 4.290 1.00 0.00 H new ATOM 0 HB2 LYS A 11 11.822 1.265 6.377 1.00 0.00 H new ATOM 0 HB3 LYS A 11 12.096 0.643 4.762 1.00 0.00 H new ATOM 0 HG2 LYS A 11 10.753 3.318 5.240 1.00 0.00 H new ATOM 0 HG3 LYS A 11 12.496 3.155 5.158 1.00 0.00 H new ATOM 0 HD2 LYS A 11 10.994 1.848 2.942 1.00 0.00 H new ATOM 0 HD3 LYS A 11 10.885 3.597 2.988 1.00 0.00 H new ATOM 0 HE2 LYS A 11 13.584 2.281 3.288 1.00 0.00 H new ATOM 0 HE3 LYS A 11 12.864 2.401 1.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 14.283 4.290 2.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 12.673 4.802 1.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 13.371 4.685 3.537 1.00 0.00 H new ATOM 139 N TYR A 12 9.485 -1.628 5.373 1.00 0.00 N ATOM 140 CA TYR A 12 9.383 -2.960 5.959 1.00 0.00 C ATOM 141 C TYR A 12 9.856 -4.025 4.975 1.00 0.00 C ATOM 142 O TYR A 12 9.216 -4.267 3.951 1.00 0.00 O ATOM 143 CB TYR A 12 7.942 -3.244 6.384 1.00 0.00 C ATOM 144 CG TYR A 12 7.650 -2.873 7.820 1.00 0.00 C ATOM 145 CD1 TYR A 12 8.464 -3.323 8.852 1.00 0.00 C ATOM 146 CD2 TYR A 12 6.561 -2.074 8.144 1.00 0.00 C ATOM 147 CE1 TYR A 12 8.201 -2.986 10.167 1.00 0.00 C ATOM 148 CE2 TYR A 12 6.291 -1.733 9.456 1.00 0.00 C ATOM 149 CZ TYR A 12 7.113 -2.192 10.463 1.00 0.00 C ATOM 150 OH TYR A 12 6.848 -1.855 11.771 1.00 0.00 O ATOM 0 H TYR A 12 9.151 -1.564 4.411 1.00 0.00 H new ATOM 0 HA TYR A 12 10.026 -2.993 6.838 1.00 0.00 H new ATOM 0 HB2 TYR A 12 7.264 -2.694 5.731 1.00 0.00 H new ATOM 0 HB3 TYR A 12 7.732 -4.304 6.242 1.00 0.00 H new ATOM 0 HD1 TYR A 12 9.316 -3.946 8.623 1.00 0.00 H new ATOM 0 HD2 TYR A 12 5.914 -1.713 7.358 1.00 0.00 H new ATOM 0 HE1 TYR A 12 8.844 -3.343 10.958 1.00 0.00 H new ATOM 0 HE2 TYR A 12 5.441 -1.110 9.691 1.00 0.00 H new ATOM 0 HH TYR A 12 6.410 -0.979 11.801 1.00 0.00 H new ATOM 160 N THR A 13 10.981 -4.658 5.292 1.00 0.00 N ATOM 161 CA THR A 13 11.540 -5.697 4.436 1.00 0.00 C ATOM 162 C THR A 13 10.578 -6.875 4.309 1.00 0.00 C ATOM 163 O THR A 13 9.669 -7.036 5.124 1.00 0.00 O ATOM 164 CB THR A 13 12.882 -6.178 4.990 1.00 0.00 C ATOM 165 OG1 THR A 13 12.740 -6.630 6.326 1.00 0.00 O ATOM 166 CG2 THR A 13 13.951 -5.107 4.979 1.00 0.00 C ATOM 0 H THR A 13 11.523 -4.469 6.135 1.00 0.00 H new ATOM 0 HA THR A 13 11.696 -5.270 3.445 1.00 0.00 H new ATOM 0 HB THR A 13 13.194 -6.988 4.330 1.00 0.00 H new ATOM 0 HG1 THR A 13 13.609 -6.935 6.662 1.00 0.00 H new ATOM 0 HG21 THR A 13 14.877 -5.513 5.385 1.00 0.00 H new ATOM 0 HG22 THR A 13 14.119 -4.771 3.956 1.00 0.00 H new ATOM 0 HG23 THR A 13 13.627 -4.264 5.589 1.00 0.00 H new ATOM 174 N ALA A 14 10.786 -7.695 3.284 1.00 0.00 N ATOM 175 CA ALA A 14 9.939 -8.858 3.053 1.00 0.00 C ATOM 176 C ALA A 14 9.978 -9.811 4.242 1.00 0.00 C ATOM 177 O ALA A 14 8.957 -10.381 4.628 1.00 0.00 O ATOM 178 CB ALA A 14 10.365 -9.576 1.781 1.00 0.00 C ATOM 0 H ALA A 14 11.534 -7.575 2.601 1.00 0.00 H new ATOM 0 HA ALA A 14 8.912 -8.512 2.934 1.00 0.00 H new ATOM 0 HB1 ALA A 14 9.724 -10.443 1.620 1.00 0.00 H new ATOM 0 HB2 ALA A 14 10.276 -8.897 0.933 1.00 0.00 H new ATOM 0 HB3 ALA A 14 11.400 -9.903 1.877 1.00 0.00 H new ATOM 184 N ALA A 15 11.164 -9.979 4.819 1.00 0.00 N ATOM 185 CA ALA A 15 11.336 -10.863 5.966 1.00 0.00 C ATOM 186 C ALA A 15 10.509 -10.389 7.155 1.00 0.00 C ATOM 187 O ALA A 15 9.966 -11.197 7.908 1.00 0.00 O ATOM 188 CB ALA A 15 12.807 -10.951 6.346 1.00 0.00 C ATOM 0 H ALA A 15 12.019 -9.515 4.511 1.00 0.00 H new ATOM 0 HA ALA A 15 10.983 -11.855 5.685 1.00 0.00 H new ATOM 0 HB1 ALA A 15 12.922 -11.614 7.204 1.00 0.00 H new ATOM 0 HB2 ALA A 15 13.377 -11.344 5.504 1.00 0.00 H new ATOM 0 HB3 ALA A 15 13.177 -9.958 6.603 1.00 0.00 H new ATOM 194 N ARG A 16 10.417 -9.073 7.319 1.00 0.00 N ATOM 195 CA ARG A 16 9.656 -8.491 8.419 1.00 0.00 C ATOM 196 C ARG A 16 8.190 -8.905 8.344 1.00 0.00 C ATOM 197 O ARG A 16 7.633 -9.430 9.308 1.00 0.00 O ATOM 198 CB ARG A 16 9.769 -6.965 8.394 1.00 0.00 C ATOM 199 CG ARG A 16 11.055 -6.440 9.008 1.00 0.00 C ATOM 200 CD ARG A 16 11.061 -6.610 10.519 1.00 0.00 C ATOM 201 NE ARG A 16 12.416 -6.599 11.066 1.00 0.00 N ATOM 202 CZ ARG A 16 13.250 -7.633 11.000 1.00 0.00 C ATOM 203 NH1 ARG A 16 12.874 -8.762 10.412 1.00 0.00 N ATOM 204 NH2 ARG A 16 14.465 -7.538 11.523 1.00 0.00 N ATOM 0 H ARG A 16 10.860 -8.390 6.704 1.00 0.00 H new ATOM 0 HA ARG A 16 10.073 -8.864 9.354 1.00 0.00 H new ATOM 0 HB2 ARG A 16 9.702 -6.621 7.362 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.920 -6.537 8.928 1.00 0.00 H new ATOM 0 HG2 ARG A 16 11.907 -6.967 8.578 1.00 0.00 H new ATOM 0 HG3 ARG A 16 11.174 -5.386 8.759 1.00 0.00 H new ATOM 0 HD2 ARG A 16 10.479 -5.810 10.976 1.00 0.00 H new ATOM 0 HD3 ARG A 16 10.572 -7.549 10.780 1.00 0.00 H new ATOM 0 HE ARG A 16 12.741 -5.748 11.525 1.00 0.00 H new ATOM 0 HH11 ARG A 16 11.941 -8.840 10.008 1.00 0.00 H new ATOM 0 HH12 ARG A 16 13.518 -9.551 10.365 1.00 0.00 H new ATOM 0 HH21 ARG A 16 14.759 -6.672 11.975 1.00 0.00 H new ATOM 0 HH22 ARG A 16 15.105 -8.330 11.473 1.00 0.00 H new ATOM 218 N LEU A 17 7.570 -8.665 7.193 1.00 0.00 N ATOM 219 CA LEU A 17 6.168 -9.013 6.993 1.00 0.00 C ATOM 220 C LEU A 17 5.965 -10.523 7.075 1.00 0.00 C ATOM 221 O LEU A 17 4.926 -10.996 7.536 1.00 0.00 O ATOM 222 CB LEU A 17 5.679 -8.494 5.640 1.00 0.00 C ATOM 223 CG LEU A 17 5.597 -6.971 5.522 1.00 0.00 C ATOM 224 CD1 LEU A 17 5.097 -6.568 4.145 1.00 0.00 C ATOM 225 CD2 LEU A 17 4.696 -6.402 6.607 1.00 0.00 C ATOM 0 H LEU A 17 8.016 -8.231 6.385 1.00 0.00 H new ATOM 0 HA LEU A 17 5.587 -8.542 7.786 1.00 0.00 H new ATOM 0 HB2 LEU A 17 6.345 -8.868 4.862 1.00 0.00 H new ATOM 0 HB3 LEU A 17 4.692 -8.912 5.443 1.00 0.00 H new ATOM 0 HG LEU A 17 6.598 -6.560 5.655 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.045 -5.481 4.080 1.00 0.00 H new ATOM 0 HD12 LEU A 17 5.781 -6.945 3.385 1.00 0.00 H new ATOM 0 HD13 LEU A 17 4.105 -6.989 3.981 1.00 0.00 H new ATOM 0 HD21 LEU A 17 4.649 -5.317 6.509 1.00 0.00 H new ATOM 0 HD22 LEU A 17 3.694 -6.820 6.504 1.00 0.00 H new ATOM 0 HD23 LEU A 17 5.098 -6.660 7.587 1.00 0.00 H new ATOM 237 N HIS A 18 6.965 -11.274 6.626 1.00 0.00 N ATOM 238 CA HIS A 18 6.897 -12.731 6.649 1.00 0.00 C ATOM 239 C HIS A 18 6.868 -13.250 8.083 1.00 0.00 C ATOM 240 O HIS A 18 6.084 -14.138 8.417 1.00 0.00 O ATOM 241 CB HIS A 18 8.089 -13.331 5.901 1.00 0.00 C ATOM 242 CG HIS A 18 7.986 -14.812 5.703 1.00 0.00 C ATOM 243 ND1 HIS A 18 8.802 -15.716 6.350 1.00 0.00 N ATOM 244 CD2 HIS A 18 7.156 -15.547 4.925 1.00 0.00 C ATOM 245 CE1 HIS A 18 8.480 -16.942 5.977 1.00 0.00 C ATOM 246 NE2 HIS A 18 7.484 -16.867 5.114 1.00 0.00 N ATOM 0 H HIS A 18 7.832 -10.898 6.242 1.00 0.00 H new ATOM 0 HA HIS A 18 5.976 -13.035 6.152 1.00 0.00 H new ATOM 0 HB2 HIS A 18 8.178 -12.848 4.928 1.00 0.00 H new ATOM 0 HB3 HIS A 18 9.003 -13.109 6.452 1.00 0.00 H new ATOM 0 HD2 HIS A 18 6.381 -15.166 4.277 1.00 0.00 H new ATOM 0 HE1 HIS A 18 8.952 -17.851 6.320 1.00 0.00 H new ATOM 0 HE2 HIS A 18 7.031 -17.661 4.661 1.00 0.00 H new ATOM 255 N GLU A 19 7.729 -12.691 8.927 1.00 0.00 N ATOM 256 CA GLU A 19 7.803 -13.098 10.325 1.00 0.00 C ATOM 257 C GLU A 19 6.522 -12.728 11.066 1.00 0.00 C ATOM 258 O GLU A 19 6.041 -13.483 11.911 1.00 0.00 O ATOM 259 CB GLU A 19 9.006 -12.444 11.006 1.00 0.00 C ATOM 260 CG GLU A 19 10.344 -12.992 10.534 1.00 0.00 C ATOM 261 CD GLU A 19 10.538 -14.451 10.900 1.00 0.00 C ATOM 262 OE1 GLU A 19 9.900 -15.312 10.259 1.00 0.00 O ATOM 263 OE2 GLU A 19 11.325 -14.730 11.827 1.00 0.00 O ATOM 0 H GLU A 19 8.385 -11.955 8.667 1.00 0.00 H new ATOM 0 HA GLU A 19 7.922 -14.181 10.357 1.00 0.00 H new ATOM 0 HB2 GLU A 19 8.977 -11.370 10.823 1.00 0.00 H new ATOM 0 HB3 GLU A 19 8.924 -12.586 12.084 1.00 0.00 H new ATOM 0 HG2 GLU A 19 10.417 -12.880 9.452 1.00 0.00 H new ATOM 0 HG3 GLU A 19 11.149 -12.401 10.971 1.00 0.00 H new ATOM 270 N LYS A 20 5.975 -11.559 10.745 1.00 0.00 N ATOM 271 CA LYS A 20 4.751 -11.087 11.381 1.00 0.00 C ATOM 272 C LYS A 20 3.558 -11.942 10.964 1.00 0.00 C ATOM 273 O LYS A 20 2.615 -12.128 11.734 1.00 0.00 O ATOM 274 CB LYS A 20 4.494 -9.624 11.018 1.00 0.00 C ATOM 275 CG LYS A 20 5.526 -8.665 11.591 1.00 0.00 C ATOM 276 CD LYS A 20 5.182 -7.221 11.268 1.00 0.00 C ATOM 277 CE LYS A 20 5.714 -6.270 12.330 1.00 0.00 C ATOM 278 NZ LYS A 20 4.703 -5.249 12.718 1.00 0.00 N ATOM 0 H LYS A 20 6.361 -10.922 10.048 1.00 0.00 H new ATOM 0 HA LYS A 20 4.877 -11.170 12.461 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.481 -9.524 9.933 1.00 0.00 H new ATOM 0 HB3 LYS A 20 3.505 -9.338 11.376 1.00 0.00 H new ATOM 0 HG2 LYS A 20 5.584 -8.794 12.672 1.00 0.00 H new ATOM 0 HG3 LYS A 20 6.510 -8.905 11.189 1.00 0.00 H new ATOM 0 HD2 LYS A 20 5.600 -6.955 10.297 1.00 0.00 H new ATOM 0 HD3 LYS A 20 4.100 -7.112 11.190 1.00 0.00 H new ATOM 0 HE2 LYS A 20 6.011 -6.839 13.211 1.00 0.00 H new ATOM 0 HE3 LYS A 20 6.608 -5.771 11.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 5.105 -4.621 13.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 4.438 -4.689 11.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 3.859 -5.723 13.099 1.00 0.00 H new ATOM 292 N GLY A 21 3.605 -12.458 9.740 1.00 0.00 N ATOM 293 CA GLY A 21 2.521 -13.287 9.242 1.00 0.00 C ATOM 294 C GLY A 21 1.854 -12.699 8.012 1.00 0.00 C ATOM 295 O GLY A 21 1.201 -13.413 7.253 1.00 0.00 O ATOM 0 H GLY A 21 4.373 -12.317 9.084 1.00 0.00 H new ATOM 0 HA2 GLY A 21 2.907 -14.278 9.003 1.00 0.00 H new ATOM 0 HA3 GLY A 21 1.777 -13.416 10.028 1.00 0.00 H new ATOM 299 N VAL A 22 2.019 -11.393 7.815 1.00 0.00 N ATOM 300 CA VAL A 22 1.425 -10.712 6.669 1.00 0.00 C ATOM 301 C VAL A 22 1.840 -11.373 5.358 1.00 0.00 C ATOM 302 O VAL A 22 1.012 -11.953 4.655 1.00 0.00 O ATOM 303 CB VAL A 22 1.828 -9.225 6.629 1.00 0.00 C ATOM 304 CG1 VAL A 22 1.047 -8.488 5.553 1.00 0.00 C ATOM 305 CG2 VAL A 22 1.617 -8.578 7.990 1.00 0.00 C ATOM 0 H VAL A 22 2.558 -10.787 8.433 1.00 0.00 H new ATOM 0 HA VAL A 22 0.344 -10.787 6.784 1.00 0.00 H new ATOM 0 HB VAL A 22 2.888 -9.161 6.383 1.00 0.00 H new ATOM 0 HG11 VAL A 22 1.345 -7.440 5.540 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.255 -8.936 4.581 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -0.020 -8.559 5.765 1.00 0.00 H new ATOM 0 HG21 VAL A 22 1.907 -7.528 7.943 1.00 0.00 H new ATOM 0 HG22 VAL A 22 0.566 -8.652 8.269 1.00 0.00 H new ATOM 0 HG23 VAL A 22 2.227 -9.090 8.735 1.00 0.00 H new ATOM 315 N LEU A 23 3.125 -11.283 5.035 1.00 0.00 N ATOM 316 CA LEU A 23 3.648 -11.873 3.808 1.00 0.00 C ATOM 317 C LEU A 23 3.686 -13.394 3.912 1.00 0.00 C ATOM 318 O LEU A 23 4.031 -13.947 4.956 1.00 0.00 O ATOM 319 CB LEU A 23 5.050 -11.335 3.515 1.00 0.00 C ATOM 320 CG LEU A 23 5.550 -11.575 2.089 1.00 0.00 C ATOM 321 CD1 LEU A 23 4.646 -10.879 1.083 1.00 0.00 C ATOM 322 CD2 LEU A 23 6.986 -11.095 1.942 1.00 0.00 C ATOM 0 H LEU A 23 3.824 -10.807 5.605 1.00 0.00 H new ATOM 0 HA LEU A 23 2.983 -11.598 2.989 1.00 0.00 H new ATOM 0 HB2 LEU A 23 5.060 -10.263 3.712 1.00 0.00 H new ATOM 0 HB3 LEU A 23 5.752 -11.793 4.212 1.00 0.00 H new ATOM 0 HG LEU A 23 5.524 -12.646 1.889 1.00 0.00 H new ATOM 0 HD11 LEU A 23 5.017 -11.060 0.074 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.633 -11.270 1.173 1.00 0.00 H new ATOM 0 HD13 LEU A 23 4.640 -9.807 1.280 1.00 0.00 H new ATOM 0 HD21 LEU A 23 7.327 -11.273 0.922 1.00 0.00 H new ATOM 0 HD22 LEU A 23 7.037 -10.028 2.161 1.00 0.00 H new ATOM 0 HD23 LEU A 23 7.625 -11.639 2.638 1.00 0.00 H new ATOM 334 N LEU A 24 3.328 -14.066 2.822 1.00 0.00 N ATOM 335 CA LEU A 24 3.320 -15.523 2.792 1.00 0.00 C ATOM 336 C LEU A 24 4.568 -16.061 2.097 1.00 0.00 C ATOM 337 O LEU A 24 5.431 -16.667 2.732 1.00 0.00 O ATOM 338 CB LEU A 24 2.065 -16.034 2.080 1.00 0.00 C ATOM 339 CG LEU A 24 0.744 -15.498 2.633 1.00 0.00 C ATOM 340 CD1 LEU A 24 -0.429 -16.039 1.831 1.00 0.00 C ATOM 341 CD2 LEU A 24 0.598 -15.858 4.104 1.00 0.00 C ATOM 0 H LEU A 24 3.040 -13.624 1.949 1.00 0.00 H new ATOM 0 HA LEU A 24 3.316 -15.882 3.821 1.00 0.00 H new ATOM 0 HB2 LEU A 24 2.132 -15.772 1.024 1.00 0.00 H new ATOM 0 HB3 LEU A 24 2.051 -17.122 2.138 1.00 0.00 H new ATOM 0 HG LEU A 24 0.748 -14.412 2.543 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.361 -15.647 2.239 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -0.331 -15.731 0.790 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.438 -17.127 1.888 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -0.348 -15.469 4.482 1.00 0.00 H new ATOM 0 HD22 LEU A 24 0.615 -16.942 4.217 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.422 -15.421 4.669 1.00 0.00 H new ATOM 353 N GLU A 25 4.656 -15.835 0.790 1.00 0.00 N ATOM 354 CA GLU A 25 5.798 -16.298 0.009 1.00 0.00 C ATOM 355 C GLU A 25 5.913 -15.523 -1.300 1.00 0.00 C ATOM 356 O GLU A 25 5.087 -14.659 -1.596 1.00 0.00 O ATOM 357 CB GLU A 25 5.670 -17.795 -0.280 1.00 0.00 C ATOM 358 CG GLU A 25 6.321 -18.676 0.772 1.00 0.00 C ATOM 359 CD GLU A 25 7.035 -19.872 0.170 1.00 0.00 C ATOM 360 OE1 GLU A 25 6.345 -20.776 -0.346 1.00 0.00 O ATOM 361 OE2 GLU A 25 8.282 -19.902 0.215 1.00 0.00 O ATOM 0 H GLU A 25 3.951 -15.334 0.250 1.00 0.00 H new ATOM 0 HA GLU A 25 6.701 -16.123 0.593 1.00 0.00 H new ATOM 0 HB2 GLU A 25 4.614 -18.053 -0.355 1.00 0.00 H new ATOM 0 HB3 GLU A 25 6.120 -18.009 -1.250 1.00 0.00 H new ATOM 0 HG2 GLU A 25 7.033 -18.084 1.347 1.00 0.00 H new ATOM 0 HG3 GLU A 25 5.560 -19.025 1.470 1.00 0.00 H new ATOM 368 N ILE A 26 6.941 -15.840 -2.079 1.00 0.00 N ATOM 369 CA ILE A 26 7.163 -15.176 -3.359 1.00 0.00 C ATOM 370 C ILE A 26 7.389 -16.194 -4.472 1.00 0.00 C ATOM 371 O ILE A 26 7.979 -17.251 -4.249 1.00 0.00 O ATOM 372 CB ILE A 26 8.371 -14.223 -3.296 1.00 0.00 C ATOM 373 CG1 ILE A 26 8.290 -13.341 -2.050 1.00 0.00 C ATOM 374 CG2 ILE A 26 8.435 -13.368 -4.553 1.00 0.00 C ATOM 375 CD1 ILE A 26 9.510 -12.469 -1.846 1.00 0.00 C ATOM 0 H ILE A 26 7.634 -16.552 -1.847 1.00 0.00 H new ATOM 0 HA ILE A 26 6.265 -14.597 -3.576 1.00 0.00 H new ATOM 0 HB ILE A 26 9.282 -14.819 -3.236 1.00 0.00 H new ATOM 0 HG12 ILE A 26 7.407 -12.706 -2.121 1.00 0.00 H new ATOM 0 HG13 ILE A 26 8.156 -13.975 -1.174 1.00 0.00 H new ATOM 0 HG21 ILE A 26 9.294 -12.699 -4.495 1.00 0.00 H new ATOM 0 HG22 ILE A 26 8.535 -14.012 -5.427 1.00 0.00 H new ATOM 0 HG23 ILE A 26 7.522 -12.779 -4.639 1.00 0.00 H new ATOM 0 HD11 ILE A 26 9.383 -11.871 -0.944 1.00 0.00 H new ATOM 0 HD12 ILE A 26 10.394 -13.098 -1.742 1.00 0.00 H new ATOM 0 HD13 ILE A 26 9.633 -11.809 -2.705 1.00 0.00 H new ATOM 387 N GLU A 27 6.913 -15.870 -5.669 1.00 0.00 N ATOM 388 CA GLU A 27 7.062 -16.758 -6.817 1.00 0.00 C ATOM 389 C GLU A 27 8.310 -16.410 -7.622 1.00 0.00 C ATOM 390 O GLU A 27 8.259 -16.290 -8.847 1.00 0.00 O ATOM 391 CB GLU A 27 5.823 -16.678 -7.711 1.00 0.00 C ATOM 392 CG GLU A 27 4.585 -17.309 -7.092 1.00 0.00 C ATOM 393 CD GLU A 27 4.668 -18.821 -7.034 1.00 0.00 C ATOM 394 OE1 GLU A 27 5.511 -19.340 -6.272 1.00 0.00 O ATOM 395 OE2 GLU A 27 3.892 -19.487 -7.751 1.00 0.00 O ATOM 0 H GLU A 27 6.421 -15.000 -5.870 1.00 0.00 H new ATOM 0 HA GLU A 27 7.169 -17.777 -6.444 1.00 0.00 H new ATOM 0 HB2 GLU A 27 5.614 -15.632 -7.936 1.00 0.00 H new ATOM 0 HB3 GLU A 27 6.037 -17.171 -8.659 1.00 0.00 H new ATOM 0 HG2 GLU A 27 4.448 -16.918 -6.084 1.00 0.00 H new ATOM 0 HG3 GLU A 27 3.707 -17.019 -7.669 1.00 0.00 H new ATOM 402 N ASP A 28 9.433 -16.251 -6.929 1.00 0.00 N ATOM 403 CA ASP A 28 10.696 -15.919 -7.581 1.00 0.00 C ATOM 404 C ASP A 28 11.819 -15.782 -6.559 1.00 0.00 C ATOM 405 O ASP A 28 12.935 -16.253 -6.781 1.00 0.00 O ATOM 406 CB ASP A 28 10.560 -14.623 -8.384 1.00 0.00 C ATOM 407 CG ASP A 28 9.817 -13.543 -7.621 1.00 0.00 C ATOM 408 OD1 ASP A 28 8.571 -13.599 -7.572 1.00 0.00 O ATOM 409 OD2 ASP A 28 10.483 -12.638 -7.074 1.00 0.00 O ATOM 0 H ASP A 28 9.495 -16.347 -5.915 1.00 0.00 H new ATOM 0 HA ASP A 28 10.946 -16.733 -8.261 1.00 0.00 H new ATOM 0 HB2 ASP A 28 11.552 -14.258 -8.650 1.00 0.00 H new ATOM 0 HB3 ASP A 28 10.036 -14.831 -9.317 1.00 0.00 H new ATOM 414 N LEU A 29 11.519 -15.132 -5.439 1.00 0.00 N ATOM 415 CA LEU A 29 12.505 -14.933 -4.384 1.00 0.00 C ATOM 416 C LEU A 29 12.367 -15.999 -3.301 1.00 0.00 C ATOM 417 O LEU A 29 11.261 -16.444 -2.992 1.00 0.00 O ATOM 418 CB LEU A 29 12.351 -13.539 -3.769 1.00 0.00 C ATOM 419 CG LEU A 29 13.276 -12.469 -4.351 1.00 0.00 C ATOM 420 CD1 LEU A 29 14.727 -12.925 -4.296 1.00 0.00 C ATOM 421 CD2 LEU A 29 12.874 -12.137 -5.781 1.00 0.00 C ATOM 0 H LEU A 29 10.601 -14.734 -5.239 1.00 0.00 H new ATOM 0 HA LEU A 29 13.497 -15.019 -4.827 1.00 0.00 H new ATOM 0 HB2 LEU A 29 11.319 -13.214 -3.897 1.00 0.00 H new ATOM 0 HB3 LEU A 29 12.532 -13.610 -2.696 1.00 0.00 H new ATOM 0 HG LEU A 29 13.178 -11.567 -3.747 1.00 0.00 H new ATOM 0 HD11 LEU A 29 15.368 -12.149 -4.715 1.00 0.00 H new ATOM 0 HD12 LEU A 29 15.011 -13.111 -3.260 1.00 0.00 H new ATOM 0 HD13 LEU A 29 14.842 -13.842 -4.874 1.00 0.00 H new ATOM 0 HD21 LEU A 29 13.543 -11.374 -6.179 1.00 0.00 H new ATOM 0 HD22 LEU A 29 12.941 -13.035 -6.396 1.00 0.00 H new ATOM 0 HD23 LEU A 29 11.850 -11.764 -5.794 1.00 0.00 H new ATOM 433 N GLN A 30 13.495 -16.404 -2.729 1.00 0.00 N ATOM 434 CA GLN A 30 13.501 -17.418 -1.680 1.00 0.00 C ATOM 435 C GLN A 30 13.257 -16.787 -0.313 1.00 0.00 C ATOM 436 O GLN A 30 13.350 -15.571 -0.154 1.00 0.00 O ATOM 437 CB GLN A 30 14.833 -18.171 -1.677 1.00 0.00 C ATOM 438 CG GLN A 30 14.992 -19.130 -2.845 1.00 0.00 C ATOM 439 CD GLN A 30 15.648 -20.436 -2.441 1.00 0.00 C ATOM 440 OE1 GLN A 30 15.370 -20.978 -1.371 1.00 0.00 O ATOM 441 NE2 GLN A 30 16.522 -20.950 -3.298 1.00 0.00 N ATOM 0 H GLN A 30 14.418 -16.046 -2.974 1.00 0.00 H new ATOM 0 HA GLN A 30 12.694 -18.122 -1.885 1.00 0.00 H new ATOM 0 HB2 GLN A 30 15.649 -17.449 -1.697 1.00 0.00 H new ATOM 0 HB3 GLN A 30 14.924 -18.729 -0.745 1.00 0.00 H new ATOM 0 HG2 GLN A 30 14.013 -19.338 -3.276 1.00 0.00 H new ATOM 0 HG3 GLN A 30 15.588 -18.654 -3.623 1.00 0.00 H new ATOM 0 HE21 GLN A 30 16.722 -20.467 -4.174 1.00 0.00 H new ATOM 0 HE22 GLN A 30 16.993 -21.828 -3.081 1.00 0.00 H new ATOM 450 N VAL A 31 12.944 -17.625 0.670 1.00 0.00 N ATOM 451 CA VAL A 31 12.685 -17.151 2.026 1.00 0.00 C ATOM 452 C VAL A 31 13.896 -16.417 2.592 1.00 0.00 C ATOM 453 O VAL A 31 13.755 -15.423 3.304 1.00 0.00 O ATOM 454 CB VAL A 31 12.317 -18.316 2.966 1.00 0.00 C ATOM 455 CG1 VAL A 31 11.914 -17.791 4.336 1.00 0.00 C ATOM 456 CG2 VAL A 31 11.205 -19.161 2.361 1.00 0.00 C ATOM 0 H VAL A 31 12.863 -18.635 0.554 1.00 0.00 H new ATOM 0 HA VAL A 31 11.842 -16.462 1.966 1.00 0.00 H new ATOM 0 HB VAL A 31 13.195 -18.949 3.090 1.00 0.00 H new ATOM 0 HG11 VAL A 31 11.658 -18.628 4.985 1.00 0.00 H new ATOM 0 HG12 VAL A 31 12.744 -17.235 4.771 1.00 0.00 H new ATOM 0 HG13 VAL A 31 11.051 -17.133 4.234 1.00 0.00 H new ATOM 0 HG21 VAL A 31 10.959 -19.978 3.039 1.00 0.00 H new ATOM 0 HG22 VAL A 31 10.322 -18.542 2.204 1.00 0.00 H new ATOM 0 HG23 VAL A 31 11.537 -19.569 1.406 1.00 0.00 H new ATOM 466 N ASN A 32 15.087 -16.916 2.274 1.00 0.00 N ATOM 467 CA ASN A 32 16.322 -16.306 2.753 1.00 0.00 C ATOM 468 C ASN A 32 16.577 -14.967 2.067 1.00 0.00 C ATOM 469 O ASN A 32 17.243 -14.093 2.620 1.00 0.00 O ATOM 470 CB ASN A 32 17.505 -17.247 2.513 1.00 0.00 C ATOM 471 CG ASN A 32 17.552 -17.764 1.088 1.00 0.00 C ATOM 472 OD1 ASN A 32 17.190 -18.910 0.820 1.00 0.00 O ATOM 473 ND2 ASN A 32 18.001 -16.920 0.167 1.00 0.00 N ATOM 0 H ASN A 32 15.222 -17.740 1.688 1.00 0.00 H new ATOM 0 HA ASN A 32 16.215 -16.128 3.823 1.00 0.00 H new ATOM 0 HB2 ASN A 32 18.434 -16.723 2.737 1.00 0.00 H new ATOM 0 HB3 ASN A 32 17.441 -18.090 3.201 1.00 0.00 H new ATOM 0 HD21 ASN A 32 18.057 -17.212 -0.809 1.00 0.00 H new ATOM 0 HD22 ASN A 32 18.290 -15.979 0.435 1.00 0.00 H new ATOM 480 N GLN A 33 16.044 -14.815 0.859 1.00 0.00 N ATOM 481 CA GLN A 33 16.217 -13.583 0.095 1.00 0.00 C ATOM 482 C GLN A 33 15.331 -12.463 0.641 1.00 0.00 C ATOM 483 O GLN A 33 15.572 -11.286 0.370 1.00 0.00 O ATOM 484 CB GLN A 33 15.896 -13.828 -1.380 1.00 0.00 C ATOM 485 CG GLN A 33 16.907 -14.723 -2.080 1.00 0.00 C ATOM 486 CD GLN A 33 17.300 -14.201 -3.449 1.00 0.00 C ATOM 487 OE1 GLN A 33 18.031 -13.217 -3.563 1.00 0.00 O ATOM 488 NE2 GLN A 33 16.814 -14.859 -4.495 1.00 0.00 N ATOM 0 H GLN A 33 15.489 -15.529 0.387 1.00 0.00 H new ATOM 0 HA GLN A 33 17.257 -13.272 0.191 1.00 0.00 H new ATOM 0 HB2 GLN A 33 14.907 -14.280 -1.458 1.00 0.00 H new ATOM 0 HB3 GLN A 33 15.851 -12.870 -1.898 1.00 0.00 H new ATOM 0 HG2 GLN A 33 17.799 -14.812 -1.460 1.00 0.00 H new ATOM 0 HG3 GLN A 33 16.490 -15.725 -2.183 1.00 0.00 H new ATOM 0 HE21 GLN A 33 16.212 -15.670 -4.353 1.00 0.00 H new ATOM 0 HE22 GLN A 33 17.043 -14.554 -5.441 1.00 0.00 H new ATOM 497 N PHE A 34 14.308 -12.833 1.408 1.00 0.00 N ATOM 498 CA PHE A 34 13.389 -11.854 1.986 1.00 0.00 C ATOM 499 C PHE A 34 14.147 -10.723 2.678 1.00 0.00 C ATOM 500 O PHE A 34 13.658 -9.597 2.764 1.00 0.00 O ATOM 501 CB PHE A 34 12.450 -12.533 2.984 1.00 0.00 C ATOM 502 CG PHE A 34 11.209 -13.105 2.355 1.00 0.00 C ATOM 503 CD1 PHE A 34 11.265 -13.725 1.116 1.00 0.00 C ATOM 504 CD2 PHE A 34 9.988 -13.023 3.006 1.00 0.00 C ATOM 505 CE1 PHE A 34 10.125 -14.252 0.539 1.00 0.00 C ATOM 506 CE2 PHE A 34 8.846 -13.548 2.432 1.00 0.00 C ATOM 507 CZ PHE A 34 8.914 -14.163 1.197 1.00 0.00 C ATOM 0 H PHE A 34 14.094 -13.802 1.644 1.00 0.00 H new ATOM 0 HA PHE A 34 12.804 -11.426 1.172 1.00 0.00 H new ATOM 0 HB2 PHE A 34 12.990 -13.332 3.492 1.00 0.00 H new ATOM 0 HB3 PHE A 34 12.160 -11.810 3.746 1.00 0.00 H new ATOM 0 HD1 PHE A 34 12.209 -13.797 0.597 1.00 0.00 H new ATOM 0 HD2 PHE A 34 9.929 -12.544 3.972 1.00 0.00 H new ATOM 0 HE1 PHE A 34 10.181 -14.733 -0.426 1.00 0.00 H new ATOM 0 HE2 PHE A 34 7.900 -13.478 2.949 1.00 0.00 H new ATOM 0 HZ PHE A 34 8.022 -14.573 0.747 1.00 0.00 H new ATOM 517 N LYS A 35 15.343 -11.030 3.171 1.00 0.00 N ATOM 518 CA LYS A 35 16.164 -10.038 3.855 1.00 0.00 C ATOM 519 C LYS A 35 16.509 -8.879 2.926 1.00 0.00 C ATOM 520 O LYS A 35 16.409 -7.713 3.308 1.00 0.00 O ATOM 521 CB LYS A 35 17.446 -10.687 4.386 1.00 0.00 C ATOM 522 CG LYS A 35 17.648 -10.499 5.881 1.00 0.00 C ATOM 523 CD LYS A 35 18.757 -11.394 6.409 1.00 0.00 C ATOM 524 CE LYS A 35 18.501 -11.808 7.849 1.00 0.00 C ATOM 525 NZ LYS A 35 19.593 -12.670 8.382 1.00 0.00 N ATOM 0 H LYS A 35 15.764 -11.957 3.109 1.00 0.00 H new ATOM 0 HA LYS A 35 15.591 -9.644 4.694 1.00 0.00 H new ATOM 0 HB2 LYS A 35 17.423 -11.753 4.162 1.00 0.00 H new ATOM 0 HB3 LYS A 35 18.302 -10.268 3.856 1.00 0.00 H new ATOM 0 HG2 LYS A 35 17.890 -9.457 6.088 1.00 0.00 H new ATOM 0 HG3 LYS A 35 16.719 -10.721 6.406 1.00 0.00 H new ATOM 0 HD2 LYS A 35 18.838 -12.283 5.783 1.00 0.00 H new ATOM 0 HD3 LYS A 35 19.711 -10.870 6.344 1.00 0.00 H new ATOM 0 HE2 LYS A 35 18.405 -10.918 8.471 1.00 0.00 H new ATOM 0 HE3 LYS A 35 17.553 -12.343 7.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 19.381 -12.931 9.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 19.669 -13.532 7.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 20.493 -12.150 8.348 1.00 0.00 H new ATOM 539 N ASN A 36 16.917 -9.206 1.703 1.00 0.00 N ATOM 540 CA ASN A 36 17.278 -8.191 0.721 1.00 0.00 C ATOM 541 C ASN A 36 16.033 -7.563 0.099 1.00 0.00 C ATOM 542 O ASN A 36 16.055 -6.406 -0.321 1.00 0.00 O ATOM 543 CB ASN A 36 18.157 -8.799 -0.374 1.00 0.00 C ATOM 544 CG ASN A 36 17.477 -9.948 -1.091 1.00 0.00 C ATOM 545 OD1 ASN A 36 16.547 -9.745 -1.872 1.00 0.00 O ATOM 546 ND2 ASN A 36 17.937 -11.166 -0.827 1.00 0.00 N ATOM 0 H ASN A 36 17.006 -10.166 1.369 1.00 0.00 H new ATOM 0 HA ASN A 36 17.837 -7.410 1.235 1.00 0.00 H new ATOM 0 HB2 ASN A 36 18.417 -8.026 -1.097 1.00 0.00 H new ATOM 0 HB3 ASN A 36 19.090 -9.151 0.067 1.00 0.00 H new ATOM 0 HD21 ASN A 36 17.517 -11.979 -1.278 1.00 0.00 H new ATOM 0 HD22 ASN A 36 18.710 -11.289 -0.173 1.00 0.00 H new ATOM 553 N VAL A 37 14.950 -8.332 0.044 1.00 0.00 N ATOM 554 CA VAL A 37 13.700 -7.847 -0.527 1.00 0.00 C ATOM 555 C VAL A 37 13.015 -6.860 0.412 1.00 0.00 C ATOM 556 O VAL A 37 12.937 -7.088 1.620 1.00 0.00 O ATOM 557 CB VAL A 37 12.732 -9.006 -0.831 1.00 0.00 C ATOM 558 CG1 VAL A 37 11.509 -8.502 -1.582 1.00 0.00 C ATOM 559 CG2 VAL A 37 13.437 -10.099 -1.621 1.00 0.00 C ATOM 0 H VAL A 37 14.913 -9.292 0.387 1.00 0.00 H new ATOM 0 HA VAL A 37 13.953 -7.343 -1.460 1.00 0.00 H new ATOM 0 HB VAL A 37 12.398 -9.430 0.116 1.00 0.00 H new ATOM 0 HG11 VAL A 37 10.838 -9.336 -1.787 1.00 0.00 H new ATOM 0 HG12 VAL A 37 10.990 -7.760 -0.976 1.00 0.00 H new ATOM 0 HG13 VAL A 37 11.821 -8.048 -2.523 1.00 0.00 H new ATOM 0 HG21 VAL A 37 12.737 -10.909 -1.826 1.00 0.00 H new ATOM 0 HG22 VAL A 37 13.803 -9.689 -2.562 1.00 0.00 H new ATOM 0 HG23 VAL A 37 14.276 -10.483 -1.041 1.00 0.00 H new ATOM 569 N ILE A 38 12.518 -5.762 -0.150 1.00 0.00 N ATOM 570 CA ILE A 38 11.840 -4.741 0.639 1.00 0.00 C ATOM 571 C ILE A 38 10.734 -4.067 -0.167 1.00 0.00 C ATOM 572 O ILE A 38 10.825 -3.952 -1.390 1.00 0.00 O ATOM 573 CB ILE A 38 12.830 -3.669 1.140 1.00 0.00 C ATOM 574 CG1 ILE A 38 12.113 -2.657 2.038 1.00 0.00 C ATOM 575 CG2 ILE A 38 13.496 -2.967 -0.035 1.00 0.00 C ATOM 576 CD1 ILE A 38 13.056 -1.786 2.839 1.00 0.00 C ATOM 0 H ILE A 38 12.572 -5.557 -1.148 1.00 0.00 H new ATOM 0 HA ILE A 38 11.399 -5.245 1.499 1.00 0.00 H new ATOM 0 HB ILE A 38 13.605 -4.161 1.728 1.00 0.00 H new ATOM 0 HG12 ILE A 38 11.479 -2.020 1.421 1.00 0.00 H new ATOM 0 HG13 ILE A 38 11.456 -3.193 2.723 1.00 0.00 H new ATOM 0 HG21 ILE A 38 14.191 -2.214 0.337 1.00 0.00 H new ATOM 0 HG22 ILE A 38 14.039 -3.697 -0.635 1.00 0.00 H new ATOM 0 HG23 ILE A 38 12.735 -2.486 -0.650 1.00 0.00 H new ATOM 0 HD11 ILE A 38 12.479 -1.093 3.452 1.00 0.00 H new ATOM 0 HD12 ILE A 38 13.673 -2.413 3.483 1.00 0.00 H new ATOM 0 HD13 ILE A 38 13.696 -1.223 2.160 1.00 0.00 H new ATOM 588 N PHE A 39 9.691 -3.624 0.526 1.00 0.00 N ATOM 589 CA PHE A 39 8.565 -2.960 -0.125 1.00 0.00 C ATOM 590 C PHE A 39 8.352 -1.564 0.450 1.00 0.00 C ATOM 591 O PHE A 39 7.974 -1.411 1.613 1.00 0.00 O ATOM 592 CB PHE A 39 7.292 -3.792 0.038 1.00 0.00 C ATOM 593 CG PHE A 39 7.458 -5.230 -0.365 1.00 0.00 C ATOM 594 CD1 PHE A 39 7.547 -5.582 -1.702 1.00 0.00 C ATOM 595 CD2 PHE A 39 7.525 -6.228 0.594 1.00 0.00 C ATOM 596 CE1 PHE A 39 7.700 -6.904 -2.075 1.00 0.00 C ATOM 597 CE2 PHE A 39 7.677 -7.551 0.227 1.00 0.00 C ATOM 598 CZ PHE A 39 7.765 -7.889 -1.110 1.00 0.00 C ATOM 0 H PHE A 39 9.601 -3.712 1.538 1.00 0.00 H new ATOM 0 HA PHE A 39 8.794 -2.865 -1.186 1.00 0.00 H new ATOM 0 HB2 PHE A 39 6.971 -3.750 1.079 1.00 0.00 H new ATOM 0 HB3 PHE A 39 6.497 -3.345 -0.559 1.00 0.00 H new ATOM 0 HD1 PHE A 39 7.496 -4.815 -2.461 1.00 0.00 H new ATOM 0 HD2 PHE A 39 7.458 -5.969 1.640 1.00 0.00 H new ATOM 0 HE1 PHE A 39 7.769 -7.166 -3.120 1.00 0.00 H new ATOM 0 HE2 PHE A 39 7.727 -8.320 0.984 1.00 0.00 H new ATOM 0 HZ PHE A 39 7.884 -8.923 -1.400 1.00 0.00 H new ATOM 608 N GLU A 40 8.597 -0.547 -0.369 1.00 0.00 N ATOM 609 CA GLU A 40 8.431 0.837 0.058 1.00 0.00 C ATOM 610 C GLU A 40 7.005 1.316 -0.189 1.00 0.00 C ATOM 611 O GLU A 40 6.522 1.305 -1.321 1.00 0.00 O ATOM 612 CB GLU A 40 9.421 1.742 -0.678 1.00 0.00 C ATOM 613 CG GLU A 40 9.785 3.000 0.095 1.00 0.00 C ATOM 614 CD GLU A 40 9.411 4.270 -0.646 1.00 0.00 C ATOM 615 OE1 GLU A 40 9.431 4.256 -1.895 1.00 0.00 O ATOM 616 OE2 GLU A 40 9.098 5.277 0.023 1.00 0.00 O ATOM 0 H GLU A 40 8.912 -0.656 -1.333 1.00 0.00 H new ATOM 0 HA GLU A 40 8.631 0.887 1.128 1.00 0.00 H new ATOM 0 HB2 GLU A 40 10.330 1.178 -0.887 1.00 0.00 H new ATOM 0 HB3 GLU A 40 8.994 2.027 -1.640 1.00 0.00 H new ATOM 0 HG2 GLU A 40 9.281 2.986 1.062 1.00 0.00 H new ATOM 0 HG3 GLU A 40 10.857 3.002 0.294 1.00 0.00 H new ATOM 623 N ILE A 41 6.335 1.738 0.880 1.00 0.00 N ATOM 624 CA ILE A 41 4.966 2.222 0.782 1.00 0.00 C ATOM 625 C ILE A 41 4.880 3.703 1.134 1.00 0.00 C ATOM 626 O ILE A 41 5.433 4.145 2.141 1.00 0.00 O ATOM 627 CB ILE A 41 4.020 1.429 1.706 1.00 0.00 C ATOM 628 CG1 ILE A 41 4.208 -0.076 1.501 1.00 0.00 C ATOM 629 CG2 ILE A 41 2.573 1.828 1.451 1.00 0.00 C ATOM 630 CD1 ILE A 41 4.307 -0.854 2.794 1.00 0.00 C ATOM 0 H ILE A 41 6.721 1.754 1.824 1.00 0.00 H new ATOM 0 HA ILE A 41 4.654 2.079 -0.252 1.00 0.00 H new ATOM 0 HB ILE A 41 4.266 1.667 2.741 1.00 0.00 H new ATOM 0 HG12 ILE A 41 3.372 -0.462 0.917 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.111 -0.245 0.915 1.00 0.00 H new ATOM 0 HG21 ILE A 41 1.917 1.260 2.111 1.00 0.00 H new ATOM 0 HG22 ILE A 41 2.449 2.893 1.646 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.315 1.617 0.413 1.00 0.00 H new ATOM 0 HD11 ILE A 41 4.439 -1.913 2.572 1.00 0.00 H new ATOM 0 HD12 ILE A 41 5.160 -0.495 3.370 1.00 0.00 H new ATOM 0 HD13 ILE A 41 3.394 -0.716 3.373 1.00 0.00 H new ATOM 642 N SER A 42 4.182 4.466 0.298 1.00 0.00 N ATOM 643 CA SER A 42 4.025 5.898 0.522 1.00 0.00 C ATOM 644 C SER A 42 2.569 6.245 0.832 1.00 0.00 C ATOM 645 O SER A 42 1.697 6.112 -0.026 1.00 0.00 O ATOM 646 CB SER A 42 4.494 6.681 -0.703 1.00 0.00 C ATOM 647 OG SER A 42 5.729 6.184 -1.187 1.00 0.00 O ATOM 0 H SER A 42 3.717 4.116 -0.540 1.00 0.00 H new ATOM 0 HA SER A 42 4.638 6.175 1.380 1.00 0.00 H new ATOM 0 HB2 SER A 42 3.741 6.618 -1.488 1.00 0.00 H new ATOM 0 HB3 SER A 42 4.599 7.735 -0.446 1.00 0.00 H new ATOM 0 HG SER A 42 6.005 6.702 -1.972 1.00 0.00 H new ATOM 653 N PRO A 43 2.283 6.695 2.068 1.00 0.00 N ATOM 654 CA PRO A 43 0.921 7.058 2.479 1.00 0.00 C ATOM 655 C PRO A 43 0.319 8.142 1.591 1.00 0.00 C ATOM 656 O PRO A 43 1.021 8.770 0.799 1.00 0.00 O ATOM 657 CB PRO A 43 1.099 7.579 3.910 1.00 0.00 C ATOM 658 CG PRO A 43 2.384 6.988 4.376 1.00 0.00 C ATOM 659 CD PRO A 43 3.255 6.886 3.159 1.00 0.00 C ATOM 0 HA PRO A 43 0.238 6.212 2.404 1.00 0.00 H new ATOM 0 HB2 PRO A 43 1.134 8.668 3.932 1.00 0.00 H new ATOM 0 HB3 PRO A 43 0.269 7.274 4.548 1.00 0.00 H new ATOM 0 HG2 PRO A 43 2.849 7.614 5.137 1.00 0.00 H new ATOM 0 HG3 PRO A 43 2.223 6.008 4.824 1.00 0.00 H new ATOM 0 HD2 PRO A 43 3.852 7.786 3.014 1.00 0.00 H new ATOM 0 HD3 PRO A 43 3.951 6.050 3.230 1.00 0.00 H new ATOM 667 N THR A 44 -0.985 8.357 1.730 1.00 0.00 N ATOM 668 CA THR A 44 -1.683 9.367 0.941 1.00 0.00 C ATOM 669 C THR A 44 -2.357 10.392 1.847 1.00 0.00 C ATOM 670 O THR A 44 -2.525 10.162 3.044 1.00 0.00 O ATOM 671 CB THR A 44 -2.724 8.706 0.036 1.00 0.00 C ATOM 672 OG1 THR A 44 -3.554 7.833 0.782 1.00 0.00 O ATOM 673 CG2 THR A 44 -2.113 7.907 -1.094 1.00 0.00 C ATOM 0 H THR A 44 -1.580 7.846 2.382 1.00 0.00 H new ATOM 0 HA THR A 44 -0.949 9.882 0.322 1.00 0.00 H new ATOM 0 HB THR A 44 -3.299 9.527 -0.392 1.00 0.00 H new ATOM 0 HG1 THR A 44 -3.451 6.918 0.447 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.906 7.465 -1.697 1.00 0.00 H new ATOM 0 HG22 THR A 44 -1.506 8.564 -1.717 1.00 0.00 H new ATOM 0 HG23 THR A 44 -1.486 7.116 -0.683 1.00 0.00 H new ATOM 681 N GLU A 45 -2.739 11.525 1.268 1.00 0.00 N ATOM 682 CA GLU A 45 -3.395 12.586 2.023 1.00 0.00 C ATOM 683 C GLU A 45 -4.746 12.121 2.556 1.00 0.00 C ATOM 684 O GLU A 45 -5.088 12.372 3.711 1.00 0.00 O ATOM 685 CB GLU A 45 -3.579 13.827 1.147 1.00 0.00 C ATOM 686 CG GLU A 45 -3.568 15.131 1.929 1.00 0.00 C ATOM 687 CD GLU A 45 -3.360 16.342 1.040 1.00 0.00 C ATOM 688 OE1 GLU A 45 -4.365 16.894 0.544 1.00 0.00 O ATOM 689 OE2 GLU A 45 -2.193 16.738 0.839 1.00 0.00 O ATOM 0 H GLU A 45 -2.606 11.732 0.278 1.00 0.00 H new ATOM 0 HA GLU A 45 -2.758 12.840 2.871 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -2.786 13.855 0.399 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -4.523 13.744 0.608 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -4.511 15.236 2.466 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -2.777 15.095 2.678 1.00 0.00 H new ATOM 696 N GLU A 46 -5.509 11.442 1.706 1.00 0.00 N ATOM 697 CA GLU A 46 -6.823 10.940 2.092 1.00 0.00 C ATOM 698 C GLU A 46 -6.704 9.599 2.809 1.00 0.00 C ATOM 699 O GLU A 46 -5.610 9.054 2.951 1.00 0.00 O ATOM 700 CB GLU A 46 -7.719 10.798 0.860 1.00 0.00 C ATOM 701 CG GLU A 46 -9.154 11.241 1.096 1.00 0.00 C ATOM 702 CD GLU A 46 -10.158 10.400 0.334 1.00 0.00 C ATOM 703 OE1 GLU A 46 -10.462 9.278 0.792 1.00 0.00 O ATOM 704 OE2 GLU A 46 -10.639 10.862 -0.722 1.00 0.00 O ATOM 0 H GLU A 46 -5.240 11.227 0.746 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.273 11.658 2.778 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.296 11.384 0.044 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -7.717 9.757 0.538 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.376 11.188 2.162 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -9.261 12.285 0.800 1.00 0.00 H new ATOM 711 N VAL A 47 -7.839 9.073 3.260 1.00 0.00 N ATOM 712 CA VAL A 47 -7.861 7.795 3.962 1.00 0.00 C ATOM 713 C VAL A 47 -8.535 6.717 3.118 1.00 0.00 C ATOM 714 O VAL A 47 -9.550 6.967 2.468 1.00 0.00 O ATOM 715 CB VAL A 47 -8.592 7.911 5.315 1.00 0.00 C ATOM 716 CG1 VAL A 47 -10.042 8.326 5.110 1.00 0.00 C ATOM 717 CG2 VAL A 47 -8.506 6.602 6.085 1.00 0.00 C ATOM 0 H VAL A 47 -8.754 9.511 3.152 1.00 0.00 H new ATOM 0 HA VAL A 47 -6.824 7.513 4.143 1.00 0.00 H new ATOM 0 HB VAL A 47 -8.100 8.684 5.905 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -10.539 8.402 6.077 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -10.076 9.293 4.608 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -10.551 7.581 4.498 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -9.028 6.705 7.037 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -8.968 5.806 5.502 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -7.460 6.356 6.269 1.00 0.00 H new ATOM 727 N GLY A 48 -7.964 5.517 3.134 1.00 0.00 N ATOM 728 CA GLY A 48 -8.523 4.418 2.367 1.00 0.00 C ATOM 729 C GLY A 48 -7.588 3.939 1.274 1.00 0.00 C ATOM 730 O GLY A 48 -7.362 2.738 1.123 1.00 0.00 O ATOM 0 H GLY A 48 -7.124 5.286 3.664 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.748 3.589 3.037 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -9.467 4.733 1.921 1.00 0.00 H new ATOM 734 N ASP A 49 -7.043 4.879 0.509 1.00 0.00 N ATOM 735 CA ASP A 49 -6.128 4.546 -0.576 1.00 0.00 C ATOM 736 C ASP A 49 -4.705 4.378 -0.054 1.00 0.00 C ATOM 737 O ASP A 49 -4.323 4.986 0.946 1.00 0.00 O ATOM 738 CB ASP A 49 -6.164 5.633 -1.653 1.00 0.00 C ATOM 739 CG ASP A 49 -6.028 5.064 -3.052 1.00 0.00 C ATOM 740 OD1 ASP A 49 -7.019 4.502 -3.563 1.00 0.00 O ATOM 741 OD2 ASP A 49 -4.931 5.180 -3.636 1.00 0.00 O ATOM 0 H ASP A 49 -7.219 5.877 0.621 1.00 0.00 H new ATOM 0 HA ASP A 49 -6.450 3.601 -1.013 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -7.101 6.185 -1.577 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.359 6.346 -1.473 1.00 0.00 H new ATOM 746 N PHE A 50 -3.924 3.549 -0.739 1.00 0.00 N ATOM 747 CA PHE A 50 -2.542 3.300 -0.345 1.00 0.00 C ATOM 748 C PHE A 50 -1.648 3.134 -1.569 1.00 0.00 C ATOM 749 O PHE A 50 -2.007 2.443 -2.523 1.00 0.00 O ATOM 750 CB PHE A 50 -2.457 2.051 0.535 1.00 0.00 C ATOM 751 CG PHE A 50 -3.457 2.038 1.656 1.00 0.00 C ATOM 752 CD1 PHE A 50 -3.416 3.002 2.650 1.00 0.00 C ATOM 753 CD2 PHE A 50 -4.437 1.060 1.715 1.00 0.00 C ATOM 754 CE1 PHE A 50 -4.336 2.992 3.682 1.00 0.00 C ATOM 755 CE2 PHE A 50 -5.359 1.044 2.744 1.00 0.00 C ATOM 756 CZ PHE A 50 -5.308 2.011 3.730 1.00 0.00 C ATOM 0 H PHE A 50 -4.224 3.038 -1.569 1.00 0.00 H new ATOM 0 HA PHE A 50 -2.193 4.162 0.224 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -2.608 1.168 -0.086 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -1.453 1.979 0.953 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.657 3.770 2.618 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -4.481 0.301 0.948 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -4.295 3.750 4.450 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -6.118 0.277 2.778 1.00 0.00 H new ATOM 0 HZ PHE A 50 -6.026 2.000 4.536 1.00 0.00 H new ATOM 766 N GLU A 51 -0.482 3.771 -1.536 1.00 0.00 N ATOM 767 CA GLU A 51 0.464 3.693 -2.643 1.00 0.00 C ATOM 768 C GLU A 51 1.599 2.727 -2.321 1.00 0.00 C ATOM 769 O GLU A 51 2.472 3.028 -1.506 1.00 0.00 O ATOM 770 CB GLU A 51 1.031 5.079 -2.955 1.00 0.00 C ATOM 771 CG GLU A 51 1.788 5.144 -4.273 1.00 0.00 C ATOM 772 CD GLU A 51 1.261 6.225 -5.196 1.00 0.00 C ATOM 773 OE1 GLU A 51 0.102 6.107 -5.648 1.00 0.00 O ATOM 774 OE2 GLU A 51 2.006 7.190 -5.468 1.00 0.00 O ATOM 0 H GLU A 51 -0.170 4.347 -0.754 1.00 0.00 H new ATOM 0 HA GLU A 51 -0.069 3.321 -3.518 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.214 5.800 -2.979 1.00 0.00 H new ATOM 0 HB3 GLU A 51 1.698 5.380 -2.147 1.00 0.00 H new ATOM 0 HG2 GLU A 51 2.844 5.326 -4.073 1.00 0.00 H new ATOM 0 HG3 GLU A 51 1.720 4.179 -4.774 1.00 0.00 H new ATOM 781 N VAL A 52 1.581 1.565 -2.966 1.00 0.00 N ATOM 782 CA VAL A 52 2.610 0.554 -2.747 1.00 0.00 C ATOM 783 C VAL A 52 3.621 0.544 -3.888 1.00 0.00 C ATOM 784 O VAL A 52 3.278 0.819 -5.038 1.00 0.00 O ATOM 785 CB VAL A 52 1.996 -0.852 -2.608 1.00 0.00 C ATOM 786 CG1 VAL A 52 3.055 -1.858 -2.185 1.00 0.00 C ATOM 787 CG2 VAL A 52 0.841 -0.834 -1.618 1.00 0.00 C ATOM 0 H VAL A 52 0.866 1.300 -3.644 1.00 0.00 H new ATOM 0 HA VAL A 52 3.117 0.814 -1.818 1.00 0.00 H new ATOM 0 HB VAL A 52 1.607 -1.157 -3.580 1.00 0.00 H new ATOM 0 HG11 VAL A 52 2.602 -2.845 -2.092 1.00 0.00 H new ATOM 0 HG12 VAL A 52 3.846 -1.890 -2.934 1.00 0.00 H new ATOM 0 HG13 VAL A 52 3.477 -1.560 -1.225 1.00 0.00 H new ATOM 0 HG21 VAL A 52 0.419 -1.836 -1.533 1.00 0.00 H new ATOM 0 HG22 VAL A 52 1.203 -0.508 -0.643 1.00 0.00 H new ATOM 0 HG23 VAL A 52 0.072 -0.145 -1.968 1.00 0.00 H new ATOM 797 N LYS A 53 4.870 0.225 -3.562 1.00 0.00 N ATOM 798 CA LYS A 53 5.932 0.179 -4.561 1.00 0.00 C ATOM 799 C LYS A 53 6.996 -0.844 -4.176 1.00 0.00 C ATOM 800 O LYS A 53 7.332 -0.993 -3.002 1.00 0.00 O ATOM 801 CB LYS A 53 6.568 1.561 -4.722 1.00 0.00 C ATOM 802 CG LYS A 53 7.465 1.677 -5.944 1.00 0.00 C ATOM 803 CD LYS A 53 7.579 3.118 -6.414 1.00 0.00 C ATOM 804 CE LYS A 53 8.713 3.290 -7.412 1.00 0.00 C ATOM 805 NZ LYS A 53 9.405 4.598 -7.246 1.00 0.00 N ATOM 0 H LYS A 53 5.171 -0.005 -2.615 1.00 0.00 H new ATOM 0 HA LYS A 53 5.492 -0.123 -5.511 1.00 0.00 H new ATOM 0 HB2 LYS A 53 5.779 2.310 -4.788 1.00 0.00 H new ATOM 0 HB3 LYS A 53 7.151 1.790 -3.830 1.00 0.00 H new ATOM 0 HG2 LYS A 53 8.456 1.290 -5.707 1.00 0.00 H new ATOM 0 HG3 LYS A 53 7.066 1.060 -6.750 1.00 0.00 H new ATOM 0 HD2 LYS A 53 6.640 3.428 -6.872 1.00 0.00 H new ATOM 0 HD3 LYS A 53 7.746 3.770 -5.556 1.00 0.00 H new ATOM 0 HE2 LYS A 53 9.432 2.480 -7.287 1.00 0.00 H new ATOM 0 HE3 LYS A 53 8.319 3.214 -8.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 10.171 4.676 -7.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 8.725 5.371 -7.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 9.803 4.661 -6.287 1.00 0.00 H new ATOM 819 N ALA A 54 7.522 -1.546 -5.175 1.00 0.00 N ATOM 820 CA ALA A 54 8.548 -2.554 -4.941 1.00 0.00 C ATOM 821 C ALA A 54 9.929 -2.029 -5.317 1.00 0.00 C ATOM 822 O ALA A 54 10.243 -1.870 -6.497 1.00 0.00 O ATOM 823 CB ALA A 54 8.232 -3.820 -5.723 1.00 0.00 C ATOM 0 H ALA A 54 7.254 -1.435 -6.153 1.00 0.00 H new ATOM 0 HA ALA A 54 8.555 -2.790 -3.877 1.00 0.00 H new ATOM 0 HB1 ALA A 54 9.007 -4.564 -5.539 1.00 0.00 H new ATOM 0 HB2 ALA A 54 7.267 -4.214 -5.403 1.00 0.00 H new ATOM 0 HB3 ALA A 54 8.195 -3.590 -6.788 1.00 0.00 H new ATOM 829 N LYS A 55 10.750 -1.761 -4.308 1.00 0.00 N ATOM 830 CA LYS A 55 12.099 -1.253 -4.533 1.00 0.00 C ATOM 831 C LYS A 55 13.046 -2.381 -4.929 1.00 0.00 C ATOM 832 O LYS A 55 13.487 -3.160 -4.084 1.00 0.00 O ATOM 833 CB LYS A 55 12.617 -0.548 -3.276 1.00 0.00 C ATOM 834 CG LYS A 55 12.616 0.968 -3.386 1.00 0.00 C ATOM 835 CD LYS A 55 13.988 1.501 -3.764 1.00 0.00 C ATOM 836 CE LYS A 55 14.409 1.025 -5.145 1.00 0.00 C ATOM 837 NZ LYS A 55 15.167 2.071 -5.886 1.00 0.00 N ATOM 0 H LYS A 55 10.505 -1.887 -3.326 1.00 0.00 H new ATOM 0 HA LYS A 55 12.059 -0.535 -5.352 1.00 0.00 H new ATOM 0 HB2 LYS A 55 12.003 -0.843 -2.425 1.00 0.00 H new ATOM 0 HB3 LYS A 55 13.632 -0.889 -3.070 1.00 0.00 H new ATOM 0 HG2 LYS A 55 11.886 1.279 -4.133 1.00 0.00 H new ATOM 0 HG3 LYS A 55 12.305 1.402 -2.436 1.00 0.00 H new ATOM 0 HD2 LYS A 55 13.975 2.591 -3.742 1.00 0.00 H new ATOM 0 HD3 LYS A 55 14.722 1.176 -3.026 1.00 0.00 H new ATOM 0 HE2 LYS A 55 15.024 0.131 -5.049 1.00 0.00 H new ATOM 0 HE3 LYS A 55 13.525 0.744 -5.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 15.436 1.707 -6.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 14.571 2.916 -6.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 16.024 2.322 -5.353 1.00 0.00 H new ATOM 851 N PHE A 56 13.357 -2.462 -6.219 1.00 0.00 N ATOM 852 CA PHE A 56 14.252 -3.495 -6.727 1.00 0.00 C ATOM 853 C PHE A 56 14.509 -3.306 -8.219 1.00 0.00 C ATOM 854 O PHE A 56 15.657 -3.272 -8.662 1.00 0.00 O ATOM 855 CB PHE A 56 13.663 -4.883 -6.468 1.00 0.00 C ATOM 856 CG PHE A 56 14.666 -5.872 -5.946 1.00 0.00 C ATOM 857 CD1 PHE A 56 15.886 -6.043 -6.582 1.00 0.00 C ATOM 858 CD2 PHE A 56 14.389 -6.631 -4.821 1.00 0.00 C ATOM 859 CE1 PHE A 56 16.810 -6.951 -6.104 1.00 0.00 C ATOM 860 CE2 PHE A 56 15.310 -7.542 -4.339 1.00 0.00 C ATOM 861 CZ PHE A 56 16.522 -7.703 -4.981 1.00 0.00 C ATOM 0 H PHE A 56 13.002 -1.824 -6.932 1.00 0.00 H new ATOM 0 HA PHE A 56 15.202 -3.409 -6.200 1.00 0.00 H new ATOM 0 HB2 PHE A 56 12.846 -4.794 -5.752 1.00 0.00 H new ATOM 0 HB3 PHE A 56 13.235 -5.266 -7.394 1.00 0.00 H new ATOM 0 HD1 PHE A 56 16.116 -5.459 -7.461 1.00 0.00 H new ATOM 0 HD2 PHE A 56 13.443 -6.510 -4.315 1.00 0.00 H new ATOM 0 HE1 PHE A 56 17.757 -7.073 -6.608 1.00 0.00 H new ATOM 0 HE2 PHE A 56 15.082 -8.128 -3.461 1.00 0.00 H new ATOM 0 HZ PHE A 56 17.243 -8.415 -4.606 1.00 0.00 H new ATOM 871 N MET A 57 13.432 -3.183 -8.988 1.00 0.00 N ATOM 872 CA MET A 57 13.540 -2.997 -10.430 1.00 0.00 C ATOM 873 C MET A 57 12.419 -2.102 -10.948 1.00 0.00 C ATOM 874 O MET A 57 11.365 -2.586 -11.360 1.00 0.00 O ATOM 875 CB MET A 57 13.503 -4.351 -11.144 1.00 0.00 C ATOM 876 CG MET A 57 14.873 -4.844 -11.583 1.00 0.00 C ATOM 877 SD MET A 57 15.533 -3.910 -12.977 1.00 0.00 S ATOM 878 CE MET A 57 14.285 -4.228 -14.220 1.00 0.00 C ATOM 0 H MET A 57 12.475 -3.209 -8.637 1.00 0.00 H new ATOM 0 HA MET A 57 14.493 -2.511 -10.639 1.00 0.00 H new ATOM 0 HB2 MET A 57 13.055 -5.091 -10.480 1.00 0.00 H new ATOM 0 HB3 MET A 57 12.856 -4.274 -12.018 1.00 0.00 H new ATOM 0 HG2 MET A 57 15.566 -4.775 -10.744 1.00 0.00 H new ATOM 0 HG3 MET A 57 14.806 -5.897 -11.855 1.00 0.00 H new ATOM 0 HE1 MET A 57 14.761 -4.331 -15.195 1.00 0.00 H new ATOM 0 HE2 MET A 57 13.754 -5.148 -13.976 1.00 0.00 H new ATOM 0 HE3 MET A 57 13.579 -3.398 -14.247 1.00 0.00 H new ATOM 888 N GLY A 58 12.654 -0.795 -10.924 1.00 0.00 N ATOM 889 CA GLY A 58 11.654 0.147 -11.393 1.00 0.00 C ATOM 890 C GLY A 58 11.718 0.361 -12.893 1.00 0.00 C ATOM 891 O GLY A 58 12.734 0.812 -13.420 1.00 0.00 O ATOM 0 H GLY A 58 13.519 -0.371 -10.588 1.00 0.00 H new ATOM 0 HA2 GLY A 58 10.662 -0.216 -11.123 1.00 0.00 H new ATOM 0 HA3 GLY A 58 11.793 1.102 -10.886 1.00 0.00 H new ATOM 895 N VAL A 59 10.627 0.037 -13.582 1.00 0.00 N ATOM 896 CA VAL A 59 10.563 0.197 -15.029 1.00 0.00 C ATOM 897 C VAL A 59 9.637 1.345 -15.415 1.00 0.00 C ATOM 898 O VAL A 59 9.955 2.142 -16.298 1.00 0.00 O ATOM 899 CB VAL A 59 10.075 -1.093 -15.715 1.00 0.00 C ATOM 900 CG1 VAL A 59 10.205 -0.977 -17.226 1.00 0.00 C ATOM 901 CG2 VAL A 59 10.846 -2.297 -15.197 1.00 0.00 C ATOM 0 H VAL A 59 9.777 -0.337 -13.161 1.00 0.00 H new ATOM 0 HA VAL A 59 11.575 0.420 -15.367 1.00 0.00 H new ATOM 0 HB VAL A 59 9.021 -1.234 -15.475 1.00 0.00 H new ATOM 0 HG11 VAL A 59 9.855 -1.898 -17.693 1.00 0.00 H new ATOM 0 HG12 VAL A 59 9.603 -0.140 -17.580 1.00 0.00 H new ATOM 0 HG13 VAL A 59 11.249 -0.810 -17.490 1.00 0.00 H new ATOM 0 HG21 VAL A 59 10.488 -3.199 -15.693 1.00 0.00 H new ATOM 0 HG22 VAL A 59 11.908 -2.166 -15.405 1.00 0.00 H new ATOM 0 HG23 VAL A 59 10.696 -2.390 -14.121 1.00 0.00 H new ATOM 911 N GLN A 60 8.490 1.423 -14.748 1.00 0.00 N ATOM 912 CA GLN A 60 7.517 2.474 -15.022 1.00 0.00 C ATOM 913 C GLN A 60 7.824 3.726 -14.206 1.00 0.00 C ATOM 914 O GLN A 60 8.813 3.775 -13.474 1.00 0.00 O ATOM 915 CB GLN A 60 6.103 1.983 -14.711 1.00 0.00 C ATOM 916 CG GLN A 60 5.433 1.277 -15.879 1.00 0.00 C ATOM 917 CD GLN A 60 3.940 1.536 -15.938 1.00 0.00 C ATOM 918 OE1 GLN A 60 3.489 2.670 -15.783 1.00 0.00 O ATOM 919 NE2 GLN A 60 3.165 0.481 -16.163 1.00 0.00 N ATOM 0 H GLN A 60 8.212 0.771 -14.014 1.00 0.00 H new ATOM 0 HA GLN A 60 7.581 2.727 -16.080 1.00 0.00 H new ATOM 0 HB2 GLN A 60 6.143 1.303 -13.860 1.00 0.00 H new ATOM 0 HB3 GLN A 60 5.490 2.833 -14.411 1.00 0.00 H new ATOM 0 HG2 GLN A 60 5.892 1.608 -16.811 1.00 0.00 H new ATOM 0 HG3 GLN A 60 5.609 0.204 -15.800 1.00 0.00 H new ATOM 0 HE21 GLN A 60 3.582 -0.442 -16.286 1.00 0.00 H new ATOM 0 HE22 GLN A 60 2.152 0.593 -16.213 1.00 0.00 H new ATOM 928 N MET A 61 6.969 4.736 -14.338 1.00 0.00 N ATOM 929 CA MET A 61 7.148 5.988 -13.612 1.00 0.00 C ATOM 930 C MET A 61 6.125 6.118 -12.489 1.00 0.00 C ATOM 931 O MET A 61 6.475 6.427 -11.350 1.00 0.00 O ATOM 932 CB MET A 61 7.027 7.177 -14.568 1.00 0.00 C ATOM 933 CG MET A 61 8.153 7.257 -15.586 1.00 0.00 C ATOM 934 SD MET A 61 7.744 8.309 -16.992 1.00 0.00 S ATOM 935 CE MET A 61 8.630 9.805 -16.565 1.00 0.00 C ATOM 0 H MET A 61 6.146 4.711 -14.940 1.00 0.00 H new ATOM 0 HA MET A 61 8.145 5.984 -13.171 1.00 0.00 H new ATOM 0 HB2 MET A 61 6.075 7.113 -15.096 1.00 0.00 H new ATOM 0 HB3 MET A 61 7.008 8.099 -13.987 1.00 0.00 H new ATOM 0 HG2 MET A 61 9.051 7.639 -15.100 1.00 0.00 H new ATOM 0 HG3 MET A 61 8.387 6.254 -15.943 1.00 0.00 H new ATOM 0 HE1 MET A 61 8.475 10.554 -17.341 1.00 0.00 H new ATOM 0 HE2 MET A 61 8.261 10.187 -15.613 1.00 0.00 H new ATOM 0 HE3 MET A 61 9.694 9.586 -16.480 1.00 0.00 H new ATOM 945 N GLU A 62 4.860 5.879 -12.818 1.00 0.00 N ATOM 946 CA GLU A 62 3.785 5.968 -11.837 1.00 0.00 C ATOM 947 C GLU A 62 3.835 4.792 -10.866 1.00 0.00 C ATOM 948 O GLU A 62 4.231 3.688 -11.235 1.00 0.00 O ATOM 949 CB GLU A 62 2.426 6.010 -12.541 1.00 0.00 C ATOM 950 CG GLU A 62 1.477 7.050 -11.969 1.00 0.00 C ATOM 951 CD GLU A 62 0.901 6.639 -10.628 1.00 0.00 C ATOM 952 OE1 GLU A 62 0.182 5.619 -10.579 1.00 0.00 O ATOM 953 OE2 GLU A 62 1.170 7.337 -9.628 1.00 0.00 O ATOM 0 H GLU A 62 4.554 5.622 -13.757 1.00 0.00 H new ATOM 0 HA GLU A 62 3.920 6.889 -11.269 1.00 0.00 H new ATOM 0 HB2 GLU A 62 2.581 6.215 -13.600 1.00 0.00 H new ATOM 0 HB3 GLU A 62 1.960 5.027 -12.472 1.00 0.00 H new ATOM 0 HG2 GLU A 62 2.005 7.997 -11.858 1.00 0.00 H new ATOM 0 HG3 GLU A 62 0.663 7.220 -12.673 1.00 0.00 H new ATOM 960 N THR A 63 3.429 5.039 -9.625 1.00 0.00 N ATOM 961 CA THR A 63 3.427 4.001 -8.602 1.00 0.00 C ATOM 962 C THR A 63 2.140 3.184 -8.657 1.00 0.00 C ATOM 963 O THR A 63 1.167 3.585 -9.294 1.00 0.00 O ATOM 964 CB THR A 63 3.591 4.622 -7.214 1.00 0.00 C ATOM 965 OG1 THR A 63 4.409 5.777 -7.275 1.00 0.00 O ATOM 966 CG2 THR A 63 4.208 3.678 -6.204 1.00 0.00 C ATOM 0 H THR A 63 3.097 5.949 -9.304 1.00 0.00 H new ATOM 0 HA THR A 63 4.268 3.335 -8.796 1.00 0.00 H new ATOM 0 HB THR A 63 2.581 4.869 -6.888 1.00 0.00 H new ATOM 0 HG1 THR A 63 4.501 6.161 -6.378 1.00 0.00 H new ATOM 0 HG21 THR A 63 4.296 4.182 -5.241 1.00 0.00 H new ATOM 0 HG22 THR A 63 3.576 2.797 -6.096 1.00 0.00 H new ATOM 0 HG23 THR A 63 5.197 3.375 -6.546 1.00 0.00 H new ATOM 974 N PHE A 64 2.142 2.038 -7.983 1.00 0.00 N ATOM 975 CA PHE A 64 0.975 1.166 -7.954 1.00 0.00 C ATOM 976 C PHE A 64 -0.033 1.639 -6.912 1.00 0.00 C ATOM 977 O PHE A 64 0.341 2.032 -5.807 1.00 0.00 O ATOM 978 CB PHE A 64 1.395 -0.275 -7.658 1.00 0.00 C ATOM 979 CG PHE A 64 0.270 -1.263 -7.770 1.00 0.00 C ATOM 980 CD1 PHE A 64 -0.466 -1.365 -8.939 1.00 0.00 C ATOM 981 CD2 PHE A 64 -0.050 -2.092 -6.705 1.00 0.00 C ATOM 982 CE1 PHE A 64 -1.502 -2.275 -9.045 1.00 0.00 C ATOM 983 CE2 PHE A 64 -1.085 -3.003 -6.806 1.00 0.00 C ATOM 984 CZ PHE A 64 -1.812 -3.094 -7.978 1.00 0.00 C ATOM 0 H PHE A 64 2.940 1.692 -7.450 1.00 0.00 H new ATOM 0 HA PHE A 64 0.501 1.204 -8.935 1.00 0.00 H new ATOM 0 HB2 PHE A 64 2.190 -0.562 -8.347 1.00 0.00 H new ATOM 0 HB3 PHE A 64 1.812 -0.324 -6.652 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -0.228 -0.727 -9.777 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.515 -2.025 -5.787 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -2.068 -2.345 -9.962 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -1.325 -3.643 -5.970 1.00 0.00 H new ATOM 0 HZ PHE A 64 -2.621 -3.805 -8.059 1.00 0.00 H new ATOM 994 N MET A 65 -1.311 1.600 -7.271 1.00 0.00 N ATOM 995 CA MET A 65 -2.373 2.025 -6.367 1.00 0.00 C ATOM 996 C MET A 65 -3.033 0.823 -5.700 1.00 0.00 C ATOM 997 O MET A 65 -3.238 -0.214 -6.330 1.00 0.00 O ATOM 998 CB MET A 65 -3.420 2.844 -7.124 1.00 0.00 C ATOM 999 CG MET A 65 -3.177 4.343 -7.070 1.00 0.00 C ATOM 1000 SD MET A 65 -4.706 5.297 -7.142 1.00 0.00 S ATOM 1001 CE MET A 65 -4.158 6.866 -6.473 1.00 0.00 C ATOM 0 H MET A 65 -1.637 1.278 -8.182 1.00 0.00 H new ATOM 0 HA MET A 65 -1.928 2.648 -5.591 1.00 0.00 H new ATOM 0 HB2 MET A 65 -3.435 2.524 -8.166 1.00 0.00 H new ATOM 0 HB3 MET A 65 -4.405 2.629 -6.710 1.00 0.00 H new ATOM 0 HG2 MET A 65 -2.643 4.588 -6.152 1.00 0.00 H new ATOM 0 HG3 MET A 65 -2.533 4.633 -7.900 1.00 0.00 H new ATOM 0 HE1 MET A 65 -4.994 7.565 -6.453 1.00 0.00 H new ATOM 0 HE2 MET A 65 -3.784 6.719 -5.460 1.00 0.00 H new ATOM 0 HE3 MET A 65 -3.362 7.270 -7.099 1.00 0.00 H new ATOM 1011 N LEU A 66 -3.364 0.970 -4.420 1.00 0.00 N ATOM 1012 CA LEU A 66 -4.002 -0.104 -3.668 1.00 0.00 C ATOM 1013 C LEU A 66 -5.292 0.382 -3.015 1.00 0.00 C ATOM 1014 O LEU A 66 -5.262 1.113 -2.025 1.00 0.00 O ATOM 1015 CB LEU A 66 -3.048 -0.643 -2.600 1.00 0.00 C ATOM 1016 CG LEU A 66 -3.349 -2.064 -2.120 1.00 0.00 C ATOM 1017 CD1 LEU A 66 -3.212 -3.054 -3.266 1.00 0.00 C ATOM 1018 CD2 LEU A 66 -2.427 -2.443 -0.971 1.00 0.00 C ATOM 0 H LEU A 66 -3.201 1.822 -3.883 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.248 -0.906 -4.364 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.033 -0.617 -2.995 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.073 0.027 -1.741 1.00 0.00 H new ATOM 0 HG LEU A 66 -4.377 -2.097 -1.761 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -3.430 -4.060 -2.906 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -3.913 -2.792 -4.059 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.195 -3.021 -3.656 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.654 -3.457 -0.641 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.391 -2.394 -1.305 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.575 -1.750 -0.142 1.00 0.00 H new ATOM 1030 N HIS A 67 -6.424 -0.029 -3.576 1.00 0.00 N ATOM 1031 CA HIS A 67 -7.725 0.364 -3.049 1.00 0.00 C ATOM 1032 C HIS A 67 -8.113 -0.501 -1.853 1.00 0.00 C ATOM 1033 O HIS A 67 -7.657 -1.637 -1.723 1.00 0.00 O ATOM 1034 CB HIS A 67 -8.794 0.260 -4.141 1.00 0.00 C ATOM 1035 CG HIS A 67 -9.510 1.549 -4.402 1.00 0.00 C ATOM 1036 ND1 HIS A 67 -10.743 1.847 -3.861 1.00 0.00 N ATOM 1037 CD2 HIS A 67 -9.159 2.622 -5.150 1.00 0.00 C ATOM 1038 CE1 HIS A 67 -11.120 3.047 -4.267 1.00 0.00 C ATOM 1039 NE2 HIS A 67 -10.177 3.539 -5.049 1.00 0.00 N ATOM 0 H HIS A 67 -6.467 -0.634 -4.396 1.00 0.00 H new ATOM 0 HA HIS A 67 -7.657 1.400 -2.716 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -8.326 -0.080 -5.065 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -9.522 -0.499 -3.854 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -8.249 2.736 -5.720 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -12.043 3.541 -4.004 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -10.200 4.452 -5.504 1.00 0.00 H new ATOM 1048 N TYR A 68 -8.956 0.044 -0.983 1.00 0.00 N ATOM 1049 CA TYR A 68 -9.404 -0.677 0.203 1.00 0.00 C ATOM 1050 C TYR A 68 -10.515 -1.662 -0.147 1.00 0.00 C ATOM 1051 O TYR A 68 -10.648 -2.711 0.484 1.00 0.00 O ATOM 1052 CB TYR A 68 -9.895 0.305 1.267 1.00 0.00 C ATOM 1053 CG TYR A 68 -10.049 -0.314 2.638 1.00 0.00 C ATOM 1054 CD1 TYR A 68 -9.002 -1.009 3.229 1.00 0.00 C ATOM 1055 CD2 TYR A 68 -11.242 -0.203 3.341 1.00 0.00 C ATOM 1056 CE1 TYR A 68 -9.140 -1.575 4.482 1.00 0.00 C ATOM 1057 CE2 TYR A 68 -11.388 -0.766 4.594 1.00 0.00 C ATOM 1058 CZ TYR A 68 -10.334 -1.451 5.160 1.00 0.00 C ATOM 1059 OH TYR A 68 -10.475 -2.015 6.407 1.00 0.00 O ATOM 0 H TYR A 68 -9.343 0.983 -1.077 1.00 0.00 H new ATOM 0 HA TYR A 68 -8.557 -1.237 0.599 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -9.195 1.138 1.330 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -10.854 0.717 0.954 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -8.065 -1.109 2.701 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -12.070 0.333 2.900 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -8.316 -2.112 4.928 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -12.322 -0.670 5.127 1.00 0.00 H new ATOM 0 HH TYR A 68 -11.376 -1.835 6.747 1.00 0.00 H new ATOM 1069 N GLN A 69 -11.309 -1.318 -1.155 1.00 0.00 N ATOM 1070 CA GLN A 69 -12.409 -2.173 -1.588 1.00 0.00 C ATOM 1071 C GLN A 69 -11.885 -3.486 -2.160 1.00 0.00 C ATOM 1072 O GLN A 69 -12.417 -4.558 -1.866 1.00 0.00 O ATOM 1073 CB GLN A 69 -13.263 -1.448 -2.632 1.00 0.00 C ATOM 1074 CG GLN A 69 -14.736 -1.375 -2.268 1.00 0.00 C ATOM 1075 CD GLN A 69 -14.996 -0.487 -1.066 1.00 0.00 C ATOM 1076 OE1 GLN A 69 -15.017 0.738 -1.178 1.00 0.00 O ATOM 1077 NE2 GLN A 69 -15.195 -1.104 0.093 1.00 0.00 N ATOM 0 H GLN A 69 -11.212 -0.454 -1.688 1.00 0.00 H new ATOM 0 HA GLN A 69 -13.026 -2.400 -0.719 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -12.879 -0.436 -2.764 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -13.159 -1.956 -3.591 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -15.299 -0.999 -3.122 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -15.105 -2.379 -2.060 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -15.169 -2.123 0.140 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -15.374 -0.559 0.937 1.00 0.00 H new ATOM 1086 N ASP A 70 -10.840 -3.396 -2.976 1.00 0.00 N ATOM 1087 CA ASP A 70 -10.245 -4.579 -3.588 1.00 0.00 C ATOM 1088 C ASP A 70 -9.739 -5.547 -2.524 1.00 0.00 C ATOM 1089 O ASP A 70 -9.777 -6.764 -2.710 1.00 0.00 O ATOM 1090 CB ASP A 70 -9.098 -4.174 -4.516 1.00 0.00 C ATOM 1091 CG ASP A 70 -9.539 -4.052 -5.961 1.00 0.00 C ATOM 1092 OD1 ASP A 70 -10.747 -3.838 -6.197 1.00 0.00 O ATOM 1093 OD2 ASP A 70 -8.677 -4.169 -6.858 1.00 0.00 O ATOM 0 H ASP A 70 -10.388 -2.517 -3.229 1.00 0.00 H new ATOM 0 HA ASP A 70 -11.015 -5.083 -4.172 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -8.684 -3.222 -4.184 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -8.298 -4.911 -4.444 1.00 0.00 H new ATOM 1098 N LEU A 71 -9.265 -5.000 -1.410 1.00 0.00 N ATOM 1099 CA LEU A 71 -8.750 -5.816 -0.316 1.00 0.00 C ATOM 1100 C LEU A 71 -9.877 -6.590 0.362 1.00 0.00 C ATOM 1101 O LEU A 71 -9.784 -7.802 0.551 1.00 0.00 O ATOM 1102 CB LEU A 71 -8.031 -4.938 0.709 1.00 0.00 C ATOM 1103 CG LEU A 71 -6.787 -4.218 0.184 1.00 0.00 C ATOM 1104 CD1 LEU A 71 -6.309 -3.179 1.187 1.00 0.00 C ATOM 1105 CD2 LEU A 71 -5.681 -5.219 -0.117 1.00 0.00 C ATOM 0 H LEU A 71 -9.227 -3.995 -1.241 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.041 -6.531 -0.732 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -8.733 -4.193 1.083 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -7.742 -5.558 1.558 1.00 0.00 H new ATOM 0 HG LEU A 71 -7.049 -3.706 -0.742 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -5.424 -2.677 0.797 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.098 -2.446 1.355 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.063 -3.669 2.129 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -4.803 -4.691 -0.489 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -5.420 -5.758 0.794 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -6.026 -5.926 -0.871 1.00 0.00 H new ATOM 1117 N LEU A 72 -10.940 -5.880 0.724 1.00 0.00 N ATOM 1118 CA LEU A 72 -12.086 -6.499 1.381 1.00 0.00 C ATOM 1119 C LEU A 72 -12.814 -7.447 0.432 1.00 0.00 C ATOM 1120 O LEU A 72 -13.448 -8.409 0.866 1.00 0.00 O ATOM 1121 CB LEU A 72 -13.051 -5.426 1.888 1.00 0.00 C ATOM 1122 CG LEU A 72 -12.490 -4.513 2.979 1.00 0.00 C ATOM 1123 CD1 LEU A 72 -13.406 -3.318 3.198 1.00 0.00 C ATOM 1124 CD2 LEU A 72 -12.301 -5.286 4.274 1.00 0.00 C ATOM 0 H LEU A 72 -11.032 -4.875 0.574 1.00 0.00 H new ATOM 0 HA LEU A 72 -11.717 -7.077 2.229 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -13.361 -4.810 1.044 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -13.946 -5.916 2.271 1.00 0.00 H new ATOM 0 HG LEU A 72 -11.517 -4.144 2.654 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -12.991 -2.679 3.978 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -13.491 -2.750 2.271 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -14.393 -3.667 3.502 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -11.901 -4.621 5.040 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -13.261 -5.683 4.604 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -11.605 -6.109 4.108 1.00 0.00 H new ATOM 1136 N GLN A 73 -12.719 -7.169 -0.865 1.00 0.00 N ATOM 1137 CA GLN A 73 -13.370 -7.997 -1.874 1.00 0.00 C ATOM 1138 C GLN A 73 -12.890 -9.443 -1.785 1.00 0.00 C ATOM 1139 O GLN A 73 -13.647 -10.376 -2.057 1.00 0.00 O ATOM 1140 CB GLN A 73 -13.094 -7.440 -3.272 1.00 0.00 C ATOM 1141 CG GLN A 73 -13.755 -8.236 -4.384 1.00 0.00 C ATOM 1142 CD GLN A 73 -15.225 -7.902 -4.547 1.00 0.00 C ATOM 1143 OE1 GLN A 73 -15.579 -6.829 -5.037 1.00 0.00 O ATOM 1144 NE2 GLN A 73 -16.089 -8.822 -4.134 1.00 0.00 N ATOM 0 H GLN A 73 -12.198 -6.377 -1.241 1.00 0.00 H new ATOM 0 HA GLN A 73 -14.444 -7.979 -1.687 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -13.442 -6.408 -3.318 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -12.017 -7.421 -3.441 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -13.236 -8.042 -5.323 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -13.649 -9.301 -4.176 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -15.750 -9.697 -3.734 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -17.092 -8.654 -4.217 1.00 0.00 H new ATOM 1153 N LEU A 74 -11.630 -9.622 -1.404 1.00 0.00 N ATOM 1154 CA LEU A 74 -11.051 -10.954 -1.279 1.00 0.00 C ATOM 1155 C LEU A 74 -11.557 -11.651 -0.019 1.00 0.00 C ATOM 1156 O LEU A 74 -11.774 -12.863 -0.013 1.00 0.00 O ATOM 1157 CB LEU A 74 -9.524 -10.870 -1.251 1.00 0.00 C ATOM 1158 CG LEU A 74 -8.907 -9.952 -2.306 1.00 0.00 C ATOM 1159 CD1 LEU A 74 -7.588 -9.381 -1.811 1.00 0.00 C ATOM 1160 CD2 LEU A 74 -8.709 -10.701 -3.614 1.00 0.00 C ATOM 0 H LEU A 74 -10.990 -8.861 -1.176 1.00 0.00 H new ATOM 0 HA LEU A 74 -11.359 -11.539 -2.145 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -9.212 -10.526 -0.265 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -9.118 -11.873 -1.382 1.00 0.00 H new ATOM 0 HG LEU A 74 -9.593 -9.124 -2.485 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -7.164 -8.730 -2.575 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -7.759 -8.807 -0.900 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -6.894 -10.196 -1.602 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -8.269 -10.032 -4.353 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -8.044 -11.549 -3.451 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -9.672 -11.060 -3.977 1.00 0.00 H new ATOM 1172 N GLN A 75 -11.742 -10.878 1.044 1.00 0.00 N ATOM 1173 CA GLN A 75 -12.222 -11.420 2.310 1.00 0.00 C ATOM 1174 C GLN A 75 -13.650 -11.937 2.172 1.00 0.00 C ATOM 1175 O GLN A 75 -14.015 -12.947 2.775 1.00 0.00 O ATOM 1176 CB GLN A 75 -12.156 -10.352 3.404 1.00 0.00 C ATOM 1177 CG GLN A 75 -10.851 -10.364 4.187 1.00 0.00 C ATOM 1178 CD GLN A 75 -11.057 -10.657 5.661 1.00 0.00 C ATOM 1179 OE1 GLN A 75 -11.463 -11.757 6.037 1.00 0.00 O ATOM 1180 NE2 GLN A 75 -10.779 -9.671 6.505 1.00 0.00 N ATOM 0 H GLN A 75 -11.567 -9.873 1.055 1.00 0.00 H new ATOM 0 HA GLN A 75 -11.578 -12.254 2.588 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -12.289 -9.370 2.950 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -12.986 -10.499 4.095 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -10.183 -11.113 3.761 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -10.357 -9.398 4.078 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -10.445 -8.775 6.150 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -10.900 -9.809 7.508 1.00 0.00 H new ATOM 1189 N TYR A 76 -14.453 -11.240 1.377 1.00 0.00 N ATOM 1190 CA TYR A 76 -15.842 -11.631 1.161 1.00 0.00 C ATOM 1191 C TYR A 76 -15.931 -12.817 0.207 1.00 0.00 C ATOM 1192 O TYR A 76 -16.728 -13.732 0.411 1.00 0.00 O ATOM 1193 CB TYR A 76 -16.646 -10.454 0.606 1.00 0.00 C ATOM 1194 CG TYR A 76 -18.125 -10.737 0.476 1.00 0.00 C ATOM 1195 CD1 TYR A 76 -18.937 -10.824 1.600 1.00 0.00 C ATOM 1196 CD2 TYR A 76 -18.710 -10.920 -0.771 1.00 0.00 C ATOM 1197 CE1 TYR A 76 -20.288 -11.084 1.485 1.00 0.00 C ATOM 1198 CE2 TYR A 76 -20.061 -11.179 -0.895 1.00 0.00 C ATOM 1199 CZ TYR A 76 -20.846 -11.261 0.236 1.00 0.00 C ATOM 1200 OH TYR A 76 -22.192 -11.520 0.117 1.00 0.00 O ATOM 0 H TYR A 76 -14.167 -10.402 0.871 1.00 0.00 H new ATOM 0 HA TYR A 76 -16.263 -11.928 2.122 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -16.506 -9.591 1.257 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -16.249 -10.183 -0.373 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -18.504 -10.686 2.580 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -18.098 -10.859 -1.659 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -20.905 -11.149 2.369 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -20.500 -11.317 -1.872 1.00 0.00 H new ATOM 0 HH TYR A 76 -22.424 -11.617 -0.830 1.00 0.00 H new ATOM 1210 N GLU A 77 -15.106 -12.795 -0.835 1.00 0.00 N ATOM 1211 CA GLU A 77 -15.091 -13.869 -1.821 1.00 0.00 C ATOM 1212 C GLU A 77 -14.487 -15.140 -1.231 1.00 0.00 C ATOM 1213 O GLU A 77 -14.863 -16.250 -1.608 1.00 0.00 O ATOM 1214 CB GLU A 77 -14.301 -13.443 -3.059 1.00 0.00 C ATOM 1215 CG GLU A 77 -15.053 -12.473 -3.956 1.00 0.00 C ATOM 1216 CD GLU A 77 -14.705 -12.645 -5.421 1.00 0.00 C ATOM 1217 OE1 GLU A 77 -13.637 -13.222 -5.715 1.00 0.00 O ATOM 1218 OE2 GLU A 77 -15.501 -12.204 -6.276 1.00 0.00 O ATOM 0 H GLU A 77 -14.439 -12.045 -1.018 1.00 0.00 H new ATOM 0 HA GLU A 77 -16.121 -14.077 -2.110 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -13.366 -12.981 -2.742 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -14.039 -14.330 -3.636 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -16.125 -12.616 -3.822 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -14.827 -11.451 -3.650 1.00 0.00 H new ATOM 1225 N GLY A 78 -13.551 -14.969 -0.304 1.00 0.00 N ATOM 1226 CA GLY A 78 -12.910 -16.110 0.324 1.00 0.00 C ATOM 1227 C GLY A 78 -11.417 -16.155 0.066 1.00 0.00 C ATOM 1228 O GLY A 78 -10.662 -16.734 0.847 1.00 0.00 O ATOM 0 H GLY A 78 -13.224 -14.060 0.024 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -13.088 -16.076 1.399 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -13.367 -17.028 -0.046 1.00 0.00 H new ATOM 1232 N VAL A 79 -10.988 -15.541 -1.034 1.00 0.00 N ATOM 1233 CA VAL A 79 -9.575 -15.515 -1.393 1.00 0.00 C ATOM 1234 C VAL A 79 -8.738 -14.879 -0.288 1.00 0.00 C ATOM 1235 O VAL A 79 -8.790 -13.668 -0.074 1.00 0.00 O ATOM 1236 CB VAL A 79 -9.342 -14.743 -2.704 1.00 0.00 C ATOM 1237 CG1 VAL A 79 -7.901 -14.898 -3.167 1.00 0.00 C ATOM 1238 CG2 VAL A 79 -10.308 -15.214 -3.781 1.00 0.00 C ATOM 0 H VAL A 79 -11.599 -15.056 -1.691 1.00 0.00 H new ATOM 0 HA VAL A 79 -9.266 -16.551 -1.530 1.00 0.00 H new ATOM 0 HB VAL A 79 -9.528 -13.685 -2.518 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -7.756 -14.345 -4.095 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -7.229 -14.507 -2.403 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -7.684 -15.953 -3.335 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -10.128 -14.657 -4.700 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -10.157 -16.277 -3.966 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -11.333 -15.046 -3.450 1.00 0.00 H new ATOM 1248 N ALA A 80 -7.967 -15.704 0.412 1.00 0.00 N ATOM 1249 CA ALA A 80 -7.118 -15.224 1.495 1.00 0.00 C ATOM 1250 C ALA A 80 -5.761 -14.772 0.968 1.00 0.00 C ATOM 1251 O ALA A 80 -5.143 -13.858 1.515 1.00 0.00 O ATOM 1252 CB ALA A 80 -6.944 -16.307 2.549 1.00 0.00 C ATOM 0 H ALA A 80 -7.913 -16.709 0.248 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.606 -14.363 1.953 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -6.308 -15.935 3.352 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.918 -16.580 2.955 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -6.481 -17.184 2.097 1.00 0.00 H new ATOM 1258 N VAL A 81 -5.300 -15.419 -0.098 1.00 0.00 N ATOM 1259 CA VAL A 81 -4.015 -15.084 -0.699 1.00 0.00 C ATOM 1260 C VAL A 81 -4.178 -14.021 -1.781 1.00 0.00 C ATOM 1261 O VAL A 81 -5.133 -14.052 -2.557 1.00 0.00 O ATOM 1262 CB VAL A 81 -3.339 -16.325 -1.313 1.00 0.00 C ATOM 1263 CG1 VAL A 81 -1.936 -15.987 -1.794 1.00 0.00 C ATOM 1264 CG2 VAL A 81 -3.304 -17.467 -0.309 1.00 0.00 C ATOM 0 H VAL A 81 -5.798 -16.178 -0.563 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.384 -14.695 0.100 1.00 0.00 H new ATOM 0 HB VAL A 81 -3.926 -16.646 -2.173 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -1.475 -16.876 -2.224 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.989 -15.204 -2.550 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -1.337 -15.639 -0.953 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -2.823 -18.334 -0.761 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -2.742 -17.159 0.573 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -4.322 -17.727 -0.018 1.00 0.00 H new ATOM 1274 N MET A 82 -3.239 -13.081 -1.825 1.00 0.00 N ATOM 1275 CA MET A 82 -3.280 -12.007 -2.812 1.00 0.00 C ATOM 1276 C MET A 82 -2.091 -12.096 -3.763 1.00 0.00 C ATOM 1277 O MET A 82 -1.004 -12.526 -3.376 1.00 0.00 O ATOM 1278 CB MET A 82 -3.289 -10.645 -2.115 1.00 0.00 C ATOM 1279 CG MET A 82 -3.657 -9.493 -3.034 1.00 0.00 C ATOM 1280 SD MET A 82 -4.249 -8.047 -2.135 1.00 0.00 S ATOM 1281 CE MET A 82 -3.211 -6.765 -2.832 1.00 0.00 C ATOM 0 H MET A 82 -2.442 -13.041 -1.190 1.00 0.00 H new ATOM 0 HA MET A 82 -4.196 -12.116 -3.393 1.00 0.00 H new ATOM 0 HB2 MET A 82 -3.995 -10.676 -1.285 1.00 0.00 H new ATOM 0 HB3 MET A 82 -2.303 -10.458 -1.689 1.00 0.00 H new ATOM 0 HG2 MET A 82 -2.786 -9.215 -3.628 1.00 0.00 H new ATOM 0 HG3 MET A 82 -4.427 -9.822 -3.732 1.00 0.00 H new ATOM 0 HE1 MET A 82 -2.676 -6.255 -2.031 1.00 0.00 H new ATOM 0 HE2 MET A 82 -2.494 -7.212 -3.520 1.00 0.00 H new ATOM 0 HE3 MET A 82 -3.831 -6.047 -3.369 1.00 0.00 H new ATOM 1291 N LYS A 83 -2.305 -11.687 -5.009 1.00 0.00 N ATOM 1292 CA LYS A 83 -1.250 -11.719 -6.016 1.00 0.00 C ATOM 1293 C LYS A 83 -0.765 -10.309 -6.340 1.00 0.00 C ATOM 1294 O LYS A 83 -1.376 -9.601 -7.141 1.00 0.00 O ATOM 1295 CB LYS A 83 -1.755 -12.405 -7.288 1.00 0.00 C ATOM 1296 CG LYS A 83 -0.726 -12.452 -8.406 1.00 0.00 C ATOM 1297 CD LYS A 83 -0.726 -13.800 -9.110 1.00 0.00 C ATOM 1298 CE LYS A 83 0.209 -14.784 -8.427 1.00 0.00 C ATOM 1299 NZ LYS A 83 -0.135 -14.971 -6.989 1.00 0.00 N ATOM 0 H LYS A 83 -3.199 -11.330 -5.346 1.00 0.00 H new ATOM 0 HA LYS A 83 -0.411 -12.287 -5.613 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -2.061 -13.422 -7.045 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -2.642 -11.882 -7.645 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -0.937 -11.663 -9.129 1.00 0.00 H new ATOM 0 HG3 LYS A 83 0.265 -12.254 -7.998 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -1.738 -14.206 -9.122 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -0.423 -13.669 -10.149 1.00 0.00 H new ATOM 0 HE2 LYS A 83 0.162 -15.745 -8.939 1.00 0.00 H new ATOM 0 HE3 LYS A 83 1.236 -14.428 -8.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 0.435 -15.746 -6.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 0.064 -14.094 -6.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -1.145 -15.204 -6.901 1.00 0.00 H new ATOM 1313 N LEU A 84 0.335 -9.909 -5.712 1.00 0.00 N ATOM 1314 CA LEU A 84 0.903 -8.584 -5.932 1.00 0.00 C ATOM 1315 C LEU A 84 2.000 -8.630 -6.991 1.00 0.00 C ATOM 1316 O LEU A 84 2.935 -9.425 -6.898 1.00 0.00 O ATOM 1317 CB LEU A 84 1.464 -8.023 -4.624 1.00 0.00 C ATOM 1318 CG LEU A 84 0.459 -7.252 -3.767 1.00 0.00 C ATOM 1319 CD1 LEU A 84 0.915 -7.212 -2.317 1.00 0.00 C ATOM 1320 CD2 LEU A 84 0.271 -5.842 -4.307 1.00 0.00 C ATOM 0 H LEU A 84 0.851 -10.484 -5.046 1.00 0.00 H new ATOM 0 HA LEU A 84 0.107 -7.930 -6.288 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.864 -8.848 -4.034 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.300 -7.364 -4.858 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.500 -7.768 -3.811 1.00 0.00 H new ATOM 0 HD11 LEU A 84 0.188 -6.659 -1.722 1.00 0.00 H new ATOM 0 HD12 LEU A 84 1.000 -8.229 -1.934 1.00 0.00 H new ATOM 0 HD13 LEU A 84 1.885 -6.719 -2.254 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.447 -5.307 -3.686 1.00 0.00 H new ATOM 0 HD22 LEU A 84 1.226 -5.316 -4.292 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.100 -5.891 -5.331 1.00 0.00 H new ATOM 1332 N PHE A 85 1.877 -7.771 -7.998 1.00 0.00 N ATOM 1333 CA PHE A 85 2.857 -7.712 -9.077 1.00 0.00 C ATOM 1334 C PHE A 85 2.978 -9.057 -9.787 1.00 0.00 C ATOM 1335 O PHE A 85 3.995 -9.345 -10.418 1.00 0.00 O ATOM 1336 CB PHE A 85 4.222 -7.287 -8.531 1.00 0.00 C ATOM 1337 CG PHE A 85 4.162 -6.083 -7.635 1.00 0.00 C ATOM 1338 CD1 PHE A 85 3.738 -4.858 -8.126 1.00 0.00 C ATOM 1339 CD2 PHE A 85 4.529 -6.177 -6.302 1.00 0.00 C ATOM 1340 CE1 PHE A 85 3.682 -3.749 -7.303 1.00 0.00 C ATOM 1341 CE2 PHE A 85 4.475 -5.071 -5.475 1.00 0.00 C ATOM 1342 CZ PHE A 85 4.051 -3.855 -5.976 1.00 0.00 C ATOM 0 H PHE A 85 1.109 -7.106 -8.089 1.00 0.00 H new ATOM 0 HA PHE A 85 2.513 -6.973 -9.801 1.00 0.00 H new ATOM 0 HB2 PHE A 85 4.658 -8.119 -7.979 1.00 0.00 H new ATOM 0 HB3 PHE A 85 4.888 -7.075 -9.367 1.00 0.00 H new ATOM 0 HD1 PHE A 85 3.448 -4.769 -9.163 1.00 0.00 H new ATOM 0 HD2 PHE A 85 4.861 -7.125 -5.905 1.00 0.00 H new ATOM 0 HE1 PHE A 85 3.350 -2.800 -7.697 1.00 0.00 H new ATOM 0 HE2 PHE A 85 4.764 -5.157 -4.438 1.00 0.00 H new ATOM 0 HZ PHE A 85 4.008 -2.989 -5.332 1.00 0.00 H new ATOM 1352 N ASP A 86 1.936 -9.879 -9.681 1.00 0.00 N ATOM 1353 CA ASP A 86 1.930 -11.193 -10.316 1.00 0.00 C ATOM 1354 C ASP A 86 3.151 -12.009 -9.897 1.00 0.00 C ATOM 1355 O ASP A 86 3.651 -12.832 -10.664 1.00 0.00 O ATOM 1356 CB ASP A 86 1.897 -11.048 -11.838 1.00 0.00 C ATOM 1357 CG ASP A 86 0.485 -11.030 -12.387 1.00 0.00 C ATOM 1358 OD1 ASP A 86 -0.436 -10.634 -11.642 1.00 0.00 O ATOM 1359 OD2 ASP A 86 0.299 -11.412 -13.561 1.00 0.00 O ATOM 0 H ASP A 86 1.086 -9.658 -9.162 1.00 0.00 H new ATOM 0 HA ASP A 86 1.034 -11.721 -9.989 1.00 0.00 H new ATOM 0 HB2 ASP A 86 2.406 -10.128 -12.123 1.00 0.00 H new ATOM 0 HB3 ASP A 86 2.449 -11.872 -12.291 1.00 0.00 H new ATOM 1364 N ARG A 87 3.626 -11.773 -8.678 1.00 0.00 N ATOM 1365 CA ARG A 87 4.789 -12.487 -8.163 1.00 0.00 C ATOM 1366 C ARG A 87 4.662 -12.724 -6.661 1.00 0.00 C ATOM 1367 O ARG A 87 4.375 -13.839 -6.221 1.00 0.00 O ATOM 1368 CB ARG A 87 6.067 -11.700 -8.460 1.00 0.00 C ATOM 1369 CG ARG A 87 6.416 -11.641 -9.938 1.00 0.00 C ATOM 1370 CD ARG A 87 7.091 -12.921 -10.406 1.00 0.00 C ATOM 1371 NE ARG A 87 6.221 -13.711 -11.273 1.00 0.00 N ATOM 1372 CZ ARG A 87 6.662 -14.655 -12.103 1.00 0.00 C ATOM 1373 NH1 ARG A 87 7.958 -14.931 -12.179 1.00 0.00 N ATOM 1374 NH2 ARG A 87 5.803 -15.327 -12.858 1.00 0.00 N ATOM 0 H ARG A 87 3.225 -11.095 -8.030 1.00 0.00 H new ATOM 0 HA ARG A 87 4.841 -13.455 -8.662 1.00 0.00 H new ATOM 0 HB2 ARG A 87 5.954 -10.684 -8.081 1.00 0.00 H new ATOM 0 HB3 ARG A 87 6.897 -12.153 -7.917 1.00 0.00 H new ATOM 0 HG2 ARG A 87 5.510 -11.473 -10.520 1.00 0.00 H new ATOM 0 HG3 ARG A 87 7.075 -10.793 -10.123 1.00 0.00 H new ATOM 0 HD2 ARG A 87 8.008 -12.673 -10.941 1.00 0.00 H new ATOM 0 HD3 ARG A 87 7.378 -13.517 -9.540 1.00 0.00 H new ATOM 0 HE ARG A 87 5.218 -13.529 -11.241 1.00 0.00 H new ATOM 0 HH11 ARG A 87 8.623 -14.419 -11.600 1.00 0.00 H new ATOM 0 HH12 ARG A 87 8.289 -15.655 -12.817 1.00 0.00 H new ATOM 0 HH21 ARG A 87 4.806 -15.121 -12.803 1.00 0.00 H new ATOM 0 HH22 ARG A 87 6.140 -16.050 -13.494 1.00 0.00 H new ATOM 1388 N ALA A 88 4.883 -11.673 -5.880 1.00 0.00 N ATOM 1389 CA ALA A 88 4.799 -11.768 -4.427 1.00 0.00 C ATOM 1390 C ALA A 88 3.403 -12.188 -3.978 1.00 0.00 C ATOM 1391 O ALA A 88 2.414 -11.924 -4.661 1.00 0.00 O ATOM 1392 CB ALA A 88 5.181 -10.440 -3.790 1.00 0.00 C ATOM 0 H ALA A 88 5.122 -10.745 -6.229 1.00 0.00 H new ATOM 0 HA ALA A 88 5.501 -12.535 -4.099 1.00 0.00 H new ATOM 0 HB1 ALA A 88 5.114 -10.524 -2.705 1.00 0.00 H new ATOM 0 HB2 ALA A 88 6.202 -10.182 -4.072 1.00 0.00 H new ATOM 0 HB3 ALA A 88 4.501 -9.662 -4.136 1.00 0.00 H new ATOM 1398 N LYS A 89 3.333 -12.843 -2.823 1.00 0.00 N ATOM 1399 CA LYS A 89 2.060 -13.300 -2.278 1.00 0.00 C ATOM 1400 C LYS A 89 1.905 -12.858 -0.826 1.00 0.00 C ATOM 1401 O LYS A 89 2.706 -13.226 0.035 1.00 0.00 O ATOM 1402 CB LYS A 89 1.958 -14.823 -2.372 1.00 0.00 C ATOM 1403 CG LYS A 89 1.435 -15.317 -3.711 1.00 0.00 C ATOM 1404 CD LYS A 89 1.511 -16.832 -3.814 1.00 0.00 C ATOM 1405 CE LYS A 89 0.333 -17.398 -4.590 1.00 0.00 C ATOM 1406 NZ LYS A 89 -0.019 -18.773 -4.140 1.00 0.00 N ATOM 0 H LYS A 89 4.144 -13.069 -2.247 1.00 0.00 H new ATOM 0 HA LYS A 89 1.258 -12.853 -2.866 1.00 0.00 H new ATOM 0 HB2 LYS A 89 2.942 -15.256 -2.194 1.00 0.00 H new ATOM 0 HB3 LYS A 89 1.302 -15.184 -1.580 1.00 0.00 H new ATOM 0 HG2 LYS A 89 0.402 -14.994 -3.841 1.00 0.00 H new ATOM 0 HG3 LYS A 89 2.014 -14.867 -4.517 1.00 0.00 H new ATOM 0 HD2 LYS A 89 2.442 -17.118 -4.304 1.00 0.00 H new ATOM 0 HD3 LYS A 89 1.531 -17.265 -2.814 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -0.530 -16.744 -4.468 1.00 0.00 H new ATOM 0 HE3 LYS A 89 0.573 -17.414 -5.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -0.827 -19.123 -4.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 0.796 -19.403 -4.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -0.273 -18.754 -3.132 1.00 0.00 H new ATOM 1420 N VAL A 90 0.869 -12.069 -0.558 1.00 0.00 N ATOM 1421 CA VAL A 90 0.609 -11.579 0.790 1.00 0.00 C ATOM 1422 C VAL A 90 -0.760 -12.031 1.285 1.00 0.00 C ATOM 1423 O VAL A 90 -1.671 -12.270 0.491 1.00 0.00 O ATOM 1424 CB VAL A 90 0.683 -10.041 0.856 1.00 0.00 C ATOM 1425 CG1 VAL A 90 0.578 -9.561 2.296 1.00 0.00 C ATOM 1426 CG2 VAL A 90 1.965 -9.537 0.210 1.00 0.00 C ATOM 0 H VAL A 90 0.196 -11.756 -1.257 1.00 0.00 H new ATOM 0 HA VAL A 90 1.383 -12.000 1.432 1.00 0.00 H new ATOM 0 HB VAL A 90 -0.160 -9.633 0.299 1.00 0.00 H new ATOM 0 HG11 VAL A 90 0.632 -8.473 2.322 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -0.372 -9.887 2.720 1.00 0.00 H new ATOM 0 HG13 VAL A 90 1.398 -9.979 2.880 1.00 0.00 H new ATOM 0 HG21 VAL A 90 1.998 -8.449 0.267 1.00 0.00 H new ATOM 0 HG22 VAL A 90 2.825 -9.954 0.734 1.00 0.00 H new ATOM 0 HG23 VAL A 90 1.992 -9.847 -0.835 1.00 0.00 H new ATOM 1436 N ASN A 91 -0.899 -12.147 2.602 1.00 0.00 N ATOM 1437 CA ASN A 91 -2.158 -12.569 3.204 1.00 0.00 C ATOM 1438 C ASN A 91 -3.096 -11.380 3.393 1.00 0.00 C ATOM 1439 O ASN A 91 -2.755 -10.411 4.071 1.00 0.00 O ATOM 1440 CB ASN A 91 -1.900 -13.250 4.550 1.00 0.00 C ATOM 1441 CG ASN A 91 -3.119 -13.992 5.066 1.00 0.00 C ATOM 1442 OD1 ASN A 91 -3.988 -14.393 4.293 1.00 0.00 O ATOM 1443 ND2 ASN A 91 -3.185 -14.177 6.378 1.00 0.00 N ATOM 0 H ASN A 91 -0.155 -11.955 3.272 1.00 0.00 H new ATOM 0 HA ASN A 91 -2.635 -13.281 2.530 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -1.069 -13.948 4.447 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -1.598 -12.500 5.281 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -3.980 -14.670 6.784 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -2.440 -13.827 6.981 1.00 0.00 H new ATOM 1450 N VAL A 92 -4.276 -11.461 2.788 1.00 0.00 N ATOM 1451 CA VAL A 92 -5.262 -10.393 2.889 1.00 0.00 C ATOM 1452 C VAL A 92 -5.862 -10.332 4.290 1.00 0.00 C ATOM 1453 O VAL A 92 -6.232 -9.261 4.773 1.00 0.00 O ATOM 1454 CB VAL A 92 -6.398 -10.574 1.863 1.00 0.00 C ATOM 1455 CG1 VAL A 92 -7.329 -9.371 1.873 1.00 0.00 C ATOM 1456 CG2 VAL A 92 -5.829 -10.804 0.471 1.00 0.00 C ATOM 0 H VAL A 92 -4.573 -12.256 2.222 1.00 0.00 H new ATOM 0 HA VAL A 92 -4.740 -9.460 2.678 1.00 0.00 H new ATOM 0 HB VAL A 92 -6.977 -11.453 2.145 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -8.123 -9.520 1.142 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -7.766 -9.257 2.865 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -6.766 -8.473 1.619 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -6.646 -10.930 -0.240 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -5.223 -9.946 0.179 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -5.210 -11.701 0.475 1.00 0.00 H new ATOM 1466 N ASN A 93 -5.956 -11.488 4.938 1.00 0.00 N ATOM 1467 CA ASN A 93 -6.511 -11.568 6.284 1.00 0.00 C ATOM 1468 C ASN A 93 -5.721 -10.696 7.256 1.00 0.00 C ATOM 1469 O ASN A 93 -6.267 -10.191 8.236 1.00 0.00 O ATOM 1470 CB ASN A 93 -6.516 -13.018 6.771 1.00 0.00 C ATOM 1471 CG ASN A 93 -7.816 -13.730 6.451 1.00 0.00 C ATOM 1472 OD1 ASN A 93 -8.829 -13.097 6.159 1.00 0.00 O ATOM 1473 ND2 ASN A 93 -7.793 -15.058 6.508 1.00 0.00 N ATOM 0 H ASN A 93 -5.655 -12.383 4.553 1.00 0.00 H new ATOM 0 HA ASN A 93 -7.536 -11.199 6.247 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -5.687 -13.556 6.311 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -6.350 -13.037 7.848 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -8.638 -15.592 6.305 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -6.930 -15.543 6.755 1.00 0.00 H new ATOM 1480 N LEU A 94 -4.432 -10.526 6.978 1.00 0.00 N ATOM 1481 CA LEU A 94 -3.568 -9.718 7.831 1.00 0.00 C ATOM 1482 C LEU A 94 -3.227 -8.388 7.164 1.00 0.00 C ATOM 1483 O LEU A 94 -2.999 -7.385 7.840 1.00 0.00 O ATOM 1484 CB LEU A 94 -2.283 -10.480 8.159 1.00 0.00 C ATOM 1485 CG LEU A 94 -2.382 -11.432 9.352 1.00 0.00 C ATOM 1486 CD1 LEU A 94 -1.324 -12.520 9.257 1.00 0.00 C ATOM 1487 CD2 LEU A 94 -2.245 -10.664 10.658 1.00 0.00 C ATOM 0 H LEU A 94 -3.964 -10.936 6.170 1.00 0.00 H new ATOM 0 HA LEU A 94 -4.107 -9.511 8.755 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -1.984 -11.052 7.281 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.490 -9.758 8.355 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.363 -11.907 9.334 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -1.410 -13.187 10.114 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -1.468 -13.089 8.338 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.334 -12.065 9.250 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -2.318 -11.356 11.497 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -1.278 -10.162 10.685 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -3.041 -9.923 10.729 1.00 0.00 H new ATOM 1499 N LEU A 95 -3.194 -8.387 5.835 1.00 0.00 N ATOM 1500 CA LEU A 95 -2.880 -7.178 5.079 1.00 0.00 C ATOM 1501 C LEU A 95 -3.834 -6.044 5.441 1.00 0.00 C ATOM 1502 O LEU A 95 -3.444 -4.876 5.472 1.00 0.00 O ATOM 1503 CB LEU A 95 -2.952 -7.458 3.577 1.00 0.00 C ATOM 1504 CG LEU A 95 -2.485 -6.310 2.681 1.00 0.00 C ATOM 1505 CD1 LEU A 95 -1.066 -5.897 3.039 1.00 0.00 C ATOM 1506 CD2 LEU A 95 -2.574 -6.708 1.216 1.00 0.00 C ATOM 0 H LEU A 95 -3.380 -9.208 5.259 1.00 0.00 H new ATOM 0 HA LEU A 95 -1.866 -6.872 5.338 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -2.348 -8.338 3.358 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -3.982 -7.705 3.318 1.00 0.00 H new ATOM 0 HG LEU A 95 -3.142 -5.456 2.845 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -0.751 -5.079 2.391 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -1.033 -5.570 4.078 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -0.395 -6.746 2.905 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -2.238 -5.879 0.593 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -1.941 -7.577 1.036 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -3.607 -6.953 0.968 1.00 0.00 H new ATOM 1518 N ILE A 96 -5.086 -6.396 5.714 1.00 0.00 N ATOM 1519 CA ILE A 96 -6.096 -5.409 6.074 1.00 0.00 C ATOM 1520 C ILE A 96 -6.018 -5.053 7.554 1.00 0.00 C ATOM 1521 O ILE A 96 -6.357 -3.938 7.953 1.00 0.00 O ATOM 1522 CB ILE A 96 -7.516 -5.918 5.756 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -7.579 -6.465 4.329 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -8.534 -4.804 5.949 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -8.837 -7.254 4.039 1.00 0.00 C ATOM 0 H ILE A 96 -5.425 -7.358 5.693 1.00 0.00 H new ATOM 0 HA ILE A 96 -5.893 -4.519 5.479 1.00 0.00 H new ATOM 0 HB ILE A 96 -7.758 -6.727 6.445 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -7.511 -5.634 3.627 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -6.712 -7.102 4.154 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -9.532 -5.179 5.721 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -8.504 -4.459 6.982 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -8.297 -3.975 5.282 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -8.813 -7.611 3.009 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -8.897 -8.105 4.717 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -9.708 -6.615 4.181 1.00 0.00 H new ATOM 1537 N PHE A 97 -5.570 -6.005 8.366 1.00 0.00 N ATOM 1538 CA PHE A 97 -5.448 -5.790 9.804 1.00 0.00 C ATOM 1539 C PHE A 97 -4.276 -4.868 10.123 1.00 0.00 C ATOM 1540 O PHE A 97 -4.376 -4.000 10.991 1.00 0.00 O ATOM 1541 CB PHE A 97 -5.271 -7.127 10.526 1.00 0.00 C ATOM 1542 CG PHE A 97 -5.673 -7.085 11.974 1.00 0.00 C ATOM 1543 CD1 PHE A 97 -5.011 -6.257 12.866 1.00 0.00 C ATOM 1544 CD2 PHE A 97 -6.713 -7.871 12.441 1.00 0.00 C ATOM 1545 CE1 PHE A 97 -5.379 -6.216 14.198 1.00 0.00 C ATOM 1546 CE2 PHE A 97 -7.086 -7.834 13.771 1.00 0.00 C ATOM 1547 CZ PHE A 97 -6.417 -7.005 14.651 1.00 0.00 C ATOM 0 H PHE A 97 -5.285 -6.933 8.053 1.00 0.00 H new ATOM 0 HA PHE A 97 -6.364 -5.313 10.152 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -5.862 -7.888 10.015 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -4.227 -7.433 10.456 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -4.199 -5.637 12.517 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -7.239 -8.521 11.757 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -4.855 -5.567 14.884 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -7.899 -8.452 14.122 1.00 0.00 H new ATOM 0 HZ PHE A 97 -6.706 -6.974 15.691 1.00 0.00 H new ATOM 1557 N LEU A 98 -3.166 -5.062 9.419 1.00 0.00 N ATOM 1558 CA LEU A 98 -1.975 -4.247 9.631 1.00 0.00 C ATOM 1559 C LEU A 98 -2.273 -2.771 9.388 1.00 0.00 C ATOM 1560 O LEU A 98 -2.042 -1.930 10.256 1.00 0.00 O ATOM 1561 CB LEU A 98 -0.843 -4.709 8.712 1.00 0.00 C ATOM 1562 CG LEU A 98 0.522 -4.083 8.999 1.00 0.00 C ATOM 1563 CD1 LEU A 98 1.263 -4.880 10.060 1.00 0.00 C ATOM 1564 CD2 LEU A 98 1.346 -3.994 7.724 1.00 0.00 C ATOM 0 H LEU A 98 -3.066 -5.776 8.697 1.00 0.00 H new ATOM 0 HA LEU A 98 -1.664 -4.369 10.668 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -0.752 -5.792 8.790 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -1.118 -4.485 7.681 1.00 0.00 H new ATOM 0 HG LEU A 98 0.364 -3.073 9.378 1.00 0.00 H new ATOM 0 HD11 LEU A 98 2.232 -4.419 10.251 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.679 -4.891 10.980 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.410 -5.902 9.711 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.314 -3.546 7.947 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.494 -4.994 7.316 1.00 0.00 H new ATOM 0 HD23 LEU A 98 0.821 -3.378 6.994 1.00 0.00 H new ATOM 1576 N LEU A 99 -2.788 -2.464 8.202 1.00 0.00 N ATOM 1577 CA LEU A 99 -3.119 -1.090 7.844 1.00 0.00 C ATOM 1578 C LEU A 99 -4.195 -0.529 8.769 1.00 0.00 C ATOM 1579 O LEU A 99 -4.259 0.679 8.999 1.00 0.00 O ATOM 1580 CB LEU A 99 -3.592 -1.019 6.391 1.00 0.00 C ATOM 1581 CG LEU A 99 -2.690 -1.729 5.379 1.00 0.00 C ATOM 1582 CD1 LEU A 99 -3.252 -1.587 3.974 1.00 0.00 C ATOM 1583 CD2 LEU A 99 -1.275 -1.177 5.448 1.00 0.00 C ATOM 0 H LEU A 99 -2.985 -3.149 7.472 1.00 0.00 H new ATOM 0 HA LEU A 99 -2.219 -0.486 7.956 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -4.591 -1.450 6.329 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -3.679 0.029 6.104 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.657 -2.789 5.630 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.598 -2.098 3.267 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -4.247 -2.030 3.934 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -3.315 -0.531 3.712 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.647 -1.693 4.722 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -1.289 -0.111 5.223 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -0.873 -1.331 6.449 1.00 0.00 H new ATOM 1595 N ASN A 100 -5.038 -1.412 9.294 1.00 0.00 N ATOM 1596 CA ASN A 100 -6.113 -1.003 10.194 1.00 0.00 C ATOM 1597 C ASN A 100 -5.559 -0.262 11.408 1.00 0.00 C ATOM 1598 O ASN A 100 -6.225 0.605 11.974 1.00 0.00 O ATOM 1599 CB ASN A 100 -6.917 -2.223 10.648 1.00 0.00 C ATOM 1600 CG ASN A 100 -8.410 -1.965 10.641 1.00 0.00 C ATOM 1601 OD1 ASN A 100 -8.873 -0.914 11.084 1.00 0.00 O ATOM 1602 ND2 ASN A 100 -9.176 -2.928 10.137 1.00 0.00 N ATOM 0 H ASN A 100 -4.999 -2.415 9.113 1.00 0.00 H new ATOM 0 HA ASN A 100 -6.770 -0.325 9.649 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -6.693 -3.066 9.994 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -6.605 -2.507 11.653 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -10.189 -2.811 10.107 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -8.751 -3.784 9.780 1.00 0.00 H new ATOM 1609 N LYS A 101 -4.340 -0.611 11.805 1.00 0.00 N ATOM 1610 CA LYS A 101 -3.700 0.021 12.953 1.00 0.00 C ATOM 1611 C LYS A 101 -2.519 0.883 12.515 1.00 0.00 C ATOM 1612 O LYS A 101 -2.207 1.891 13.148 1.00 0.00 O ATOM 1613 CB LYS A 101 -3.230 -1.040 13.949 1.00 0.00 C ATOM 1614 CG LYS A 101 -3.313 -0.592 15.400 1.00 0.00 C ATOM 1615 CD LYS A 101 -4.192 -1.520 16.224 1.00 0.00 C ATOM 1616 CE LYS A 101 -5.586 -0.944 16.416 1.00 0.00 C ATOM 1617 NZ LYS A 101 -6.550 -1.477 15.415 1.00 0.00 N ATOM 0 H LYS A 101 -3.775 -1.328 11.349 1.00 0.00 H new ATOM 0 HA LYS A 101 -4.435 0.664 13.437 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -3.832 -1.939 13.820 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -2.199 -1.311 13.719 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -2.312 -0.562 15.830 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -3.710 0.422 15.446 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -4.263 -2.489 15.730 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -3.731 -1.691 17.197 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -5.940 -1.177 17.420 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -5.544 0.142 16.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -7.488 -1.060 15.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -6.226 -1.233 14.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -6.610 -2.511 15.507 1.00 0.00 H new ATOM 1631 N LYS A 102 -1.866 0.478 11.431 1.00 0.00 N ATOM 1632 CA LYS A 102 -0.719 1.214 10.911 1.00 0.00 C ATOM 1633 C LYS A 102 -1.156 2.532 10.278 1.00 0.00 C ATOM 1634 O LYS A 102 -0.986 3.600 10.865 1.00 0.00 O ATOM 1635 CB LYS A 102 0.034 0.366 9.884 1.00 0.00 C ATOM 1636 CG LYS A 102 0.952 -0.672 10.509 1.00 0.00 C ATOM 1637 CD LYS A 102 2.110 -0.019 11.245 1.00 0.00 C ATOM 1638 CE LYS A 102 3.263 -0.990 11.443 1.00 0.00 C ATOM 1639 NZ LYS A 102 3.222 -1.638 12.783 1.00 0.00 N ATOM 0 H LYS A 102 -2.111 -0.355 10.896 1.00 0.00 H new ATOM 0 HA LYS A 102 -0.055 1.437 11.746 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -0.688 -0.139 9.242 1.00 0.00 H new ATOM 0 HB3 LYS A 102 0.624 1.023 9.245 1.00 0.00 H new ATOM 0 HG2 LYS A 102 0.383 -1.293 11.201 1.00 0.00 H new ATOM 0 HG3 LYS A 102 1.339 -1.332 9.733 1.00 0.00 H new ATOM 0 HD2 LYS A 102 2.456 0.849 10.684 1.00 0.00 H new ATOM 0 HD3 LYS A 102 1.768 0.344 12.214 1.00 0.00 H new ATOM 0 HE2 LYS A 102 3.229 -1.756 10.668 1.00 0.00 H new ATOM 0 HE3 LYS A 102 4.208 -0.460 11.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 4.025 -2.292 12.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 3.280 -0.909 13.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 2.332 -2.166 12.886 1.00 0.00 H new ATOM 1653 N PHE A 103 -1.720 2.448 9.077 1.00 0.00 N ATOM 1654 CA PHE A 103 -2.179 3.635 8.365 1.00 0.00 C ATOM 1655 C PHE A 103 -3.418 4.225 9.030 1.00 0.00 C ATOM 1656 O PHE A 103 -3.477 5.424 9.304 1.00 0.00 O ATOM 1657 CB PHE A 103 -2.484 3.293 6.906 1.00 0.00 C ATOM 1658 CG PHE A 103 -1.255 3.147 6.054 1.00 0.00 C ATOM 1659 CD1 PHE A 103 -0.577 1.940 5.993 1.00 0.00 C ATOM 1660 CD2 PHE A 103 -0.779 4.218 5.315 1.00 0.00 C ATOM 1661 CE1 PHE A 103 0.554 1.804 5.211 1.00 0.00 C ATOM 1662 CE2 PHE A 103 0.353 4.088 4.531 1.00 0.00 C ATOM 1663 CZ PHE A 103 1.019 2.879 4.479 1.00 0.00 C ATOM 0 H PHE A 103 -1.870 1.572 8.577 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.383 4.378 8.399 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -3.053 2.364 6.870 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -3.119 4.072 6.484 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.937 1.096 6.563 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -1.298 5.165 5.352 1.00 0.00 H new ATOM 0 HE1 PHE A 103 1.074 0.858 5.172 1.00 0.00 H new ATOM 0 HE2 PHE A 103 0.716 4.930 3.960 1.00 0.00 H new ATOM 0 HZ PHE A 103 1.902 2.774 3.867 1.00 0.00 H new ATOM 1673 N TYR A 104 -4.407 3.376 9.290 1.00 0.00 N ATOM 1674 CA TYR A 104 -5.644 3.814 9.924 1.00 0.00 C ATOM 1675 C TYR A 104 -5.368 4.416 11.298 1.00 0.00 C ATOM 1676 O TYR A 104 -5.216 3.696 12.284 1.00 0.00 O ATOM 1677 CB TYR A 104 -6.621 2.641 10.052 1.00 0.00 C ATOM 1678 CG TYR A 104 -7.872 2.801 9.218 1.00 0.00 C ATOM 1679 CD1 TYR A 104 -8.831 3.751 9.545 1.00 0.00 C ATOM 1680 CD2 TYR A 104 -8.093 2.003 8.102 1.00 0.00 C ATOM 1681 CE1 TYR A 104 -9.976 3.900 8.786 1.00 0.00 C ATOM 1682 CE2 TYR A 104 -9.236 2.147 7.338 1.00 0.00 C ATOM 1683 CZ TYR A 104 -10.173 3.096 7.683 1.00 0.00 C ATOM 1684 OH TYR A 104 -11.312 3.242 6.925 1.00 0.00 O ATOM 0 H TYR A 104 -4.375 2.380 9.071 1.00 0.00 H new ATOM 0 HA TYR A 104 -6.093 4.583 9.295 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -6.113 1.722 9.758 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -6.904 2.527 11.098 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -8.679 4.384 10.407 1.00 0.00 H new ATOM 0 HD2 TYR A 104 -7.360 1.259 7.827 1.00 0.00 H new ATOM 0 HE1 TYR A 104 -10.713 4.642 9.055 1.00 0.00 H new ATOM 0 HE2 TYR A 104 -9.394 1.518 6.474 1.00 0.00 H new ATOM 0 HH TYR A 104 -11.296 2.601 6.184 1.00 0.00 H new ATOM 1694 N GLY A 105 -5.303 5.743 11.355 1.00 0.00 N ATOM 1695 CA GLY A 105 -5.044 6.420 12.612 1.00 0.00 C ATOM 1696 C GLY A 105 -5.848 7.696 12.761 1.00 0.00 C ATOM 1697 O GLY A 105 -5.359 8.686 13.304 1.00 0.00 O ATOM 0 H GLY A 105 -5.425 6.361 10.553 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -5.279 5.748 13.438 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -3.982 6.653 12.683 1.00 0.00 H new ATOM 1701 N LYS A 106 -7.085 7.674 12.275 1.00 0.00 N ATOM 1702 CA LYS A 106 -7.959 8.839 12.355 1.00 0.00 C ATOM 1703 C LYS A 106 -8.463 9.044 13.780 1.00 0.00 C ATOM 1704 O LYS A 106 -8.591 10.175 14.247 1.00 0.00 O ATOM 1705 CB LYS A 106 -9.144 8.681 11.400 1.00 0.00 C ATOM 1706 CG LYS A 106 -8.790 8.935 9.945 1.00 0.00 C ATOM 1707 CD LYS A 106 -10.008 8.806 9.045 1.00 0.00 C ATOM 1708 CE LYS A 106 -10.606 10.166 8.721 1.00 0.00 C ATOM 1709 NZ LYS A 106 -12.073 10.083 8.476 1.00 0.00 N ATOM 0 H LYS A 106 -7.505 6.862 11.822 1.00 0.00 H new ATOM 0 HA LYS A 106 -7.381 9.716 12.063 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -9.546 7.672 11.497 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -9.935 9.369 11.698 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -8.364 9.933 9.842 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -8.024 8.227 9.627 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -9.727 8.301 8.121 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -10.758 8.184 9.533 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -10.414 10.853 9.545 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -10.114 10.579 7.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -12.443 11.030 8.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -12.255 9.447 7.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -12.546 9.713 9.325 1.00 0.00 H new ATOM 1723 N SER A 107 -8.747 7.942 14.467 1.00 0.00 N ATOM 1724 CA SER A 107 -9.237 8.000 15.838 1.00 0.00 C ATOM 1725 C SER A 107 -8.078 8.055 16.828 1.00 0.00 C ATOM 1726 O SER A 107 -7.304 7.104 16.947 1.00 0.00 O ATOM 1727 CB SER A 107 -10.122 6.789 16.138 1.00 0.00 C ATOM 1728 OG SER A 107 -11.197 6.704 15.220 1.00 0.00 O ATOM 0 H SER A 107 -8.646 6.997 14.095 1.00 0.00 H new ATOM 0 HA SER A 107 -9.828 8.909 15.947 1.00 0.00 H new ATOM 0 HB2 SER A 107 -9.526 5.878 16.090 1.00 0.00 H new ATOM 0 HB3 SER A 107 -10.512 6.862 17.153 1.00 0.00 H new ATOM 0 HG SER A 107 -11.747 5.921 15.432 1.00 0.00 H new ATOM 1734 N GLY A 108 -7.963 9.174 17.537 1.00 0.00 N ATOM 1735 CA GLY A 108 -6.896 9.332 18.507 1.00 0.00 C ATOM 1736 C GLY A 108 -6.154 10.645 18.347 1.00 0.00 C ATOM 1737 O GLY A 108 -6.507 11.640 18.982 1.00 0.00 O ATOM 0 H GLY A 108 -8.590 9.974 17.456 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -7.312 9.274 19.513 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -6.192 8.506 18.405 1.00 0.00 H new ATOM 1741 N PRO A 109 -5.114 10.683 17.497 1.00 0.00 N ATOM 1742 CA PRO A 109 -4.328 11.898 17.264 1.00 0.00 C ATOM 1743 C PRO A 109 -5.113 12.958 16.499 1.00 0.00 C ATOM 1744 O PRO A 109 -5.577 12.718 15.384 1.00 0.00 O ATOM 1745 CB PRO A 109 -3.145 11.402 16.429 1.00 0.00 C ATOM 1746 CG PRO A 109 -3.652 10.181 15.744 1.00 0.00 C ATOM 1747 CD PRO A 109 -4.624 9.544 16.697 1.00 0.00 C ATOM 0 HA PRO A 109 -4.036 12.379 18.197 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -2.824 12.155 15.710 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -2.284 11.175 17.058 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -4.139 10.436 14.803 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -2.835 9.499 15.506 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -5.436 9.045 16.169 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -4.141 8.793 17.321 1.00 0.00 H new ATOM 1755 N SER A 110 -5.258 14.131 17.105 1.00 0.00 N ATOM 1756 CA SER A 110 -5.988 15.229 16.481 1.00 0.00 C ATOM 1757 C SER A 110 -5.189 15.827 15.328 1.00 0.00 C ATOM 1758 O SER A 110 -5.759 16.309 14.348 1.00 0.00 O ATOM 1759 CB SER A 110 -6.303 16.313 17.514 1.00 0.00 C ATOM 1760 OG SER A 110 -5.219 16.497 18.408 1.00 0.00 O ATOM 0 H SER A 110 -4.880 14.346 18.028 1.00 0.00 H new ATOM 0 HA SER A 110 -6.923 14.832 16.085 1.00 0.00 H new ATOM 0 HB2 SER A 110 -6.522 17.252 17.005 1.00 0.00 H new ATOM 0 HB3 SER A 110 -7.197 16.038 18.073 1.00 0.00 H new ATOM 0 HG SER A 110 -5.445 17.196 19.057 1.00 0.00 H new ATOM 1766 N SER A 111 -3.867 15.793 15.450 1.00 0.00 N ATOM 1767 CA SER A 111 -2.988 16.331 14.418 1.00 0.00 C ATOM 1768 C SER A 111 -1.965 15.290 13.977 1.00 0.00 C ATOM 1769 O SER A 111 -1.078 14.914 14.743 1.00 0.00 O ATOM 1770 CB SER A 111 -2.273 17.583 14.929 1.00 0.00 C ATOM 1771 OG SER A 111 -3.197 18.524 15.445 1.00 0.00 O ATOM 0 H SER A 111 -3.380 15.398 16.254 1.00 0.00 H new ATOM 0 HA SER A 111 -3.601 16.598 13.557 1.00 0.00 H new ATOM 0 HB2 SER A 111 -1.559 17.307 15.705 1.00 0.00 H new ATOM 0 HB3 SER A 111 -1.703 18.036 14.118 1.00 0.00 H new ATOM 0 HG SER A 111 -2.714 19.314 15.767 1.00 0.00 H new ATOM 1777 N GLY A 112 -2.093 14.828 12.738 1.00 0.00 N ATOM 1778 CA GLY A 112 -1.173 13.835 12.216 1.00 0.00 C ATOM 1779 C GLY A 112 -1.795 12.981 11.130 1.00 0.00 C ATOM 1780 O GLY A 112 -1.079 12.132 10.559 1.00 0.00 O ATOM 1781 OXT GLY A 112 -2.999 13.160 10.850 1.00 0.00 O ATOM 0 H GLY A 112 -2.819 15.124 12.085 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -0.290 14.336 11.819 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -0.836 13.193 13.030 1.00 0.00 H new TER 1785 GLY A 112