USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 757 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 56 GLN : amide:sc= 0 X(o=0,f=0.15) USER MOD Set 1.2: A 61 CYS SG : rot 180:sc= 0 USER MOD Set 2.1: A 53 SER OG : rot 115:sc= 0.201 USER MOD Set 2.2: A 66 HIS : no HE2:sc= 0.0143 X(o=0.22,f=-0.074) USER MOD Set 3.1: A 51 LYS NZ :NH3+ -130:sc= 0.142 (180deg=0) USER MOD Set 3.2: A 52 TYR OH : rot 180:sc= 0.137 USER MOD Set 4.1: A 32 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 33 LYS NZ :NH3+ -155:sc= -1.43 (180deg=-2.99!) USER MOD Set 5.1: A 29 CYS SG : rot -105:sc= -1.29 USER MOD Set 5.2: A 78 CYS SG : rot 92:sc= 0.974 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= -0.138 X(o=-0.14,f=-0.22) USER MOD Single : A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot -19:sc= 0.592 USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 LYS NZ :NH3+ 164:sc= -0.886 (180deg=-1.31!) USER MOD Single : A 64 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 MET CE :methyl -125:sc= -1.03 (180deg=-2.69) USER MOD Single : A 73 ASN : amide:sc= -0.0934 X(o=-0.093,f=-0.48) USER MOD Single : A 76 TYR OH : rot 51:sc= 0.0746 USER MOD Single : A 77 SER OG : rot 180:sc= -0.957 USER MOD Single : A 80 CYS SG : rot 160:sc= -1.52 USER MOD Single : A 82 GLN : amide:sc= 0.0374 X(o=0.037,f=0) USER MOD Single : A 85 THR OG1 : rot 110:sc= 0.36 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= -0.0769 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 16.966 29.844 -14.115 1.00 0.00 N ATOM 2 CA GLY A 1 17.414 28.591 -14.694 1.00 0.00 C ATOM 3 C GLY A 1 17.809 27.574 -13.641 1.00 0.00 C ATOM 4 O GLY A 1 18.886 26.984 -13.712 1.00 0.00 O ATOM 0 H1 GLY A 1 16.708 30.505 -14.875 1.00 0.00 H new ATOM 0 H2 GLY A 1 16.138 29.671 -13.511 1.00 0.00 H new ATOM 0 H3 GLY A 1 17.731 30.256 -13.544 1.00 0.00 H new ATOM 0 HA2 GLY A 1 16.620 28.177 -15.315 1.00 0.00 H new ATOM 0 HA3 GLY A 1 18.265 28.780 -15.349 1.00 0.00 H new ATOM 8 N SER A 2 16.935 27.371 -12.660 1.00 0.00 N ATOM 9 CA SER A 2 17.201 26.423 -11.584 1.00 0.00 C ATOM 10 C SER A 2 16.042 25.444 -11.425 1.00 0.00 C ATOM 11 O SER A 2 14.966 25.641 -11.989 1.00 0.00 O ATOM 12 CB SER A 2 17.441 27.166 -10.269 1.00 0.00 C ATOM 13 OG SER A 2 18.177 26.367 -9.359 1.00 0.00 O ATOM 0 H SER A 2 16.037 27.850 -12.588 1.00 0.00 H new ATOM 0 HA SER A 2 18.097 25.859 -11.842 1.00 0.00 H new ATOM 0 HB2 SER A 2 17.982 28.092 -10.464 1.00 0.00 H new ATOM 0 HB3 SER A 2 16.485 27.443 -9.824 1.00 0.00 H new ATOM 0 HG SER A 2 18.319 26.865 -8.527 1.00 0.00 H new ATOM 19 N SER A 3 16.270 24.387 -10.651 1.00 0.00 N ATOM 20 CA SER A 3 15.247 23.374 -10.419 1.00 0.00 C ATOM 21 C SER A 3 14.880 23.301 -8.940 1.00 0.00 C ATOM 22 O SER A 3 15.590 23.831 -8.086 1.00 0.00 O ATOM 23 CB SER A 3 15.734 22.007 -10.903 1.00 0.00 C ATOM 24 OG SER A 3 16.650 21.437 -9.984 1.00 0.00 O ATOM 0 H SER A 3 17.154 24.210 -10.174 1.00 0.00 H new ATOM 0 HA SER A 3 14.358 23.656 -10.983 1.00 0.00 H new ATOM 0 HB2 SER A 3 14.882 21.339 -11.034 1.00 0.00 H new ATOM 0 HB3 SER A 3 16.210 22.111 -11.878 1.00 0.00 H new ATOM 0 HG SER A 3 16.945 20.563 -10.315 1.00 0.00 H new ATOM 30 N GLY A 4 13.765 22.640 -8.645 1.00 0.00 N ATOM 31 CA GLY A 4 13.321 22.510 -7.270 1.00 0.00 C ATOM 32 C GLY A 4 13.948 21.321 -6.569 1.00 0.00 C ATOM 33 O GLY A 4 13.541 20.179 -6.785 1.00 0.00 O ATOM 0 H GLY A 4 13.161 22.192 -9.334 1.00 0.00 H new ATOM 0 HA2 GLY A 4 13.567 23.421 -6.724 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.236 22.409 -7.250 1.00 0.00 H new ATOM 37 N SER A 5 14.942 21.588 -5.729 1.00 0.00 N ATOM 38 CA SER A 5 15.631 20.530 -4.998 1.00 0.00 C ATOM 39 C SER A 5 14.648 19.728 -4.150 1.00 0.00 C ATOM 40 O SER A 5 14.549 18.508 -4.282 1.00 0.00 O ATOM 41 CB SER A 5 16.724 21.124 -4.108 1.00 0.00 C ATOM 42 OG SER A 5 17.779 21.663 -4.886 1.00 0.00 O ATOM 0 H SER A 5 15.289 22.528 -5.537 1.00 0.00 H new ATOM 0 HA SER A 5 16.090 19.859 -5.724 1.00 0.00 H new ATOM 0 HB2 SER A 5 16.299 21.904 -3.476 1.00 0.00 H new ATOM 0 HB3 SER A 5 17.115 20.353 -3.444 1.00 0.00 H new ATOM 0 HG SER A 5 18.464 22.038 -4.294 1.00 0.00 H new ATOM 48 N SER A 6 13.924 20.423 -3.278 1.00 0.00 N ATOM 49 CA SER A 6 12.952 19.777 -2.405 1.00 0.00 C ATOM 50 C SER A 6 11.645 19.514 -3.147 1.00 0.00 C ATOM 51 O SER A 6 10.922 20.444 -3.502 1.00 0.00 O ATOM 52 CB SER A 6 12.686 20.643 -1.172 1.00 0.00 C ATOM 53 OG SER A 6 11.746 20.028 -0.309 1.00 0.00 O ATOM 0 H SER A 6 13.993 21.434 -3.158 1.00 0.00 H new ATOM 0 HA SER A 6 13.367 18.821 -2.086 1.00 0.00 H new ATOM 0 HB2 SER A 6 13.619 20.813 -0.636 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.314 21.619 -1.483 1.00 0.00 H new ATOM 0 HG SER A 6 11.595 20.601 0.472 1.00 0.00 H new ATOM 59 N GLY A 7 11.349 18.239 -3.378 1.00 0.00 N ATOM 60 CA GLY A 7 10.130 17.875 -4.076 1.00 0.00 C ATOM 61 C GLY A 7 9.046 17.387 -3.136 1.00 0.00 C ATOM 62 O GLY A 7 8.674 18.083 -2.192 1.00 0.00 O ATOM 0 H GLY A 7 11.932 17.451 -3.094 1.00 0.00 H new ATOM 0 HA2 GLY A 7 9.763 18.737 -4.632 1.00 0.00 H new ATOM 0 HA3 GLY A 7 10.352 17.096 -4.805 1.00 0.00 H new ATOM 66 N ALA A 8 8.537 16.187 -3.395 1.00 0.00 N ATOM 67 CA ALA A 8 7.490 15.605 -2.564 1.00 0.00 C ATOM 68 C ALA A 8 8.081 14.693 -1.494 1.00 0.00 C ATOM 69 O ALA A 8 8.772 13.723 -1.805 1.00 0.00 O ATOM 70 CB ALA A 8 6.497 14.839 -3.425 1.00 0.00 C ATOM 0 H ALA A 8 8.833 15.599 -4.174 1.00 0.00 H new ATOM 0 HA ALA A 8 6.966 16.418 -2.061 1.00 0.00 H new ATOM 0 HB1 ALA A 8 5.721 14.410 -2.791 1.00 0.00 H new ATOM 0 HB2 ALA A 8 6.042 15.517 -4.147 1.00 0.00 H new ATOM 0 HB3 ALA A 8 7.015 14.040 -3.955 1.00 0.00 H new ATOM 76 N ARG A 9 7.805 15.011 -0.234 1.00 0.00 N ATOM 77 CA ARG A 9 8.311 14.220 0.882 1.00 0.00 C ATOM 78 C ARG A 9 7.165 13.572 1.653 1.00 0.00 C ATOM 79 O ARG A 9 6.171 14.224 1.973 1.00 0.00 O ATOM 80 CB ARG A 9 9.140 15.097 1.822 1.00 0.00 C ATOM 81 CG ARG A 9 8.301 16.004 2.707 1.00 0.00 C ATOM 82 CD ARG A 9 9.129 17.142 3.283 1.00 0.00 C ATOM 83 NE ARG A 9 9.936 16.710 4.421 1.00 0.00 N ATOM 84 CZ ARG A 9 10.814 17.493 5.039 1.00 0.00 C ATOM 85 NH1 ARG A 9 10.997 18.741 4.630 1.00 0.00 N ATOM 86 NH2 ARG A 9 11.510 17.028 6.067 1.00 0.00 N ATOM 0 H ARG A 9 7.234 15.811 0.040 1.00 0.00 H new ATOM 0 HA ARG A 9 8.946 13.432 0.477 1.00 0.00 H new ATOM 0 HB2 ARG A 9 9.756 14.457 2.453 1.00 0.00 H new ATOM 0 HB3 ARG A 9 9.819 15.709 1.229 1.00 0.00 H new ATOM 0 HG2 ARG A 9 7.472 16.412 2.129 1.00 0.00 H new ATOM 0 HG3 ARG A 9 7.867 15.421 3.519 1.00 0.00 H new ATOM 0 HD2 ARG A 9 9.781 17.544 2.508 1.00 0.00 H new ATOM 0 HD3 ARG A 9 8.467 17.951 3.594 1.00 0.00 H new ATOM 0 HE ARG A 9 9.819 15.755 4.760 1.00 0.00 H new ATOM 0 HH11 ARG A 9 10.463 19.102 3.839 1.00 0.00 H new ATOM 0 HH12 ARG A 9 11.672 19.340 5.106 1.00 0.00 H new ATOM 0 HH21 ARG A 9 11.372 16.068 6.384 1.00 0.00 H new ATOM 0 HH22 ARG A 9 12.184 17.630 6.541 1.00 0.00 H new ATOM 100 N PHE A 10 7.311 12.284 1.947 1.00 0.00 N ATOM 101 CA PHE A 10 6.288 11.547 2.679 1.00 0.00 C ATOM 102 C PHE A 10 6.105 12.118 4.083 1.00 0.00 C ATOM 103 O PHE A 10 6.952 11.933 4.957 1.00 0.00 O ATOM 104 CB PHE A 10 6.659 10.065 2.764 1.00 0.00 C ATOM 105 CG PHE A 10 6.345 9.295 1.513 1.00 0.00 C ATOM 106 CD1 PHE A 10 7.245 9.262 0.460 1.00 0.00 C ATOM 107 CD2 PHE A 10 5.150 8.606 1.390 1.00 0.00 C ATOM 108 CE1 PHE A 10 6.960 8.555 -0.692 1.00 0.00 C ATOM 109 CE2 PHE A 10 4.859 7.897 0.240 1.00 0.00 C ATOM 110 CZ PHE A 10 5.764 7.872 -0.803 1.00 0.00 C ATOM 0 H PHE A 10 8.128 11.730 1.690 1.00 0.00 H new ATOM 0 HA PHE A 10 5.347 11.649 2.139 1.00 0.00 H new ATOM 0 HB2 PHE A 10 7.724 9.977 2.977 1.00 0.00 H new ATOM 0 HB3 PHE A 10 6.128 9.613 3.602 1.00 0.00 H new ATOM 0 HD1 PHE A 10 8.181 9.795 0.541 1.00 0.00 H new ATOM 0 HD2 PHE A 10 4.438 8.623 2.202 1.00 0.00 H new ATOM 0 HE1 PHE A 10 7.671 8.536 -1.505 1.00 0.00 H new ATOM 0 HE2 PHE A 10 3.924 7.363 0.157 1.00 0.00 H new ATOM 0 HZ PHE A 10 5.537 7.320 -1.703 1.00 0.00 H new ATOM 120 N THR A 11 4.991 12.814 4.291 1.00 0.00 N ATOM 121 CA THR A 11 4.697 13.414 5.586 1.00 0.00 C ATOM 122 C THR A 11 3.872 12.471 6.454 1.00 0.00 C ATOM 123 O THR A 11 3.867 12.586 7.679 1.00 0.00 O ATOM 124 CB THR A 11 3.937 14.745 5.429 1.00 0.00 C ATOM 125 OG1 THR A 11 3.665 15.309 6.716 1.00 0.00 O ATOM 126 CG2 THR A 11 2.632 14.537 4.675 1.00 0.00 C ATOM 0 H THR A 11 4.278 12.976 3.579 1.00 0.00 H new ATOM 0 HA THR A 11 5.655 13.605 6.070 1.00 0.00 H new ATOM 0 HB THR A 11 4.563 15.430 4.858 1.00 0.00 H new ATOM 0 HG1 THR A 11 3.183 16.155 6.607 1.00 0.00 H new ATOM 0 HG21 THR A 11 2.113 15.490 4.576 1.00 0.00 H new ATOM 0 HG22 THR A 11 2.844 14.135 3.684 1.00 0.00 H new ATOM 0 HG23 THR A 11 2.003 13.836 5.223 1.00 0.00 H new ATOM 134 N GLU A 12 3.177 11.538 5.811 1.00 0.00 N ATOM 135 CA GLU A 12 2.348 10.575 6.527 1.00 0.00 C ATOM 136 C GLU A 12 2.930 9.168 6.416 1.00 0.00 C ATOM 137 O GLU A 12 2.848 8.375 7.353 1.00 0.00 O ATOM 138 CB GLU A 12 0.919 10.592 5.980 1.00 0.00 C ATOM 139 CG GLU A 12 0.037 9.494 6.549 1.00 0.00 C ATOM 140 CD GLU A 12 -0.597 9.880 7.871 1.00 0.00 C ATOM 141 OE1 GLU A 12 0.060 9.698 8.918 1.00 0.00 O ATOM 142 OE2 GLU A 12 -1.748 10.364 7.860 1.00 0.00 O ATOM 0 H GLU A 12 3.171 11.428 4.797 1.00 0.00 H new ATOM 0 HA GLU A 12 2.330 10.861 7.579 1.00 0.00 H new ATOM 0 HB2 GLU A 12 0.467 11.559 6.198 1.00 0.00 H new ATOM 0 HB3 GLU A 12 0.953 10.494 4.895 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -0.747 9.254 5.831 1.00 0.00 H new ATOM 0 HG3 GLU A 12 0.631 8.590 6.686 1.00 0.00 H new ATOM 149 N GLY A 13 3.517 8.866 5.262 1.00 0.00 N ATOM 150 CA GLY A 13 4.103 7.556 5.048 1.00 0.00 C ATOM 151 C GLY A 13 3.073 6.445 5.096 1.00 0.00 C ATOM 152 O GLY A 13 1.869 6.705 5.114 1.00 0.00 O ATOM 0 H GLY A 13 3.597 9.505 4.471 1.00 0.00 H new ATOM 0 HA2 GLY A 13 4.605 7.540 4.081 1.00 0.00 H new ATOM 0 HA3 GLY A 13 4.865 7.374 5.806 1.00 0.00 H new ATOM 156 N LEU A 14 3.545 5.203 5.117 1.00 0.00 N ATOM 157 CA LEU A 14 2.655 4.048 5.162 1.00 0.00 C ATOM 158 C LEU A 14 2.585 3.469 6.571 1.00 0.00 C ATOM 159 O LEU A 14 3.455 3.727 7.403 1.00 0.00 O ATOM 160 CB LEU A 14 3.132 2.975 4.180 1.00 0.00 C ATOM 161 CG LEU A 14 2.802 3.219 2.707 1.00 0.00 C ATOM 162 CD1 LEU A 14 3.769 2.460 1.811 1.00 0.00 C ATOM 163 CD2 LEU A 14 1.366 2.815 2.408 1.00 0.00 C ATOM 0 H LEU A 14 4.538 4.970 5.104 1.00 0.00 H new ATOM 0 HA LEU A 14 1.656 4.377 4.875 1.00 0.00 H new ATOM 0 HB2 LEU A 14 4.213 2.876 4.278 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.697 2.021 4.476 1.00 0.00 H new ATOM 0 HG LEU A 14 2.908 4.284 2.502 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.519 2.645 0.766 1.00 0.00 H new ATOM 0 HD12 LEU A 14 4.787 2.798 2.006 1.00 0.00 H new ATOM 0 HD13 LEU A 14 3.695 1.392 2.018 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.149 2.996 1.355 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.232 1.756 2.630 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.687 3.403 3.025 1.00 0.00 H new ATOM 175 N ARG A 15 1.545 2.684 6.831 1.00 0.00 N ATOM 176 CA ARG A 15 1.362 2.067 8.140 1.00 0.00 C ATOM 177 C ARG A 15 1.377 0.545 8.031 1.00 0.00 C ATOM 178 O ARG A 15 1.462 -0.007 6.935 1.00 0.00 O ATOM 179 CB ARG A 15 0.045 2.531 8.766 1.00 0.00 C ATOM 180 CG ARG A 15 -1.183 1.881 8.151 1.00 0.00 C ATOM 181 CD ARG A 15 -2.424 2.738 8.348 1.00 0.00 C ATOM 182 NE ARG A 15 -2.263 4.074 7.780 1.00 0.00 N ATOM 183 CZ ARG A 15 -3.206 5.008 7.819 1.00 0.00 C ATOM 184 NH1 ARG A 15 -4.373 4.753 8.395 1.00 0.00 N ATOM 185 NH2 ARG A 15 -2.984 6.200 7.280 1.00 0.00 N ATOM 0 H ARG A 15 0.816 2.460 6.153 1.00 0.00 H new ATOM 0 HA ARG A 15 2.189 2.376 8.779 1.00 0.00 H new ATOM 0 HB2 ARG A 15 0.064 2.315 9.834 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -0.036 3.613 8.661 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -1.016 1.720 7.086 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -1.341 0.901 8.601 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -3.280 2.248 7.884 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -2.642 2.821 9.413 1.00 0.00 H new ATOM 0 HE ARG A 15 -1.377 4.302 7.328 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -4.548 3.838 8.809 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -5.096 5.472 8.424 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -2.088 6.400 6.835 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -3.709 6.917 7.311 1.00 0.00 H new ATOM 199 N ASN A 16 1.296 -0.126 9.175 1.00 0.00 N ATOM 200 CA ASN A 16 1.301 -1.584 9.208 1.00 0.00 C ATOM 201 C ASN A 16 -0.042 -2.144 8.750 1.00 0.00 C ATOM 202 O ASN A 16 -1.096 -1.702 9.205 1.00 0.00 O ATOM 203 CB ASN A 16 1.619 -2.081 10.620 1.00 0.00 C ATOM 204 CG ASN A 16 2.674 -1.236 11.307 1.00 0.00 C ATOM 205 OD1 ASN A 16 2.354 -0.336 12.085 1.00 0.00 O ATOM 206 ND2 ASN A 16 3.939 -1.521 11.022 1.00 0.00 N ATOM 0 H ASN A 16 1.226 0.316 10.091 1.00 0.00 H new ATOM 0 HA ASN A 16 2.073 -1.935 8.523 1.00 0.00 H new ATOM 0 HB2 ASN A 16 0.708 -2.076 11.218 1.00 0.00 H new ATOM 0 HB3 ASN A 16 1.961 -3.115 10.570 1.00 0.00 H new ATOM 0 HD21 ASN A 16 4.692 -0.985 11.454 1.00 0.00 H new ATOM 0 HD22 ASN A 16 4.158 -2.276 10.371 1.00 0.00 H new ATOM 213 N GLU A 17 0.006 -3.118 7.847 1.00 0.00 N ATOM 214 CA GLU A 17 -1.207 -3.738 7.328 1.00 0.00 C ATOM 215 C GLU A 17 -1.228 -5.233 7.632 1.00 0.00 C ATOM 216 O GLU A 17 -0.188 -5.838 7.892 1.00 0.00 O ATOM 217 CB GLU A 17 -1.316 -3.512 5.818 1.00 0.00 C ATOM 218 CG GLU A 17 -2.747 -3.464 5.311 1.00 0.00 C ATOM 219 CD GLU A 17 -3.601 -2.465 6.068 1.00 0.00 C ATOM 220 OE1 GLU A 17 -4.185 -2.848 7.103 1.00 0.00 O ATOM 221 OE2 GLU A 17 -3.686 -1.301 5.625 1.00 0.00 O ATOM 0 H GLU A 17 0.871 -3.495 7.460 1.00 0.00 H new ATOM 0 HA GLU A 17 -2.061 -3.273 7.821 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -0.817 -2.577 5.562 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -0.783 -4.309 5.300 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -2.745 -3.206 4.252 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -3.192 -4.455 5.396 1.00 0.00 H new ATOM 228 N GLU A 18 -2.419 -5.822 7.599 1.00 0.00 N ATOM 229 CA GLU A 18 -2.575 -7.246 7.872 1.00 0.00 C ATOM 230 C GLU A 18 -3.918 -7.755 7.356 1.00 0.00 C ATOM 231 O GLU A 18 -4.962 -7.157 7.615 1.00 0.00 O ATOM 232 CB GLU A 18 -2.458 -7.515 9.374 1.00 0.00 C ATOM 233 CG GLU A 18 -2.804 -8.942 9.765 1.00 0.00 C ATOM 234 CD GLU A 18 -4.282 -9.127 10.050 1.00 0.00 C ATOM 235 OE1 GLU A 18 -4.841 -8.325 10.827 1.00 0.00 O ATOM 236 OE2 GLU A 18 -4.879 -10.073 9.496 1.00 0.00 O ATOM 0 H GLU A 18 -3.290 -5.335 7.386 1.00 0.00 H new ATOM 0 HA GLU A 18 -1.780 -7.779 7.351 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.440 -7.296 9.696 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.116 -6.831 9.910 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.505 -9.617 8.963 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.230 -9.222 10.648 1.00 0.00 H new ATOM 243 N ALA A 19 -3.882 -8.864 6.624 1.00 0.00 N ATOM 244 CA ALA A 19 -5.094 -9.455 6.073 1.00 0.00 C ATOM 245 C ALA A 19 -4.978 -10.973 5.993 1.00 0.00 C ATOM 246 O ALA A 19 -3.935 -11.543 6.312 1.00 0.00 O ATOM 247 CB ALA A 19 -5.387 -8.873 4.698 1.00 0.00 C ATOM 0 H ALA A 19 -3.026 -9.371 6.399 1.00 0.00 H new ATOM 0 HA ALA A 19 -5.921 -9.215 6.741 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -6.295 -9.324 4.298 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -5.523 -7.795 4.781 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -4.553 -9.083 4.029 1.00 0.00 H new ATOM 253 N MET A 20 -6.055 -11.623 5.565 1.00 0.00 N ATOM 254 CA MET A 20 -6.072 -13.076 5.443 1.00 0.00 C ATOM 255 C MET A 20 -5.770 -13.505 4.011 1.00 0.00 C ATOM 256 O MET A 20 -5.744 -12.679 3.099 1.00 0.00 O ATOM 257 CB MET A 20 -7.431 -13.630 5.877 1.00 0.00 C ATOM 258 CG MET A 20 -7.528 -13.900 7.370 1.00 0.00 C ATOM 259 SD MET A 20 -8.677 -15.233 7.762 1.00 0.00 S ATOM 260 CE MET A 20 -7.541 -16.588 8.043 1.00 0.00 C ATOM 0 H MET A 20 -6.927 -11.167 5.297 1.00 0.00 H new ATOM 0 HA MET A 20 -5.298 -13.479 6.096 1.00 0.00 H new ATOM 0 HB2 MET A 20 -8.210 -12.923 5.593 1.00 0.00 H new ATOM 0 HB3 MET A 20 -7.627 -14.555 5.335 1.00 0.00 H new ATOM 0 HG2 MET A 20 -6.540 -14.153 7.754 1.00 0.00 H new ATOM 0 HG3 MET A 20 -7.845 -12.990 7.880 1.00 0.00 H new ATOM 0 HE1 MET A 20 -8.103 -17.487 8.297 1.00 0.00 H new ATOM 0 HE2 MET A 20 -6.958 -16.767 7.140 1.00 0.00 H new ATOM 0 HE3 MET A 20 -6.870 -16.336 8.864 1.00 0.00 H new ATOM 270 N GLU A 21 -5.541 -14.801 3.821 1.00 0.00 N ATOM 271 CA GLU A 21 -5.239 -15.337 2.499 1.00 0.00 C ATOM 272 C GLU A 21 -6.478 -15.317 1.608 1.00 0.00 C ATOM 273 O GLU A 21 -7.556 -15.749 2.015 1.00 0.00 O ATOM 274 CB GLU A 21 -4.704 -16.766 2.614 1.00 0.00 C ATOM 275 CG GLU A 21 -4.494 -17.448 1.273 1.00 0.00 C ATOM 276 CD GLU A 21 -4.424 -18.958 1.390 1.00 0.00 C ATOM 277 OE1 GLU A 21 -5.493 -19.594 1.497 1.00 0.00 O ATOM 278 OE2 GLU A 21 -3.301 -19.503 1.375 1.00 0.00 O ATOM 0 H GLU A 21 -5.559 -15.498 4.565 1.00 0.00 H new ATOM 0 HA GLU A 21 -4.475 -14.706 2.045 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -3.758 -16.748 3.155 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -5.400 -17.358 3.208 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -5.308 -17.177 0.601 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -3.572 -17.079 0.823 1.00 0.00 H new ATOM 285 N GLY A 22 -6.315 -14.811 0.389 1.00 0.00 N ATOM 286 CA GLY A 22 -7.427 -14.743 -0.541 1.00 0.00 C ATOM 287 C GLY A 22 -8.177 -13.429 -0.451 1.00 0.00 C ATOM 288 O GLY A 22 -9.010 -13.123 -1.304 1.00 0.00 O ATOM 0 H GLY A 22 -5.433 -14.447 0.029 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -7.056 -14.877 -1.557 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -8.115 -15.565 -0.341 1.00 0.00 H new ATOM 292 N ALA A 23 -7.883 -12.651 0.585 1.00 0.00 N ATOM 293 CA ALA A 23 -8.536 -11.362 0.782 1.00 0.00 C ATOM 294 C ALA A 23 -7.907 -10.288 -0.098 1.00 0.00 C ATOM 295 O ALA A 23 -6.939 -10.545 -0.814 1.00 0.00 O ATOM 296 CB ALA A 23 -8.468 -10.955 2.246 1.00 0.00 C ATOM 0 H ALA A 23 -7.197 -12.890 1.301 1.00 0.00 H new ATOM 0 HA ALA A 23 -9.582 -11.464 0.493 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -8.959 -9.991 2.379 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -8.971 -11.706 2.856 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -7.425 -10.876 2.554 1.00 0.00 H new ATOM 302 N THR A 24 -8.464 -9.082 -0.042 1.00 0.00 N ATOM 303 CA THR A 24 -7.959 -7.969 -0.835 1.00 0.00 C ATOM 304 C THR A 24 -7.369 -6.882 0.056 1.00 0.00 C ATOM 305 O THR A 24 -8.099 -6.110 0.676 1.00 0.00 O ATOM 306 CB THR A 24 -9.068 -7.353 -1.710 1.00 0.00 C ATOM 307 OG1 THR A 24 -9.682 -8.370 -2.510 1.00 0.00 O ATOM 308 CG2 THR A 24 -8.505 -6.264 -2.610 1.00 0.00 C ATOM 0 H THR A 24 -9.266 -8.852 0.545 1.00 0.00 H new ATOM 0 HA THR A 24 -7.178 -8.370 -1.480 1.00 0.00 H new ATOM 0 HB THR A 24 -9.815 -6.908 -1.052 1.00 0.00 H new ATOM 0 HG1 THR A 24 -10.387 -7.971 -3.062 1.00 0.00 H new ATOM 0 HG21 THR A 24 -9.306 -5.844 -3.218 1.00 0.00 H new ATOM 0 HG22 THR A 24 -8.064 -5.478 -1.997 1.00 0.00 H new ATOM 0 HG23 THR A 24 -7.740 -6.689 -3.260 1.00 0.00 H new ATOM 316 N ALA A 25 -6.042 -6.827 0.114 1.00 0.00 N ATOM 317 CA ALA A 25 -5.354 -5.832 0.928 1.00 0.00 C ATOM 318 C ALA A 25 -5.623 -4.422 0.414 1.00 0.00 C ATOM 319 O ALA A 25 -6.153 -4.239 -0.682 1.00 0.00 O ATOM 320 CB ALA A 25 -3.858 -6.112 0.949 1.00 0.00 C ATOM 0 H ALA A 25 -5.422 -7.459 -0.393 1.00 0.00 H new ATOM 0 HA ALA A 25 -5.740 -5.899 1.945 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -3.356 -5.362 1.560 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -3.679 -7.102 1.369 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -3.466 -6.073 -0.067 1.00 0.00 H new ATOM 326 N THR A 26 -5.255 -3.425 1.214 1.00 0.00 N ATOM 327 CA THR A 26 -5.458 -2.031 0.841 1.00 0.00 C ATOM 328 C THR A 26 -4.559 -1.108 1.655 1.00 0.00 C ATOM 329 O THR A 26 -4.722 -0.977 2.869 1.00 0.00 O ATOM 330 CB THR A 26 -6.925 -1.605 1.039 1.00 0.00 C ATOM 331 OG1 THR A 26 -7.791 -2.465 0.288 1.00 0.00 O ATOM 332 CG2 THR A 26 -7.133 -0.162 0.604 1.00 0.00 C ATOM 0 H THR A 26 -4.815 -3.558 2.124 1.00 0.00 H new ATOM 0 HA THR A 26 -5.201 -1.945 -0.215 1.00 0.00 H new ATOM 0 HB THR A 26 -7.164 -1.686 2.099 1.00 0.00 H new ATOM 0 HG1 THR A 26 -7.275 -2.920 -0.410 1.00 0.00 H new ATOM 0 HG21 THR A 26 -8.176 0.116 0.753 1.00 0.00 H new ATOM 0 HG22 THR A 26 -6.495 0.493 1.197 1.00 0.00 H new ATOM 0 HG23 THR A 26 -6.877 -0.059 -0.451 1.00 0.00 H new ATOM 340 N LEU A 27 -3.610 -0.468 0.980 1.00 0.00 N ATOM 341 CA LEU A 27 -2.684 0.445 1.641 1.00 0.00 C ATOM 342 C LEU A 27 -3.111 1.895 1.437 1.00 0.00 C ATOM 343 O LEU A 27 -4.008 2.182 0.644 1.00 0.00 O ATOM 344 CB LEU A 27 -1.266 0.239 1.107 1.00 0.00 C ATOM 345 CG LEU A 27 -0.566 -1.049 1.540 1.00 0.00 C ATOM 346 CD1 LEU A 27 0.521 -1.427 0.546 1.00 0.00 C ATOM 347 CD2 LEU A 27 0.018 -0.895 2.937 1.00 0.00 C ATOM 0 H LEU A 27 -3.462 -0.565 -0.025 1.00 0.00 H new ATOM 0 HA LEU A 27 -2.698 0.228 2.709 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -1.303 0.260 0.018 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -0.654 1.085 1.422 1.00 0.00 H new ATOM 0 HG LEU A 27 -1.304 -1.850 1.562 1.00 0.00 H new ATOM 0 HD11 LEU A 27 1.008 -2.346 0.871 1.00 0.00 H new ATOM 0 HD12 LEU A 27 0.077 -1.580 -0.438 1.00 0.00 H new ATOM 0 HD13 LEU A 27 1.258 -0.626 0.491 1.00 0.00 H new ATOM 0 HD21 LEU A 27 0.512 -1.822 3.229 1.00 0.00 H new ATOM 0 HD22 LEU A 27 0.742 -0.080 2.941 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -0.782 -0.673 3.643 1.00 0.00 H new ATOM 359 N GLN A 28 -2.461 2.804 2.156 1.00 0.00 N ATOM 360 CA GLN A 28 -2.773 4.225 2.052 1.00 0.00 C ATOM 361 C GLN A 28 -1.618 5.075 2.570 1.00 0.00 C ATOM 362 O GLN A 28 -0.921 4.688 3.509 1.00 0.00 O ATOM 363 CB GLN A 28 -4.049 4.547 2.833 1.00 0.00 C ATOM 364 CG GLN A 28 -5.318 4.409 2.009 1.00 0.00 C ATOM 365 CD GLN A 28 -6.501 5.121 2.634 1.00 0.00 C ATOM 366 OE1 GLN A 28 -7.129 4.609 3.561 1.00 0.00 O ATOM 367 NE2 GLN A 28 -6.811 6.310 2.130 1.00 0.00 N ATOM 0 H GLN A 28 -1.716 2.583 2.816 1.00 0.00 H new ATOM 0 HA GLN A 28 -2.930 4.461 0.999 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -4.113 3.885 3.697 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -3.983 5.565 3.216 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -5.144 4.810 1.011 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -5.556 3.352 1.891 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -6.263 6.697 1.361 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -7.597 6.837 2.512 1.00 0.00 H new ATOM 376 N CYS A 29 -1.420 6.235 1.953 1.00 0.00 N ATOM 377 CA CYS A 29 -0.348 7.140 2.350 1.00 0.00 C ATOM 378 C CYS A 29 -0.610 8.552 1.838 1.00 0.00 C ATOM 379 O CYS A 29 -1.211 8.737 0.781 1.00 0.00 O ATOM 380 CB CYS A 29 0.996 6.635 1.823 1.00 0.00 C ATOM 381 SG CYS A 29 1.051 6.420 0.028 1.00 0.00 S ATOM 0 H CYS A 29 -1.988 6.571 1.175 1.00 0.00 H new ATOM 0 HA CYS A 29 -0.316 7.168 3.439 1.00 0.00 H new ATOM 0 HB2 CYS A 29 1.777 7.336 2.118 1.00 0.00 H new ATOM 0 HB3 CYS A 29 1.226 5.682 2.300 1.00 0.00 H new ATOM 0 HG CYS A 29 1.002 5.153 -0.259 1.00 0.00 H new ATOM 387 N GLU A 30 -0.157 9.545 2.598 1.00 0.00 N ATOM 388 CA GLU A 30 -0.346 10.941 2.221 1.00 0.00 C ATOM 389 C GLU A 30 0.995 11.621 1.960 1.00 0.00 C ATOM 390 O GLU A 30 1.940 11.474 2.737 1.00 0.00 O ATOM 391 CB GLU A 30 -1.105 11.690 3.319 1.00 0.00 C ATOM 392 CG GLU A 30 -1.850 12.916 2.816 1.00 0.00 C ATOM 393 CD GLU A 30 -2.455 13.732 3.941 1.00 0.00 C ATOM 394 OE1 GLU A 30 -1.693 14.423 4.649 1.00 0.00 O ATOM 395 OE2 GLU A 30 -3.691 13.681 4.114 1.00 0.00 O ATOM 0 H GLU A 30 0.343 9.409 3.477 1.00 0.00 H new ATOM 0 HA GLU A 30 -0.931 10.966 1.302 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -1.816 11.009 3.786 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -0.400 11.995 4.093 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -1.166 13.543 2.244 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -2.640 12.602 2.134 1.00 0.00 H new ATOM 402 N LEU A 31 1.071 12.364 0.862 1.00 0.00 N ATOM 403 CA LEU A 31 2.296 13.067 0.497 1.00 0.00 C ATOM 404 C LEU A 31 2.149 14.569 0.717 1.00 0.00 C ATOM 405 O LEU A 31 1.044 15.108 0.663 1.00 0.00 O ATOM 406 CB LEU A 31 2.652 12.786 -0.964 1.00 0.00 C ATOM 407 CG LEU A 31 2.902 11.322 -1.325 1.00 0.00 C ATOM 408 CD1 LEU A 31 2.667 11.090 -2.809 1.00 0.00 C ATOM 409 CD2 LEU A 31 4.315 10.910 -0.936 1.00 0.00 C ATOM 0 H LEU A 31 0.299 12.495 0.209 1.00 0.00 H new ATOM 0 HA LEU A 31 3.099 12.702 1.137 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.844 13.161 -1.592 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.544 13.359 -1.216 1.00 0.00 H new ATOM 0 HG LEU A 31 2.198 10.705 -0.766 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.850 10.042 -3.047 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.637 11.344 -3.058 1.00 0.00 H new ATOM 0 HD13 LEU A 31 3.346 11.717 -3.387 1.00 0.00 H new ATOM 0 HD21 LEU A 31 4.475 9.865 -1.200 1.00 0.00 H new ATOM 0 HD22 LEU A 31 5.035 11.533 -1.467 1.00 0.00 H new ATOM 0 HD23 LEU A 31 4.448 11.037 0.138 1.00 0.00 H new ATOM 421 N SER A 32 3.270 15.238 0.963 1.00 0.00 N ATOM 422 CA SER A 32 3.266 16.678 1.193 1.00 0.00 C ATOM 423 C SER A 32 2.537 17.406 0.067 1.00 0.00 C ATOM 424 O SER A 32 2.046 18.520 0.248 1.00 0.00 O ATOM 425 CB SER A 32 4.699 17.202 1.310 1.00 0.00 C ATOM 426 OG SER A 32 4.733 18.616 1.235 1.00 0.00 O ATOM 0 H SER A 32 4.193 14.806 1.008 1.00 0.00 H new ATOM 0 HA SER A 32 2.739 16.870 2.128 1.00 0.00 H new ATOM 0 HB2 SER A 32 5.133 16.874 2.255 1.00 0.00 H new ATOM 0 HB3 SER A 32 5.311 16.778 0.514 1.00 0.00 H new ATOM 0 HG SER A 32 5.659 18.926 1.314 1.00 0.00 H new ATOM 432 N LYS A 33 2.471 16.767 -1.096 1.00 0.00 N ATOM 433 CA LYS A 33 1.802 17.350 -2.253 1.00 0.00 C ATOM 434 C LYS A 33 1.611 16.311 -3.352 1.00 0.00 C ATOM 435 O LYS A 33 2.366 15.343 -3.443 1.00 0.00 O ATOM 436 CB LYS A 33 2.609 18.535 -2.791 1.00 0.00 C ATOM 437 CG LYS A 33 4.004 18.158 -3.259 1.00 0.00 C ATOM 438 CD LYS A 33 4.845 19.389 -3.552 1.00 0.00 C ATOM 439 CE LYS A 33 5.514 19.920 -2.294 1.00 0.00 C ATOM 440 NZ LYS A 33 4.533 20.550 -1.368 1.00 0.00 N ATOM 0 H LYS A 33 2.873 15.844 -1.262 1.00 0.00 H new ATOM 0 HA LYS A 33 0.820 17.701 -1.935 1.00 0.00 H new ATOM 0 HB2 LYS A 33 2.066 18.987 -3.621 1.00 0.00 H new ATOM 0 HB3 LYS A 33 2.689 19.293 -2.012 1.00 0.00 H new ATOM 0 HG2 LYS A 33 4.494 17.555 -2.495 1.00 0.00 H new ATOM 0 HG3 LYS A 33 3.934 17.542 -4.156 1.00 0.00 H new ATOM 0 HD2 LYS A 33 5.605 19.143 -4.293 1.00 0.00 H new ATOM 0 HD3 LYS A 33 4.216 20.166 -3.986 1.00 0.00 H new ATOM 0 HE2 LYS A 33 6.024 19.104 -1.782 1.00 0.00 H new ATOM 0 HE3 LYS A 33 6.275 20.650 -2.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 5.020 21.246 -0.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 3.792 21.027 -1.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 4.101 19.818 -0.769 1.00 0.00 H new ATOM 454 N ALA A 34 0.597 16.518 -4.186 1.00 0.00 N ATOM 455 CA ALA A 34 0.309 15.600 -5.282 1.00 0.00 C ATOM 456 C ALA A 34 1.548 15.363 -6.139 1.00 0.00 C ATOM 457 O ALA A 34 2.160 16.308 -6.636 1.00 0.00 O ATOM 458 CB ALA A 34 -0.830 16.137 -6.134 1.00 0.00 C ATOM 0 H ALA A 34 -0.039 17.313 -4.124 1.00 0.00 H new ATOM 0 HA ALA A 34 0.008 14.644 -4.854 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -1.034 15.442 -6.948 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -1.723 16.248 -5.519 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -0.550 17.106 -6.546 1.00 0.00 H new ATOM 464 N ALA A 35 1.912 14.096 -6.307 1.00 0.00 N ATOM 465 CA ALA A 35 3.077 13.735 -7.105 1.00 0.00 C ATOM 466 C ALA A 35 3.016 12.274 -7.537 1.00 0.00 C ATOM 467 O ALA A 35 2.419 11.429 -6.869 1.00 0.00 O ATOM 468 CB ALA A 35 4.355 14.004 -6.325 1.00 0.00 C ATOM 0 H ALA A 35 1.417 13.302 -5.901 1.00 0.00 H new ATOM 0 HA ALA A 35 3.076 14.352 -8.003 1.00 0.00 H new ATOM 0 HB1 ALA A 35 5.217 13.730 -6.933 1.00 0.00 H new ATOM 0 HB2 ALA A 35 4.411 15.063 -6.073 1.00 0.00 H new ATOM 0 HB3 ALA A 35 4.354 13.412 -5.410 1.00 0.00 H new ATOM 474 N PRO A 36 3.645 11.967 -8.680 1.00 0.00 N ATOM 475 CA PRO A 36 3.676 10.607 -9.227 1.00 0.00 C ATOM 476 C PRO A 36 4.533 9.665 -8.388 1.00 0.00 C ATOM 477 O PRO A 36 5.689 9.962 -8.087 1.00 0.00 O ATOM 478 CB PRO A 36 4.293 10.796 -10.615 1.00 0.00 C ATOM 479 CG PRO A 36 5.105 12.040 -10.503 1.00 0.00 C ATOM 480 CD PRO A 36 4.376 12.924 -9.528 1.00 0.00 C ATOM 0 HA PRO A 36 2.686 10.152 -9.244 1.00 0.00 H new ATOM 0 HB2 PRO A 36 4.912 9.943 -10.892 1.00 0.00 H new ATOM 0 HB3 PRO A 36 3.523 10.893 -11.380 1.00 0.00 H new ATOM 0 HG2 PRO A 36 6.112 11.818 -10.151 1.00 0.00 H new ATOM 0 HG3 PRO A 36 5.207 12.528 -11.472 1.00 0.00 H new ATOM 0 HD2 PRO A 36 5.066 13.533 -8.944 1.00 0.00 H new ATOM 0 HD3 PRO A 36 3.698 13.610 -10.036 1.00 0.00 H new ATOM 488 N VAL A 37 3.958 8.526 -8.013 1.00 0.00 N ATOM 489 CA VAL A 37 4.670 7.539 -7.210 1.00 0.00 C ATOM 490 C VAL A 37 4.684 6.178 -7.897 1.00 0.00 C ATOM 491 O VAL A 37 3.951 5.950 -8.859 1.00 0.00 O ATOM 492 CB VAL A 37 4.037 7.390 -5.813 1.00 0.00 C ATOM 493 CG1 VAL A 37 4.022 8.726 -5.088 1.00 0.00 C ATOM 494 CG2 VAL A 37 2.631 6.819 -5.924 1.00 0.00 C ATOM 0 H VAL A 37 3.002 8.264 -8.253 1.00 0.00 H new ATOM 0 HA VAL A 37 5.693 7.898 -7.101 1.00 0.00 H new ATOM 0 HB VAL A 37 4.643 6.695 -5.231 1.00 0.00 H new ATOM 0 HG11 VAL A 37 3.571 8.601 -4.103 1.00 0.00 H new ATOM 0 HG12 VAL A 37 5.043 9.091 -4.976 1.00 0.00 H new ATOM 0 HG13 VAL A 37 3.441 9.446 -5.664 1.00 0.00 H new ATOM 0 HG21 VAL A 37 2.199 6.720 -4.928 1.00 0.00 H new ATOM 0 HG22 VAL A 37 2.013 7.488 -6.523 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.673 5.839 -6.400 1.00 0.00 H new ATOM 504 N GLU A 38 5.524 5.277 -7.396 1.00 0.00 N ATOM 505 CA GLU A 38 5.634 3.938 -7.963 1.00 0.00 C ATOM 506 C GLU A 38 5.844 2.899 -6.867 1.00 0.00 C ATOM 507 O GLU A 38 6.871 2.897 -6.187 1.00 0.00 O ATOM 508 CB GLU A 38 6.788 3.878 -8.967 1.00 0.00 C ATOM 509 CG GLU A 38 7.036 2.488 -9.526 1.00 0.00 C ATOM 510 CD GLU A 38 7.963 2.498 -10.726 1.00 0.00 C ATOM 511 OE1 GLU A 38 8.935 3.283 -10.718 1.00 0.00 O ATOM 512 OE2 GLU A 38 7.717 1.721 -11.672 1.00 0.00 O ATOM 0 H GLU A 38 6.137 5.450 -6.600 1.00 0.00 H new ATOM 0 HA GLU A 38 4.701 3.712 -8.479 1.00 0.00 H new ATOM 0 HB2 GLU A 38 6.577 4.560 -9.791 1.00 0.00 H new ATOM 0 HB3 GLU A 38 7.698 4.234 -8.484 1.00 0.00 H new ATOM 0 HG2 GLU A 38 7.464 1.858 -8.746 1.00 0.00 H new ATOM 0 HG3 GLU A 38 6.084 2.040 -9.811 1.00 0.00 H new ATOM 519 N TRP A 39 4.866 2.017 -6.700 1.00 0.00 N ATOM 520 CA TRP A 39 4.943 0.972 -5.686 1.00 0.00 C ATOM 521 C TRP A 39 5.881 -0.147 -6.127 1.00 0.00 C ATOM 522 O TRP A 39 5.966 -0.467 -7.312 1.00 0.00 O ATOM 523 CB TRP A 39 3.551 0.405 -5.401 1.00 0.00 C ATOM 524 CG TRP A 39 2.558 1.448 -4.986 1.00 0.00 C ATOM 525 CD1 TRP A 39 1.872 2.298 -5.805 1.00 0.00 C ATOM 526 CD2 TRP A 39 2.142 1.751 -3.650 1.00 0.00 C ATOM 527 NE1 TRP A 39 1.055 3.112 -5.059 1.00 0.00 N ATOM 528 CE2 TRP A 39 1.201 2.796 -3.735 1.00 0.00 C ATOM 529 CE3 TRP A 39 2.470 1.241 -2.392 1.00 0.00 C ATOM 530 CZ2 TRP A 39 0.589 3.338 -2.608 1.00 0.00 C ATOM 531 CZ3 TRP A 39 1.862 1.780 -1.275 1.00 0.00 C ATOM 532 CH2 TRP A 39 0.929 2.819 -1.388 1.00 0.00 C ATOM 0 H TRP A 39 4.010 2.004 -7.254 1.00 0.00 H new ATOM 0 HA TRP A 39 5.341 1.415 -4.773 1.00 0.00 H new ATOM 0 HB2 TRP A 39 3.183 -0.102 -6.293 1.00 0.00 H new ATOM 0 HB3 TRP A 39 3.627 -0.347 -4.616 1.00 0.00 H new ATOM 0 HD1 TRP A 39 1.959 2.326 -6.881 1.00 0.00 H new ATOM 0 HE1 TRP A 39 0.439 3.835 -5.431 1.00 0.00 H new ATOM 0 HE3 TRP A 39 3.187 0.439 -2.294 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 -0.129 4.140 -2.693 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 2.110 1.394 -0.297 1.00 0.00 H new ATOM 0 HH2 TRP A 39 0.469 3.218 -0.496 1.00 0.00 H new ATOM 543 N ARG A 40 6.583 -0.738 -5.165 1.00 0.00 N ATOM 544 CA ARG A 40 7.515 -1.821 -5.456 1.00 0.00 C ATOM 545 C ARG A 40 7.510 -2.858 -4.336 1.00 0.00 C ATOM 546 O ARG A 40 7.338 -2.522 -3.164 1.00 0.00 O ATOM 547 CB ARG A 40 8.929 -1.267 -5.646 1.00 0.00 C ATOM 548 CG ARG A 40 9.108 -0.486 -6.937 1.00 0.00 C ATOM 549 CD ARG A 40 10.465 0.199 -6.990 1.00 0.00 C ATOM 550 NE ARG A 40 10.641 0.970 -8.218 1.00 0.00 N ATOM 551 CZ ARG A 40 11.814 1.439 -8.629 1.00 0.00 C ATOM 552 NH1 ARG A 40 12.908 1.216 -7.914 1.00 0.00 N ATOM 553 NH2 ARG A 40 11.894 2.133 -9.757 1.00 0.00 N ATOM 0 H ARG A 40 6.524 -0.485 -4.179 1.00 0.00 H new ATOM 0 HA ARG A 40 7.194 -2.306 -6.378 1.00 0.00 H new ATOM 0 HB2 ARG A 40 9.173 -0.620 -4.803 1.00 0.00 H new ATOM 0 HB3 ARG A 40 9.639 -2.094 -5.630 1.00 0.00 H new ATOM 0 HG2 ARG A 40 9.006 -1.159 -7.788 1.00 0.00 H new ATOM 0 HG3 ARG A 40 8.319 0.261 -7.024 1.00 0.00 H new ATOM 0 HD2 ARG A 40 10.572 0.859 -6.129 1.00 0.00 H new ATOM 0 HD3 ARG A 40 11.253 -0.551 -6.917 1.00 0.00 H new ATOM 0 HE ARG A 40 9.819 1.159 -8.791 1.00 0.00 H new ATOM 0 HH11 ARG A 40 12.850 0.683 -7.046 1.00 0.00 H new ATOM 0 HH12 ARG A 40 13.807 1.577 -8.232 1.00 0.00 H new ATOM 0 HH21 ARG A 40 11.054 2.307 -10.309 1.00 0.00 H new ATOM 0 HH22 ARG A 40 12.795 2.493 -10.072 1.00 0.00 H new ATOM 567 N LYS A 41 7.698 -4.120 -4.706 1.00 0.00 N ATOM 568 CA LYS A 41 7.715 -5.207 -3.735 1.00 0.00 C ATOM 569 C LYS A 41 9.123 -5.774 -3.578 1.00 0.00 C ATOM 570 O LYS A 41 9.685 -6.334 -4.518 1.00 0.00 O ATOM 571 CB LYS A 41 6.752 -6.317 -4.163 1.00 0.00 C ATOM 572 CG LYS A 41 6.097 -7.037 -2.997 1.00 0.00 C ATOM 573 CD LYS A 41 7.125 -7.742 -2.128 1.00 0.00 C ATOM 574 CE LYS A 41 7.544 -9.074 -2.731 1.00 0.00 C ATOM 575 NZ LYS A 41 8.724 -8.929 -3.629 1.00 0.00 N ATOM 0 H LYS A 41 7.841 -4.415 -5.672 1.00 0.00 H new ATOM 0 HA LYS A 41 7.394 -4.807 -2.774 1.00 0.00 H new ATOM 0 HB2 LYS A 41 5.976 -5.889 -4.797 1.00 0.00 H new ATOM 0 HB3 LYS A 41 7.294 -7.043 -4.769 1.00 0.00 H new ATOM 0 HG2 LYS A 41 5.539 -6.321 -2.394 1.00 0.00 H new ATOM 0 HG3 LYS A 41 5.378 -7.764 -3.375 1.00 0.00 H new ATOM 0 HD2 LYS A 41 8.001 -7.104 -2.008 1.00 0.00 H new ATOM 0 HD3 LYS A 41 6.711 -7.906 -1.133 1.00 0.00 H new ATOM 0 HE2 LYS A 41 7.780 -9.777 -1.932 1.00 0.00 H new ATOM 0 HE3 LYS A 41 6.711 -9.497 -3.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 9.144 -9.864 -3.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 8.423 -8.511 -4.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 9.429 -8.311 -3.179 1.00 0.00 H new ATOM 589 N GLY A 42 9.686 -5.626 -2.383 1.00 0.00 N ATOM 590 CA GLY A 42 11.023 -6.130 -2.125 1.00 0.00 C ATOM 591 C GLY A 42 12.009 -5.737 -3.207 1.00 0.00 C ATOM 592 O GLY A 42 12.379 -4.568 -3.326 1.00 0.00 O ATOM 0 H GLY A 42 9.241 -5.166 -1.589 1.00 0.00 H new ATOM 0 HA2 GLY A 42 11.372 -5.751 -1.165 1.00 0.00 H new ATOM 0 HA3 GLY A 42 10.989 -7.217 -2.045 1.00 0.00 H new ATOM 596 N LEU A 43 12.438 -6.714 -3.998 1.00 0.00 N ATOM 597 CA LEU A 43 13.389 -6.465 -5.075 1.00 0.00 C ATOM 598 C LEU A 43 12.721 -6.620 -6.438 1.00 0.00 C ATOM 599 O LEU A 43 13.303 -7.186 -7.363 1.00 0.00 O ATOM 600 CB LEU A 43 14.577 -7.422 -4.965 1.00 0.00 C ATOM 601 CG LEU A 43 15.638 -7.059 -3.925 1.00 0.00 C ATOM 602 CD1 LEU A 43 15.062 -7.148 -2.521 1.00 0.00 C ATOM 603 CD2 LEU A 43 16.853 -7.964 -4.064 1.00 0.00 C ATOM 0 H LEU A 43 12.142 -7.686 -3.914 1.00 0.00 H new ATOM 0 HA LEU A 43 13.747 -5.440 -4.980 1.00 0.00 H new ATOM 0 HB2 LEU A 43 14.196 -8.417 -4.734 1.00 0.00 H new ATOM 0 HB3 LEU A 43 15.059 -7.484 -5.940 1.00 0.00 H new ATOM 0 HG LEU A 43 15.954 -6.031 -4.101 1.00 0.00 H new ATOM 0 HD11 LEU A 43 15.832 -6.886 -1.795 1.00 0.00 H new ATOM 0 HD12 LEU A 43 14.224 -6.457 -2.427 1.00 0.00 H new ATOM 0 HD13 LEU A 43 14.717 -8.165 -2.333 1.00 0.00 H new ATOM 0 HD21 LEU A 43 17.597 -7.691 -3.316 1.00 0.00 H new ATOM 0 HD22 LEU A 43 16.553 -9.001 -3.916 1.00 0.00 H new ATOM 0 HD23 LEU A 43 17.280 -7.849 -5.060 1.00 0.00 H new ATOM 615 N GLU A 44 11.499 -6.112 -6.554 1.00 0.00 N ATOM 616 CA GLU A 44 10.753 -6.194 -7.804 1.00 0.00 C ATOM 617 C GLU A 44 9.955 -4.916 -8.046 1.00 0.00 C ATOM 618 O GLU A 44 9.856 -4.058 -7.170 1.00 0.00 O ATOM 619 CB GLU A 44 9.812 -7.400 -7.785 1.00 0.00 C ATOM 620 CG GLU A 44 9.351 -7.834 -9.167 1.00 0.00 C ATOM 621 CD GLU A 44 9.027 -9.314 -9.236 1.00 0.00 C ATOM 622 OE1 GLU A 44 9.870 -10.125 -8.799 1.00 0.00 O ATOM 623 OE2 GLU A 44 7.932 -9.660 -9.726 1.00 0.00 O ATOM 0 H GLU A 44 11.004 -5.639 -5.798 1.00 0.00 H new ATOM 0 HA GLU A 44 11.469 -6.314 -8.617 1.00 0.00 H new ATOM 0 HB2 GLU A 44 10.316 -8.236 -7.300 1.00 0.00 H new ATOM 0 HB3 GLU A 44 8.939 -7.159 -7.179 1.00 0.00 H new ATOM 0 HG2 GLU A 44 8.469 -7.259 -9.449 1.00 0.00 H new ATOM 0 HG3 GLU A 44 10.128 -7.602 -9.895 1.00 0.00 H new ATOM 630 N ALA A 45 9.387 -4.797 -9.242 1.00 0.00 N ATOM 631 CA ALA A 45 8.597 -3.626 -9.599 1.00 0.00 C ATOM 632 C ALA A 45 7.143 -4.004 -9.862 1.00 0.00 C ATOM 633 O ALA A 45 6.861 -4.991 -10.543 1.00 0.00 O ATOM 634 CB ALA A 45 9.193 -2.938 -10.818 1.00 0.00 C ATOM 0 H ALA A 45 9.460 -5.498 -9.980 1.00 0.00 H new ATOM 0 HA ALA A 45 8.619 -2.934 -8.757 1.00 0.00 H new ATOM 0 HB1 ALA A 45 8.592 -2.065 -11.073 1.00 0.00 H new ATOM 0 HB2 ALA A 45 10.213 -2.624 -10.596 1.00 0.00 H new ATOM 0 HB3 ALA A 45 9.201 -3.631 -11.659 1.00 0.00 H new ATOM 640 N LEU A 46 6.223 -3.215 -9.318 1.00 0.00 N ATOM 641 CA LEU A 46 4.797 -3.468 -9.493 1.00 0.00 C ATOM 642 C LEU A 46 4.197 -2.513 -10.519 1.00 0.00 C ATOM 643 O LEU A 46 4.641 -1.372 -10.654 1.00 0.00 O ATOM 644 CB LEU A 46 4.066 -3.325 -8.157 1.00 0.00 C ATOM 645 CG LEU A 46 4.630 -4.139 -6.992 1.00 0.00 C ATOM 646 CD1 LEU A 46 3.961 -3.738 -5.687 1.00 0.00 C ATOM 647 CD2 LEU A 46 4.455 -5.628 -7.248 1.00 0.00 C ATOM 0 H LEU A 46 6.439 -2.394 -8.752 1.00 0.00 H new ATOM 0 HA LEU A 46 4.676 -4.488 -9.859 1.00 0.00 H new ATOM 0 HB2 LEU A 46 4.071 -2.272 -7.874 1.00 0.00 H new ATOM 0 HB3 LEU A 46 3.024 -3.611 -8.303 1.00 0.00 H new ATOM 0 HG LEU A 46 5.696 -3.928 -6.909 1.00 0.00 H new ATOM 0 HD11 LEU A 46 4.375 -4.328 -4.869 1.00 0.00 H new ATOM 0 HD12 LEU A 46 4.139 -2.680 -5.497 1.00 0.00 H new ATOM 0 HD13 LEU A 46 2.888 -3.919 -5.757 1.00 0.00 H new ATOM 0 HD21 LEU A 46 4.862 -6.192 -6.409 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.395 -5.856 -7.358 1.00 0.00 H new ATOM 0 HD23 LEU A 46 4.983 -5.905 -8.161 1.00 0.00 H new ATOM 659 N ARG A 47 3.185 -2.985 -11.239 1.00 0.00 N ATOM 660 CA ARG A 47 2.523 -2.173 -12.252 1.00 0.00 C ATOM 661 C ARG A 47 1.006 -2.230 -12.089 1.00 0.00 C ATOM 662 O ARG A 47 0.471 -3.164 -11.494 1.00 0.00 O ATOM 663 CB ARG A 47 2.914 -2.648 -13.653 1.00 0.00 C ATOM 664 CG ARG A 47 2.448 -4.059 -13.969 1.00 0.00 C ATOM 665 CD ARG A 47 2.214 -4.247 -15.460 1.00 0.00 C ATOM 666 NE ARG A 47 1.305 -5.357 -15.735 1.00 0.00 N ATOM 667 CZ ARG A 47 0.849 -5.650 -16.948 1.00 0.00 C ATOM 668 NH1 ARG A 47 1.216 -4.920 -17.992 1.00 0.00 N ATOM 669 NH2 ARG A 47 0.025 -6.676 -17.119 1.00 0.00 N ATOM 0 H ARG A 47 2.805 -3.926 -11.139 1.00 0.00 H new ATOM 0 HA ARG A 47 2.847 -1.140 -12.122 1.00 0.00 H new ATOM 0 HB2 ARG A 47 2.495 -1.963 -14.390 1.00 0.00 H new ATOM 0 HB3 ARG A 47 3.998 -2.601 -13.754 1.00 0.00 H new ATOM 0 HG2 ARG A 47 3.193 -4.776 -13.623 1.00 0.00 H new ATOM 0 HG3 ARG A 47 1.527 -4.270 -13.426 1.00 0.00 H new ATOM 0 HD2 ARG A 47 1.804 -3.329 -15.881 1.00 0.00 H new ATOM 0 HD3 ARG A 47 3.167 -4.427 -15.957 1.00 0.00 H new ATOM 0 HE ARG A 47 1.004 -5.939 -14.953 1.00 0.00 H new ATOM 0 HH11 ARG A 47 1.850 -4.131 -17.865 1.00 0.00 H new ATOM 0 HH12 ARG A 47 0.864 -5.147 -18.922 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -0.259 -7.241 -16.319 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -0.324 -6.900 -18.051 1.00 0.00 H new ATOM 683 N ASP A 48 0.322 -1.223 -12.622 1.00 0.00 N ATOM 684 CA ASP A 48 -1.133 -1.159 -12.536 1.00 0.00 C ATOM 685 C ASP A 48 -1.778 -1.817 -13.751 1.00 0.00 C ATOM 686 O ASP A 48 -1.264 -1.728 -14.865 1.00 0.00 O ATOM 687 CB ASP A 48 -1.594 0.295 -12.423 1.00 0.00 C ATOM 688 CG ASP A 48 -0.950 1.190 -13.464 1.00 0.00 C ATOM 689 OD1 ASP A 48 -1.101 0.901 -14.670 1.00 0.00 O ATOM 690 OD2 ASP A 48 -0.292 2.177 -13.073 1.00 0.00 O ATOM 0 H ASP A 48 0.751 -0.441 -13.117 1.00 0.00 H new ATOM 0 HA ASP A 48 -1.445 -1.702 -11.643 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -2.678 0.339 -12.531 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -1.357 0.672 -11.428 1.00 0.00 H new ATOM 695 N GLY A 49 -2.909 -2.480 -13.528 1.00 0.00 N ATOM 696 CA GLY A 49 -3.606 -3.145 -14.614 1.00 0.00 C ATOM 697 C GLY A 49 -4.651 -4.125 -14.118 1.00 0.00 C ATOM 698 O GLY A 49 -5.805 -3.755 -13.900 1.00 0.00 O ATOM 0 H GLY A 49 -3.355 -2.568 -12.615 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -4.085 -2.397 -15.246 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -2.883 -3.673 -15.236 1.00 0.00 H new ATOM 702 N ASP A 50 -4.248 -5.378 -13.940 1.00 0.00 N ATOM 703 CA ASP A 50 -5.158 -6.415 -13.467 1.00 0.00 C ATOM 704 C ASP A 50 -4.698 -6.970 -12.123 1.00 0.00 C ATOM 705 O ASP A 50 -5.488 -7.093 -11.187 1.00 0.00 O ATOM 706 CB ASP A 50 -5.255 -7.545 -14.494 1.00 0.00 C ATOM 707 CG ASP A 50 -6.094 -7.163 -15.697 1.00 0.00 C ATOM 708 OD1 ASP A 50 -7.290 -6.855 -15.513 1.00 0.00 O ATOM 709 OD2 ASP A 50 -5.554 -7.172 -16.823 1.00 0.00 O ATOM 0 H ASP A 50 -3.297 -5.701 -14.116 1.00 0.00 H new ATOM 0 HA ASP A 50 -6.143 -5.968 -13.336 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -4.253 -7.818 -14.825 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -5.685 -8.427 -14.020 1.00 0.00 H new ATOM 714 N LYS A 51 -3.415 -7.304 -12.035 1.00 0.00 N ATOM 715 CA LYS A 51 -2.848 -7.847 -10.805 1.00 0.00 C ATOM 716 C LYS A 51 -3.062 -6.888 -9.639 1.00 0.00 C ATOM 717 O LYS A 51 -3.689 -7.241 -8.640 1.00 0.00 O ATOM 718 CB LYS A 51 -1.354 -8.122 -10.987 1.00 0.00 C ATOM 719 CG LYS A 51 -0.656 -8.555 -9.709 1.00 0.00 C ATOM 720 CD LYS A 51 -1.113 -9.935 -9.265 1.00 0.00 C ATOM 721 CE LYS A 51 -0.503 -10.319 -7.926 1.00 0.00 C ATOM 722 NZ LYS A 51 0.914 -10.757 -8.067 1.00 0.00 N ATOM 0 H LYS A 51 -2.748 -7.208 -12.800 1.00 0.00 H new ATOM 0 HA LYS A 51 -3.358 -8.784 -10.580 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -1.225 -8.897 -11.742 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -0.871 -7.222 -11.368 1.00 0.00 H new ATOM 0 HG2 LYS A 51 0.423 -8.561 -9.866 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -0.859 -7.832 -8.919 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -2.200 -9.953 -9.189 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -0.834 -10.672 -10.018 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -0.554 -9.468 -7.246 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -1.088 -11.122 -7.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 1.047 -11.665 -7.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 1.144 -10.871 -9.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 1.542 -10.042 -7.648 1.00 0.00 H new ATOM 736 N TYR A 52 -2.538 -5.675 -9.773 1.00 0.00 N ATOM 737 CA TYR A 52 -2.671 -4.665 -8.729 1.00 0.00 C ATOM 738 C TYR A 52 -3.550 -3.510 -9.197 1.00 0.00 C ATOM 739 O TYR A 52 -3.631 -3.220 -10.391 1.00 0.00 O ATOM 740 CB TYR A 52 -1.294 -4.140 -8.320 1.00 0.00 C ATOM 741 CG TYR A 52 -0.335 -5.226 -7.888 1.00 0.00 C ATOM 742 CD1 TYR A 52 -0.360 -5.727 -6.592 1.00 0.00 C ATOM 743 CD2 TYR A 52 0.597 -5.751 -8.775 1.00 0.00 C ATOM 744 CE1 TYR A 52 0.514 -6.719 -6.192 1.00 0.00 C ATOM 745 CE2 TYR A 52 1.474 -6.744 -8.384 1.00 0.00 C ATOM 746 CZ TYR A 52 1.429 -7.225 -7.092 1.00 0.00 C ATOM 747 OH TYR A 52 2.302 -8.213 -6.698 1.00 0.00 O ATOM 0 H TYR A 52 -2.017 -5.367 -10.594 1.00 0.00 H new ATOM 0 HA TYR A 52 -3.146 -5.132 -7.866 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -0.859 -3.595 -9.158 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -1.414 -3.427 -7.504 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -1.075 -5.334 -5.885 1.00 0.00 H new ATOM 0 HD2 TYR A 52 0.636 -5.376 -9.787 1.00 0.00 H new ATOM 0 HE1 TYR A 52 0.481 -7.096 -5.181 1.00 0.00 H new ATOM 0 HE2 TYR A 52 2.191 -7.142 -9.086 1.00 0.00 H new ATOM 0 HH TYR A 52 2.879 -8.459 -7.451 1.00 0.00 H new ATOM 757 N SER A 53 -4.207 -2.852 -8.247 1.00 0.00 N ATOM 758 CA SER A 53 -5.083 -1.729 -8.560 1.00 0.00 C ATOM 759 C SER A 53 -4.674 -0.485 -7.778 1.00 0.00 C ATOM 760 O SER A 53 -4.715 -0.470 -6.547 1.00 0.00 O ATOM 761 CB SER A 53 -6.538 -2.087 -8.247 1.00 0.00 C ATOM 762 OG SER A 53 -7.142 -2.764 -9.336 1.00 0.00 O ATOM 0 H SER A 53 -4.149 -3.077 -7.254 1.00 0.00 H new ATOM 0 HA SER A 53 -4.990 -1.514 -9.624 1.00 0.00 H new ATOM 0 HB2 SER A 53 -6.578 -2.715 -7.357 1.00 0.00 H new ATOM 0 HB3 SER A 53 -7.099 -1.180 -8.022 1.00 0.00 H new ATOM 0 HG SER A 53 -7.368 -3.679 -9.068 1.00 0.00 H new ATOM 768 N LEU A 54 -4.279 0.557 -8.500 1.00 0.00 N ATOM 769 CA LEU A 54 -3.861 1.807 -7.875 1.00 0.00 C ATOM 770 C LEU A 54 -4.944 2.873 -8.013 1.00 0.00 C ATOM 771 O LEU A 54 -5.318 3.251 -9.123 1.00 0.00 O ATOM 772 CB LEU A 54 -2.558 2.304 -8.503 1.00 0.00 C ATOM 773 CG LEU A 54 -1.290 1.550 -8.101 1.00 0.00 C ATOM 774 CD1 LEU A 54 -1.195 1.433 -6.588 1.00 0.00 C ATOM 775 CD2 LEU A 54 -1.261 0.172 -8.747 1.00 0.00 C ATOM 0 H LEU A 54 -4.239 0.561 -9.519 1.00 0.00 H new ATOM 0 HA LEU A 54 -3.696 1.617 -6.814 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -2.658 2.254 -9.587 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -2.430 3.355 -8.243 1.00 0.00 H new ATOM 0 HG LEU A 54 -0.428 2.114 -8.456 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -0.286 0.893 -6.321 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -1.168 2.429 -6.147 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -2.062 0.892 -6.210 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -0.352 -0.350 -8.450 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -2.130 -0.400 -8.423 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.280 0.278 -9.832 1.00 0.00 H new ATOM 787 N ARG A 55 -5.441 3.354 -6.879 1.00 0.00 N ATOM 788 CA ARG A 55 -6.480 4.377 -6.873 1.00 0.00 C ATOM 789 C ARG A 55 -6.092 5.540 -5.964 1.00 0.00 C ATOM 790 O ARG A 55 -6.437 5.558 -4.783 1.00 0.00 O ATOM 791 CB ARG A 55 -7.811 3.780 -6.415 1.00 0.00 C ATOM 792 CG ARG A 55 -8.929 4.803 -6.294 1.00 0.00 C ATOM 793 CD ARG A 55 -9.696 4.947 -7.599 1.00 0.00 C ATOM 794 NE ARG A 55 -9.073 5.916 -8.497 1.00 0.00 N ATOM 795 CZ ARG A 55 -8.977 7.213 -8.226 1.00 0.00 C ATOM 796 NH1 ARG A 55 -9.461 7.694 -7.089 1.00 0.00 N ATOM 797 NH2 ARG A 55 -8.396 8.032 -9.093 1.00 0.00 N ATOM 0 H ARG A 55 -5.141 3.052 -5.952 1.00 0.00 H new ATOM 0 HA ARG A 55 -6.590 4.754 -7.890 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -8.114 3.006 -7.120 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -7.668 3.294 -5.450 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -9.613 4.504 -5.500 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -8.511 5.768 -6.008 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -9.753 3.978 -8.095 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -10.719 5.256 -7.386 1.00 0.00 H new ATOM 0 HE ARG A 55 -8.691 5.578 -9.380 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -9.908 7.068 -6.420 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -9.386 8.690 -6.884 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -8.022 7.666 -9.969 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -8.323 9.028 -8.884 1.00 0.00 H new ATOM 811 N GLN A 56 -5.374 6.509 -6.524 1.00 0.00 N ATOM 812 CA GLN A 56 -4.939 7.674 -5.763 1.00 0.00 C ATOM 813 C GLN A 56 -5.715 8.918 -6.183 1.00 0.00 C ATOM 814 O GLN A 56 -6.102 9.058 -7.343 1.00 0.00 O ATOM 815 CB GLN A 56 -3.439 7.904 -5.955 1.00 0.00 C ATOM 816 CG GLN A 56 -3.066 8.339 -7.363 1.00 0.00 C ATOM 817 CD GLN A 56 -1.585 8.629 -7.511 1.00 0.00 C ATOM 818 OE1 GLN A 56 -0.852 7.868 -8.144 1.00 0.00 O ATOM 819 NE2 GLN A 56 -1.137 9.733 -6.927 1.00 0.00 N ATOM 0 H GLN A 56 -5.082 6.510 -7.501 1.00 0.00 H new ATOM 0 HA GLN A 56 -5.137 7.483 -4.708 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -3.103 8.663 -5.248 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -2.905 6.985 -5.714 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -3.352 7.558 -8.068 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -3.635 9.231 -7.627 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -1.780 10.335 -6.412 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -0.150 9.980 -6.993 1.00 0.00 H new ATOM 828 N ASP A 57 -5.937 9.819 -5.233 1.00 0.00 N ATOM 829 CA ASP A 57 -6.666 11.053 -5.504 1.00 0.00 C ATOM 830 C ASP A 57 -5.801 12.273 -5.201 1.00 0.00 C ATOM 831 O ASP A 57 -5.898 12.863 -4.126 1.00 0.00 O ATOM 832 CB ASP A 57 -7.950 11.105 -4.675 1.00 0.00 C ATOM 833 CG ASP A 57 -8.930 12.141 -5.190 1.00 0.00 C ATOM 834 OD1 ASP A 57 -8.822 13.315 -4.778 1.00 0.00 O ATOM 835 OD2 ASP A 57 -9.805 11.778 -6.004 1.00 0.00 O ATOM 0 H ASP A 57 -5.623 9.718 -4.268 1.00 0.00 H new ATOM 0 HA ASP A 57 -6.925 11.067 -6.563 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -8.425 10.124 -4.684 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -7.701 11.329 -3.638 1.00 0.00 H new ATOM 840 N GLY A 58 -4.954 12.644 -6.157 1.00 0.00 N ATOM 841 CA GLY A 58 -4.084 13.790 -5.972 1.00 0.00 C ATOM 842 C GLY A 58 -2.922 13.493 -5.045 1.00 0.00 C ATOM 843 O GLY A 58 -1.913 12.928 -5.466 1.00 0.00 O ATOM 0 H GLY A 58 -4.855 12.171 -7.055 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -3.699 14.110 -6.940 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -4.663 14.621 -5.569 1.00 0.00 H new ATOM 847 N ALA A 59 -3.063 13.875 -3.780 1.00 0.00 N ATOM 848 CA ALA A 59 -2.018 13.646 -2.791 1.00 0.00 C ATOM 849 C ALA A 59 -2.173 12.278 -2.135 1.00 0.00 C ATOM 850 O ALA A 59 -1.186 11.605 -1.838 1.00 0.00 O ATOM 851 CB ALA A 59 -2.036 14.744 -1.739 1.00 0.00 C ATOM 0 H ALA A 59 -3.892 14.345 -3.416 1.00 0.00 H new ATOM 0 HA ALA A 59 -1.056 13.667 -3.304 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -1.250 14.559 -1.007 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -1.867 15.709 -2.217 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -3.004 14.752 -1.238 1.00 0.00 H new ATOM 857 N VAL A 60 -3.419 11.874 -1.909 1.00 0.00 N ATOM 858 CA VAL A 60 -3.704 10.586 -1.288 1.00 0.00 C ATOM 859 C VAL A 60 -3.487 9.441 -2.271 1.00 0.00 C ATOM 860 O VAL A 60 -3.988 9.472 -3.396 1.00 0.00 O ATOM 861 CB VAL A 60 -5.149 10.526 -0.758 1.00 0.00 C ATOM 862 CG1 VAL A 60 -5.440 9.161 -0.153 1.00 0.00 C ATOM 863 CG2 VAL A 60 -5.390 11.631 0.259 1.00 0.00 C ATOM 0 H VAL A 60 -4.247 12.420 -2.147 1.00 0.00 H new ATOM 0 HA VAL A 60 -3.013 10.478 -0.452 1.00 0.00 H new ATOM 0 HB VAL A 60 -5.831 10.679 -1.595 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -6.465 9.138 0.216 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -5.310 8.391 -0.913 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -4.753 8.975 0.673 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -6.416 11.573 0.623 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -4.701 11.512 1.095 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -5.226 12.600 -0.211 1.00 0.00 H new ATOM 873 N CYS A 61 -2.739 8.432 -1.839 1.00 0.00 N ATOM 874 CA CYS A 61 -2.455 7.276 -2.682 1.00 0.00 C ATOM 875 C CYS A 61 -2.964 5.992 -2.033 1.00 0.00 C ATOM 876 O CYS A 61 -2.900 5.834 -0.815 1.00 0.00 O ATOM 877 CB CYS A 61 -0.952 7.167 -2.945 1.00 0.00 C ATOM 878 SG CYS A 61 -0.255 8.578 -3.836 1.00 0.00 S ATOM 0 H CYS A 61 -2.318 8.391 -0.911 1.00 0.00 H new ATOM 0 HA CYS A 61 -2.974 7.413 -3.631 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -0.434 7.061 -1.992 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -0.759 6.259 -3.516 1.00 0.00 H new ATOM 0 HG CYS A 61 1.020 8.395 -4.009 1.00 0.00 H new ATOM 884 N GLU A 62 -3.470 5.080 -2.857 1.00 0.00 N ATOM 885 CA GLU A 62 -3.993 3.812 -2.363 1.00 0.00 C ATOM 886 C GLU A 62 -3.581 2.661 -3.276 1.00 0.00 C ATOM 887 O GLU A 62 -3.511 2.815 -4.496 1.00 0.00 O ATOM 888 CB GLU A 62 -5.518 3.871 -2.254 1.00 0.00 C ATOM 889 CG GLU A 62 -6.085 2.976 -1.164 1.00 0.00 C ATOM 890 CD GLU A 62 -7.601 2.986 -1.132 1.00 0.00 C ATOM 891 OE1 GLU A 62 -8.215 2.152 -1.830 1.00 0.00 O ATOM 892 OE2 GLU A 62 -8.173 3.828 -0.408 1.00 0.00 O ATOM 0 H GLU A 62 -3.529 5.196 -3.869 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.572 3.636 -1.373 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -5.821 4.900 -2.061 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -5.954 3.584 -3.211 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.735 1.955 -1.318 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.703 3.301 -0.196 1.00 0.00 H new ATOM 899 N LEU A 63 -3.309 1.506 -2.677 1.00 0.00 N ATOM 900 CA LEU A 63 -2.904 0.328 -3.435 1.00 0.00 C ATOM 901 C LEU A 63 -3.795 -0.865 -3.106 1.00 0.00 C ATOM 902 O LEU A 63 -4.044 -1.161 -1.937 1.00 0.00 O ATOM 903 CB LEU A 63 -1.443 -0.016 -3.139 1.00 0.00 C ATOM 904 CG LEU A 63 -1.000 -1.434 -3.499 1.00 0.00 C ATOM 905 CD1 LEU A 63 -1.093 -1.657 -5.001 1.00 0.00 C ATOM 906 CD2 LEU A 63 0.416 -1.693 -3.007 1.00 0.00 C ATOM 0 H LEU A 63 -3.362 1.361 -1.669 1.00 0.00 H new ATOM 0 HA LEU A 63 -3.010 0.556 -4.496 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -0.809 0.689 -3.677 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -1.262 0.140 -2.076 1.00 0.00 H new ATOM 0 HG LEU A 63 -1.669 -2.139 -3.005 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.774 -2.672 -5.239 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -2.123 -1.515 -5.327 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.449 -0.944 -5.515 1.00 0.00 H new ATOM 0 HD21 LEU A 63 0.714 -2.707 -3.273 1.00 0.00 H new ATOM 0 HD22 LEU A 63 1.098 -0.981 -3.471 1.00 0.00 H new ATOM 0 HD23 LEU A 63 0.452 -1.576 -1.924 1.00 0.00 H new ATOM 918 N GLN A 64 -4.271 -1.546 -4.143 1.00 0.00 N ATOM 919 CA GLN A 64 -5.134 -2.708 -3.963 1.00 0.00 C ATOM 920 C GLN A 64 -4.472 -3.968 -4.512 1.00 0.00 C ATOM 921 O GLN A 64 -4.033 -3.999 -5.662 1.00 0.00 O ATOM 922 CB GLN A 64 -6.480 -2.482 -4.653 1.00 0.00 C ATOM 923 CG GLN A 64 -7.515 -1.812 -3.764 1.00 0.00 C ATOM 924 CD GLN A 64 -8.931 -2.008 -4.267 1.00 0.00 C ATOM 925 OE1 GLN A 64 -9.238 -1.714 -5.423 1.00 0.00 O ATOM 926 NE2 GLN A 64 -9.804 -2.508 -3.400 1.00 0.00 N ATOM 0 H GLN A 64 -4.074 -1.314 -5.116 1.00 0.00 H new ATOM 0 HA GLN A 64 -5.300 -2.844 -2.894 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -6.325 -1.869 -5.541 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -6.871 -3.442 -4.992 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -7.434 -2.212 -2.753 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -7.300 -0.745 -3.703 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -9.507 -2.738 -2.452 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -10.772 -2.662 -3.682 1.00 0.00 H new ATOM 935 N ILE A 65 -4.404 -5.003 -3.683 1.00 0.00 N ATOM 936 CA ILE A 65 -3.796 -6.265 -4.086 1.00 0.00 C ATOM 937 C ILE A 65 -4.829 -7.386 -4.122 1.00 0.00 C ATOM 938 O ILE A 65 -5.455 -7.701 -3.109 1.00 0.00 O ATOM 939 CB ILE A 65 -2.651 -6.668 -3.138 1.00 0.00 C ATOM 940 CG1 ILE A 65 -1.641 -5.526 -3.009 1.00 0.00 C ATOM 941 CG2 ILE A 65 -1.969 -7.932 -3.638 1.00 0.00 C ATOM 942 CD1 ILE A 65 -0.880 -5.536 -1.702 1.00 0.00 C ATOM 0 H ILE A 65 -4.762 -4.993 -2.728 1.00 0.00 H new ATOM 0 HA ILE A 65 -3.391 -6.114 -5.087 1.00 0.00 H new ATOM 0 HB ILE A 65 -3.070 -6.871 -2.152 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -0.931 -5.585 -3.834 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -2.165 -4.575 -3.107 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -1.162 -8.204 -2.957 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -2.695 -8.744 -3.683 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -1.560 -7.756 -4.633 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -0.183 -4.699 -1.681 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -1.581 -5.446 -0.872 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -0.327 -6.471 -1.610 1.00 0.00 H new ATOM 954 N HIS A 66 -5.003 -7.987 -5.295 1.00 0.00 N ATOM 955 CA HIS A 66 -5.959 -9.076 -5.462 1.00 0.00 C ATOM 956 C HIS A 66 -5.277 -10.429 -5.287 1.00 0.00 C ATOM 957 O HIS A 66 -4.179 -10.653 -5.796 1.00 0.00 O ATOM 958 CB HIS A 66 -6.616 -8.998 -6.840 1.00 0.00 C ATOM 959 CG HIS A 66 -7.164 -7.642 -7.167 1.00 0.00 C ATOM 960 ND1 HIS A 66 -7.937 -6.911 -6.290 1.00 0.00 N ATOM 961 CD2 HIS A 66 -7.044 -6.884 -8.282 1.00 0.00 C ATOM 962 CE1 HIS A 66 -8.270 -5.763 -6.852 1.00 0.00 C ATOM 963 NE2 HIS A 66 -7.741 -5.722 -8.061 1.00 0.00 N ATOM 0 H HIS A 66 -4.495 -7.738 -6.144 1.00 0.00 H new ATOM 0 HA HIS A 66 -6.727 -8.974 -4.695 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -5.885 -9.278 -7.598 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -7.423 -9.729 -6.890 1.00 0.00 H new ATOM 0 HD1 HIS A 66 -8.209 -7.210 -5.354 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -6.501 -7.145 -9.178 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -8.873 -4.989 -6.399 1.00 0.00 H new ATOM 971 N GLY A 67 -5.935 -11.329 -4.562 1.00 0.00 N ATOM 972 CA GLY A 67 -5.377 -12.649 -4.332 1.00 0.00 C ATOM 973 C GLY A 67 -4.201 -12.622 -3.376 1.00 0.00 C ATOM 974 O GLY A 67 -3.046 -12.583 -3.801 1.00 0.00 O ATOM 0 H GLY A 67 -6.845 -11.167 -4.130 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -6.152 -13.303 -3.932 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -5.059 -13.076 -5.283 1.00 0.00 H new ATOM 978 N LEU A 68 -4.494 -12.641 -2.080 1.00 0.00 N ATOM 979 CA LEU A 68 -3.451 -12.617 -1.060 1.00 0.00 C ATOM 980 C LEU A 68 -2.991 -14.031 -0.718 1.00 0.00 C ATOM 981 O LEU A 68 -3.775 -14.978 -0.768 1.00 0.00 O ATOM 982 CB LEU A 68 -3.960 -11.916 0.201 1.00 0.00 C ATOM 983 CG LEU A 68 -3.987 -10.388 0.154 1.00 0.00 C ATOM 984 CD1 LEU A 68 -4.682 -9.828 1.385 1.00 0.00 C ATOM 985 CD2 LEU A 68 -2.575 -9.833 0.038 1.00 0.00 C ATOM 0 H LEU A 68 -5.444 -12.673 -1.711 1.00 0.00 H new ATOM 0 HA LEU A 68 -2.600 -12.064 -1.458 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -4.970 -12.271 0.408 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -3.336 -12.223 1.040 1.00 0.00 H new ATOM 0 HG LEU A 68 -4.550 -10.081 -0.727 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -4.691 -8.739 1.334 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -5.706 -10.198 1.425 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.147 -10.144 2.280 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -2.614 -8.744 0.006 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.988 -10.150 0.900 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.111 -10.207 -0.875 1.00 0.00 H new ATOM 997 N ALA A 69 -1.716 -14.164 -0.369 1.00 0.00 N ATOM 998 CA ALA A 69 -1.152 -15.461 -0.014 1.00 0.00 C ATOM 999 C ALA A 69 0.154 -15.300 0.755 1.00 0.00 C ATOM 1000 O ALA A 69 0.592 -14.182 1.026 1.00 0.00 O ATOM 1001 CB ALA A 69 -0.931 -16.300 -1.265 1.00 0.00 C ATOM 0 H ALA A 69 -1.054 -13.390 -0.324 1.00 0.00 H new ATOM 0 HA ALA A 69 -1.863 -15.974 0.634 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.510 -17.266 -0.986 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -1.883 -16.453 -1.773 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -0.242 -15.783 -1.933 1.00 0.00 H new ATOM 1007 N MET A 70 0.772 -16.424 1.105 1.00 0.00 N ATOM 1008 CA MET A 70 2.029 -16.406 1.843 1.00 0.00 C ATOM 1009 C MET A 70 3.106 -15.658 1.065 1.00 0.00 C ATOM 1010 O MET A 70 3.716 -14.719 1.577 1.00 0.00 O ATOM 1011 CB MET A 70 2.494 -17.834 2.135 1.00 0.00 C ATOM 1012 CG MET A 70 1.709 -18.514 3.246 1.00 0.00 C ATOM 1013 SD MET A 70 0.005 -18.867 2.776 1.00 0.00 S ATOM 1014 CE MET A 70 -0.843 -17.461 3.493 1.00 0.00 C ATOM 0 H MET A 70 0.423 -17.358 0.889 1.00 0.00 H new ATOM 0 HA MET A 70 1.860 -15.886 2.786 1.00 0.00 H new ATOM 0 HB2 MET A 70 2.409 -18.428 1.225 1.00 0.00 H new ATOM 0 HB3 MET A 70 3.550 -17.815 2.406 1.00 0.00 H new ATOM 0 HG2 MET A 70 2.206 -19.444 3.520 1.00 0.00 H new ATOM 0 HG3 MET A 70 1.713 -17.877 4.131 1.00 0.00 H new ATOM 0 HE1 MET A 70 -1.637 -17.812 4.152 1.00 0.00 H new ATOM 0 HE2 MET A 70 -0.135 -16.862 4.065 1.00 0.00 H new ATOM 0 HE3 MET A 70 -1.274 -16.852 2.698 1.00 0.00 H new ATOM 1024 N ALA A 71 3.335 -16.079 -0.175 1.00 0.00 N ATOM 1025 CA ALA A 71 4.338 -15.447 -1.024 1.00 0.00 C ATOM 1026 C ALA A 71 4.197 -13.929 -1.002 1.00 0.00 C ATOM 1027 O ALA A 71 5.176 -13.203 -1.176 1.00 0.00 O ATOM 1028 CB ALA A 71 4.227 -15.969 -2.449 1.00 0.00 C ATOM 0 H ALA A 71 2.839 -16.855 -0.614 1.00 0.00 H new ATOM 0 HA ALA A 71 5.323 -15.700 -0.632 1.00 0.00 H new ATOM 0 HB1 ALA A 71 4.982 -15.489 -3.072 1.00 0.00 H new ATOM 0 HB2 ALA A 71 4.384 -17.048 -2.455 1.00 0.00 H new ATOM 0 HB3 ALA A 71 3.235 -15.745 -2.842 1.00 0.00 H new ATOM 1034 N ASP A 72 2.975 -13.456 -0.787 1.00 0.00 N ATOM 1035 CA ASP A 72 2.707 -12.023 -0.742 1.00 0.00 C ATOM 1036 C ASP A 72 3.501 -11.356 0.377 1.00 0.00 C ATOM 1037 O ASP A 72 3.961 -10.224 0.236 1.00 0.00 O ATOM 1038 CB ASP A 72 1.212 -11.768 -0.545 1.00 0.00 C ATOM 1039 CG ASP A 72 0.761 -10.460 -1.165 1.00 0.00 C ATOM 1040 OD1 ASP A 72 0.784 -10.355 -2.409 1.00 0.00 O ATOM 1041 OD2 ASP A 72 0.385 -9.542 -0.406 1.00 0.00 O ATOM 0 H ASP A 72 2.154 -14.043 -0.641 1.00 0.00 H new ATOM 0 HA ASP A 72 3.019 -11.590 -1.692 1.00 0.00 H new ATOM 0 HB2 ASP A 72 0.645 -12.589 -0.984 1.00 0.00 H new ATOM 0 HB3 ASP A 72 0.985 -11.759 0.521 1.00 0.00 H new ATOM 1046 N ASN A 73 3.657 -12.067 1.489 1.00 0.00 N ATOM 1047 CA ASN A 73 4.394 -11.543 2.633 1.00 0.00 C ATOM 1048 C ASN A 73 5.691 -10.876 2.186 1.00 0.00 C ATOM 1049 O ASN A 73 6.478 -11.462 1.444 1.00 0.00 O ATOM 1050 CB ASN A 73 4.701 -12.667 3.626 1.00 0.00 C ATOM 1051 CG ASN A 73 3.535 -12.955 4.552 1.00 0.00 C ATOM 1052 OD1 ASN A 73 3.422 -12.365 5.627 1.00 0.00 O ATOM 1053 ND2 ASN A 73 2.662 -13.865 4.138 1.00 0.00 N ATOM 0 H ASN A 73 3.283 -13.007 1.622 1.00 0.00 H new ATOM 0 HA ASN A 73 3.772 -10.794 3.123 1.00 0.00 H new ATOM 0 HB2 ASN A 73 4.958 -13.573 3.077 1.00 0.00 H new ATOM 0 HB3 ASN A 73 5.574 -12.396 4.219 1.00 0.00 H new ATOM 0 HD21 ASN A 73 1.857 -14.101 4.718 1.00 0.00 H new ATOM 0 HD22 ASN A 73 2.796 -14.329 3.239 1.00 0.00 H new ATOM 1060 N GLY A 74 5.907 -9.647 2.644 1.00 0.00 N ATOM 1061 CA GLY A 74 7.110 -8.920 2.281 1.00 0.00 C ATOM 1062 C GLY A 74 6.979 -7.429 2.516 1.00 0.00 C ATOM 1063 O GLY A 74 5.871 -6.893 2.549 1.00 0.00 O ATOM 0 H GLY A 74 5.270 -9.141 3.260 1.00 0.00 H new ATOM 0 HA2 GLY A 74 7.951 -9.303 2.859 1.00 0.00 H new ATOM 0 HA3 GLY A 74 7.337 -9.101 1.230 1.00 0.00 H new ATOM 1067 N VAL A 75 8.113 -6.755 2.682 1.00 0.00 N ATOM 1068 CA VAL A 75 8.121 -5.316 2.915 1.00 0.00 C ATOM 1069 C VAL A 75 8.006 -4.546 1.605 1.00 0.00 C ATOM 1070 O VAL A 75 8.897 -4.607 0.757 1.00 0.00 O ATOM 1071 CB VAL A 75 9.402 -4.874 3.648 1.00 0.00 C ATOM 1072 CG1 VAL A 75 10.626 -5.124 2.782 1.00 0.00 C ATOM 1073 CG2 VAL A 75 9.309 -3.408 4.043 1.00 0.00 C ATOM 0 H VAL A 75 9.038 -7.183 2.659 1.00 0.00 H new ATOM 0 HA VAL A 75 7.257 -5.092 3.541 1.00 0.00 H new ATOM 0 HB VAL A 75 9.503 -5.467 4.557 1.00 0.00 H new ATOM 0 HG11 VAL A 75 11.521 -4.806 3.316 1.00 0.00 H new ATOM 0 HG12 VAL A 75 10.699 -6.187 2.553 1.00 0.00 H new ATOM 0 HG13 VAL A 75 10.537 -4.559 1.854 1.00 0.00 H new ATOM 0 HG21 VAL A 75 10.222 -3.112 4.560 1.00 0.00 H new ATOM 0 HG22 VAL A 75 9.184 -2.797 3.149 1.00 0.00 H new ATOM 0 HG23 VAL A 75 8.455 -3.263 4.704 1.00 0.00 H new ATOM 1083 N TYR A 76 6.905 -3.821 1.446 1.00 0.00 N ATOM 1084 CA TYR A 76 6.672 -3.040 0.237 1.00 0.00 C ATOM 1085 C TYR A 76 7.340 -1.672 0.335 1.00 0.00 C ATOM 1086 O TYR A 76 7.711 -1.227 1.421 1.00 0.00 O ATOM 1087 CB TYR A 76 5.171 -2.870 -0.004 1.00 0.00 C ATOM 1088 CG TYR A 76 4.472 -4.151 -0.400 1.00 0.00 C ATOM 1089 CD1 TYR A 76 4.342 -5.201 0.501 1.00 0.00 C ATOM 1090 CD2 TYR A 76 3.943 -4.312 -1.675 1.00 0.00 C ATOM 1091 CE1 TYR A 76 3.705 -6.374 0.144 1.00 0.00 C ATOM 1092 CE2 TYR A 76 3.304 -5.481 -2.040 1.00 0.00 C ATOM 1093 CZ TYR A 76 3.187 -6.509 -1.128 1.00 0.00 C ATOM 1094 OH TYR A 76 2.552 -7.675 -1.488 1.00 0.00 O ATOM 0 H TYR A 76 6.159 -3.758 2.139 1.00 0.00 H new ATOM 0 HA TYR A 76 7.110 -3.579 -0.603 1.00 0.00 H new ATOM 0 HB2 TYR A 76 4.708 -2.479 0.902 1.00 0.00 H new ATOM 0 HB3 TYR A 76 5.019 -2.126 -0.786 1.00 0.00 H new ATOM 0 HD1 TYR A 76 4.746 -5.098 1.497 1.00 0.00 H new ATOM 0 HD2 TYR A 76 4.033 -3.510 -2.392 1.00 0.00 H new ATOM 0 HE1 TYR A 76 3.613 -7.181 0.856 1.00 0.00 H new ATOM 0 HE2 TYR A 76 2.898 -5.589 -3.035 1.00 0.00 H new ATOM 0 HH TYR A 76 1.873 -7.898 -0.818 1.00 0.00 H new ATOM 1104 N SER A 77 7.491 -1.011 -0.808 1.00 0.00 N ATOM 1105 CA SER A 77 8.117 0.305 -0.852 1.00 0.00 C ATOM 1106 C SER A 77 7.346 1.243 -1.776 1.00 0.00 C ATOM 1107 O SER A 77 6.782 0.814 -2.783 1.00 0.00 O ATOM 1108 CB SER A 77 9.568 0.187 -1.323 1.00 0.00 C ATOM 1109 OG SER A 77 9.638 -0.360 -2.628 1.00 0.00 O ATOM 0 H SER A 77 7.189 -1.365 -1.716 1.00 0.00 H new ATOM 0 HA SER A 77 8.101 0.721 0.155 1.00 0.00 H new ATOM 0 HB2 SER A 77 10.038 1.170 -1.312 1.00 0.00 H new ATOM 0 HB3 SER A 77 10.128 -0.442 -0.631 1.00 0.00 H new ATOM 0 HG SER A 77 10.576 -0.424 -2.906 1.00 0.00 H new ATOM 1115 N CYS A 78 7.327 2.524 -1.426 1.00 0.00 N ATOM 1116 CA CYS A 78 6.624 3.524 -2.222 1.00 0.00 C ATOM 1117 C CYS A 78 7.532 4.710 -2.530 1.00 0.00 C ATOM 1118 O CYS A 78 7.633 5.650 -1.741 1.00 0.00 O ATOM 1119 CB CYS A 78 5.371 4.003 -1.488 1.00 0.00 C ATOM 1120 SG CYS A 78 4.068 4.622 -2.578 1.00 0.00 S ATOM 0 H CYS A 78 7.790 2.895 -0.596 1.00 0.00 H new ATOM 0 HA CYS A 78 6.329 3.061 -3.164 1.00 0.00 H new ATOM 0 HB2 CYS A 78 4.973 3.179 -0.895 1.00 0.00 H new ATOM 0 HB3 CYS A 78 5.651 4.792 -0.790 1.00 0.00 H new ATOM 0 HG CYS A 78 3.263 3.649 -2.888 1.00 0.00 H new ATOM 1126 N VAL A 79 8.194 4.659 -3.682 1.00 0.00 N ATOM 1127 CA VAL A 79 9.095 5.729 -4.094 1.00 0.00 C ATOM 1128 C VAL A 79 8.346 6.814 -4.859 1.00 0.00 C ATOM 1129 O VAL A 79 7.649 6.532 -5.834 1.00 0.00 O ATOM 1130 CB VAL A 79 10.238 5.191 -4.975 1.00 0.00 C ATOM 1131 CG1 VAL A 79 11.320 6.247 -5.150 1.00 0.00 C ATOM 1132 CG2 VAL A 79 10.817 3.917 -4.378 1.00 0.00 C ATOM 0 H VAL A 79 8.123 3.888 -4.346 1.00 0.00 H new ATOM 0 HA VAL A 79 9.517 6.156 -3.184 1.00 0.00 H new ATOM 0 HB VAL A 79 9.833 4.953 -5.959 1.00 0.00 H new ATOM 0 HG11 VAL A 79 12.119 5.849 -5.775 1.00 0.00 H new ATOM 0 HG12 VAL A 79 10.893 7.130 -5.625 1.00 0.00 H new ATOM 0 HG13 VAL A 79 11.724 6.519 -4.175 1.00 0.00 H new ATOM 0 HG21 VAL A 79 11.623 3.551 -5.014 1.00 0.00 H new ATOM 0 HG22 VAL A 79 11.207 4.126 -3.382 1.00 0.00 H new ATOM 0 HG23 VAL A 79 10.036 3.159 -4.310 1.00 0.00 H new ATOM 1142 N CYS A 80 8.495 8.056 -4.410 1.00 0.00 N ATOM 1143 CA CYS A 80 7.832 9.185 -5.052 1.00 0.00 C ATOM 1144 C CYS A 80 8.788 9.918 -5.987 1.00 0.00 C ATOM 1145 O CYS A 80 8.612 9.907 -7.204 1.00 0.00 O ATOM 1146 CB CYS A 80 7.290 10.152 -3.998 1.00 0.00 C ATOM 1147 SG CYS A 80 6.482 11.616 -4.684 1.00 0.00 S ATOM 0 H CYS A 80 9.069 8.306 -3.605 1.00 0.00 H new ATOM 0 HA CYS A 80 7.001 8.798 -5.642 1.00 0.00 H new ATOM 0 HB2 CYS A 80 6.579 9.621 -3.365 1.00 0.00 H new ATOM 0 HB3 CYS A 80 8.112 10.471 -3.357 1.00 0.00 H new ATOM 0 HG CYS A 80 5.703 12.143 -3.786 1.00 0.00 H new ATOM 1153 N GLY A 81 9.802 10.555 -5.408 1.00 0.00 N ATOM 1154 CA GLY A 81 10.771 11.285 -6.204 1.00 0.00 C ATOM 1155 C GLY A 81 12.053 11.564 -5.446 1.00 0.00 C ATOM 1156 O GLY A 81 13.147 11.425 -5.992 1.00 0.00 O ATOM 0 H GLY A 81 9.969 10.578 -4.402 1.00 0.00 H new ATOM 0 HA2 GLY A 81 11.002 10.714 -7.103 1.00 0.00 H new ATOM 0 HA3 GLY A 81 10.332 12.228 -6.529 1.00 0.00 H new ATOM 1160 N GLN A 82 11.918 11.959 -4.184 1.00 0.00 N ATOM 1161 CA GLN A 82 13.076 12.260 -3.350 1.00 0.00 C ATOM 1162 C GLN A 82 13.059 11.426 -2.073 1.00 0.00 C ATOM 1163 O GLN A 82 14.095 11.216 -1.444 1.00 0.00 O ATOM 1164 CB GLN A 82 13.106 13.749 -3.001 1.00 0.00 C ATOM 1165 CG GLN A 82 14.393 14.189 -2.323 1.00 0.00 C ATOM 1166 CD GLN A 82 15.499 14.498 -3.313 1.00 0.00 C ATOM 1167 OE1 GLN A 82 16.436 13.717 -3.479 1.00 0.00 O ATOM 1168 NE2 GLN A 82 15.394 15.642 -3.979 1.00 0.00 N ATOM 0 H GLN A 82 11.019 12.078 -3.717 1.00 0.00 H new ATOM 0 HA GLN A 82 13.974 12.008 -3.914 1.00 0.00 H new ATOM 0 HB2 GLN A 82 12.968 14.330 -3.913 1.00 0.00 H new ATOM 0 HB3 GLN A 82 12.264 13.977 -2.347 1.00 0.00 H new ATOM 0 HG2 GLN A 82 14.196 15.073 -1.717 1.00 0.00 H new ATOM 0 HG3 GLN A 82 14.727 13.405 -1.644 1.00 0.00 H new ATOM 0 HE21 GLN A 82 14.600 16.260 -3.810 1.00 0.00 H new ATOM 0 HE22 GLN A 82 16.107 15.903 -4.660 1.00 0.00 H new ATOM 1177 N GLU A 83 11.874 10.955 -1.696 1.00 0.00 N ATOM 1178 CA GLU A 83 11.723 10.145 -0.492 1.00 0.00 C ATOM 1179 C GLU A 83 10.826 8.939 -0.757 1.00 0.00 C ATOM 1180 O GLU A 83 10.168 8.857 -1.794 1.00 0.00 O ATOM 1181 CB GLU A 83 11.143 10.987 0.646 1.00 0.00 C ATOM 1182 CG GLU A 83 11.801 12.348 0.793 1.00 0.00 C ATOM 1183 CD GLU A 83 11.617 12.939 2.178 1.00 0.00 C ATOM 1184 OE1 GLU A 83 11.107 12.222 3.064 1.00 0.00 O ATOM 1185 OE2 GLU A 83 11.981 14.116 2.374 1.00 0.00 O ATOM 0 H GLU A 83 11.006 11.120 -2.206 1.00 0.00 H new ATOM 0 HA GLU A 83 12.710 9.785 -0.201 1.00 0.00 H new ATOM 0 HB2 GLU A 83 10.075 11.126 0.476 1.00 0.00 H new ATOM 0 HB3 GLU A 83 11.248 10.439 1.582 1.00 0.00 H new ATOM 0 HG2 GLU A 83 12.866 12.257 0.579 1.00 0.00 H new ATOM 0 HG3 GLU A 83 11.384 13.031 0.052 1.00 0.00 H new ATOM 1192 N ARG A 84 10.805 8.006 0.189 1.00 0.00 N ATOM 1193 CA ARG A 84 9.990 6.804 0.058 1.00 0.00 C ATOM 1194 C ARG A 84 9.549 6.294 1.427 1.00 0.00 C ATOM 1195 O ARG A 84 9.954 6.828 2.461 1.00 0.00 O ATOM 1196 CB ARG A 84 10.769 5.712 -0.678 1.00 0.00 C ATOM 1197 CG ARG A 84 11.873 5.083 0.158 1.00 0.00 C ATOM 1198 CD ARG A 84 13.139 5.924 0.132 1.00 0.00 C ATOM 1199 NE ARG A 84 13.971 5.697 1.311 1.00 0.00 N ATOM 1200 CZ ARG A 84 14.844 4.701 1.414 1.00 0.00 C ATOM 1201 NH1 ARG A 84 14.998 3.844 0.414 1.00 0.00 N ATOM 1202 NH2 ARG A 84 15.564 4.560 2.519 1.00 0.00 N ATOM 0 H ARG A 84 11.343 8.059 1.054 1.00 0.00 H new ATOM 0 HA ARG A 84 9.101 7.059 -0.519 1.00 0.00 H new ATOM 0 HB2 ARG A 84 10.075 4.933 -0.994 1.00 0.00 H new ATOM 0 HB3 ARG A 84 11.206 6.136 -1.582 1.00 0.00 H new ATOM 0 HG2 ARG A 84 11.532 4.969 1.187 1.00 0.00 H new ATOM 0 HG3 ARG A 84 12.091 4.083 -0.218 1.00 0.00 H new ATOM 0 HD2 ARG A 84 13.711 5.690 -0.766 1.00 0.00 H new ATOM 0 HD3 ARG A 84 12.872 6.979 0.074 1.00 0.00 H new ATOM 0 HE ARG A 84 13.876 6.338 2.098 1.00 0.00 H new ATOM 0 HH11 ARG A 84 14.445 3.949 -0.437 1.00 0.00 H new ATOM 0 HH12 ARG A 84 15.669 3.080 0.496 1.00 0.00 H new ATOM 0 HH21 ARG A 84 15.448 5.217 3.291 1.00 0.00 H new ATOM 0 HH22 ARG A 84 16.234 3.795 2.597 1.00 0.00 H new ATOM 1216 N THR A 85 8.716 5.258 1.427 1.00 0.00 N ATOM 1217 CA THR A 85 8.219 4.678 2.668 1.00 0.00 C ATOM 1218 C THR A 85 8.009 3.174 2.526 1.00 0.00 C ATOM 1219 O THR A 85 7.473 2.705 1.522 1.00 0.00 O ATOM 1220 CB THR A 85 6.893 5.331 3.102 1.00 0.00 C ATOM 1221 OG1 THR A 85 6.426 4.733 4.316 1.00 0.00 O ATOM 1222 CG2 THR A 85 5.836 5.182 2.018 1.00 0.00 C ATOM 0 H THR A 85 8.372 4.804 0.581 1.00 0.00 H new ATOM 0 HA THR A 85 8.975 4.867 3.430 1.00 0.00 H new ATOM 0 HB THR A 85 7.074 6.393 3.267 1.00 0.00 H new ATOM 0 HG1 THR A 85 6.510 5.376 5.051 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.909 5.651 2.347 1.00 0.00 H new ATOM 0 HG22 THR A 85 6.182 5.664 1.104 1.00 0.00 H new ATOM 0 HG23 THR A 85 5.659 4.124 1.825 1.00 0.00 H new ATOM 1230 N SER A 86 8.434 2.424 3.537 1.00 0.00 N ATOM 1231 CA SER A 86 8.295 0.973 3.524 1.00 0.00 C ATOM 1232 C SER A 86 7.366 0.505 4.641 1.00 0.00 C ATOM 1233 O SER A 86 7.391 1.041 5.748 1.00 0.00 O ATOM 1234 CB SER A 86 9.664 0.307 3.671 1.00 0.00 C ATOM 1235 OG SER A 86 10.324 0.751 4.844 1.00 0.00 O ATOM 0 H SER A 86 8.878 2.797 4.376 1.00 0.00 H new ATOM 0 HA SER A 86 7.859 0.684 2.568 1.00 0.00 H new ATOM 0 HB2 SER A 86 9.543 -0.776 3.706 1.00 0.00 H new ATOM 0 HB3 SER A 86 10.277 0.532 2.798 1.00 0.00 H new ATOM 0 HG SER A 86 11.196 0.309 4.916 1.00 0.00 H new ATOM 1241 N ALA A 87 6.547 -0.497 4.340 1.00 0.00 N ATOM 1242 CA ALA A 87 5.612 -1.039 5.318 1.00 0.00 C ATOM 1243 C ALA A 87 5.652 -2.564 5.330 1.00 0.00 C ATOM 1244 O ALA A 87 6.259 -3.186 4.458 1.00 0.00 O ATOM 1245 CB ALA A 87 4.201 -0.548 5.027 1.00 0.00 C ATOM 0 H ALA A 87 6.512 -0.950 3.427 1.00 0.00 H new ATOM 0 HA ALA A 87 5.912 -0.686 6.305 1.00 0.00 H new ATOM 0 HB1 ALA A 87 3.513 -0.960 5.765 1.00 0.00 H new ATOM 0 HB2 ALA A 87 4.177 0.541 5.077 1.00 0.00 H new ATOM 0 HB3 ALA A 87 3.901 -0.872 4.030 1.00 0.00 H new ATOM 1251 N THR A 88 5.001 -3.160 6.323 1.00 0.00 N ATOM 1252 CA THR A 88 4.963 -4.612 6.450 1.00 0.00 C ATOM 1253 C THR A 88 3.537 -5.137 6.334 1.00 0.00 C ATOM 1254 O THR A 88 2.627 -4.644 7.002 1.00 0.00 O ATOM 1255 CB THR A 88 5.562 -5.074 7.791 1.00 0.00 C ATOM 1256 OG1 THR A 88 6.863 -4.504 7.970 1.00 0.00 O ATOM 1257 CG2 THR A 88 5.656 -6.592 7.848 1.00 0.00 C ATOM 0 H THR A 88 4.492 -2.660 7.052 1.00 0.00 H new ATOM 0 HA THR A 88 5.563 -5.017 5.635 1.00 0.00 H new ATOM 0 HB THR A 88 4.905 -4.736 8.592 1.00 0.00 H new ATOM 0 HG1 THR A 88 7.236 -4.802 8.826 1.00 0.00 H new ATOM 0 HG21 THR A 88 6.082 -6.894 8.805 1.00 0.00 H new ATOM 0 HG22 THR A 88 4.660 -7.022 7.742 1.00 0.00 H new ATOM 0 HG23 THR A 88 6.293 -6.948 7.038 1.00 0.00 H new ATOM 1265 N LEU A 89 3.348 -6.140 5.484 1.00 0.00 N ATOM 1266 CA LEU A 89 2.031 -6.734 5.282 1.00 0.00 C ATOM 1267 C LEU A 89 2.032 -8.208 5.675 1.00 0.00 C ATOM 1268 O LEU A 89 2.748 -9.019 5.087 1.00 0.00 O ATOM 1269 CB LEU A 89 1.601 -6.584 3.822 1.00 0.00 C ATOM 1270 CG LEU A 89 0.335 -7.339 3.414 1.00 0.00 C ATOM 1271 CD1 LEU A 89 -0.905 -6.599 3.892 1.00 0.00 C ATOM 1272 CD2 LEU A 89 0.294 -7.535 1.905 1.00 0.00 C ATOM 0 H LEU A 89 4.090 -6.559 4.923 1.00 0.00 H new ATOM 0 HA LEU A 89 1.321 -6.208 5.920 1.00 0.00 H new ATOM 0 HB2 LEU A 89 1.450 -5.524 3.616 1.00 0.00 H new ATOM 0 HB3 LEU A 89 2.421 -6.919 3.186 1.00 0.00 H new ATOM 0 HG LEU A 89 0.352 -8.321 3.887 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.796 -7.151 3.593 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.880 -6.511 4.978 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -0.928 -5.604 3.448 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -0.613 -8.074 1.633 1.00 0.00 H new ATOM 0 HD22 LEU A 89 0.301 -6.563 1.412 1.00 0.00 H new ATOM 0 HD23 LEU A 89 1.165 -8.109 1.589 1.00 0.00 H new ATOM 1284 N THR A 90 1.222 -8.549 6.673 1.00 0.00 N ATOM 1285 CA THR A 90 1.128 -9.925 7.144 1.00 0.00 C ATOM 1286 C THR A 90 -0.116 -10.612 6.592 1.00 0.00 C ATOM 1287 O THR A 90 -1.237 -10.150 6.803 1.00 0.00 O ATOM 1288 CB THR A 90 1.098 -9.992 8.683 1.00 0.00 C ATOM 1289 OG1 THR A 90 2.312 -9.457 9.220 1.00 0.00 O ATOM 1290 CG2 THR A 90 0.914 -11.424 9.159 1.00 0.00 C ATOM 0 H THR A 90 0.622 -7.891 7.170 1.00 0.00 H new ATOM 0 HA THR A 90 2.016 -10.443 6.783 1.00 0.00 H new ATOM 0 HB THR A 90 0.254 -9.399 9.034 1.00 0.00 H new ATOM 0 HG1 THR A 90 2.284 -9.502 10.199 1.00 0.00 H new ATOM 0 HG21 THR A 90 0.896 -11.446 10.249 1.00 0.00 H new ATOM 0 HG22 THR A 90 -0.026 -11.818 8.773 1.00 0.00 H new ATOM 0 HG23 THR A 90 1.740 -12.037 8.798 1.00 0.00 H new ATOM 1298 N VAL A 91 0.089 -11.719 5.885 1.00 0.00 N ATOM 1299 CA VAL A 91 -1.017 -12.471 5.304 1.00 0.00 C ATOM 1300 C VAL A 91 -1.197 -13.813 6.004 1.00 0.00 C ATOM 1301 O VAL A 91 -0.272 -14.624 6.060 1.00 0.00 O ATOM 1302 CB VAL A 91 -0.801 -12.714 3.799 1.00 0.00 C ATOM 1303 CG1 VAL A 91 -2.004 -13.421 3.194 1.00 0.00 C ATOM 1304 CG2 VAL A 91 -0.527 -11.401 3.081 1.00 0.00 C ATOM 0 H VAL A 91 1.011 -12.115 5.701 1.00 0.00 H new ATOM 0 HA VAL A 91 -1.916 -11.870 5.442 1.00 0.00 H new ATOM 0 HB VAL A 91 0.069 -13.358 3.674 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.833 -13.584 2.130 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -2.149 -14.381 3.690 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -2.893 -12.805 3.328 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -0.377 -11.592 2.018 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -1.376 -10.730 3.213 1.00 0.00 H new ATOM 0 HG23 VAL A 91 0.368 -10.939 3.497 1.00 0.00 H new ATOM 1314 N ARG A 92 -2.392 -14.041 6.537 1.00 0.00 N ATOM 1315 CA ARG A 92 -2.694 -15.285 7.235 1.00 0.00 C ATOM 1316 C ARG A 92 -3.270 -16.321 6.274 1.00 0.00 C ATOM 1317 O ARG A 92 -3.762 -15.979 5.199 1.00 0.00 O ATOM 1318 CB ARG A 92 -3.679 -15.029 8.377 1.00 0.00 C ATOM 1319 CG ARG A 92 -3.015 -14.552 9.658 1.00 0.00 C ATOM 1320 CD ARG A 92 -2.548 -15.720 10.513 1.00 0.00 C ATOM 1321 NE ARG A 92 -2.508 -15.378 11.932 1.00 0.00 N ATOM 1322 CZ ARG A 92 -1.563 -14.623 12.480 1.00 0.00 C ATOM 1323 NH1 ARG A 92 -0.584 -14.134 11.731 1.00 0.00 N ATOM 1324 NH2 ARG A 92 -1.595 -14.356 13.779 1.00 0.00 N ATOM 0 H ARG A 92 -3.168 -13.380 6.499 1.00 0.00 H new ATOM 0 HA ARG A 92 -1.764 -15.675 7.648 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -4.408 -14.285 8.057 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -4.230 -15.947 8.583 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -2.164 -13.916 9.413 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -3.716 -13.941 10.227 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -3.216 -16.568 10.363 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -1.556 -16.034 10.188 1.00 0.00 H new ATOM 0 HE ARG A 92 -3.247 -15.739 12.536 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -0.556 -14.338 10.732 1.00 0.00 H new ATOM 0 HH12 ARG A 92 0.141 -13.554 12.154 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -2.346 -14.731 14.358 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -0.868 -13.776 14.198 1.00 0.00 H new ATOM 1338 N ALA A 93 -3.206 -17.588 6.670 1.00 0.00 N ATOM 1339 CA ALA A 93 -3.722 -18.673 5.845 1.00 0.00 C ATOM 1340 C ALA A 93 -5.087 -19.139 6.342 1.00 0.00 C ATOM 1341 O ALA A 93 -5.334 -19.194 7.548 1.00 0.00 O ATOM 1342 CB ALA A 93 -2.741 -19.836 5.827 1.00 0.00 C ATOM 0 H ALA A 93 -2.802 -17.888 7.557 1.00 0.00 H new ATOM 0 HA ALA A 93 -3.842 -18.297 4.829 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -3.140 -20.639 5.207 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -1.787 -19.501 5.418 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -2.592 -20.202 6.843 1.00 0.00 H new ATOM 1348 N LEU A 94 -5.970 -19.471 5.407 1.00 0.00 N ATOM 1349 CA LEU A 94 -7.311 -19.931 5.750 1.00 0.00 C ATOM 1350 C LEU A 94 -7.282 -21.374 6.242 1.00 0.00 C ATOM 1351 O LEU A 94 -6.508 -22.204 5.765 1.00 0.00 O ATOM 1352 CB LEU A 94 -8.238 -19.811 4.539 1.00 0.00 C ATOM 1353 CG LEU A 94 -8.575 -18.389 4.090 1.00 0.00 C ATOM 1354 CD1 LEU A 94 -8.993 -18.376 2.627 1.00 0.00 C ATOM 1355 CD2 LEU A 94 -9.671 -17.798 4.965 1.00 0.00 C ATOM 0 H LEU A 94 -5.782 -19.430 4.405 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.691 -19.300 6.554 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.778 -20.336 3.701 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -9.170 -20.329 4.767 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.682 -17.774 4.197 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -9.229 -17.356 2.325 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -8.177 -18.757 2.012 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -9.872 -19.006 2.494 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.897 -16.786 4.630 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -10.567 -18.414 4.891 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -9.334 -17.771 6.001 1.00 0.00 H new ATOM 1367 N PRO A 95 -8.148 -21.685 7.218 1.00 0.00 N ATOM 1368 CA PRO A 95 -8.244 -23.029 7.794 1.00 0.00 C ATOM 1369 C PRO A 95 -8.834 -24.039 6.816 1.00 0.00 C ATOM 1370 O PRO A 95 -10.034 -24.021 6.540 1.00 0.00 O ATOM 1371 CB PRO A 95 -9.177 -22.837 8.992 1.00 0.00 C ATOM 1372 CG PRO A 95 -9.997 -21.642 8.645 1.00 0.00 C ATOM 1373 CD PRO A 95 -9.102 -20.746 7.835 1.00 0.00 C ATOM 0 HA PRO A 95 -7.265 -23.429 8.059 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -9.804 -23.715 9.151 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -8.613 -22.677 9.911 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -10.881 -21.928 8.076 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -10.347 -21.134 9.544 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -9.663 -20.191 7.083 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -8.595 -20.012 8.461 1.00 0.00 H new ATOM 1381 N ALA A 96 -7.985 -24.917 6.294 1.00 0.00 N ATOM 1382 CA ALA A 96 -8.424 -25.936 5.349 1.00 0.00 C ATOM 1383 C ALA A 96 -9.091 -27.103 6.069 1.00 0.00 C ATOM 1384 O ALA A 96 -8.438 -28.090 6.408 1.00 0.00 O ATOM 1385 CB ALA A 96 -7.247 -26.428 4.519 1.00 0.00 C ATOM 0 H ALA A 96 -6.988 -24.943 6.510 1.00 0.00 H new ATOM 0 HA ALA A 96 -9.161 -25.486 4.684 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -7.589 -27.189 3.817 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -6.817 -25.593 3.967 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -6.491 -26.856 5.177 1.00 0.00 H new ATOM 1391 N ARG A 97 -10.394 -26.982 6.300 1.00 0.00 N ATOM 1392 CA ARG A 97 -11.149 -28.026 6.982 1.00 0.00 C ATOM 1393 C ARG A 97 -12.210 -28.620 6.060 1.00 0.00 C ATOM 1394 O ARG A 97 -12.764 -27.927 5.206 1.00 0.00 O ATOM 1395 CB ARG A 97 -11.809 -27.467 8.243 1.00 0.00 C ATOM 1396 CG ARG A 97 -10.863 -27.356 9.428 1.00 0.00 C ATOM 1397 CD ARG A 97 -11.623 -27.236 10.739 1.00 0.00 C ATOM 1398 NE ARG A 97 -10.731 -26.991 11.869 1.00 0.00 N ATOM 1399 CZ ARG A 97 -9.964 -27.928 12.416 1.00 0.00 C ATOM 1400 NH1 ARG A 97 -9.981 -29.165 11.938 1.00 0.00 N ATOM 1401 NH2 ARG A 97 -9.178 -27.628 13.442 1.00 0.00 N ATOM 0 H ARG A 97 -10.949 -26.171 6.025 1.00 0.00 H new ATOM 0 HA ARG A 97 -10.454 -28.817 7.264 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -12.218 -26.481 8.022 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -12.648 -28.106 8.517 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -10.215 -28.232 9.461 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -10.218 -26.487 9.300 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -12.346 -26.424 10.666 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -12.188 -28.151 10.915 1.00 0.00 H new ATOM 0 HE ARG A 97 -10.695 -26.049 12.260 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -10.584 -29.399 11.149 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -9.391 -29.883 12.359 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -9.162 -26.677 13.811 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -8.590 -28.348 13.861 1.00 0.00 H new ATOM 1415 N PHE A 98 -12.488 -29.908 6.238 1.00 0.00 N ATOM 1416 CA PHE A 98 -13.481 -30.595 5.421 1.00 0.00 C ATOM 1417 C PHE A 98 -14.750 -30.869 6.224 1.00 0.00 C ATOM 1418 O PHE A 98 -14.697 -31.076 7.437 1.00 0.00 O ATOM 1419 CB PHE A 98 -12.910 -31.910 4.885 1.00 0.00 C ATOM 1420 CG PHE A 98 -13.003 -33.047 5.862 1.00 0.00 C ATOM 1421 CD1 PHE A 98 -12.018 -33.240 6.816 1.00 0.00 C ATOM 1422 CD2 PHE A 98 -14.076 -33.922 5.825 1.00 0.00 C ATOM 1423 CE1 PHE A 98 -12.100 -34.286 7.717 1.00 0.00 C ATOM 1424 CE2 PHE A 98 -14.165 -34.969 6.724 1.00 0.00 C ATOM 1425 CZ PHE A 98 -13.175 -35.152 7.670 1.00 0.00 C ATOM 0 H PHE A 98 -12.040 -30.496 6.940 1.00 0.00 H new ATOM 0 HA PHE A 98 -13.735 -29.948 4.581 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -13.440 -32.182 3.972 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -11.865 -31.759 4.614 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -11.176 -32.565 6.857 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -14.852 -33.785 5.086 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -11.325 -34.425 8.456 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -15.008 -35.643 6.687 1.00 0.00 H new ATOM 0 HZ PHE A 98 -13.241 -35.971 8.371 1.00 0.00 H new ATOM 1435 N ILE A 99 -15.888 -30.867 5.539 1.00 0.00 N ATOM 1436 CA ILE A 99 -17.170 -31.116 6.187 1.00 0.00 C ATOM 1437 C ILE A 99 -17.077 -32.289 7.156 1.00 0.00 C ATOM 1438 O ILE A 99 -16.885 -33.433 6.744 1.00 0.00 O ATOM 1439 CB ILE A 99 -18.276 -31.403 5.155 1.00 0.00 C ATOM 1440 CG1 ILE A 99 -18.425 -30.223 4.193 1.00 0.00 C ATOM 1441 CG2 ILE A 99 -19.594 -31.690 5.858 1.00 0.00 C ATOM 1442 CD1 ILE A 99 -19.123 -30.582 2.900 1.00 0.00 C ATOM 0 H ILE A 99 -15.949 -30.696 4.535 1.00 0.00 H new ATOM 0 HA ILE A 99 -17.426 -30.212 6.739 1.00 0.00 H new ATOM 0 HB ILE A 99 -17.995 -32.284 4.578 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -18.983 -29.429 4.689 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -17.437 -29.824 3.964 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -20.366 -31.891 5.115 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -19.479 -32.559 6.506 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -19.883 -30.826 6.457 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -19.194 -29.698 2.267 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -18.555 -31.355 2.382 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -20.125 -30.953 3.118 1.00 0.00 H new ATOM 1454 N GLU A 100 -17.217 -31.997 8.446 1.00 0.00 N ATOM 1455 CA GLU A 100 -17.150 -33.029 9.473 1.00 0.00 C ATOM 1456 C GLU A 100 -18.504 -33.210 10.152 1.00 0.00 C ATOM 1457 O GLU A 100 -19.444 -32.458 9.895 1.00 0.00 O ATOM 1458 CB GLU A 100 -16.088 -32.674 10.516 1.00 0.00 C ATOM 1459 CG GLU A 100 -16.318 -31.329 11.185 1.00 0.00 C ATOM 1460 CD GLU A 100 -15.357 -31.074 12.330 1.00 0.00 C ATOM 1461 OE1 GLU A 100 -14.169 -31.436 12.197 1.00 0.00 O ATOM 1462 OE2 GLU A 100 -15.792 -30.514 13.357 1.00 0.00 O ATOM 0 H GLU A 100 -17.377 -31.055 8.803 1.00 0.00 H new ATOM 0 HA GLU A 100 -16.876 -33.967 8.991 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -16.067 -33.451 11.280 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -15.108 -32.670 10.038 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -16.213 -30.536 10.444 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -17.341 -31.283 11.558 1.00 0.00 H new ATOM 1469 N ASP A 101 -18.596 -34.213 11.018 1.00 0.00 N ATOM 1470 CA ASP A 101 -19.835 -34.493 11.735 1.00 0.00 C ATOM 1471 C ASP A 101 -19.550 -34.878 13.183 1.00 0.00 C ATOM 1472 O ASP A 101 -18.709 -35.735 13.454 1.00 0.00 O ATOM 1473 CB ASP A 101 -20.609 -35.614 11.039 1.00 0.00 C ATOM 1474 CG ASP A 101 -21.495 -35.099 9.922 1.00 0.00 C ATOM 1475 OD1 ASP A 101 -21.886 -33.915 9.973 1.00 0.00 O ATOM 1476 OD2 ASP A 101 -21.797 -35.881 8.996 1.00 0.00 O ATOM 0 H ASP A 101 -17.828 -34.846 11.241 1.00 0.00 H new ATOM 0 HA ASP A 101 -20.441 -33.587 11.732 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -19.905 -36.341 10.634 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -21.222 -36.138 11.772 1.00 0.00 H new ATOM 1481 N SER A 102 -20.255 -34.237 14.110 1.00 0.00 N ATOM 1482 CA SER A 102 -20.074 -34.509 15.532 1.00 0.00 C ATOM 1483 C SER A 102 -21.419 -34.550 16.252 1.00 0.00 C ATOM 1484 O SER A 102 -22.295 -33.724 16.002 1.00 0.00 O ATOM 1485 CB SER A 102 -19.175 -33.445 16.165 1.00 0.00 C ATOM 1486 OG SER A 102 -19.855 -32.207 16.284 1.00 0.00 O ATOM 0 H SER A 102 -20.956 -33.526 13.902 1.00 0.00 H new ATOM 0 HA SER A 102 -19.598 -35.484 15.634 1.00 0.00 H new ATOM 0 HB2 SER A 102 -18.848 -33.780 17.149 1.00 0.00 H new ATOM 0 HB3 SER A 102 -18.279 -33.314 15.559 1.00 0.00 H new ATOM 0 HG SER A 102 -19.260 -31.545 16.693 1.00 0.00 H new ATOM 1492 N GLY A 103 -21.573 -35.519 17.149 1.00 0.00 N ATOM 1493 CA GLY A 103 -22.812 -35.651 17.893 1.00 0.00 C ATOM 1494 C GLY A 103 -22.929 -36.991 18.591 1.00 0.00 C ATOM 1495 O GLY A 103 -22.460 -38.016 18.096 1.00 0.00 O ATOM 0 H GLY A 103 -20.862 -36.215 17.374 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -22.875 -34.853 18.633 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -23.655 -35.524 17.214 1.00 0.00 H new ATOM 1499 N PRO A 104 -23.568 -36.995 19.770 1.00 0.00 N ATOM 1500 CA PRO A 104 -23.759 -38.213 20.563 1.00 0.00 C ATOM 1501 C PRO A 104 -24.746 -39.178 19.915 1.00 0.00 C ATOM 1502 O PRO A 104 -24.457 -40.364 19.757 1.00 0.00 O ATOM 1503 CB PRO A 104 -24.316 -37.689 21.889 1.00 0.00 C ATOM 1504 CG PRO A 104 -24.967 -36.394 21.542 1.00 0.00 C ATOM 1505 CD PRO A 104 -24.153 -35.810 20.420 1.00 0.00 C ATOM 0 HA PRO A 104 -22.834 -38.780 20.668 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -25.032 -38.388 22.322 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -23.523 -37.549 22.624 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -26.002 -36.547 21.235 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -24.985 -35.724 22.401 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -24.773 -35.238 19.730 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -23.383 -35.134 20.792 1.00 0.00 H new ATOM 1513 N SER A 105 -25.912 -38.661 19.540 1.00 0.00 N ATOM 1514 CA SER A 105 -26.944 -39.478 18.911 1.00 0.00 C ATOM 1515 C SER A 105 -27.390 -38.865 17.588 1.00 0.00 C ATOM 1516 O SER A 105 -27.155 -37.686 17.326 1.00 0.00 O ATOM 1517 CB SER A 105 -28.144 -39.630 19.847 1.00 0.00 C ATOM 1518 OG SER A 105 -28.825 -40.850 19.610 1.00 0.00 O ATOM 0 H SER A 105 -26.166 -37.680 19.661 1.00 0.00 H new ATOM 0 HA SER A 105 -26.522 -40.463 18.711 1.00 0.00 H new ATOM 0 HB2 SER A 105 -27.808 -39.593 20.883 1.00 0.00 H new ATOM 0 HB3 SER A 105 -28.829 -38.794 19.704 1.00 0.00 H new ATOM 0 HG SER A 105 -29.587 -40.924 20.222 1.00 0.00 H new ATOM 1524 N SER A 106 -28.036 -39.676 16.756 1.00 0.00 N ATOM 1525 CA SER A 106 -28.513 -39.216 15.457 1.00 0.00 C ATOM 1526 C SER A 106 -29.239 -37.880 15.586 1.00 0.00 C ATOM 1527 O SER A 106 -29.045 -36.974 14.777 1.00 0.00 O ATOM 1528 CB SER A 106 -29.445 -40.257 14.834 1.00 0.00 C ATOM 1529 OG SER A 106 -30.680 -40.315 15.527 1.00 0.00 O ATOM 0 H SER A 106 -28.241 -40.654 16.958 1.00 0.00 H new ATOM 0 HA SER A 106 -27.648 -39.079 14.808 1.00 0.00 H new ATOM 0 HB2 SER A 106 -29.623 -40.010 13.787 1.00 0.00 H new ATOM 0 HB3 SER A 106 -28.967 -41.236 14.854 1.00 0.00 H new ATOM 0 HG SER A 106 -31.259 -40.986 15.109 1.00 0.00 H new ATOM 1535 N GLY A 107 -30.077 -37.766 16.612 1.00 0.00 N ATOM 1536 CA GLY A 107 -30.819 -36.538 16.830 1.00 0.00 C ATOM 1537 C GLY A 107 -31.685 -36.166 15.643 1.00 0.00 C ATOM 1538 O GLY A 107 -32.904 -36.043 15.770 1.00 0.00 O ATOM 0 H GLY A 107 -30.255 -38.502 17.296 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -31.447 -36.649 17.714 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -30.121 -35.727 17.035 1.00 0.00 H new TER 1542 GLY A 107