USER MOD reduce.3.24.130724 H: found=0, std=0, add=773, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 771 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 25 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 54 SER OG : rot 180:sc= 0 USER MOD Set 1.3: A 67 HIS : no HD1:sc=-0.00865 X(o=-0.0086,f=-0.0086) USER MOD Set 2.1: A 30 CYS SG : rot 180:sc= -0.575 USER MOD Set 2.2: A 79 CYS SG : rot 112:sc= 0.0352 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 61:sc= 0.412 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 GLN :FLIP amide:sc= 0.263 F(o=-0.37,f=0.26) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 170:sc= -0.693 USER MOD Single : A 18 LYS NZ :NH3+ 144:sc= -0.423 (180deg=-1.72!) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 27 THR OG1 : rot -18:sc= 0.789 USER MOD Single : A 29 GLN : amide:sc= 0.214 K(o=0.21,f=-0.93) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ -168:sc= 1.09 (180deg=0.371) USER MOD Single : A 41 LYS NZ :NH3+ 162:sc= -0.325 (180deg=-0.942) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= -0.155 (180deg=-0.155) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.757 USER MOD Single : A 53 TYR OH : rot 27:sc= 0.528 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN : amide:sc= 0.961 K(o=0.96,f=-0.31) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 CYS SG : rot 140:sc= 0 USER MOD Single : A 65 GLN : amide:sc= 0 K(o=0,f=-0.92) USER MOD Single : A 70 SER OG : rot 7:sc= 0.0991 USER MOD Single : A 77 TYR OH : rot -31:sc= 0.0953 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 MET CE :methyl 177:sc= 0 (180deg=-0.0359) USER MOD Single : A 81 CYS SG : rot -130:sc= -3.56! USER MOD Single : A 83 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 86 THR OG1 : rot 160:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 180:sc= -0.0163 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 22.289 33.861 -15.252 1.00 0.00 N ATOM 2 CA GLY A 1 21.126 33.002 -15.375 1.00 0.00 C ATOM 3 C GLY A 1 20.144 33.190 -14.236 1.00 0.00 C ATOM 4 O GLY A 1 19.601 34.279 -14.049 1.00 0.00 O ATOM 0 H1 GLY A 1 22.930 33.695 -16.054 1.00 0.00 H new ATOM 0 H2 GLY A 1 21.987 34.856 -15.250 1.00 0.00 H new ATOM 0 H3 GLY A 1 22.785 33.648 -14.363 1.00 0.00 H new ATOM 0 HA2 GLY A 1 20.625 33.208 -16.321 1.00 0.00 H new ATOM 0 HA3 GLY A 1 21.448 31.961 -15.405 1.00 0.00 H new ATOM 8 N SER A 2 19.913 32.126 -13.473 1.00 0.00 N ATOM 9 CA SER A 2 18.985 32.177 -12.350 1.00 0.00 C ATOM 10 C SER A 2 19.170 33.464 -11.551 1.00 0.00 C ATOM 11 O SER A 2 20.247 33.727 -11.017 1.00 0.00 O ATOM 12 CB SER A 2 19.185 30.965 -11.439 1.00 0.00 C ATOM 13 OG SER A 2 18.523 29.824 -11.956 1.00 0.00 O ATOM 0 H SER A 2 20.356 31.218 -13.613 1.00 0.00 H new ATOM 0 HA SER A 2 17.971 32.159 -12.748 1.00 0.00 H new ATOM 0 HB2 SER A 2 20.250 30.756 -11.335 1.00 0.00 H new ATOM 0 HB3 SER A 2 18.806 31.189 -10.442 1.00 0.00 H new ATOM 0 HG SER A 2 18.667 29.062 -11.357 1.00 0.00 H new ATOM 19 N SER A 3 18.110 34.262 -11.473 1.00 0.00 N ATOM 20 CA SER A 3 18.155 35.524 -10.743 1.00 0.00 C ATOM 21 C SER A 3 16.772 35.897 -10.218 1.00 0.00 C ATOM 22 O SER A 3 15.886 36.275 -10.983 1.00 0.00 O ATOM 23 CB SER A 3 18.690 36.639 -11.642 1.00 0.00 C ATOM 24 OG SER A 3 18.846 37.847 -10.918 1.00 0.00 O ATOM 0 H SER A 3 17.210 34.057 -11.906 1.00 0.00 H new ATOM 0 HA SER A 3 18.826 35.400 -9.893 1.00 0.00 H new ATOM 0 HB2 SER A 3 19.648 36.340 -12.067 1.00 0.00 H new ATOM 0 HB3 SER A 3 18.007 36.797 -12.476 1.00 0.00 H new ATOM 0 HG SER A 3 19.191 38.544 -11.515 1.00 0.00 H new ATOM 30 N GLY A 4 16.595 35.788 -8.904 1.00 0.00 N ATOM 31 CA GLY A 4 15.318 36.117 -8.298 1.00 0.00 C ATOM 32 C GLY A 4 15.185 35.567 -6.892 1.00 0.00 C ATOM 33 O GLY A 4 15.924 34.665 -6.499 1.00 0.00 O ATOM 0 H GLY A 4 17.313 35.478 -8.249 1.00 0.00 H new ATOM 0 HA2 GLY A 4 15.199 37.200 -8.274 1.00 0.00 H new ATOM 0 HA3 GLY A 4 14.513 35.722 -8.917 1.00 0.00 H new ATOM 37 N SER A 5 14.240 36.111 -6.132 1.00 0.00 N ATOM 38 CA SER A 5 14.016 35.673 -4.760 1.00 0.00 C ATOM 39 C SER A 5 13.122 34.437 -4.723 1.00 0.00 C ATOM 40 O SER A 5 12.224 34.331 -3.888 1.00 0.00 O ATOM 41 CB SER A 5 13.383 36.798 -3.939 1.00 0.00 C ATOM 42 OG SER A 5 12.019 36.975 -4.283 1.00 0.00 O ATOM 0 H SER A 5 13.617 36.856 -6.444 1.00 0.00 H new ATOM 0 HA SER A 5 14.982 35.415 -4.326 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.467 36.569 -2.877 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.928 37.727 -4.108 1.00 0.00 H new ATOM 0 HG SER A 5 11.524 36.150 -4.094 1.00 0.00 H new ATOM 48 N SER A 6 13.376 33.504 -5.636 1.00 0.00 N ATOM 49 CA SER A 6 12.593 32.277 -5.712 1.00 0.00 C ATOM 50 C SER A 6 13.462 31.058 -5.416 1.00 0.00 C ATOM 51 O SER A 6 14.653 31.041 -5.725 1.00 0.00 O ATOM 52 CB SER A 6 11.956 32.138 -7.096 1.00 0.00 C ATOM 53 OG SER A 6 11.150 30.975 -7.173 1.00 0.00 O ATOM 0 H SER A 6 14.118 33.575 -6.333 1.00 0.00 H new ATOM 0 HA SER A 6 11.805 32.332 -4.961 1.00 0.00 H new ATOM 0 HB2 SER A 6 11.351 33.019 -7.311 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.736 32.094 -7.856 1.00 0.00 H new ATOM 0 HG SER A 6 10.753 30.911 -8.067 1.00 0.00 H new ATOM 59 N GLY A 7 12.856 30.039 -4.814 1.00 0.00 N ATOM 60 CA GLY A 7 13.589 28.830 -4.485 1.00 0.00 C ATOM 61 C GLY A 7 12.679 27.633 -4.300 1.00 0.00 C ATOM 62 O GLY A 7 11.541 27.755 -3.846 1.00 0.00 O ATOM 0 H GLY A 7 11.871 30.029 -4.548 1.00 0.00 H new ATOM 0 HA2 GLY A 7 14.307 28.617 -5.277 1.00 0.00 H new ATOM 0 HA3 GLY A 7 14.161 28.993 -3.571 1.00 0.00 H new ATOM 66 N PRO A 8 13.181 26.442 -4.659 1.00 0.00 N ATOM 67 CA PRO A 8 12.420 25.194 -4.541 1.00 0.00 C ATOM 68 C PRO A 8 12.212 24.778 -3.089 1.00 0.00 C ATOM 69 O PRO A 8 12.912 25.247 -2.192 1.00 0.00 O ATOM 70 CB PRO A 8 13.298 24.173 -5.269 1.00 0.00 C ATOM 71 CG PRO A 8 14.679 24.726 -5.175 1.00 0.00 C ATOM 72 CD PRO A 8 14.529 26.222 -5.208 1.00 0.00 C ATOM 0 HA PRO A 8 11.417 25.287 -4.957 1.00 0.00 H new ATOM 0 HB2 PRO A 8 13.232 23.190 -4.802 1.00 0.00 H new ATOM 0 HB3 PRO A 8 12.989 24.054 -6.307 1.00 0.00 H new ATOM 0 HG2 PRO A 8 15.167 24.403 -4.255 1.00 0.00 H new ATOM 0 HG3 PRO A 8 15.296 24.377 -6.003 1.00 0.00 H new ATOM 0 HD2 PRO A 8 15.293 26.716 -4.607 1.00 0.00 H new ATOM 0 HD3 PRO A 8 14.619 26.613 -6.222 1.00 0.00 H new ATOM 80 N ALA A 9 11.245 23.894 -2.864 1.00 0.00 N ATOM 81 CA ALA A 9 10.946 23.413 -1.521 1.00 0.00 C ATOM 82 C ALA A 9 11.880 22.275 -1.125 1.00 0.00 C ATOM 83 O ALA A 9 12.515 21.655 -1.979 1.00 0.00 O ATOM 84 CB ALA A 9 9.495 22.963 -1.432 1.00 0.00 C ATOM 0 H ALA A 9 10.655 23.496 -3.595 1.00 0.00 H new ATOM 0 HA ALA A 9 11.103 24.236 -0.824 1.00 0.00 H new ATOM 0 HB1 ALA A 9 9.286 22.606 -0.423 1.00 0.00 H new ATOM 0 HB2 ALA A 9 8.839 23.802 -1.663 1.00 0.00 H new ATOM 0 HB3 ALA A 9 9.319 22.158 -2.145 1.00 0.00 H new ATOM 90 N ARG A 10 11.960 22.006 0.174 1.00 0.00 N ATOM 91 CA ARG A 10 12.819 20.943 0.682 1.00 0.00 C ATOM 92 C ARG A 10 12.087 20.107 1.729 1.00 0.00 C ATOM 93 O ARG A 10 11.074 20.534 2.282 1.00 0.00 O ATOM 94 CB ARG A 10 14.094 21.533 1.286 1.00 0.00 C ATOM 95 CG ARG A 10 13.845 22.390 2.516 1.00 0.00 C ATOM 96 CD ARG A 10 13.842 21.554 3.787 1.00 0.00 C ATOM 97 NE ARG A 10 15.174 21.448 4.376 1.00 0.00 N ATOM 98 CZ ARG A 10 15.996 20.428 4.156 1.00 0.00 C ATOM 99 NH1 ARG A 10 15.624 19.432 3.363 1.00 0.00 N ATOM 100 NH2 ARG A 10 17.192 20.403 4.728 1.00 0.00 N ATOM 0 H ARG A 10 11.441 22.509 0.893 1.00 0.00 H new ATOM 0 HA ARG A 10 13.087 20.296 -0.153 1.00 0.00 H new ATOM 0 HB2 ARG A 10 14.770 20.720 1.551 1.00 0.00 H new ATOM 0 HB3 ARG A 10 14.599 22.135 0.530 1.00 0.00 H new ATOM 0 HG2 ARG A 10 14.614 23.159 2.587 1.00 0.00 H new ATOM 0 HG3 ARG A 10 12.889 22.904 2.415 1.00 0.00 H new ATOM 0 HD2 ARG A 10 13.160 21.999 4.512 1.00 0.00 H new ATOM 0 HD3 ARG A 10 13.464 20.556 3.564 1.00 0.00 H new ATOM 0 HE ARG A 10 15.491 22.198 4.990 1.00 0.00 H new ATOM 0 HH11 ARG A 10 14.705 19.448 2.921 1.00 0.00 H new ATOM 0 HH12 ARG A 10 16.257 18.650 3.196 1.00 0.00 H new ATOM 0 HH21 ARG A 10 17.482 21.168 5.338 1.00 0.00 H new ATOM 0 HH22 ARG A 10 17.822 19.619 4.558 1.00 0.00 H new ATOM 114 N PHE A 11 12.608 18.913 1.995 1.00 0.00 N ATOM 115 CA PHE A 11 12.004 18.017 2.974 1.00 0.00 C ATOM 116 C PHE A 11 12.442 18.382 4.389 1.00 0.00 C ATOM 117 O PHE A 11 13.616 18.658 4.637 1.00 0.00 O ATOM 118 CB PHE A 11 12.383 16.566 2.669 1.00 0.00 C ATOM 119 CG PHE A 11 11.743 16.029 1.421 1.00 0.00 C ATOM 120 CD1 PHE A 11 10.468 15.489 1.457 1.00 0.00 C ATOM 121 CD2 PHE A 11 12.418 16.063 0.211 1.00 0.00 C ATOM 122 CE1 PHE A 11 9.876 14.994 0.310 1.00 0.00 C ATOM 123 CE2 PHE A 11 11.832 15.570 -0.939 1.00 0.00 C ATOM 124 CZ PHE A 11 10.560 15.033 -0.889 1.00 0.00 C ATOM 0 H PHE A 11 13.447 18.544 1.546 1.00 0.00 H new ATOM 0 HA PHE A 11 10.921 18.125 2.909 1.00 0.00 H new ATOM 0 HB2 PHE A 11 13.466 16.495 2.572 1.00 0.00 H new ATOM 0 HB3 PHE A 11 12.097 15.939 3.513 1.00 0.00 H new ATOM 0 HD1 PHE A 11 9.930 15.454 2.393 1.00 0.00 H new ATOM 0 HD2 PHE A 11 13.413 16.480 0.167 1.00 0.00 H new ATOM 0 HE1 PHE A 11 8.880 14.578 0.352 1.00 0.00 H new ATOM 0 HE2 PHE A 11 12.368 15.604 -1.876 1.00 0.00 H new ATOM 0 HZ PHE A 11 10.101 14.644 -1.786 1.00 0.00 H new ATOM 134 N THR A 12 11.488 18.384 5.315 1.00 0.00 N ATOM 135 CA THR A 12 11.773 18.717 6.705 1.00 0.00 C ATOM 136 C THR A 12 11.573 17.508 7.612 1.00 0.00 C ATOM 137 O THR A 12 12.082 17.471 8.732 1.00 0.00 O ATOM 138 CB THR A 12 10.879 19.870 7.201 1.00 0.00 C ATOM 139 OG1 THR A 12 9.506 19.467 7.185 1.00 0.00 O ATOM 140 CG2 THR A 12 11.060 21.106 6.333 1.00 0.00 C ATOM 0 H THR A 12 10.511 18.159 5.127 1.00 0.00 H new ATOM 0 HA THR A 12 12.816 19.031 6.747 1.00 0.00 H new ATOM 0 HB THR A 12 11.173 20.115 8.222 1.00 0.00 H new ATOM 0 HG1 THR A 12 8.945 20.205 7.503 1.00 0.00 H new ATOM 0 HG21 THR A 12 10.419 21.907 6.702 1.00 0.00 H new ATOM 0 HG22 THR A 12 12.101 21.428 6.371 1.00 0.00 H new ATOM 0 HG23 THR A 12 10.790 20.870 5.304 1.00 0.00 H new ATOM 148 N GLN A 13 10.830 16.522 7.121 1.00 0.00 N ATOM 149 CA GLN A 13 10.564 15.311 7.889 1.00 0.00 C ATOM 150 C GLN A 13 10.747 14.068 7.025 1.00 0.00 C ATOM 151 O GLN A 13 9.881 13.726 6.220 1.00 0.00 O ATOM 152 CB GLN A 13 9.146 15.346 8.460 1.00 0.00 C ATOM 153 CG GLN A 13 9.045 16.065 9.796 1.00 0.00 C ATOM 154 CD GLN A 13 7.935 15.518 10.671 1.00 0.00 C ATOM 155 OE1 GLN A 13 7.946 14.209 10.894 1.00 0.00 O flip ATOM 156 NE2 GLN A 13 7.075 16.264 11.142 1.00 0.00 N flip ATOM 0 H GLN A 13 10.402 16.537 6.195 1.00 0.00 H new ATOM 0 HA GLN A 13 11.278 15.268 8.711 1.00 0.00 H new ATOM 0 HB2 GLN A 13 8.487 15.835 7.743 1.00 0.00 H new ATOM 0 HB3 GLN A 13 8.786 14.324 8.579 1.00 0.00 H new ATOM 0 HG2 GLN A 13 9.995 15.978 10.324 1.00 0.00 H new ATOM 0 HG3 GLN A 13 8.874 17.127 9.621 1.00 0.00 H new ATOM 0 HE21 GLN A 13 7.104 17.264 10.945 1.00 0.00 H new ATOM 0 HE22 GLN A 13 6.334 15.881 11.729 1.00 0.00 H new ATOM 165 N ASP A 14 11.879 13.395 7.198 1.00 0.00 N ATOM 166 CA ASP A 14 12.176 12.188 6.435 1.00 0.00 C ATOM 167 C ASP A 14 10.909 11.373 6.193 1.00 0.00 C ATOM 168 O ASP A 14 10.088 11.199 7.095 1.00 0.00 O ATOM 169 CB ASP A 14 13.212 11.336 7.169 1.00 0.00 C ATOM 170 CG ASP A 14 12.968 11.290 8.665 1.00 0.00 C ATOM 171 OD1 ASP A 14 13.430 12.212 9.370 1.00 0.00 O ATOM 172 OD2 ASP A 14 12.318 10.331 9.131 1.00 0.00 O ATOM 0 H ASP A 14 12.606 13.665 7.860 1.00 0.00 H new ATOM 0 HA ASP A 14 12.583 12.489 5.470 1.00 0.00 H new ATOM 0 HB2 ASP A 14 13.193 10.322 6.769 1.00 0.00 H new ATOM 0 HB3 ASP A 14 14.208 11.736 6.978 1.00 0.00 H new ATOM 177 N LEU A 15 10.755 10.878 4.970 1.00 0.00 N ATOM 178 CA LEU A 15 9.587 10.082 4.608 1.00 0.00 C ATOM 179 C LEU A 15 9.358 8.962 5.617 1.00 0.00 C ATOM 180 O LEU A 15 10.304 8.435 6.203 1.00 0.00 O ATOM 181 CB LEU A 15 9.761 9.494 3.206 1.00 0.00 C ATOM 182 CG LEU A 15 8.476 9.277 2.406 1.00 0.00 C ATOM 183 CD1 LEU A 15 8.787 9.144 0.923 1.00 0.00 C ATOM 184 CD2 LEU A 15 7.735 8.047 2.910 1.00 0.00 C ATOM 0 H LEU A 15 11.424 11.014 4.212 1.00 0.00 H new ATOM 0 HA LEU A 15 8.715 10.736 4.615 1.00 0.00 H new ATOM 0 HB2 LEU A 15 10.414 10.154 2.635 1.00 0.00 H new ATOM 0 HB3 LEU A 15 10.275 8.537 3.296 1.00 0.00 H new ATOM 0 HG LEU A 15 7.833 10.146 2.545 1.00 0.00 H new ATOM 0 HD11 LEU A 15 7.861 8.990 0.369 1.00 0.00 H new ATOM 0 HD12 LEU A 15 9.274 10.053 0.570 1.00 0.00 H new ATOM 0 HD13 LEU A 15 9.450 8.293 0.765 1.00 0.00 H new ATOM 0 HD21 LEU A 15 6.823 7.908 2.329 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.372 7.169 2.802 1.00 0.00 H new ATOM 0 HD23 LEU A 15 7.479 8.182 3.961 1.00 0.00 H new ATOM 196 N LYS A 16 8.095 8.600 5.814 1.00 0.00 N ATOM 197 CA LYS A 16 7.739 7.539 6.750 1.00 0.00 C ATOM 198 C LYS A 16 6.917 6.456 6.058 1.00 0.00 C ATOM 199 O LYS A 16 6.206 6.725 5.089 1.00 0.00 O ATOM 200 CB LYS A 16 6.954 8.114 7.931 1.00 0.00 C ATOM 201 CG LYS A 16 6.062 7.097 8.621 1.00 0.00 C ATOM 202 CD LYS A 16 4.701 7.004 7.952 1.00 0.00 C ATOM 203 CE LYS A 16 4.099 5.615 8.104 1.00 0.00 C ATOM 204 NZ LYS A 16 3.370 5.465 9.394 1.00 0.00 N ATOM 0 H LYS A 16 7.300 9.026 5.338 1.00 0.00 H new ATOM 0 HA LYS A 16 8.661 7.090 7.119 1.00 0.00 H new ATOM 0 HB2 LYS A 16 7.656 8.522 8.658 1.00 0.00 H new ATOM 0 HB3 LYS A 16 6.341 8.944 7.579 1.00 0.00 H new ATOM 0 HG2 LYS A 16 6.544 6.119 8.605 1.00 0.00 H new ATOM 0 HG3 LYS A 16 5.936 7.373 9.668 1.00 0.00 H new ATOM 0 HD2 LYS A 16 4.029 7.743 8.388 1.00 0.00 H new ATOM 0 HD3 LYS A 16 4.797 7.246 6.894 1.00 0.00 H new ATOM 0 HE2 LYS A 16 3.416 5.422 7.276 1.00 0.00 H new ATOM 0 HE3 LYS A 16 4.890 4.868 8.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 2.975 4.505 9.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 4.027 5.624 10.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 2.599 6.161 9.440 1.00 0.00 H new ATOM 218 N THR A 17 7.018 5.230 6.562 1.00 0.00 N ATOM 219 CA THR A 17 6.284 4.107 5.993 1.00 0.00 C ATOM 220 C THR A 17 6.057 3.015 7.032 1.00 0.00 C ATOM 221 O THR A 17 6.605 3.068 8.134 1.00 0.00 O ATOM 222 CB THR A 17 7.027 3.504 4.786 1.00 0.00 C ATOM 223 OG1 THR A 17 6.399 2.282 4.385 1.00 0.00 O ATOM 224 CG2 THR A 17 8.487 3.243 5.124 1.00 0.00 C ATOM 0 H THR A 17 7.601 4.990 7.364 1.00 0.00 H new ATOM 0 HA THR A 17 5.321 4.495 5.661 1.00 0.00 H new ATOM 0 HB THR A 17 6.983 4.221 3.966 1.00 0.00 H new ATOM 0 HG1 THR A 17 6.771 1.989 3.527 1.00 0.00 H new ATOM 0 HG21 THR A 17 8.991 2.817 4.256 1.00 0.00 H new ATOM 0 HG22 THR A 17 8.970 4.180 5.400 1.00 0.00 H new ATOM 0 HG23 THR A 17 8.548 2.544 5.958 1.00 0.00 H new ATOM 232 N LYS A 18 5.246 2.025 6.675 1.00 0.00 N ATOM 233 CA LYS A 18 4.948 0.918 7.576 1.00 0.00 C ATOM 234 C LYS A 18 4.976 -0.413 6.831 1.00 0.00 C ATOM 235 O LYS A 18 5.275 -0.460 5.638 1.00 0.00 O ATOM 236 CB LYS A 18 3.578 1.120 8.229 1.00 0.00 C ATOM 237 CG LYS A 18 2.434 0.497 7.447 1.00 0.00 C ATOM 238 CD LYS A 18 2.328 1.087 6.051 1.00 0.00 C ATOM 239 CE LYS A 18 0.891 1.080 5.551 1.00 0.00 C ATOM 240 NZ LYS A 18 -0.055 1.606 6.574 1.00 0.00 N ATOM 0 H LYS A 18 4.783 1.967 5.768 1.00 0.00 H new ATOM 0 HA LYS A 18 5.714 0.897 8.351 1.00 0.00 H new ATOM 0 HB2 LYS A 18 3.596 0.693 9.232 1.00 0.00 H new ATOM 0 HB3 LYS A 18 3.392 2.188 8.340 1.00 0.00 H new ATOM 0 HG2 LYS A 18 2.584 -0.580 7.377 1.00 0.00 H new ATOM 0 HG3 LYS A 18 1.498 0.655 7.982 1.00 0.00 H new ATOM 0 HD2 LYS A 18 2.707 2.109 6.057 1.00 0.00 H new ATOM 0 HD3 LYS A 18 2.956 0.518 5.365 1.00 0.00 H new ATOM 0 HE2 LYS A 18 0.819 1.683 4.646 1.00 0.00 H new ATOM 0 HE3 LYS A 18 0.605 0.063 5.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -0.810 2.145 6.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -0.472 0.813 7.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 0.456 2.228 7.232 1.00 0.00 H new ATOM 254 N GLU A 19 4.664 -1.491 7.543 1.00 0.00 N ATOM 255 CA GLU A 19 4.653 -2.822 6.947 1.00 0.00 C ATOM 256 C GLU A 19 3.245 -3.410 6.952 1.00 0.00 C ATOM 257 O GLU A 19 2.709 -3.756 8.004 1.00 0.00 O ATOM 258 CB GLU A 19 5.607 -3.750 7.702 1.00 0.00 C ATOM 259 CG GLU A 19 5.051 -4.249 9.025 1.00 0.00 C ATOM 260 CD GLU A 19 6.140 -4.663 9.997 1.00 0.00 C ATOM 261 OE1 GLU A 19 6.732 -5.744 9.799 1.00 0.00 O ATOM 262 OE2 GLU A 19 6.399 -3.904 10.954 1.00 0.00 O ATOM 0 H GLU A 19 4.416 -1.469 8.532 1.00 0.00 H new ATOM 0 HA GLU A 19 4.986 -2.732 5.913 1.00 0.00 H new ATOM 0 HB2 GLU A 19 5.843 -4.607 7.070 1.00 0.00 H new ATOM 0 HB3 GLU A 19 6.543 -3.223 7.887 1.00 0.00 H new ATOM 0 HG2 GLU A 19 4.443 -3.466 9.478 1.00 0.00 H new ATOM 0 HG3 GLU A 19 4.392 -5.097 8.841 1.00 0.00 H new ATOM 269 N ALA A 20 2.652 -3.518 5.768 1.00 0.00 N ATOM 270 CA ALA A 20 1.307 -4.065 5.634 1.00 0.00 C ATOM 271 C ALA A 20 1.340 -5.462 5.024 1.00 0.00 C ATOM 272 O ALA A 20 2.371 -5.904 4.517 1.00 0.00 O ATOM 273 CB ALA A 20 0.442 -3.139 4.791 1.00 0.00 C ATOM 0 H ALA A 20 3.082 -3.234 4.888 1.00 0.00 H new ATOM 0 HA ALA A 20 0.873 -4.143 6.631 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -0.559 -3.560 4.699 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.382 -2.161 5.269 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.883 -3.032 3.800 1.00 0.00 H new ATOM 279 N SER A 21 0.206 -6.152 5.076 1.00 0.00 N ATOM 280 CA SER A 21 0.106 -7.501 4.532 1.00 0.00 C ATOM 281 C SER A 21 -0.402 -7.471 3.094 1.00 0.00 C ATOM 282 O SER A 21 -0.943 -6.465 2.637 1.00 0.00 O ATOM 283 CB SER A 21 -0.823 -8.355 5.396 1.00 0.00 C ATOM 284 OG SER A 21 -2.182 -8.022 5.167 1.00 0.00 O ATOM 0 H SER A 21 -0.657 -5.799 5.489 1.00 0.00 H new ATOM 0 HA SER A 21 1.102 -7.943 4.537 1.00 0.00 H new ATOM 0 HB2 SER A 21 -0.662 -9.410 5.176 1.00 0.00 H new ATOM 0 HB3 SER A 21 -0.582 -8.209 6.449 1.00 0.00 H new ATOM 0 HG SER A 21 -2.756 -8.583 5.730 1.00 0.00 H new ATOM 290 N GLU A 22 -0.224 -8.583 2.386 1.00 0.00 N ATOM 291 CA GLU A 22 -0.664 -8.684 1.000 1.00 0.00 C ATOM 292 C GLU A 22 -2.148 -8.352 0.874 1.00 0.00 C ATOM 293 O GLU A 22 -2.976 -8.863 1.628 1.00 0.00 O ATOM 294 CB GLU A 22 -0.397 -10.089 0.458 1.00 0.00 C ATOM 295 CG GLU A 22 0.974 -10.246 -0.178 1.00 0.00 C ATOM 296 CD GLU A 22 1.335 -11.696 -0.436 1.00 0.00 C ATOM 297 OE1 GLU A 22 0.525 -12.580 -0.087 1.00 0.00 O ATOM 298 OE2 GLU A 22 2.428 -11.947 -0.985 1.00 0.00 O ATOM 0 H GLU A 22 0.222 -9.425 2.750 1.00 0.00 H new ATOM 0 HA GLU A 22 -0.097 -7.962 0.413 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -0.495 -10.808 1.272 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.161 -10.336 -0.279 1.00 0.00 H new ATOM 0 HG2 GLU A 22 0.999 -9.696 -1.119 1.00 0.00 H new ATOM 0 HG3 GLU A 22 1.726 -9.799 0.473 1.00 0.00 H new ATOM 305 N GLY A 23 -2.478 -7.491 -0.084 1.00 0.00 N ATOM 306 CA GLY A 23 -3.861 -7.105 -0.291 1.00 0.00 C ATOM 307 C GLY A 23 -4.227 -5.837 0.455 1.00 0.00 C ATOM 308 O GLY A 23 -5.212 -5.178 0.126 1.00 0.00 O ATOM 0 H GLY A 23 -1.812 -7.054 -0.721 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -4.039 -6.960 -1.357 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -4.514 -7.915 0.034 1.00 0.00 H new ATOM 312 N ALA A 24 -3.431 -5.495 1.464 1.00 0.00 N ATOM 313 CA ALA A 24 -3.676 -4.298 2.258 1.00 0.00 C ATOM 314 C ALA A 24 -3.363 -3.037 1.461 1.00 0.00 C ATOM 315 O ALA A 24 -3.055 -3.102 0.270 1.00 0.00 O ATOM 316 CB ALA A 24 -2.852 -4.335 3.536 1.00 0.00 C ATOM 0 H ALA A 24 -2.611 -6.031 1.750 1.00 0.00 H new ATOM 0 HA ALA A 24 -4.734 -4.277 2.521 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -3.045 -3.435 4.119 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -3.127 -5.212 4.121 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -1.793 -4.384 3.285 1.00 0.00 H new ATOM 322 N THR A 25 -3.446 -1.887 2.124 1.00 0.00 N ATOM 323 CA THR A 25 -3.173 -0.610 1.476 1.00 0.00 C ATOM 324 C THR A 25 -2.083 0.159 2.214 1.00 0.00 C ATOM 325 O THR A 25 -2.267 0.571 3.359 1.00 0.00 O ATOM 326 CB THR A 25 -4.440 0.263 1.401 1.00 0.00 C ATOM 327 OG1 THR A 25 -5.463 -0.421 0.669 1.00 0.00 O ATOM 328 CG2 THR A 25 -4.138 1.597 0.734 1.00 0.00 C ATOM 0 H THR A 25 -3.700 -1.814 3.109 1.00 0.00 H new ATOM 0 HA THR A 25 -2.834 -0.834 0.465 1.00 0.00 H new ATOM 0 HB THR A 25 -4.786 0.452 2.417 1.00 0.00 H new ATOM 0 HG1 THR A 25 -6.266 0.140 0.627 1.00 0.00 H new ATOM 0 HG21 THR A 25 -5.047 2.197 0.692 1.00 0.00 H new ATOM 0 HG22 THR A 25 -3.379 2.128 1.309 1.00 0.00 H new ATOM 0 HG23 THR A 25 -3.771 1.423 -0.278 1.00 0.00 H new ATOM 336 N ALA A 26 -0.947 0.348 1.551 1.00 0.00 N ATOM 337 CA ALA A 26 0.172 1.071 2.144 1.00 0.00 C ATOM 338 C ALA A 26 -0.213 2.510 2.466 1.00 0.00 C ATOM 339 O ALA A 26 -1.334 2.941 2.194 1.00 0.00 O ATOM 340 CB ALA A 26 1.373 1.040 1.211 1.00 0.00 C ATOM 0 H ALA A 26 -0.777 0.011 0.603 1.00 0.00 H new ATOM 0 HA ALA A 26 0.438 0.577 3.078 1.00 0.00 H new ATOM 0 HB1 ALA A 26 2.201 1.583 1.666 1.00 0.00 H new ATOM 0 HB2 ALA A 26 1.670 0.006 1.035 1.00 0.00 H new ATOM 0 HB3 ALA A 26 1.109 1.508 0.263 1.00 0.00 H new ATOM 346 N THR A 27 0.724 3.252 3.050 1.00 0.00 N ATOM 347 CA THR A 27 0.482 4.643 3.412 1.00 0.00 C ATOM 348 C THR A 27 1.786 5.362 3.736 1.00 0.00 C ATOM 349 O THR A 27 2.374 5.155 4.799 1.00 0.00 O ATOM 350 CB THR A 27 -0.465 4.752 4.622 1.00 0.00 C ATOM 351 OG1 THR A 27 -1.742 4.190 4.297 1.00 0.00 O ATOM 352 CG2 THR A 27 -0.637 6.203 5.045 1.00 0.00 C ATOM 0 H THR A 27 1.657 2.912 3.282 1.00 0.00 H new ATOM 0 HA THR A 27 0.014 5.117 2.549 1.00 0.00 H new ATOM 0 HB THR A 27 -0.025 4.198 5.451 1.00 0.00 H new ATOM 0 HG1 THR A 27 -1.836 4.134 3.323 1.00 0.00 H new ATOM 0 HG21 THR A 27 -1.310 6.255 5.901 1.00 0.00 H new ATOM 0 HG22 THR A 27 0.332 6.619 5.319 1.00 0.00 H new ATOM 0 HG23 THR A 27 -1.057 6.776 4.218 1.00 0.00 H new ATOM 360 N LEU A 28 2.235 6.206 2.814 1.00 0.00 N ATOM 361 CA LEU A 28 3.472 6.957 3.002 1.00 0.00 C ATOM 362 C LEU A 28 3.188 8.451 3.127 1.00 0.00 C ATOM 363 O LEU A 28 2.672 9.073 2.200 1.00 0.00 O ATOM 364 CB LEU A 28 4.428 6.704 1.835 1.00 0.00 C ATOM 365 CG LEU A 28 4.803 5.244 1.579 1.00 0.00 C ATOM 366 CD1 LEU A 28 3.841 4.612 0.586 1.00 0.00 C ATOM 367 CD2 LEU A 28 6.236 5.142 1.076 1.00 0.00 C ATOM 0 H LEU A 28 1.762 6.388 1.929 1.00 0.00 H new ATOM 0 HA LEU A 28 3.939 6.616 3.926 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.977 7.107 0.928 1.00 0.00 H new ATOM 0 HB3 LEU A 28 5.344 7.268 2.013 1.00 0.00 H new ATOM 0 HG LEU A 28 4.730 4.699 2.520 1.00 0.00 H new ATOM 0 HD11 LEU A 28 4.124 3.573 0.416 1.00 0.00 H new ATOM 0 HD12 LEU A 28 2.828 4.652 0.985 1.00 0.00 H new ATOM 0 HD13 LEU A 28 3.881 5.158 -0.357 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.486 4.096 0.899 1.00 0.00 H new ATOM 0 HD22 LEU A 28 6.336 5.701 0.146 1.00 0.00 H new ATOM 0 HD23 LEU A 28 6.914 5.556 1.823 1.00 0.00 H new ATOM 379 N GLN A 29 3.531 9.019 4.279 1.00 0.00 N ATOM 380 CA GLN A 29 3.314 10.440 4.524 1.00 0.00 C ATOM 381 C GLN A 29 4.641 11.172 4.690 1.00 0.00 C ATOM 382 O GLN A 29 5.545 10.693 5.376 1.00 0.00 O ATOM 383 CB GLN A 29 2.449 10.638 5.770 1.00 0.00 C ATOM 384 CG GLN A 29 1.006 10.197 5.586 1.00 0.00 C ATOM 385 CD GLN A 29 0.116 10.617 6.739 1.00 0.00 C ATOM 386 OE1 GLN A 29 0.572 11.250 7.691 1.00 0.00 O ATOM 387 NE2 GLN A 29 -1.162 10.265 6.658 1.00 0.00 N ATOM 0 H GLN A 29 3.960 8.517 5.057 1.00 0.00 H new ATOM 0 HA GLN A 29 2.795 10.857 3.661 1.00 0.00 H new ATOM 0 HB2 GLN A 29 2.887 10.081 6.598 1.00 0.00 H new ATOM 0 HB3 GLN A 29 2.465 11.691 6.050 1.00 0.00 H new ATOM 0 HG2 GLN A 29 0.617 10.618 4.659 1.00 0.00 H new ATOM 0 HG3 GLN A 29 0.972 9.113 5.482 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -1.496 9.740 5.850 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -1.809 10.519 7.404 1.00 0.00 H new ATOM 396 N CYS A 30 4.752 12.335 4.058 1.00 0.00 N ATOM 397 CA CYS A 30 5.971 13.134 4.134 1.00 0.00 C ATOM 398 C CYS A 30 5.643 14.602 4.388 1.00 0.00 C ATOM 399 O CYS A 30 4.486 15.012 4.307 1.00 0.00 O ATOM 400 CB CYS A 30 6.778 12.995 2.843 1.00 0.00 C ATOM 401 SG CYS A 30 6.082 13.893 1.436 1.00 0.00 S ATOM 0 H CYS A 30 4.013 12.746 3.487 1.00 0.00 H new ATOM 0 HA CYS A 30 6.568 12.764 4.968 1.00 0.00 H new ATOM 0 HB2 CYS A 30 7.793 13.351 3.021 1.00 0.00 H new ATOM 0 HB3 CYS A 30 6.852 11.938 2.585 1.00 0.00 H new ATOM 0 HG CYS A 30 6.836 13.716 0.392 1.00 0.00 H new ATOM 407 N GLU A 31 6.670 15.387 4.698 1.00 0.00 N ATOM 408 CA GLU A 31 6.491 16.809 4.966 1.00 0.00 C ATOM 409 C GLU A 31 7.385 17.651 4.062 1.00 0.00 C ATOM 410 O GLU A 31 8.394 17.169 3.545 1.00 0.00 O ATOM 411 CB GLU A 31 6.797 17.116 6.434 1.00 0.00 C ATOM 412 CG GLU A 31 6.051 18.326 6.971 1.00 0.00 C ATOM 413 CD GLU A 31 5.909 18.302 8.480 1.00 0.00 C ATOM 414 OE1 GLU A 31 6.932 18.099 9.168 1.00 0.00 O ATOM 415 OE2 GLU A 31 4.777 18.485 8.973 1.00 0.00 O ATOM 0 H GLU A 31 7.634 15.062 4.770 1.00 0.00 H new ATOM 0 HA GLU A 31 5.452 17.063 4.757 1.00 0.00 H new ATOM 0 HB2 GLU A 31 6.543 16.245 7.039 1.00 0.00 H new ATOM 0 HB3 GLU A 31 7.869 17.281 6.546 1.00 0.00 H new ATOM 0 HG2 GLU A 31 6.577 19.233 6.674 1.00 0.00 H new ATOM 0 HG3 GLU A 31 5.061 18.368 6.517 1.00 0.00 H new ATOM 422 N LEU A 32 7.009 18.911 3.874 1.00 0.00 N ATOM 423 CA LEU A 32 7.776 19.821 3.031 1.00 0.00 C ATOM 424 C LEU A 32 7.921 21.187 3.696 1.00 0.00 C ATOM 425 O LEU A 32 7.080 21.589 4.500 1.00 0.00 O ATOM 426 CB LEU A 32 7.102 19.975 1.667 1.00 0.00 C ATOM 427 CG LEU A 32 6.903 18.686 0.868 1.00 0.00 C ATOM 428 CD1 LEU A 32 5.888 18.899 -0.244 1.00 0.00 C ATOM 429 CD2 LEU A 32 8.228 18.202 0.298 1.00 0.00 C ATOM 0 H LEU A 32 6.177 19.326 4.294 1.00 0.00 H new ATOM 0 HA LEU A 32 8.770 19.397 2.892 1.00 0.00 H new ATOM 0 HB2 LEU A 32 6.128 20.441 1.816 1.00 0.00 H new ATOM 0 HB3 LEU A 32 7.696 20.663 1.066 1.00 0.00 H new ATOM 0 HG LEU A 32 6.518 17.920 1.541 1.00 0.00 H new ATOM 0 HD11 LEU A 32 5.759 17.971 -0.802 1.00 0.00 H new ATOM 0 HD12 LEU A 32 4.933 19.198 0.188 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.243 19.680 -0.916 1.00 0.00 H new ATOM 0 HD21 LEU A 32 8.067 17.284 -0.267 1.00 0.00 H new ATOM 0 HD22 LEU A 32 8.642 18.966 -0.360 1.00 0.00 H new ATOM 0 HD23 LEU A 32 8.926 18.009 1.113 1.00 0.00 H new ATOM 441 N SER A 33 8.992 21.895 3.353 1.00 0.00 N ATOM 442 CA SER A 33 9.248 23.215 3.918 1.00 0.00 C ATOM 443 C SER A 33 8.184 24.213 3.470 1.00 0.00 C ATOM 444 O SER A 33 7.925 25.209 4.147 1.00 0.00 O ATOM 445 CB SER A 33 10.634 23.711 3.502 1.00 0.00 C ATOM 446 OG SER A 33 10.723 25.121 3.602 1.00 0.00 O ATOM 0 H SER A 33 9.696 21.577 2.687 1.00 0.00 H new ATOM 0 HA SER A 33 9.210 23.132 5.004 1.00 0.00 H new ATOM 0 HB2 SER A 33 11.393 23.250 4.134 1.00 0.00 H new ATOM 0 HB3 SER A 33 10.842 23.402 2.477 1.00 0.00 H new ATOM 0 HG SER A 33 11.619 25.412 3.332 1.00 0.00 H new ATOM 452 N LYS A 34 7.569 23.939 2.324 1.00 0.00 N ATOM 453 CA LYS A 34 6.532 24.810 1.784 1.00 0.00 C ATOM 454 C LYS A 34 5.770 24.116 0.660 1.00 0.00 C ATOM 455 O LYS A 34 6.306 23.239 -0.018 1.00 0.00 O ATOM 456 CB LYS A 34 7.148 26.113 1.269 1.00 0.00 C ATOM 457 CG LYS A 34 8.163 25.907 0.158 1.00 0.00 C ATOM 458 CD LYS A 34 8.312 27.153 -0.699 1.00 0.00 C ATOM 459 CE LYS A 34 9.711 27.263 -1.286 1.00 0.00 C ATOM 460 NZ LYS A 34 9.869 28.489 -2.117 1.00 0.00 N ATOM 0 H LYS A 34 7.771 23.120 1.751 1.00 0.00 H new ATOM 0 HA LYS A 34 5.831 25.040 2.587 1.00 0.00 H new ATOM 0 HB2 LYS A 34 6.352 26.763 0.907 1.00 0.00 H new ATOM 0 HB3 LYS A 34 7.630 26.630 2.099 1.00 0.00 H new ATOM 0 HG2 LYS A 34 9.128 25.644 0.590 1.00 0.00 H new ATOM 0 HG3 LYS A 34 7.855 25.069 -0.467 1.00 0.00 H new ATOM 0 HD2 LYS A 34 7.579 27.131 -1.505 1.00 0.00 H new ATOM 0 HD3 LYS A 34 8.098 28.037 -0.098 1.00 0.00 H new ATOM 0 HE2 LYS A 34 10.444 27.274 -0.479 1.00 0.00 H new ATOM 0 HE3 LYS A 34 9.920 26.383 -1.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 10.754 28.429 -2.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 9.066 28.570 -2.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 9.897 29.326 -1.500 1.00 0.00 H new ATOM 474 N VAL A 35 4.517 24.516 0.467 1.00 0.00 N ATOM 475 CA VAL A 35 3.682 23.934 -0.577 1.00 0.00 C ATOM 476 C VAL A 35 4.421 23.886 -1.910 1.00 0.00 C ATOM 477 O VAL A 35 4.733 24.922 -2.496 1.00 0.00 O ATOM 478 CB VAL A 35 2.374 24.727 -0.757 1.00 0.00 C ATOM 479 CG1 VAL A 35 1.531 24.122 -1.869 1.00 0.00 C ATOM 480 CG2 VAL A 35 1.595 24.772 0.549 1.00 0.00 C ATOM 0 H VAL A 35 4.058 25.240 1.020 1.00 0.00 H new ATOM 0 HA VAL A 35 3.443 22.919 -0.261 1.00 0.00 H new ATOM 0 HB VAL A 35 2.625 25.749 -1.040 1.00 0.00 H new ATOM 0 HG11 VAL A 35 0.611 24.696 -1.981 1.00 0.00 H new ATOM 0 HG12 VAL A 35 2.090 24.147 -2.804 1.00 0.00 H new ATOM 0 HG13 VAL A 35 1.287 23.089 -1.620 1.00 0.00 H new ATOM 0 HG21 VAL A 35 0.674 25.336 0.404 1.00 0.00 H new ATOM 0 HG22 VAL A 35 1.353 23.757 0.864 1.00 0.00 H new ATOM 0 HG23 VAL A 35 2.199 25.255 1.317 1.00 0.00 H new ATOM 490 N ALA A 36 4.698 22.676 -2.383 1.00 0.00 N ATOM 491 CA ALA A 36 5.399 22.492 -3.648 1.00 0.00 C ATOM 492 C ALA A 36 5.053 21.147 -4.277 1.00 0.00 C ATOM 493 O ALA A 36 4.806 20.157 -3.588 1.00 0.00 O ATOM 494 CB ALA A 36 6.902 22.609 -3.441 1.00 0.00 C ATOM 0 H ALA A 36 4.448 21.808 -1.909 1.00 0.00 H new ATOM 0 HA ALA A 36 5.075 23.277 -4.331 1.00 0.00 H new ATOM 0 HB1 ALA A 36 7.412 22.469 -4.394 1.00 0.00 H new ATOM 0 HB2 ALA A 36 7.139 23.596 -3.044 1.00 0.00 H new ATOM 0 HB3 ALA A 36 7.233 21.845 -2.737 1.00 0.00 H new ATOM 500 N PRO A 37 5.034 21.107 -5.618 1.00 0.00 N ATOM 501 CA PRO A 37 4.720 19.888 -6.369 1.00 0.00 C ATOM 502 C PRO A 37 5.819 18.837 -6.256 1.00 0.00 C ATOM 503 O PRO A 37 7.002 19.142 -6.409 1.00 0.00 O ATOM 504 CB PRO A 37 4.600 20.383 -7.813 1.00 0.00 C ATOM 505 CG PRO A 37 5.436 21.615 -7.862 1.00 0.00 C ATOM 506 CD PRO A 37 5.319 22.249 -6.503 1.00 0.00 C ATOM 0 HA PRO A 37 3.821 19.399 -5.995 1.00 0.00 H new ATOM 0 HB2 PRO A 37 4.957 19.634 -8.519 1.00 0.00 H new ATOM 0 HB3 PRO A 37 3.563 20.597 -8.073 1.00 0.00 H new ATOM 0 HG2 PRO A 37 6.474 21.374 -8.092 1.00 0.00 H new ATOM 0 HG3 PRO A 37 5.086 22.293 -8.640 1.00 0.00 H new ATOM 0 HD2 PRO A 37 6.239 22.759 -6.217 1.00 0.00 H new ATOM 0 HD3 PRO A 37 4.520 22.990 -6.473 1.00 0.00 H new ATOM 514 N VAL A 38 5.421 17.598 -5.987 1.00 0.00 N ATOM 515 CA VAL A 38 6.372 16.501 -5.855 1.00 0.00 C ATOM 516 C VAL A 38 5.933 15.291 -6.672 1.00 0.00 C ATOM 517 O VAL A 38 4.807 15.239 -7.166 1.00 0.00 O ATOM 518 CB VAL A 38 6.540 16.078 -4.383 1.00 0.00 C ATOM 519 CG1 VAL A 38 6.758 17.297 -3.499 1.00 0.00 C ATOM 520 CG2 VAL A 38 5.332 15.280 -3.917 1.00 0.00 C ATOM 0 H VAL A 38 4.446 17.329 -5.856 1.00 0.00 H new ATOM 0 HA VAL A 38 7.328 16.864 -6.233 1.00 0.00 H new ATOM 0 HB VAL A 38 7.420 15.440 -4.304 1.00 0.00 H new ATOM 0 HG11 VAL A 38 6.875 16.979 -2.463 1.00 0.00 H new ATOM 0 HG12 VAL A 38 7.657 17.823 -3.820 1.00 0.00 H new ATOM 0 HG13 VAL A 38 5.899 17.963 -3.580 1.00 0.00 H new ATOM 0 HG21 VAL A 38 5.468 14.989 -2.875 1.00 0.00 H new ATOM 0 HG22 VAL A 38 4.434 15.891 -4.009 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.227 14.386 -4.532 1.00 0.00 H new ATOM 530 N GLU A 39 6.831 14.321 -6.811 1.00 0.00 N ATOM 531 CA GLU A 39 6.536 13.111 -7.570 1.00 0.00 C ATOM 532 C GLU A 39 7.165 11.887 -6.910 1.00 0.00 C ATOM 533 O GLU A 39 8.329 11.914 -6.511 1.00 0.00 O ATOM 534 CB GLU A 39 7.044 13.247 -9.007 1.00 0.00 C ATOM 535 CG GLU A 39 6.731 12.042 -9.879 1.00 0.00 C ATOM 536 CD GLU A 39 5.390 12.160 -10.577 1.00 0.00 C ATOM 537 OE1 GLU A 39 5.224 13.092 -11.391 1.00 0.00 O ATOM 538 OE2 GLU A 39 4.506 11.319 -10.308 1.00 0.00 O ATOM 0 H GLU A 39 7.768 14.349 -6.409 1.00 0.00 H new ATOM 0 HA GLU A 39 5.454 12.978 -7.586 1.00 0.00 H new ATOM 0 HB2 GLU A 39 6.602 14.136 -9.457 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.123 13.402 -8.989 1.00 0.00 H new ATOM 0 HG2 GLU A 39 7.516 11.925 -10.626 1.00 0.00 H new ATOM 0 HG3 GLU A 39 6.739 11.142 -9.265 1.00 0.00 H new ATOM 545 N TRP A 40 6.386 10.817 -6.797 1.00 0.00 N ATOM 546 CA TRP A 40 6.867 9.584 -6.185 1.00 0.00 C ATOM 547 C TRP A 40 7.506 8.672 -7.226 1.00 0.00 C ATOM 548 O TRP A 40 6.998 8.531 -8.339 1.00 0.00 O ATOM 549 CB TRP A 40 5.717 8.855 -5.488 1.00 0.00 C ATOM 550 CG TRP A 40 5.049 9.676 -4.427 1.00 0.00 C ATOM 551 CD1 TRP A 40 4.224 10.747 -4.619 1.00 0.00 C ATOM 552 CD2 TRP A 40 5.150 9.493 -3.011 1.00 0.00 C ATOM 553 NE1 TRP A 40 3.807 11.242 -3.406 1.00 0.00 N ATOM 554 CE2 TRP A 40 4.361 10.490 -2.405 1.00 0.00 C ATOM 555 CE3 TRP A 40 5.830 8.584 -2.196 1.00 0.00 C ATOM 556 CZ2 TRP A 40 4.235 10.601 -1.023 1.00 0.00 C ATOM 557 CZ3 TRP A 40 5.705 8.696 -0.825 1.00 0.00 C ATOM 558 CH2 TRP A 40 4.912 9.697 -0.249 1.00 0.00 C ATOM 0 H TRP A 40 5.420 10.778 -7.121 1.00 0.00 H new ATOM 0 HA TRP A 40 7.624 9.846 -5.446 1.00 0.00 H new ATOM 0 HB2 TRP A 40 4.976 8.565 -6.233 1.00 0.00 H new ATOM 0 HB3 TRP A 40 6.097 7.936 -5.041 1.00 0.00 H new ATOM 0 HD1 TRP A 40 3.941 11.146 -5.582 1.00 0.00 H new ATOM 0 HE1 TRP A 40 3.186 12.040 -3.273 1.00 0.00 H new ATOM 0 HE3 TRP A 40 6.442 7.808 -2.630 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 3.625 11.373 -0.577 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 6.228 8.000 -0.186 1.00 0.00 H new ATOM 0 HH2 TRP A 40 4.833 9.757 0.826 1.00 0.00 H new ATOM 569 N LYS A 41 8.624 8.055 -6.859 1.00 0.00 N ATOM 570 CA LYS A 41 9.333 7.155 -7.761 1.00 0.00 C ATOM 571 C LYS A 41 9.664 5.838 -7.067 1.00 0.00 C ATOM 572 O LYS A 41 9.964 5.812 -5.873 1.00 0.00 O ATOM 573 CB LYS A 41 10.619 7.814 -8.266 1.00 0.00 C ATOM 574 CG LYS A 41 10.423 8.649 -9.519 1.00 0.00 C ATOM 575 CD LYS A 41 11.667 8.647 -10.391 1.00 0.00 C ATOM 576 CE LYS A 41 11.564 9.671 -11.512 1.00 0.00 C ATOM 577 NZ LYS A 41 11.159 11.011 -11.003 1.00 0.00 N ATOM 0 H LYS A 41 9.059 8.162 -5.943 1.00 0.00 H new ATOM 0 HA LYS A 41 8.682 6.945 -8.609 1.00 0.00 H new ATOM 0 HB2 LYS A 41 11.027 8.447 -7.478 1.00 0.00 H new ATOM 0 HB3 LYS A 41 11.359 7.040 -8.468 1.00 0.00 H new ATOM 0 HG2 LYS A 41 9.578 8.260 -10.088 1.00 0.00 H new ATOM 0 HG3 LYS A 41 10.175 9.673 -9.240 1.00 0.00 H new ATOM 0 HD2 LYS A 41 12.542 8.863 -9.778 1.00 0.00 H new ATOM 0 HD3 LYS A 41 11.813 7.654 -10.816 1.00 0.00 H new ATOM 0 HE2 LYS A 41 12.525 9.751 -12.021 1.00 0.00 H new ATOM 0 HE3 LYS A 41 10.840 9.329 -12.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 11.390 11.736 -11.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 10.135 11.018 -10.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 11.669 11.216 -10.120 1.00 0.00 H new ATOM 591 N LYS A 42 9.608 4.746 -7.821 1.00 0.00 N ATOM 592 CA LYS A 42 9.903 3.425 -7.280 1.00 0.00 C ATOM 593 C LYS A 42 11.121 2.815 -7.967 1.00 0.00 C ATOM 594 O LYS A 42 11.105 1.650 -8.362 1.00 0.00 O ATOM 595 CB LYS A 42 8.695 2.501 -7.446 1.00 0.00 C ATOM 596 CG LYS A 42 8.788 1.225 -6.627 1.00 0.00 C ATOM 597 CD LYS A 42 7.595 0.316 -6.872 1.00 0.00 C ATOM 598 CE LYS A 42 7.833 -1.079 -6.316 1.00 0.00 C ATOM 599 NZ LYS A 42 7.076 -2.115 -7.073 1.00 0.00 N ATOM 0 H LYS A 42 9.361 4.750 -8.811 1.00 0.00 H new ATOM 0 HA LYS A 42 10.124 3.536 -6.218 1.00 0.00 H new ATOM 0 HB2 LYS A 42 7.793 3.041 -7.160 1.00 0.00 H new ATOM 0 HB3 LYS A 42 8.590 2.240 -8.499 1.00 0.00 H new ATOM 0 HG2 LYS A 42 9.707 0.696 -6.879 1.00 0.00 H new ATOM 0 HG3 LYS A 42 8.844 1.475 -5.568 1.00 0.00 H new ATOM 0 HD2 LYS A 42 6.707 0.747 -6.409 1.00 0.00 H new ATOM 0 HD3 LYS A 42 7.398 0.253 -7.942 1.00 0.00 H new ATOM 0 HE2 LYS A 42 8.898 -1.308 -6.353 1.00 0.00 H new ATOM 0 HE3 LYS A 42 7.537 -1.107 -5.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 7.265 -3.052 -6.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 6.058 -1.911 -7.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 7.376 -2.106 -8.069 1.00 0.00 H new ATOM 613 N GLY A 43 12.177 3.611 -8.107 1.00 0.00 N ATOM 614 CA GLY A 43 13.388 3.131 -8.745 1.00 0.00 C ATOM 615 C GLY A 43 13.756 3.940 -9.973 1.00 0.00 C ATOM 616 O GLY A 43 13.496 5.141 -10.052 1.00 0.00 O ATOM 0 H GLY A 43 12.215 4.580 -7.790 1.00 0.00 H new ATOM 0 HA2 GLY A 43 14.210 3.167 -8.030 1.00 0.00 H new ATOM 0 HA3 GLY A 43 13.257 2.087 -9.028 1.00 0.00 H new ATOM 620 N PRO A 44 14.378 3.277 -10.959 1.00 0.00 N ATOM 621 CA PRO A 44 14.796 3.924 -12.207 1.00 0.00 C ATOM 622 C PRO A 44 13.611 4.314 -13.083 1.00 0.00 C ATOM 623 O PRO A 44 13.788 4.799 -14.200 1.00 0.00 O ATOM 624 CB PRO A 44 15.641 2.850 -12.897 1.00 0.00 C ATOM 625 CG PRO A 44 15.134 1.560 -12.350 1.00 0.00 C ATOM 626 CD PRO A 44 14.719 1.845 -10.933 1.00 0.00 C ATOM 0 HA PRO A 44 15.332 4.855 -12.024 1.00 0.00 H new ATOM 0 HB2 PRO A 44 15.528 2.893 -13.980 1.00 0.00 H new ATOM 0 HB3 PRO A 44 16.701 2.982 -12.682 1.00 0.00 H new ATOM 0 HG2 PRO A 44 14.292 1.192 -12.936 1.00 0.00 H new ATOM 0 HG3 PRO A 44 15.906 0.792 -12.383 1.00 0.00 H new ATOM 0 HD2 PRO A 44 13.867 1.234 -10.633 1.00 0.00 H new ATOM 0 HD3 PRO A 44 15.524 1.636 -10.229 1.00 0.00 H new ATOM 634 N GLU A 45 12.404 4.100 -12.569 1.00 0.00 N ATOM 635 CA GLU A 45 11.191 4.429 -13.307 1.00 0.00 C ATOM 636 C GLU A 45 10.385 5.501 -12.578 1.00 0.00 C ATOM 637 O GLU A 45 10.697 5.865 -11.444 1.00 0.00 O ATOM 638 CB GLU A 45 10.332 3.178 -13.506 1.00 0.00 C ATOM 639 CG GLU A 45 10.705 2.374 -14.740 1.00 0.00 C ATOM 640 CD GLU A 45 10.670 3.204 -16.009 1.00 0.00 C ATOM 641 OE1 GLU A 45 9.558 3.567 -16.449 1.00 0.00 O ATOM 642 OE2 GLU A 45 11.752 3.489 -16.562 1.00 0.00 O ATOM 0 H GLU A 45 12.241 3.700 -11.645 1.00 0.00 H new ATOM 0 HA GLU A 45 11.484 4.818 -14.282 1.00 0.00 H new ATOM 0 HB2 GLU A 45 10.423 2.541 -12.626 1.00 0.00 H new ATOM 0 HB3 GLU A 45 9.285 3.474 -13.578 1.00 0.00 H new ATOM 0 HG2 GLU A 45 11.704 1.958 -14.610 1.00 0.00 H new ATOM 0 HG3 GLU A 45 10.020 1.532 -14.842 1.00 0.00 H new ATOM 649 N THR A 46 9.347 6.005 -13.239 1.00 0.00 N ATOM 650 CA THR A 46 8.498 7.036 -12.656 1.00 0.00 C ATOM 651 C THR A 46 7.059 6.551 -12.521 1.00 0.00 C ATOM 652 O THR A 46 6.475 6.033 -13.474 1.00 0.00 O ATOM 653 CB THR A 46 8.516 8.323 -13.502 1.00 0.00 C ATOM 654 OG1 THR A 46 9.806 8.498 -14.099 1.00 0.00 O ATOM 655 CG2 THR A 46 8.178 9.536 -12.649 1.00 0.00 C ATOM 0 H THR A 46 9.075 5.716 -14.178 1.00 0.00 H new ATOM 0 HA THR A 46 8.900 7.254 -11.667 1.00 0.00 H new ATOM 0 HB THR A 46 7.763 8.228 -14.285 1.00 0.00 H new ATOM 0 HG1 THR A 46 9.809 9.317 -14.637 1.00 0.00 H new ATOM 0 HG21 THR A 46 8.197 10.433 -13.268 1.00 0.00 H new ATOM 0 HG22 THR A 46 7.184 9.413 -12.219 1.00 0.00 H new ATOM 0 HG23 THR A 46 8.911 9.633 -11.848 1.00 0.00 H new ATOM 663 N LEU A 47 6.491 6.723 -11.332 1.00 0.00 N ATOM 664 CA LEU A 47 5.118 6.303 -11.073 1.00 0.00 C ATOM 665 C LEU A 47 4.136 7.428 -11.386 1.00 0.00 C ATOM 666 O LEU A 47 4.540 8.548 -11.700 1.00 0.00 O ATOM 667 CB LEU A 47 4.964 5.868 -9.614 1.00 0.00 C ATOM 668 CG LEU A 47 5.934 4.790 -9.129 1.00 0.00 C ATOM 669 CD1 LEU A 47 6.155 4.906 -7.629 1.00 0.00 C ATOM 670 CD2 LEU A 47 5.415 3.405 -9.489 1.00 0.00 C ATOM 0 H LEU A 47 6.960 7.150 -10.533 1.00 0.00 H new ATOM 0 HA LEU A 47 4.894 5.458 -11.724 1.00 0.00 H new ATOM 0 HB2 LEU A 47 5.082 6.746 -8.980 1.00 0.00 H new ATOM 0 HB3 LEU A 47 3.947 5.505 -9.470 1.00 0.00 H new ATOM 0 HG LEU A 47 6.892 4.938 -9.628 1.00 0.00 H new ATOM 0 HD11 LEU A 47 6.848 4.131 -7.302 1.00 0.00 H new ATOM 0 HD12 LEU A 47 6.572 5.886 -7.397 1.00 0.00 H new ATOM 0 HD13 LEU A 47 5.204 4.784 -7.111 1.00 0.00 H new ATOM 0 HD21 LEU A 47 6.118 2.650 -9.136 1.00 0.00 H new ATOM 0 HD22 LEU A 47 4.445 3.246 -9.018 1.00 0.00 H new ATOM 0 HD23 LEU A 47 5.310 3.326 -10.571 1.00 0.00 H new ATOM 682 N ARG A 48 2.846 7.122 -11.297 1.00 0.00 N ATOM 683 CA ARG A 48 1.807 8.107 -11.570 1.00 0.00 C ATOM 684 C ARG A 48 0.562 7.830 -10.733 1.00 0.00 C ATOM 685 O ARG A 48 0.216 6.676 -10.479 1.00 0.00 O ATOM 686 CB ARG A 48 1.446 8.101 -13.057 1.00 0.00 C ATOM 687 CG ARG A 48 2.630 8.369 -13.971 1.00 0.00 C ATOM 688 CD ARG A 48 3.350 7.081 -14.342 1.00 0.00 C ATOM 689 NE ARG A 48 2.590 6.287 -15.305 1.00 0.00 N ATOM 690 CZ ARG A 48 2.630 6.488 -16.617 1.00 0.00 C ATOM 691 NH1 ARG A 48 3.389 7.452 -17.121 1.00 0.00 N ATOM 692 NH2 ARG A 48 1.910 5.724 -17.429 1.00 0.00 N ATOM 0 H ARG A 48 2.496 6.200 -11.038 1.00 0.00 H new ATOM 0 HA ARG A 48 2.194 9.090 -11.301 1.00 0.00 H new ATOM 0 HB2 ARG A 48 1.011 7.135 -13.313 1.00 0.00 H new ATOM 0 HB3 ARG A 48 0.679 8.854 -13.239 1.00 0.00 H new ATOM 0 HG2 ARG A 48 2.286 8.869 -14.877 1.00 0.00 H new ATOM 0 HG3 ARG A 48 3.326 9.047 -13.477 1.00 0.00 H new ATOM 0 HD2 ARG A 48 4.328 7.320 -14.760 1.00 0.00 H new ATOM 0 HD3 ARG A 48 3.524 6.491 -13.442 1.00 0.00 H new ATOM 0 HE ARG A 48 1.996 5.537 -14.950 1.00 0.00 H new ATOM 0 HH11 ARG A 48 3.944 8.041 -16.500 1.00 0.00 H new ATOM 0 HH12 ARG A 48 3.418 7.604 -18.129 1.00 0.00 H new ATOM 0 HH21 ARG A 48 1.325 4.982 -17.045 1.00 0.00 H new ATOM 0 HH22 ARG A 48 1.941 5.879 -18.437 1.00 0.00 H new ATOM 706 N ASP A 49 -0.107 8.896 -10.306 1.00 0.00 N ATOM 707 CA ASP A 49 -1.314 8.768 -9.498 1.00 0.00 C ATOM 708 C ASP A 49 -2.407 8.032 -10.266 1.00 0.00 C ATOM 709 O ASP A 49 -2.402 8.000 -11.496 1.00 0.00 O ATOM 710 CB ASP A 49 -1.816 10.148 -9.070 1.00 0.00 C ATOM 711 CG ASP A 49 -2.528 10.879 -10.191 1.00 0.00 C ATOM 712 OD1 ASP A 49 -3.714 10.576 -10.438 1.00 0.00 O ATOM 713 OD2 ASP A 49 -1.899 11.754 -10.822 1.00 0.00 O ATOM 0 H ASP A 49 0.166 9.858 -10.506 1.00 0.00 H new ATOM 0 HA ASP A 49 -1.066 8.188 -8.609 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -2.494 10.038 -8.224 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -0.973 10.748 -8.727 1.00 0.00 H new ATOM 718 N GLY A 50 -3.344 7.440 -9.532 1.00 0.00 N ATOM 719 CA GLY A 50 -4.430 6.711 -10.161 1.00 0.00 C ATOM 720 C GLY A 50 -4.155 5.223 -10.248 1.00 0.00 C ATOM 721 O GLY A 50 -3.115 4.749 -9.794 1.00 0.00 O ATOM 0 H GLY A 50 -3.370 7.452 -8.512 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -5.348 6.875 -9.597 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -4.596 7.106 -11.163 1.00 0.00 H new ATOM 725 N GLY A 51 -5.093 4.482 -10.832 1.00 0.00 N ATOM 726 CA GLY A 51 -4.929 3.046 -10.965 1.00 0.00 C ATOM 727 C GLY A 51 -4.729 2.360 -9.628 1.00 0.00 C ATOM 728 O GLY A 51 -5.656 2.276 -8.822 1.00 0.00 O ATOM 0 H GLY A 51 -5.963 4.851 -11.215 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -5.807 2.627 -11.457 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -4.074 2.839 -11.608 1.00 0.00 H new ATOM 732 N ARG A 52 -3.518 1.866 -9.393 1.00 0.00 N ATOM 733 CA ARG A 52 -3.202 1.180 -8.146 1.00 0.00 C ATOM 734 C ARG A 52 -2.330 2.056 -7.251 1.00 0.00 C ATOM 735 O ARG A 52 -1.454 1.559 -6.543 1.00 0.00 O ATOM 736 CB ARG A 52 -2.490 -0.143 -8.433 1.00 0.00 C ATOM 737 CG ARG A 52 -3.412 -1.229 -8.961 1.00 0.00 C ATOM 738 CD ARG A 52 -2.709 -2.576 -9.022 1.00 0.00 C ATOM 739 NE ARG A 52 -2.007 -2.770 -10.288 1.00 0.00 N ATOM 740 CZ ARG A 52 -1.232 -3.817 -10.545 1.00 0.00 C ATOM 741 NH1 ARG A 52 -1.062 -4.761 -9.630 1.00 0.00 N ATOM 742 NH2 ARG A 52 -0.626 -3.923 -11.721 1.00 0.00 N ATOM 0 H ARG A 52 -2.740 1.928 -10.049 1.00 0.00 H new ATOM 0 HA ARG A 52 -4.137 0.975 -7.625 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -1.696 0.032 -9.159 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -2.014 -0.496 -7.518 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -4.291 -1.305 -8.321 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -3.765 -0.956 -9.956 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -1.999 -2.652 -8.198 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -3.440 -3.373 -8.887 1.00 0.00 H new ATOM 0 HE ARG A 52 -2.118 -2.063 -11.014 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -1.527 -4.684 -8.726 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -0.466 -5.564 -9.830 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -0.755 -3.200 -12.428 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -0.031 -4.728 -11.917 1.00 0.00 H new ATOM 756 N TYR A 53 -2.575 3.361 -7.288 1.00 0.00 N ATOM 757 CA TYR A 53 -1.811 4.306 -6.482 1.00 0.00 C ATOM 758 C TYR A 53 -2.585 5.606 -6.288 1.00 0.00 C ATOM 759 O TYR A 53 -2.921 6.292 -7.253 1.00 0.00 O ATOM 760 CB TYR A 53 -0.462 4.596 -7.142 1.00 0.00 C ATOM 761 CG TYR A 53 0.452 3.393 -7.207 1.00 0.00 C ATOM 762 CD1 TYR A 53 1.220 3.020 -6.111 1.00 0.00 C ATOM 763 CD2 TYR A 53 0.547 2.629 -8.363 1.00 0.00 C ATOM 764 CE1 TYR A 53 2.057 1.922 -6.165 1.00 0.00 C ATOM 765 CE2 TYR A 53 1.380 1.529 -8.426 1.00 0.00 C ATOM 766 CZ TYR A 53 2.133 1.179 -7.325 1.00 0.00 C ATOM 767 OH TYR A 53 2.965 0.085 -7.384 1.00 0.00 O ATOM 0 H TYR A 53 -3.297 3.789 -7.868 1.00 0.00 H new ATOM 0 HA TYR A 53 -1.640 3.857 -5.504 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -0.634 4.966 -8.153 1.00 0.00 H new ATOM 0 HB3 TYR A 53 0.038 5.393 -6.591 1.00 0.00 H new ATOM 0 HD1 TYR A 53 1.162 3.598 -5.201 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -0.041 2.900 -9.228 1.00 0.00 H new ATOM 0 HE1 TYR A 53 2.648 1.647 -5.304 1.00 0.00 H new ATOM 0 HE2 TYR A 53 1.441 0.946 -9.333 1.00 0.00 H new ATOM 0 HH TYR A 53 3.085 -0.284 -6.484 1.00 0.00 H new ATOM 777 N SER A 54 -2.863 5.939 -5.031 1.00 0.00 N ATOM 778 CA SER A 54 -3.599 7.155 -4.708 1.00 0.00 C ATOM 779 C SER A 54 -2.737 8.111 -3.890 1.00 0.00 C ATOM 780 O SER A 54 -2.273 7.770 -2.801 1.00 0.00 O ATOM 781 CB SER A 54 -4.876 6.814 -3.937 1.00 0.00 C ATOM 782 OG SER A 54 -5.956 6.569 -4.820 1.00 0.00 O ATOM 0 H SER A 54 -2.589 5.384 -4.220 1.00 0.00 H new ATOM 0 HA SER A 54 -3.868 7.646 -5.643 1.00 0.00 H new ATOM 0 HB2 SER A 54 -4.705 5.936 -3.315 1.00 0.00 H new ATOM 0 HB3 SER A 54 -5.130 7.635 -3.267 1.00 0.00 H new ATOM 0 HG SER A 54 -6.759 6.352 -4.302 1.00 0.00 H new ATOM 788 N LEU A 55 -2.526 9.310 -4.422 1.00 0.00 N ATOM 789 CA LEU A 55 -1.719 10.318 -3.742 1.00 0.00 C ATOM 790 C LEU A 55 -2.551 11.554 -3.418 1.00 0.00 C ATOM 791 O LEU A 55 -3.395 11.973 -4.211 1.00 0.00 O ATOM 792 CB LEU A 55 -0.520 10.709 -4.607 1.00 0.00 C ATOM 793 CG LEU A 55 0.290 9.552 -5.194 1.00 0.00 C ATOM 794 CD1 LEU A 55 -0.394 8.995 -6.433 1.00 0.00 C ATOM 795 CD2 LEU A 55 1.706 10.004 -5.522 1.00 0.00 C ATOM 0 H LEU A 55 -2.902 9.608 -5.322 1.00 0.00 H new ATOM 0 HA LEU A 55 -1.360 9.889 -2.807 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -0.877 11.330 -5.429 1.00 0.00 H new ATOM 0 HB3 LEU A 55 0.149 11.327 -4.008 1.00 0.00 H new ATOM 0 HG LEU A 55 0.347 8.759 -4.448 1.00 0.00 H new ATOM 0 HD11 LEU A 55 0.197 8.173 -6.836 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -1.387 8.632 -6.168 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -0.483 9.780 -7.184 1.00 0.00 H new ATOM 0 HD21 LEU A 55 2.268 9.168 -5.939 1.00 0.00 H new ATOM 0 HD22 LEU A 55 1.670 10.815 -6.249 1.00 0.00 H new ATOM 0 HD23 LEU A 55 2.196 10.353 -4.613 1.00 0.00 H new ATOM 807 N LYS A 56 -2.307 12.136 -2.248 1.00 0.00 N ATOM 808 CA LYS A 56 -3.031 13.327 -1.820 1.00 0.00 C ATOM 809 C LYS A 56 -2.082 14.344 -1.194 1.00 0.00 C ATOM 810 O LYS A 56 -1.399 14.048 -0.215 1.00 0.00 O ATOM 811 CB LYS A 56 -4.125 12.951 -0.818 1.00 0.00 C ATOM 812 CG LYS A 56 -4.978 14.128 -0.379 1.00 0.00 C ATOM 813 CD LYS A 56 -6.111 14.391 -1.356 1.00 0.00 C ATOM 814 CE LYS A 56 -7.234 13.378 -1.193 1.00 0.00 C ATOM 815 NZ LYS A 56 -8.220 13.458 -2.306 1.00 0.00 N ATOM 0 H LYS A 56 -1.613 11.802 -1.579 1.00 0.00 H new ATOM 0 HA LYS A 56 -3.491 13.778 -2.699 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -4.769 12.193 -1.263 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -3.662 12.501 0.060 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -5.389 13.931 0.611 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -4.355 15.018 -0.295 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -6.501 15.397 -1.200 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -5.729 14.352 -2.376 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -6.813 12.373 -1.152 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -7.743 13.549 -0.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -8.969 12.752 -2.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -8.640 14.409 -2.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -7.740 13.269 -3.209 1.00 0.00 H new ATOM 829 N GLN A 57 -2.047 15.543 -1.766 1.00 0.00 N ATOM 830 CA GLN A 57 -1.182 16.604 -1.263 1.00 0.00 C ATOM 831 C GLN A 57 -1.953 17.543 -0.341 1.00 0.00 C ATOM 832 O GLN A 57 -2.682 18.422 -0.802 1.00 0.00 O ATOM 833 CB GLN A 57 -0.579 17.394 -2.426 1.00 0.00 C ATOM 834 CG GLN A 57 0.208 18.618 -1.987 1.00 0.00 C ATOM 835 CD GLN A 57 1.195 19.085 -3.039 1.00 0.00 C ATOM 836 OE1 GLN A 57 0.977 18.901 -4.237 1.00 0.00 O ATOM 837 NE2 GLN A 57 2.288 19.694 -2.595 1.00 0.00 N ATOM 0 H GLN A 57 -2.607 15.804 -2.577 1.00 0.00 H new ATOM 0 HA GLN A 57 -0.377 16.142 -0.691 1.00 0.00 H new ATOM 0 HB2 GLN A 57 0.076 16.738 -2.999 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -1.380 17.708 -3.095 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -0.485 19.428 -1.759 1.00 0.00 H new ATOM 0 HG3 GLN A 57 0.745 18.389 -1.066 1.00 0.00 H new ATOM 0 HE21 GLN A 57 2.427 19.825 -1.593 1.00 0.00 H new ATOM 0 HE22 GLN A 57 2.988 20.031 -3.256 1.00 0.00 H new ATOM 846 N ASP A 58 -1.787 17.352 0.963 1.00 0.00 N ATOM 847 CA ASP A 58 -2.466 18.182 1.950 1.00 0.00 C ATOM 848 C ASP A 58 -1.607 19.382 2.335 1.00 0.00 C ATOM 849 O ASP A 58 -1.016 19.416 3.414 1.00 0.00 O ATOM 850 CB ASP A 58 -2.802 17.360 3.196 1.00 0.00 C ATOM 851 CG ASP A 58 -4.120 16.622 3.064 1.00 0.00 C ATOM 852 OD1 ASP A 58 -4.119 15.498 2.519 1.00 0.00 O ATOM 853 OD2 ASP A 58 -5.152 17.168 3.506 1.00 0.00 O ATOM 0 H ASP A 58 -1.188 16.629 1.361 1.00 0.00 H new ATOM 0 HA ASP A 58 -3.391 18.548 1.505 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -2.003 16.641 3.380 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -2.843 18.020 4.063 1.00 0.00 H new ATOM 858 N GLY A 59 -1.540 20.366 1.443 1.00 0.00 N ATOM 859 CA GLY A 59 -0.749 21.554 1.707 1.00 0.00 C ATOM 860 C GLY A 59 0.740 21.299 1.582 1.00 0.00 C ATOM 861 O GLY A 59 1.286 21.290 0.479 1.00 0.00 O ATOM 0 H GLY A 59 -2.019 20.362 0.543 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -1.039 22.342 1.012 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -0.969 21.918 2.711 1.00 0.00 H new ATOM 865 N THR A 60 1.400 21.093 2.717 1.00 0.00 N ATOM 866 CA THR A 60 2.835 20.840 2.731 1.00 0.00 C ATOM 867 C THR A 60 3.132 19.372 3.015 1.00 0.00 C ATOM 868 O THR A 60 4.282 18.993 3.238 1.00 0.00 O ATOM 869 CB THR A 60 3.549 21.709 3.784 1.00 0.00 C ATOM 870 OG1 THR A 60 2.901 21.572 5.053 1.00 0.00 O ATOM 871 CG2 THR A 60 3.553 23.171 3.366 1.00 0.00 C ATOM 0 H THR A 60 0.963 21.096 3.639 1.00 0.00 H new ATOM 0 HA THR A 60 3.211 21.099 1.741 1.00 0.00 H new ATOM 0 HB THR A 60 4.581 21.368 3.865 1.00 0.00 H new ATOM 0 HG1 THR A 60 3.362 22.126 5.717 1.00 0.00 H new ATOM 0 HG21 THR A 60 4.062 23.765 4.125 1.00 0.00 H new ATOM 0 HG22 THR A 60 4.073 23.276 2.414 1.00 0.00 H new ATOM 0 HG23 THR A 60 2.526 23.522 3.259 1.00 0.00 H new ATOM 879 N ARG A 61 2.088 18.549 3.005 1.00 0.00 N ATOM 880 CA ARG A 61 2.237 17.122 3.262 1.00 0.00 C ATOM 881 C ARG A 61 1.639 16.299 2.124 1.00 0.00 C ATOM 882 O ARG A 61 0.675 16.718 1.483 1.00 0.00 O ATOM 883 CB ARG A 61 1.565 16.747 4.584 1.00 0.00 C ATOM 884 CG ARG A 61 2.485 16.864 5.789 1.00 0.00 C ATOM 885 CD ARG A 61 1.696 17.046 7.076 1.00 0.00 C ATOM 886 NE ARG A 61 1.000 18.329 7.115 1.00 0.00 N ATOM 887 CZ ARG A 61 -0.010 18.593 7.936 1.00 0.00 C ATOM 888 NH1 ARG A 61 -0.440 17.667 8.783 1.00 0.00 N ATOM 889 NH2 ARG A 61 -0.593 19.785 7.912 1.00 0.00 N ATOM 0 H ARG A 61 1.130 18.847 2.822 1.00 0.00 H new ATOM 0 HA ARG A 61 3.302 16.900 3.328 1.00 0.00 H new ATOM 0 HB2 ARG A 61 0.697 17.389 4.736 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.196 15.724 4.517 1.00 0.00 H new ATOM 0 HG2 ARG A 61 3.104 15.970 5.864 1.00 0.00 H new ATOM 0 HG3 ARG A 61 3.160 17.709 5.652 1.00 0.00 H new ATOM 0 HD2 ARG A 61 0.972 16.238 7.174 1.00 0.00 H new ATOM 0 HD3 ARG A 61 2.371 16.974 7.928 1.00 0.00 H new ATOM 0 HE ARG A 61 1.306 19.063 6.476 1.00 0.00 H new ATOM 0 HH11 ARG A 61 0.005 16.750 8.805 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -1.216 17.872 9.412 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -0.265 20.500 7.262 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -1.369 19.986 8.543 1.00 0.00 H new ATOM 903 N CYS A 62 2.219 15.129 1.880 1.00 0.00 N ATOM 904 CA CYS A 62 1.744 14.248 0.819 1.00 0.00 C ATOM 905 C CYS A 62 1.530 12.832 1.343 1.00 0.00 C ATOM 906 O CYS A 62 2.365 12.298 2.073 1.00 0.00 O ATOM 907 CB CYS A 62 2.740 14.230 -0.342 1.00 0.00 C ATOM 908 SG CYS A 62 2.797 15.770 -1.289 1.00 0.00 S ATOM 0 H CYS A 62 3.018 14.769 2.402 1.00 0.00 H new ATOM 0 HA CYS A 62 0.788 14.632 0.462 1.00 0.00 H new ATOM 0 HB2 CYS A 62 3.735 14.020 0.050 1.00 0.00 H new ATOM 0 HB3 CYS A 62 2.483 13.412 -1.015 1.00 0.00 H new ATOM 0 HG CYS A 62 4.030 16.045 -1.597 1.00 0.00 H new ATOM 914 N GLU A 63 0.406 12.230 0.966 1.00 0.00 N ATOM 915 CA GLU A 63 0.082 10.876 1.401 1.00 0.00 C ATOM 916 C GLU A 63 -0.109 9.951 0.203 1.00 0.00 C ATOM 917 O GLU A 63 -0.925 10.221 -0.680 1.00 0.00 O ATOM 918 CB GLU A 63 -1.182 10.882 2.262 1.00 0.00 C ATOM 919 CG GLU A 63 -1.615 9.499 2.718 1.00 0.00 C ATOM 920 CD GLU A 63 -2.998 9.495 3.340 1.00 0.00 C ATOM 921 OE1 GLU A 63 -3.135 9.976 4.484 1.00 0.00 O ATOM 922 OE2 GLU A 63 -3.943 9.012 2.682 1.00 0.00 O ATOM 0 H GLU A 63 -0.295 12.658 0.361 1.00 0.00 H new ATOM 0 HA GLU A 63 0.916 10.504 1.996 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -1.011 11.507 3.138 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -1.994 11.340 1.697 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -1.602 8.819 1.866 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -0.895 9.117 3.441 1.00 0.00 H new ATOM 929 N LEU A 64 0.648 8.860 0.178 1.00 0.00 N ATOM 930 CA LEU A 64 0.563 7.894 -0.911 1.00 0.00 C ATOM 931 C LEU A 64 0.008 6.562 -0.416 1.00 0.00 C ATOM 932 O LEU A 64 0.445 6.040 0.609 1.00 0.00 O ATOM 933 CB LEU A 64 1.941 7.683 -1.541 1.00 0.00 C ATOM 934 CG LEU A 64 2.091 6.447 -2.429 1.00 0.00 C ATOM 935 CD1 LEU A 64 1.156 6.533 -3.626 1.00 0.00 C ATOM 936 CD2 LEU A 64 3.534 6.292 -2.887 1.00 0.00 C ATOM 0 H LEU A 64 1.328 8.622 0.900 1.00 0.00 H new ATOM 0 HA LEU A 64 -0.117 8.292 -1.664 1.00 0.00 H new ATOM 0 HB2 LEU A 64 2.186 8.564 -2.134 1.00 0.00 H new ATOM 0 HB3 LEU A 64 2.679 7.623 -0.741 1.00 0.00 H new ATOM 0 HG LEU A 64 1.820 5.568 -1.845 1.00 0.00 H new ATOM 0 HD11 LEU A 64 1.277 5.645 -4.246 1.00 0.00 H new ATOM 0 HD12 LEU A 64 0.125 6.595 -3.278 1.00 0.00 H new ATOM 0 HD13 LEU A 64 1.396 7.420 -4.212 1.00 0.00 H new ATOM 0 HD21 LEU A 64 3.622 5.408 -3.518 1.00 0.00 H new ATOM 0 HD22 LEU A 64 3.832 7.174 -3.454 1.00 0.00 H new ATOM 0 HD23 LEU A 64 4.182 6.184 -2.017 1.00 0.00 H new ATOM 948 N GLN A 65 -0.956 6.018 -1.153 1.00 0.00 N ATOM 949 CA GLN A 65 -1.568 4.746 -0.788 1.00 0.00 C ATOM 950 C GLN A 65 -1.401 3.722 -1.906 1.00 0.00 C ATOM 951 O GLN A 65 -1.669 4.012 -3.072 1.00 0.00 O ATOM 952 CB GLN A 65 -3.054 4.942 -0.478 1.00 0.00 C ATOM 953 CG GLN A 65 -3.328 5.327 0.967 1.00 0.00 C ATOM 954 CD GLN A 65 -4.799 5.572 1.236 1.00 0.00 C ATOM 955 OE1 GLN A 65 -5.642 5.385 0.359 1.00 0.00 O ATOM 956 NE2 GLN A 65 -5.116 5.993 2.455 1.00 0.00 N ATOM 0 H GLN A 65 -1.329 6.438 -2.005 1.00 0.00 H new ATOM 0 HA GLN A 65 -1.064 4.371 0.103 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -3.455 5.715 -1.134 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -3.589 4.021 -0.708 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -2.969 4.535 1.624 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -2.763 6.226 1.213 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -4.385 6.135 3.152 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -6.091 6.174 2.694 1.00 0.00 H new ATOM 965 N ILE A 66 -0.957 2.524 -1.541 1.00 0.00 N ATOM 966 CA ILE A 66 -0.754 1.456 -2.513 1.00 0.00 C ATOM 967 C ILE A 66 -1.776 0.340 -2.324 1.00 0.00 C ATOM 968 O ILE A 66 -1.542 -0.610 -1.576 1.00 0.00 O ATOM 969 CB ILE A 66 0.663 0.863 -2.411 1.00 0.00 C ATOM 970 CG1 ILE A 66 1.696 1.979 -2.247 1.00 0.00 C ATOM 971 CG2 ILE A 66 0.975 0.021 -3.639 1.00 0.00 C ATOM 972 CD1 ILE A 66 2.975 1.526 -1.579 1.00 0.00 C ATOM 0 H ILE A 66 -0.731 2.268 -0.580 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.882 1.899 -3.500 1.00 0.00 H new ATOM 0 HB ILE A 66 0.709 0.219 -1.532 1.00 0.00 H new ATOM 0 HG12 ILE A 66 1.934 2.390 -3.228 1.00 0.00 H new ATOM 0 HG13 ILE A 66 1.256 2.787 -1.662 1.00 0.00 H new ATOM 0 HG21 ILE A 66 1.980 -0.391 -3.552 1.00 0.00 H new ATOM 0 HG22 ILE A 66 0.254 -0.793 -3.715 1.00 0.00 H new ATOM 0 HG23 ILE A 66 0.914 0.643 -4.532 1.00 0.00 H new ATOM 0 HD11 ILE A 66 3.661 2.369 -1.496 1.00 0.00 H new ATOM 0 HD12 ILE A 66 2.750 1.142 -0.584 1.00 0.00 H new ATOM 0 HD13 ILE A 66 3.438 0.739 -2.175 1.00 0.00 H new ATOM 984 N HIS A 67 -2.909 0.460 -3.009 1.00 0.00 N ATOM 985 CA HIS A 67 -3.966 -0.541 -2.918 1.00 0.00 C ATOM 986 C HIS A 67 -3.479 -1.894 -3.428 1.00 0.00 C ATOM 987 O HIS A 67 -2.686 -1.965 -4.367 1.00 0.00 O ATOM 988 CB HIS A 67 -5.191 -0.093 -3.717 1.00 0.00 C ATOM 989 CG HIS A 67 -5.748 1.224 -3.271 1.00 0.00 C ATOM 990 ND1 HIS A 67 -6.576 1.359 -2.177 1.00 0.00 N ATOM 991 CD2 HIS A 67 -5.590 2.469 -3.777 1.00 0.00 C ATOM 992 CE1 HIS A 67 -6.905 2.630 -2.030 1.00 0.00 C ATOM 993 NE2 HIS A 67 -6.319 3.325 -2.988 1.00 0.00 N ATOM 0 H HIS A 67 -3.118 1.240 -3.632 1.00 0.00 H new ATOM 0 HA HIS A 67 -4.243 -0.646 -1.869 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -4.922 -0.026 -4.771 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -5.967 -0.854 -3.633 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -5.000 2.739 -4.641 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -7.544 3.032 -1.258 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -6.395 4.333 -3.120 1.00 0.00 H new ATOM 1002 N ASP A 68 -3.957 -2.963 -2.802 1.00 0.00 N ATOM 1003 CA ASP A 68 -3.571 -4.314 -3.193 1.00 0.00 C ATOM 1004 C ASP A 68 -2.074 -4.531 -2.990 1.00 0.00 C ATOM 1005 O ASP A 68 -1.367 -4.950 -3.908 1.00 0.00 O ATOM 1006 CB ASP A 68 -3.943 -4.572 -4.654 1.00 0.00 C ATOM 1007 CG ASP A 68 -5.443 -4.598 -4.873 1.00 0.00 C ATOM 1008 OD1 ASP A 68 -6.068 -5.639 -4.579 1.00 0.00 O ATOM 1009 OD2 ASP A 68 -5.992 -3.578 -5.337 1.00 0.00 O ATOM 0 H ASP A 68 -4.612 -2.921 -2.022 1.00 0.00 H new ATOM 0 HA ASP A 68 -4.112 -5.017 -2.560 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -3.501 -3.798 -5.281 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -3.516 -5.523 -4.972 1.00 0.00 H new ATOM 1014 N LEU A 69 -1.597 -4.242 -1.785 1.00 0.00 N ATOM 1015 CA LEU A 69 -0.184 -4.404 -1.462 1.00 0.00 C ATOM 1016 C LEU A 69 0.313 -5.786 -1.871 1.00 0.00 C ATOM 1017 O LEU A 69 -0.425 -6.769 -1.796 1.00 0.00 O ATOM 1018 CB LEU A 69 0.045 -4.189 0.036 1.00 0.00 C ATOM 1019 CG LEU A 69 0.360 -2.757 0.468 1.00 0.00 C ATOM 1020 CD1 LEU A 69 0.400 -2.654 1.985 1.00 0.00 C ATOM 1021 CD2 LEU A 69 1.680 -2.296 -0.135 1.00 0.00 C ATOM 0 H LEU A 69 -2.168 -3.894 -1.015 1.00 0.00 H new ATOM 0 HA LEU A 69 0.379 -3.656 -2.020 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.845 -4.521 0.571 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.866 -4.832 0.354 1.00 0.00 H new ATOM 0 HG LEU A 69 -0.432 -2.104 0.101 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.626 -1.628 2.274 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -0.568 -2.942 2.395 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.171 -3.318 2.375 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.888 -1.274 0.183 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.483 -2.952 0.202 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.615 -2.331 -1.223 1.00 0.00 H new ATOM 1033 N SER A 70 1.569 -5.855 -2.301 1.00 0.00 N ATOM 1034 CA SER A 70 2.164 -7.117 -2.723 1.00 0.00 C ATOM 1035 C SER A 70 3.646 -7.166 -2.363 1.00 0.00 C ATOM 1036 O SER A 70 4.317 -6.136 -2.303 1.00 0.00 O ATOM 1037 CB SER A 70 1.987 -7.310 -4.231 1.00 0.00 C ATOM 1038 OG SER A 70 0.650 -7.654 -4.548 1.00 0.00 O ATOM 0 H SER A 70 2.194 -5.051 -2.366 1.00 0.00 H new ATOM 0 HA SER A 70 1.653 -7.924 -2.198 1.00 0.00 H new ATOM 0 HB2 SER A 70 2.263 -6.394 -4.753 1.00 0.00 H new ATOM 0 HB3 SER A 70 2.660 -8.092 -4.582 1.00 0.00 H new ATOM 0 HG SER A 70 0.096 -7.593 -3.742 1.00 0.00 H new ATOM 1044 N VAL A 71 4.151 -8.372 -2.124 1.00 0.00 N ATOM 1045 CA VAL A 71 5.553 -8.558 -1.771 1.00 0.00 C ATOM 1046 C VAL A 71 6.469 -7.882 -2.784 1.00 0.00 C ATOM 1047 O VAL A 71 7.613 -7.549 -2.477 1.00 0.00 O ATOM 1048 CB VAL A 71 5.917 -10.052 -1.683 1.00 0.00 C ATOM 1049 CG1 VAL A 71 5.694 -10.574 -0.271 1.00 0.00 C ATOM 1050 CG2 VAL A 71 5.110 -10.857 -2.691 1.00 0.00 C ATOM 0 H VAL A 71 3.610 -9.235 -2.169 1.00 0.00 H new ATOM 0 HA VAL A 71 5.696 -8.099 -0.793 1.00 0.00 H new ATOM 0 HB VAL A 71 6.974 -10.165 -1.924 1.00 0.00 H new ATOM 0 HG11 VAL A 71 5.956 -11.631 -0.228 1.00 0.00 H new ATOM 0 HG12 VAL A 71 6.319 -10.016 0.426 1.00 0.00 H new ATOM 0 HG13 VAL A 71 4.646 -10.449 0.002 1.00 0.00 H new ATOM 0 HG21 VAL A 71 5.380 -11.910 -2.615 1.00 0.00 H new ATOM 0 HG22 VAL A 71 4.047 -10.739 -2.483 1.00 0.00 H new ATOM 0 HG23 VAL A 71 5.325 -10.499 -3.698 1.00 0.00 H new ATOM 1060 N ALA A 72 5.958 -7.682 -3.994 1.00 0.00 N ATOM 1061 CA ALA A 72 6.729 -7.043 -5.053 1.00 0.00 C ATOM 1062 C ALA A 72 6.831 -5.538 -4.827 1.00 0.00 C ATOM 1063 O ALA A 72 7.823 -4.911 -5.198 1.00 0.00 O ATOM 1064 CB ALA A 72 6.105 -7.334 -6.410 1.00 0.00 C ATOM 0 H ALA A 72 5.013 -7.953 -4.265 1.00 0.00 H new ATOM 0 HA ALA A 72 7.738 -7.456 -5.033 1.00 0.00 H new ATOM 0 HB1 ALA A 72 6.691 -6.850 -7.191 1.00 0.00 H new ATOM 0 HB2 ALA A 72 6.091 -8.410 -6.581 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.085 -6.950 -6.431 1.00 0.00 H new ATOM 1070 N ASP A 73 5.798 -4.965 -4.219 1.00 0.00 N ATOM 1071 CA ASP A 73 5.771 -3.534 -3.943 1.00 0.00 C ATOM 1072 C ASP A 73 6.741 -3.178 -2.820 1.00 0.00 C ATOM 1073 O ASP A 73 7.159 -2.028 -2.689 1.00 0.00 O ATOM 1074 CB ASP A 73 4.356 -3.091 -3.571 1.00 0.00 C ATOM 1075 CG ASP A 73 3.538 -2.688 -4.782 1.00 0.00 C ATOM 1076 OD1 ASP A 73 3.987 -1.795 -5.530 1.00 0.00 O ATOM 1077 OD2 ASP A 73 2.448 -3.264 -4.981 1.00 0.00 O ATOM 0 H ASP A 73 4.968 -5.470 -3.908 1.00 0.00 H new ATOM 0 HA ASP A 73 6.082 -3.009 -4.847 1.00 0.00 H new ATOM 0 HB2 ASP A 73 3.850 -3.903 -3.048 1.00 0.00 H new ATOM 0 HB3 ASP A 73 4.412 -2.251 -2.878 1.00 0.00 H new ATOM 1082 N ALA A 74 7.092 -4.173 -2.012 1.00 0.00 N ATOM 1083 CA ALA A 74 8.013 -3.965 -0.901 1.00 0.00 C ATOM 1084 C ALA A 74 9.421 -3.667 -1.403 1.00 0.00 C ATOM 1085 O ALA A 74 10.153 -4.571 -1.802 1.00 0.00 O ATOM 1086 CB ALA A 74 8.023 -5.183 0.011 1.00 0.00 C ATOM 0 H ALA A 74 6.753 -5.130 -2.106 1.00 0.00 H new ATOM 0 HA ALA A 74 7.668 -3.101 -0.333 1.00 0.00 H new ATOM 0 HB1 ALA A 74 8.715 -5.014 0.836 1.00 0.00 H new ATOM 0 HB2 ALA A 74 7.021 -5.350 0.406 1.00 0.00 H new ATOM 0 HB3 ALA A 74 8.340 -6.059 -0.555 1.00 0.00 H new ATOM 1092 N GLY A 75 9.794 -2.391 -1.381 1.00 0.00 N ATOM 1093 CA GLY A 75 11.114 -1.996 -1.838 1.00 0.00 C ATOM 1094 C GLY A 75 11.554 -0.665 -1.260 1.00 0.00 C ATOM 1095 O GLY A 75 11.639 -0.509 -0.043 1.00 0.00 O ATOM 0 H GLY A 75 9.206 -1.624 -1.055 1.00 0.00 H new ATOM 0 HA2 GLY A 75 11.836 -2.765 -1.562 1.00 0.00 H new ATOM 0 HA3 GLY A 75 11.115 -1.934 -2.926 1.00 0.00 H new ATOM 1099 N GLU A 76 11.834 0.295 -2.135 1.00 0.00 N ATOM 1100 CA GLU A 76 12.270 1.618 -1.703 1.00 0.00 C ATOM 1101 C GLU A 76 11.602 2.709 -2.535 1.00 0.00 C ATOM 1102 O GLU A 76 11.836 2.818 -3.739 1.00 0.00 O ATOM 1103 CB GLU A 76 13.791 1.739 -1.811 1.00 0.00 C ATOM 1104 CG GLU A 76 14.320 3.117 -1.451 1.00 0.00 C ATOM 1105 CD GLU A 76 15.682 3.396 -2.057 1.00 0.00 C ATOM 1106 OE1 GLU A 76 15.744 3.690 -3.269 1.00 0.00 O ATOM 1107 OE2 GLU A 76 16.686 3.321 -1.318 1.00 0.00 O ATOM 0 H GLU A 76 11.767 0.182 -3.146 1.00 0.00 H new ATOM 0 HA GLU A 76 11.976 1.747 -0.661 1.00 0.00 H new ATOM 0 HB2 GLU A 76 14.253 1.000 -1.157 1.00 0.00 H new ATOM 0 HB3 GLU A 76 14.095 1.497 -2.830 1.00 0.00 H new ATOM 0 HG2 GLU A 76 13.613 3.874 -1.791 1.00 0.00 H new ATOM 0 HG3 GLU A 76 14.384 3.206 -0.366 1.00 0.00 H new ATOM 1114 N TYR A 77 10.770 3.514 -1.885 1.00 0.00 N ATOM 1115 CA TYR A 77 10.065 4.595 -2.563 1.00 0.00 C ATOM 1116 C TYR A 77 10.773 5.929 -2.345 1.00 0.00 C ATOM 1117 O TYR A 77 10.924 6.387 -1.213 1.00 0.00 O ATOM 1118 CB TYR A 77 8.622 4.684 -2.064 1.00 0.00 C ATOM 1119 CG TYR A 77 7.754 3.531 -2.513 1.00 0.00 C ATOM 1120 CD1 TYR A 77 7.724 2.339 -1.799 1.00 0.00 C ATOM 1121 CD2 TYR A 77 6.964 3.632 -3.652 1.00 0.00 C ATOM 1122 CE1 TYR A 77 6.932 1.282 -2.206 1.00 0.00 C ATOM 1123 CE2 TYR A 77 6.169 2.580 -4.066 1.00 0.00 C ATOM 1124 CZ TYR A 77 6.157 1.408 -3.339 1.00 0.00 C ATOM 1125 OH TYR A 77 5.367 0.358 -3.749 1.00 0.00 O ATOM 0 H TYR A 77 10.567 3.438 -0.888 1.00 0.00 H new ATOM 0 HA TYR A 77 10.060 4.377 -3.631 1.00 0.00 H new ATOM 0 HB2 TYR A 77 8.625 4.723 -0.975 1.00 0.00 H new ATOM 0 HB3 TYR A 77 8.182 5.617 -2.415 1.00 0.00 H new ATOM 0 HD1 TYR A 77 8.330 2.237 -0.911 1.00 0.00 H new ATOM 0 HD2 TYR A 77 6.971 4.548 -4.223 1.00 0.00 H new ATOM 0 HE1 TYR A 77 6.920 0.363 -1.640 1.00 0.00 H new ATOM 0 HE2 TYR A 77 5.561 2.675 -4.953 1.00 0.00 H new ATOM 0 HH TYR A 77 5.791 -0.489 -3.496 1.00 0.00 H new ATOM 1135 N SER A 78 11.206 6.548 -3.439 1.00 0.00 N ATOM 1136 CA SER A 78 11.901 7.827 -3.369 1.00 0.00 C ATOM 1137 C SER A 78 10.973 8.973 -3.761 1.00 0.00 C ATOM 1138 O SER A 78 10.229 8.877 -4.738 1.00 0.00 O ATOM 1139 CB SER A 78 13.129 7.815 -4.283 1.00 0.00 C ATOM 1140 OG SER A 78 13.690 6.517 -4.366 1.00 0.00 O ATOM 0 H SER A 78 11.087 6.184 -4.384 1.00 0.00 H new ATOM 0 HA SER A 78 12.224 7.980 -2.339 1.00 0.00 H new ATOM 0 HB2 SER A 78 12.848 8.158 -5.279 1.00 0.00 H new ATOM 0 HB3 SER A 78 13.875 8.514 -3.904 1.00 0.00 H new ATOM 0 HG SER A 78 14.472 6.536 -4.957 1.00 0.00 H new ATOM 1146 N CYS A 79 11.021 10.054 -2.992 1.00 0.00 N ATOM 1147 CA CYS A 79 10.184 11.219 -3.257 1.00 0.00 C ATOM 1148 C CYS A 79 11.039 12.458 -3.504 1.00 0.00 C ATOM 1149 O CYS A 79 11.677 12.976 -2.588 1.00 0.00 O ATOM 1150 CB CYS A 79 9.232 11.466 -2.086 1.00 0.00 C ATOM 1151 SG CYS A 79 7.779 12.454 -2.512 1.00 0.00 S ATOM 0 H CYS A 79 11.631 10.149 -2.180 1.00 0.00 H new ATOM 0 HA CYS A 79 9.599 11.019 -4.155 1.00 0.00 H new ATOM 0 HB2 CYS A 79 8.902 10.505 -1.691 1.00 0.00 H new ATOM 0 HB3 CYS A 79 9.778 11.968 -1.287 1.00 0.00 H new ATOM 0 HG CYS A 79 6.715 11.711 -2.447 1.00 0.00 H new ATOM 1157 N MET A 80 11.047 12.928 -4.747 1.00 0.00 N ATOM 1158 CA MET A 80 11.824 14.106 -5.114 1.00 0.00 C ATOM 1159 C MET A 80 10.953 15.358 -5.095 1.00 0.00 C ATOM 1160 O MET A 80 9.856 15.372 -5.655 1.00 0.00 O ATOM 1161 CB MET A 80 12.445 13.923 -6.500 1.00 0.00 C ATOM 1162 CG MET A 80 12.882 12.495 -6.786 1.00 0.00 C ATOM 1163 SD MET A 80 13.785 12.344 -8.340 1.00 0.00 S ATOM 1164 CE MET A 80 14.432 10.680 -8.194 1.00 0.00 C ATOM 0 H MET A 80 10.524 12.511 -5.517 1.00 0.00 H new ATOM 0 HA MET A 80 12.621 14.228 -4.381 1.00 0.00 H new ATOM 0 HB2 MET A 80 11.723 14.232 -7.256 1.00 0.00 H new ATOM 0 HB3 MET A 80 13.307 14.584 -6.593 1.00 0.00 H new ATOM 0 HG2 MET A 80 13.511 12.141 -5.969 1.00 0.00 H new ATOM 0 HG3 MET A 80 12.004 11.849 -6.816 1.00 0.00 H new ATOM 0 HE1 MET A 80 14.971 10.418 -9.104 1.00 0.00 H new ATOM 0 HE2 MET A 80 15.110 10.627 -7.342 1.00 0.00 H new ATOM 0 HE3 MET A 80 13.609 9.981 -8.046 1.00 0.00 H new ATOM 1174 N CYS A 81 11.448 16.408 -4.448 1.00 0.00 N ATOM 1175 CA CYS A 81 10.714 17.665 -4.356 1.00 0.00 C ATOM 1176 C CYS A 81 11.610 18.845 -4.720 1.00 0.00 C ATOM 1177 O CYS A 81 12.399 19.314 -3.901 1.00 0.00 O ATOM 1178 CB CYS A 81 10.154 17.850 -2.945 1.00 0.00 C ATOM 1179 SG CYS A 81 9.418 19.475 -2.651 1.00 0.00 S ATOM 0 H CYS A 81 12.354 16.413 -3.980 1.00 0.00 H new ATOM 0 HA CYS A 81 9.887 17.628 -5.065 1.00 0.00 H new ATOM 0 HB2 CYS A 81 9.401 17.083 -2.761 1.00 0.00 H new ATOM 0 HB3 CYS A 81 10.955 17.690 -2.224 1.00 0.00 H new ATOM 0 HG CYS A 81 9.900 19.977 -1.553 1.00 0.00 H new ATOM 1185 N GLY A 82 11.482 19.320 -5.955 1.00 0.00 N ATOM 1186 CA GLY A 82 12.287 20.440 -6.406 1.00 0.00 C ATOM 1187 C GLY A 82 13.730 20.052 -6.660 1.00 0.00 C ATOM 1188 O GLY A 82 14.111 19.763 -7.793 1.00 0.00 O ATOM 0 H GLY A 82 10.835 18.949 -6.651 1.00 0.00 H new ATOM 0 HA2 GLY A 82 11.857 20.847 -7.321 1.00 0.00 H new ATOM 0 HA3 GLY A 82 12.253 21.232 -5.658 1.00 0.00 H new ATOM 1192 N GLN A 83 14.534 20.047 -5.601 1.00 0.00 N ATOM 1193 CA GLN A 83 15.944 19.694 -5.716 1.00 0.00 C ATOM 1194 C GLN A 83 16.303 18.566 -4.753 1.00 0.00 C ATOM 1195 O GLN A 83 17.036 17.644 -5.109 1.00 0.00 O ATOM 1196 CB GLN A 83 16.822 20.915 -5.438 1.00 0.00 C ATOM 1197 CG GLN A 83 16.632 22.042 -6.441 1.00 0.00 C ATOM 1198 CD GLN A 83 17.465 21.854 -7.694 1.00 0.00 C ATOM 1199 OE1 GLN A 83 17.135 21.042 -8.558 1.00 0.00 O ATOM 1200 NE2 GLN A 83 18.554 22.607 -7.798 1.00 0.00 N ATOM 0 H GLN A 83 14.233 20.283 -4.655 1.00 0.00 H new ATOM 0 HA GLN A 83 16.124 19.350 -6.734 1.00 0.00 H new ATOM 0 HB2 GLN A 83 16.603 21.289 -4.438 1.00 0.00 H new ATOM 0 HB3 GLN A 83 17.868 20.609 -5.442 1.00 0.00 H new ATOM 0 HG2 GLN A 83 15.579 22.106 -6.715 1.00 0.00 H new ATOM 0 HG3 GLN A 83 16.897 22.990 -5.972 1.00 0.00 H new ATOM 0 HE21 GLN A 83 18.790 23.268 -7.057 1.00 0.00 H new ATOM 0 HE22 GLN A 83 19.154 22.525 -8.618 1.00 0.00 H new ATOM 1209 N GLU A 84 15.781 18.647 -3.533 1.00 0.00 N ATOM 1210 CA GLU A 84 16.048 17.634 -2.520 1.00 0.00 C ATOM 1211 C GLU A 84 15.423 16.297 -2.909 1.00 0.00 C ATOM 1212 O GLU A 84 14.802 16.175 -3.965 1.00 0.00 O ATOM 1213 CB GLU A 84 15.509 18.085 -1.161 1.00 0.00 C ATOM 1214 CG GLU A 84 16.435 19.039 -0.425 1.00 0.00 C ATOM 1215 CD GLU A 84 17.849 18.503 -0.305 1.00 0.00 C ATOM 1216 OE1 GLU A 84 18.017 17.388 0.232 1.00 0.00 O ATOM 1217 OE2 GLU A 84 18.787 19.199 -0.747 1.00 0.00 O ATOM 0 H GLU A 84 15.171 19.404 -3.223 1.00 0.00 H new ATOM 0 HA GLU A 84 17.128 17.504 -2.449 1.00 0.00 H new ATOM 0 HB2 GLU A 84 14.543 18.569 -1.305 1.00 0.00 H new ATOM 0 HB3 GLU A 84 15.336 17.207 -0.539 1.00 0.00 H new ATOM 0 HG2 GLU A 84 16.456 19.995 -0.948 1.00 0.00 H new ATOM 0 HG3 GLU A 84 16.037 19.230 0.572 1.00 0.00 H new ATOM 1224 N ARG A 85 15.592 15.298 -2.049 1.00 0.00 N ATOM 1225 CA ARG A 85 15.046 13.971 -2.303 1.00 0.00 C ATOM 1226 C ARG A 85 15.076 13.119 -1.037 1.00 0.00 C ATOM 1227 O ARG A 85 15.939 13.296 -0.176 1.00 0.00 O ATOM 1228 CB ARG A 85 15.833 13.277 -3.416 1.00 0.00 C ATOM 1229 CG ARG A 85 15.175 12.005 -3.926 1.00 0.00 C ATOM 1230 CD ARG A 85 15.653 10.783 -3.158 1.00 0.00 C ATOM 1231 NE ARG A 85 16.815 10.161 -3.787 1.00 0.00 N ATOM 1232 CZ ARG A 85 17.582 9.259 -3.185 1.00 0.00 C ATOM 1233 NH1 ARG A 85 17.310 8.874 -1.946 1.00 0.00 N ATOM 1234 NH2 ARG A 85 18.622 8.738 -3.824 1.00 0.00 N ATOM 0 H ARG A 85 16.103 15.383 -1.170 1.00 0.00 H new ATOM 0 HA ARG A 85 14.009 14.087 -2.618 1.00 0.00 H new ATOM 0 HB2 ARG A 85 15.957 13.970 -4.248 1.00 0.00 H new ATOM 0 HB3 ARG A 85 16.831 13.038 -3.049 1.00 0.00 H new ATOM 0 HG2 ARG A 85 14.092 12.093 -3.835 1.00 0.00 H new ATOM 0 HG3 ARG A 85 15.397 11.879 -4.986 1.00 0.00 H new ATOM 0 HD2 ARG A 85 15.904 11.072 -2.137 1.00 0.00 H new ATOM 0 HD3 ARG A 85 14.843 10.056 -3.093 1.00 0.00 H new ATOM 0 HE ARG A 85 17.051 10.434 -4.741 1.00 0.00 H new ATOM 0 HH11 ARG A 85 16.510 9.271 -1.453 1.00 0.00 H new ATOM 0 HH12 ARG A 85 17.901 8.181 -1.486 1.00 0.00 H new ATOM 0 HH21 ARG A 85 18.833 9.030 -4.778 1.00 0.00 H new ATOM 0 HH22 ARG A 85 19.210 8.045 -3.361 1.00 0.00 H new ATOM 1248 N THR A 86 14.127 12.194 -0.929 1.00 0.00 N ATOM 1249 CA THR A 86 14.044 11.317 0.231 1.00 0.00 C ATOM 1250 C THR A 86 13.632 9.906 -0.174 1.00 0.00 C ATOM 1251 O THR A 86 13.121 9.690 -1.273 1.00 0.00 O ATOM 1252 CB THR A 86 13.041 11.853 1.270 1.00 0.00 C ATOM 1253 OG1 THR A 86 13.359 11.340 2.569 1.00 0.00 O ATOM 1254 CG2 THR A 86 11.618 11.463 0.900 1.00 0.00 C ATOM 0 H THR A 86 13.405 12.033 -1.632 1.00 0.00 H new ATOM 0 HA THR A 86 15.038 11.289 0.677 1.00 0.00 H new ATOM 0 HB THR A 86 13.111 12.941 1.282 1.00 0.00 H new ATOM 0 HG1 THR A 86 12.949 11.908 3.254 1.00 0.00 H new ATOM 0 HG21 THR A 86 10.928 11.853 1.648 1.00 0.00 H new ATOM 0 HG22 THR A 86 11.369 11.880 -0.076 1.00 0.00 H new ATOM 0 HG23 THR A 86 11.537 10.377 0.862 1.00 0.00 H new ATOM 1262 N SER A 87 13.857 8.949 0.720 1.00 0.00 N ATOM 1263 CA SER A 87 13.511 7.557 0.453 1.00 0.00 C ATOM 1264 C SER A 87 12.873 6.911 1.679 1.00 0.00 C ATOM 1265 O SER A 87 13.149 7.300 2.813 1.00 0.00 O ATOM 1266 CB SER A 87 14.757 6.771 0.039 1.00 0.00 C ATOM 1267 OG SER A 87 15.876 7.137 0.827 1.00 0.00 O ATOM 0 H SER A 87 14.277 9.111 1.635 1.00 0.00 H new ATOM 0 HA SER A 87 12.789 7.538 -0.363 1.00 0.00 H new ATOM 0 HB2 SER A 87 14.568 5.703 0.144 1.00 0.00 H new ATOM 0 HB3 SER A 87 14.974 6.955 -1.013 1.00 0.00 H new ATOM 0 HG SER A 87 16.659 6.620 0.544 1.00 0.00 H new ATOM 1273 N ALA A 88 12.017 5.923 1.440 1.00 0.00 N ATOM 1274 CA ALA A 88 11.339 5.221 2.524 1.00 0.00 C ATOM 1275 C ALA A 88 11.143 3.747 2.185 1.00 0.00 C ATOM 1276 O ALA A 88 10.317 3.398 1.342 1.00 0.00 O ATOM 1277 CB ALA A 88 10.000 5.879 2.823 1.00 0.00 C ATOM 0 H ALA A 88 11.776 5.590 0.506 1.00 0.00 H new ATOM 0 HA ALA A 88 11.967 5.282 3.413 1.00 0.00 H new ATOM 0 HB1 ALA A 88 9.505 5.345 3.634 1.00 0.00 H new ATOM 0 HB2 ALA A 88 10.162 6.916 3.117 1.00 0.00 H new ATOM 0 HB3 ALA A 88 9.373 5.848 1.932 1.00 0.00 H new ATOM 1283 N THR A 89 11.909 2.886 2.847 1.00 0.00 N ATOM 1284 CA THR A 89 11.821 1.450 2.614 1.00 0.00 C ATOM 1285 C THR A 89 10.480 0.898 3.086 1.00 0.00 C ATOM 1286 O THR A 89 10.120 1.029 4.256 1.00 0.00 O ATOM 1287 CB THR A 89 12.955 0.694 3.332 1.00 0.00 C ATOM 1288 OG1 THR A 89 14.224 1.241 2.955 1.00 0.00 O ATOM 1289 CG2 THR A 89 12.916 -0.789 2.993 1.00 0.00 C ATOM 0 H THR A 89 12.597 3.158 3.549 1.00 0.00 H new ATOM 0 HA THR A 89 11.916 1.298 1.539 1.00 0.00 H new ATOM 0 HB THR A 89 12.815 0.809 4.407 1.00 0.00 H new ATOM 0 HG1 THR A 89 14.939 0.756 3.417 1.00 0.00 H new ATOM 0 HG21 THR A 89 13.726 -1.302 3.511 1.00 0.00 H new ATOM 0 HG22 THR A 89 11.960 -1.209 3.307 1.00 0.00 H new ATOM 0 HG23 THR A 89 13.034 -0.920 1.917 1.00 0.00 H new ATOM 1297 N LEU A 90 9.745 0.280 2.168 1.00 0.00 N ATOM 1298 CA LEU A 90 8.443 -0.294 2.490 1.00 0.00 C ATOM 1299 C LEU A 90 8.544 -1.804 2.677 1.00 0.00 C ATOM 1300 O LEU A 90 9.238 -2.489 1.925 1.00 0.00 O ATOM 1301 CB LEU A 90 7.434 0.029 1.387 1.00 0.00 C ATOM 1302 CG LEU A 90 6.093 -0.701 1.468 1.00 0.00 C ATOM 1303 CD1 LEU A 90 5.176 -0.022 2.474 1.00 0.00 C ATOM 1304 CD2 LEU A 90 5.434 -0.761 0.098 1.00 0.00 C ATOM 0 H LEU A 90 10.028 0.164 1.195 1.00 0.00 H new ATOM 0 HA LEU A 90 8.101 0.147 3.427 1.00 0.00 H new ATOM 0 HB2 LEU A 90 7.242 1.102 1.401 1.00 0.00 H new ATOM 0 HB3 LEU A 90 7.892 -0.200 0.425 1.00 0.00 H new ATOM 0 HG LEU A 90 6.276 -1.721 1.805 1.00 0.00 H new ATOM 0 HD11 LEU A 90 4.226 -0.555 2.518 1.00 0.00 H new ATOM 0 HD12 LEU A 90 5.644 -0.033 3.458 1.00 0.00 H new ATOM 0 HD13 LEU A 90 4.999 1.009 2.167 1.00 0.00 H new ATOM 0 HD21 LEU A 90 4.481 -1.284 0.175 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.264 0.251 -0.268 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.085 -1.293 -0.596 1.00 0.00 H new ATOM 1316 N THR A 91 7.845 -2.319 3.684 1.00 0.00 N ATOM 1317 CA THR A 91 7.855 -3.749 3.968 1.00 0.00 C ATOM 1318 C THR A 91 6.492 -4.374 3.692 1.00 0.00 C ATOM 1319 O THR A 91 5.456 -3.806 4.038 1.00 0.00 O ATOM 1320 CB THR A 91 8.248 -4.027 5.432 1.00 0.00 C ATOM 1321 OG1 THR A 91 9.557 -3.510 5.694 1.00 0.00 O ATOM 1322 CG2 THR A 91 8.218 -5.519 5.725 1.00 0.00 C ATOM 0 H THR A 91 7.265 -1.767 4.316 1.00 0.00 H new ATOM 0 HA THR A 91 8.597 -4.198 3.308 1.00 0.00 H new ATOM 0 HB THR A 91 7.526 -3.531 6.080 1.00 0.00 H new ATOM 0 HG1 THR A 91 9.799 -3.689 6.627 1.00 0.00 H new ATOM 0 HG21 THR A 91 8.499 -5.691 6.764 1.00 0.00 H new ATOM 0 HG22 THR A 91 7.213 -5.904 5.552 1.00 0.00 H new ATOM 0 HG23 THR A 91 8.921 -6.033 5.069 1.00 0.00 H new ATOM 1330 N VAL A 92 6.500 -5.547 3.068 1.00 0.00 N ATOM 1331 CA VAL A 92 5.264 -6.251 2.747 1.00 0.00 C ATOM 1332 C VAL A 92 5.305 -7.690 3.249 1.00 0.00 C ATOM 1333 O VAL A 92 6.206 -8.454 2.903 1.00 0.00 O ATOM 1334 CB VAL A 92 4.999 -6.256 1.230 1.00 0.00 C ATOM 1335 CG1 VAL A 92 3.647 -6.882 0.926 1.00 0.00 C ATOM 1336 CG2 VAL A 92 5.079 -4.843 0.670 1.00 0.00 C ATOM 0 H VAL A 92 7.349 -6.030 2.774 1.00 0.00 H new ATOM 0 HA VAL A 92 4.456 -5.717 3.248 1.00 0.00 H new ATOM 0 HB VAL A 92 5.769 -6.858 0.747 1.00 0.00 H new ATOM 0 HG11 VAL A 92 3.477 -6.877 -0.151 1.00 0.00 H new ATOM 0 HG12 VAL A 92 3.631 -7.909 1.291 1.00 0.00 H new ATOM 0 HG13 VAL A 92 2.862 -6.310 1.420 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.889 -4.866 -0.403 1.00 0.00 H new ATOM 0 HG22 VAL A 92 4.333 -4.216 1.157 1.00 0.00 H new ATOM 0 HG23 VAL A 92 6.073 -4.434 0.854 1.00 0.00 H new ATOM 1346 N ARG A 93 4.322 -8.053 4.067 1.00 0.00 N ATOM 1347 CA ARG A 93 4.245 -9.400 4.618 1.00 0.00 C ATOM 1348 C ARG A 93 3.301 -10.272 3.795 1.00 0.00 C ATOM 1349 O ARG A 93 2.140 -9.921 3.587 1.00 0.00 O ATOM 1350 CB ARG A 93 3.775 -9.353 6.073 1.00 0.00 C ATOM 1351 CG ARG A 93 4.888 -9.054 7.064 1.00 0.00 C ATOM 1352 CD ARG A 93 5.589 -10.326 7.514 1.00 0.00 C ATOM 1353 NE ARG A 93 6.715 -10.666 6.648 1.00 0.00 N ATOM 1354 CZ ARG A 93 7.651 -11.551 6.972 1.00 0.00 C ATOM 1355 NH1 ARG A 93 7.596 -12.182 8.137 1.00 0.00 N ATOM 1356 NH2 ARG A 93 8.644 -11.807 6.130 1.00 0.00 N ATOM 0 H ARG A 93 3.568 -7.433 4.362 1.00 0.00 H new ATOM 0 HA ARG A 93 5.242 -9.838 4.579 1.00 0.00 H new ATOM 0 HB2 ARG A 93 2.999 -8.593 6.171 1.00 0.00 H new ATOM 0 HB3 ARG A 93 3.319 -10.309 6.330 1.00 0.00 H new ATOM 0 HG2 ARG A 93 5.613 -8.380 6.607 1.00 0.00 H new ATOM 0 HG3 ARG A 93 4.476 -8.538 7.931 1.00 0.00 H new ATOM 0 HD2 ARG A 93 5.943 -10.202 8.537 1.00 0.00 H new ATOM 0 HD3 ARG A 93 4.876 -11.150 7.521 1.00 0.00 H new ATOM 0 HE ARG A 93 6.786 -10.198 5.745 1.00 0.00 H new ATOM 0 HH11 ARG A 93 6.834 -11.988 8.786 1.00 0.00 H new ATOM 0 HH12 ARG A 93 8.316 -12.861 8.384 1.00 0.00 H new ATOM 0 HH21 ARG A 93 8.689 -11.324 5.233 1.00 0.00 H new ATOM 0 HH22 ARG A 93 9.362 -12.487 6.380 1.00 0.00 H new ATOM 1370 N ALA A 94 3.809 -11.408 3.328 1.00 0.00 N ATOM 1371 CA ALA A 94 3.011 -12.329 2.529 1.00 0.00 C ATOM 1372 C ALA A 94 1.989 -13.061 3.392 1.00 0.00 C ATOM 1373 O ALA A 94 2.282 -13.449 4.524 1.00 0.00 O ATOM 1374 CB ALA A 94 3.913 -13.326 1.815 1.00 0.00 C ATOM 0 H ALA A 94 4.769 -11.712 3.489 1.00 0.00 H new ATOM 0 HA ALA A 94 2.468 -11.748 1.784 1.00 0.00 H new ATOM 0 HB1 ALA A 94 3.304 -14.008 1.222 1.00 0.00 H new ATOM 0 HB2 ALA A 94 4.600 -12.791 1.160 1.00 0.00 H new ATOM 0 HB3 ALA A 94 4.482 -13.894 2.551 1.00 0.00 H new ATOM 1380 N LEU A 95 0.790 -13.248 2.851 1.00 0.00 N ATOM 1381 CA LEU A 95 -0.276 -13.934 3.573 1.00 0.00 C ATOM 1382 C LEU A 95 0.222 -15.252 4.156 1.00 0.00 C ATOM 1383 O LEU A 95 1.138 -15.885 3.632 1.00 0.00 O ATOM 1384 CB LEU A 95 -1.464 -14.190 2.644 1.00 0.00 C ATOM 1385 CG LEU A 95 -2.225 -12.951 2.169 1.00 0.00 C ATOM 1386 CD1 LEU A 95 -3.683 -13.290 1.902 1.00 0.00 C ATOM 1387 CD2 LEU A 95 -2.114 -11.832 3.195 1.00 0.00 C ATOM 0 H LEU A 95 0.532 -12.934 1.915 1.00 0.00 H new ATOM 0 HA LEU A 95 -0.596 -13.293 4.395 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -1.104 -14.729 1.767 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -2.165 -14.848 3.157 1.00 0.00 H new ATOM 0 HG LEU A 95 -1.777 -12.608 1.236 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -4.208 -12.396 1.565 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -3.743 -14.058 1.131 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -4.145 -13.658 2.818 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -2.661 -10.958 2.841 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -2.536 -12.165 4.143 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -1.065 -11.571 3.336 1.00 0.00 H new ATOM 1399 N PRO A 96 -0.397 -15.679 5.267 1.00 0.00 N ATOM 1400 CA PRO A 96 -0.035 -16.927 5.945 1.00 0.00 C ATOM 1401 C PRO A 96 -0.426 -18.160 5.136 1.00 0.00 C ATOM 1402 O PRO A 96 -1.562 -18.279 4.679 1.00 0.00 O ATOM 1403 CB PRO A 96 -0.835 -16.868 7.249 1.00 0.00 C ATOM 1404 CG PRO A 96 -1.997 -15.988 6.941 1.00 0.00 C ATOM 1405 CD PRO A 96 -1.497 -14.975 5.947 1.00 0.00 C ATOM 0 HA PRO A 96 1.041 -17.013 6.093 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -1.161 -17.861 7.558 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -0.235 -16.461 8.063 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -2.825 -16.565 6.528 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -2.367 -15.500 7.843 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -2.278 -14.679 5.247 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -1.149 -14.067 6.439 1.00 0.00 H new ATOM 1413 N ALA A 97 0.523 -19.074 4.964 1.00 0.00 N ATOM 1414 CA ALA A 97 0.277 -20.299 4.213 1.00 0.00 C ATOM 1415 C ALA A 97 0.369 -21.524 5.116 1.00 0.00 C ATOM 1416 O ALA A 97 1.112 -22.463 4.830 1.00 0.00 O ATOM 1417 CB ALA A 97 1.261 -20.416 3.058 1.00 0.00 C ATOM 0 H ALA A 97 1.470 -18.989 5.335 1.00 0.00 H new ATOM 0 HA ALA A 97 -0.735 -20.253 3.810 1.00 0.00 H new ATOM 0 HB1 ALA A 97 1.066 -21.335 2.506 1.00 0.00 H new ATOM 0 HB2 ALA A 97 1.144 -19.561 2.392 1.00 0.00 H new ATOM 0 HB3 ALA A 97 2.279 -20.436 3.448 1.00 0.00 H new ATOM 1423 N ARG A 98 -0.391 -21.509 6.206 1.00 0.00 N ATOM 1424 CA ARG A 98 -0.394 -22.618 7.151 1.00 0.00 C ATOM 1425 C ARG A 98 -1.551 -23.572 6.868 1.00 0.00 C ATOM 1426 O ARG A 98 -2.713 -23.166 6.851 1.00 0.00 O ATOM 1427 CB ARG A 98 -0.490 -22.094 8.585 1.00 0.00 C ATOM 1428 CG ARG A 98 0.850 -21.689 9.177 1.00 0.00 C ATOM 1429 CD ARG A 98 1.591 -22.887 9.750 1.00 0.00 C ATOM 1430 NE ARG A 98 2.766 -22.486 10.520 1.00 0.00 N ATOM 1431 CZ ARG A 98 3.753 -23.316 10.840 1.00 0.00 C ATOM 1432 NH1 ARG A 98 3.706 -24.585 10.458 1.00 0.00 N ATOM 1433 NH2 ARG A 98 4.789 -22.877 11.543 1.00 0.00 N ATOM 0 H ARG A 98 -1.013 -20.740 6.456 1.00 0.00 H new ATOM 0 HA ARG A 98 0.542 -23.165 7.033 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -1.161 -21.235 8.605 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -0.938 -22.863 9.214 1.00 0.00 H new ATOM 0 HG2 ARG A 98 1.461 -21.216 8.408 1.00 0.00 H new ATOM 0 HG3 ARG A 98 0.694 -20.948 9.961 1.00 0.00 H new ATOM 0 HD2 ARG A 98 0.917 -23.459 10.388 1.00 0.00 H new ATOM 0 HD3 ARG A 98 1.897 -23.546 8.938 1.00 0.00 H new ATOM 0 HE ARG A 98 2.832 -21.516 10.829 1.00 0.00 H new ATOM 0 HH11 ARG A 98 2.911 -24.926 9.917 1.00 0.00 H new ATOM 0 HH12 ARG A 98 4.465 -25.220 10.705 1.00 0.00 H new ATOM 0 HH21 ARG A 98 4.828 -21.901 11.838 1.00 0.00 H new ATOM 0 HH22 ARG A 98 5.546 -23.515 11.788 1.00 0.00 H new ATOM 1447 N PHE A 99 -1.225 -24.840 6.645 1.00 0.00 N ATOM 1448 CA PHE A 99 -2.237 -25.851 6.360 1.00 0.00 C ATOM 1449 C PHE A 99 -2.544 -26.678 7.605 1.00 0.00 C ATOM 1450 O PHE A 99 -1.830 -27.629 7.925 1.00 0.00 O ATOM 1451 CB PHE A 99 -1.768 -26.767 5.228 1.00 0.00 C ATOM 1452 CG PHE A 99 -1.486 -26.039 3.945 1.00 0.00 C ATOM 1453 CD1 PHE A 99 -2.523 -25.551 3.167 1.00 0.00 C ATOM 1454 CD2 PHE A 99 -0.183 -25.842 3.518 1.00 0.00 C ATOM 1455 CE1 PHE A 99 -2.266 -24.881 1.986 1.00 0.00 C ATOM 1456 CE2 PHE A 99 0.081 -25.172 2.338 1.00 0.00 C ATOM 1457 CZ PHE A 99 -0.962 -24.690 1.571 1.00 0.00 C ATOM 0 H PHE A 99 -0.268 -25.193 6.656 1.00 0.00 H new ATOM 0 HA PHE A 99 -3.149 -25.340 6.050 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -0.866 -27.290 5.545 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -2.529 -27.525 5.046 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -3.544 -25.696 3.487 1.00 0.00 H new ATOM 0 HD2 PHE A 99 0.636 -26.216 4.114 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -3.084 -24.507 1.388 1.00 0.00 H new ATOM 0 HE2 PHE A 99 1.101 -25.026 2.016 1.00 0.00 H new ATOM 0 HZ PHE A 99 -0.759 -24.165 0.649 1.00 0.00 H new ATOM 1467 N THR A 100 -3.613 -26.309 8.304 1.00 0.00 N ATOM 1468 CA THR A 100 -4.015 -27.015 9.515 1.00 0.00 C ATOM 1469 C THR A 100 -5.427 -27.572 9.383 1.00 0.00 C ATOM 1470 O THR A 100 -6.225 -27.083 8.583 1.00 0.00 O ATOM 1471 CB THR A 100 -3.952 -26.095 10.749 1.00 0.00 C ATOM 1472 OG1 THR A 100 -4.213 -26.850 11.937 1.00 0.00 O ATOM 1473 CG2 THR A 100 -4.959 -24.961 10.630 1.00 0.00 C ATOM 0 H THR A 100 -4.216 -25.526 8.053 1.00 0.00 H new ATOM 0 HA THR A 100 -3.313 -27.838 9.648 1.00 0.00 H new ATOM 0 HB THR A 100 -2.951 -25.666 10.805 1.00 0.00 H new ATOM 0 HG1 THR A 100 -4.169 -26.258 12.717 1.00 0.00 H new ATOM 0 HG21 THR A 100 -4.896 -24.325 11.513 1.00 0.00 H new ATOM 0 HG22 THR A 100 -4.739 -24.371 9.741 1.00 0.00 H new ATOM 0 HG23 THR A 100 -5.965 -25.374 10.551 1.00 0.00 H new ATOM 1481 N GLU A 101 -5.730 -28.598 10.172 1.00 0.00 N ATOM 1482 CA GLU A 101 -7.048 -29.221 10.142 1.00 0.00 C ATOM 1483 C GLU A 101 -7.837 -28.887 11.405 1.00 0.00 C ATOM 1484 O GLU A 101 -7.442 -29.251 12.511 1.00 0.00 O ATOM 1485 CB GLU A 101 -6.915 -30.739 9.997 1.00 0.00 C ATOM 1486 CG GLU A 101 -8.249 -31.459 9.892 1.00 0.00 C ATOM 1487 CD GLU A 101 -9.102 -30.943 8.749 1.00 0.00 C ATOM 1488 OE1 GLU A 101 -8.820 -31.306 7.588 1.00 0.00 O ATOM 1489 OE2 GLU A 101 -10.052 -30.177 9.016 1.00 0.00 O ATOM 0 H GLU A 101 -5.081 -29.015 10.839 1.00 0.00 H new ATOM 0 HA GLU A 101 -7.589 -28.826 9.282 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -6.321 -30.960 9.110 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -6.367 -31.131 10.854 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -8.072 -32.526 9.756 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -8.795 -31.344 10.829 1.00 0.00 H new ATOM 1496 N GLY A 102 -8.956 -28.191 11.229 1.00 0.00 N ATOM 1497 CA GLY A 102 -9.783 -27.818 12.362 1.00 0.00 C ATOM 1498 C GLY A 102 -11.034 -28.667 12.471 1.00 0.00 C ATOM 1499 O GLY A 102 -12.071 -28.333 11.897 1.00 0.00 O ATOM 0 H GLY A 102 -9.305 -27.879 10.323 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -9.202 -27.913 13.279 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -10.066 -26.769 12.272 1.00 0.00 H new ATOM 1503 N SER A 103 -10.938 -29.769 13.208 1.00 0.00 N ATOM 1504 CA SER A 103 -12.069 -30.672 13.385 1.00 0.00 C ATOM 1505 C SER A 103 -13.359 -29.888 13.606 1.00 0.00 C ATOM 1506 O SER A 103 -14.320 -30.026 12.849 1.00 0.00 O ATOM 1507 CB SER A 103 -11.820 -31.609 14.568 1.00 0.00 C ATOM 1508 OG SER A 103 -12.751 -32.678 14.576 1.00 0.00 O ATOM 0 H SER A 103 -10.088 -30.058 13.692 1.00 0.00 H new ATOM 0 HA SER A 103 -12.175 -31.265 12.477 1.00 0.00 H new ATOM 0 HB2 SER A 103 -10.806 -32.006 14.515 1.00 0.00 H new ATOM 0 HB3 SER A 103 -11.895 -31.050 15.501 1.00 0.00 H new ATOM 0 HG SER A 103 -12.570 -33.264 15.341 1.00 0.00 H new ATOM 1514 N GLY A 104 -13.373 -29.065 14.650 1.00 0.00 N ATOM 1515 CA GLY A 104 -14.550 -28.271 14.953 1.00 0.00 C ATOM 1516 C GLY A 104 -14.978 -28.398 16.401 1.00 0.00 C ATOM 1517 O GLY A 104 -15.984 -29.033 16.720 1.00 0.00 O ATOM 0 H GLY A 104 -12.591 -28.934 15.291 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -14.346 -27.224 14.728 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -15.370 -28.582 14.306 1.00 0.00 H new ATOM 1521 N PRO A 105 -14.202 -27.785 17.308 1.00 0.00 N ATOM 1522 CA PRO A 105 -14.486 -27.819 18.745 1.00 0.00 C ATOM 1523 C PRO A 105 -15.724 -27.007 19.111 1.00 0.00 C ATOM 1524 O PRO A 105 -16.236 -26.239 18.298 1.00 0.00 O ATOM 1525 CB PRO A 105 -13.234 -27.197 19.369 1.00 0.00 C ATOM 1526 CG PRO A 105 -12.671 -26.326 18.299 1.00 0.00 C ATOM 1527 CD PRO A 105 -12.988 -27.011 16.998 1.00 0.00 C ATOM 0 HA PRO A 105 -14.696 -28.830 19.095 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -13.481 -26.620 20.260 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -12.520 -27.963 19.672 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -13.113 -25.330 18.334 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -11.595 -26.202 18.423 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -13.163 -26.292 16.197 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -12.172 -27.656 16.674 1.00 0.00 H new ATOM 1535 N SER A 106 -16.199 -27.183 20.340 1.00 0.00 N ATOM 1536 CA SER A 106 -17.379 -26.468 20.813 1.00 0.00 C ATOM 1537 C SER A 106 -17.494 -26.554 22.332 1.00 0.00 C ATOM 1538 O SER A 106 -17.087 -27.543 22.941 1.00 0.00 O ATOM 1539 CB SER A 106 -18.641 -27.038 20.162 1.00 0.00 C ATOM 1540 OG SER A 106 -18.915 -28.345 20.638 1.00 0.00 O ATOM 0 H SER A 106 -15.785 -27.814 21.026 1.00 0.00 H new ATOM 0 HA SER A 106 -17.275 -25.420 20.533 1.00 0.00 H new ATOM 0 HB2 SER A 106 -19.489 -26.386 20.372 1.00 0.00 H new ATOM 0 HB3 SER A 106 -18.517 -27.060 19.079 1.00 0.00 H new ATOM 0 HG SER A 106 -19.727 -28.686 20.208 1.00 0.00 H new ATOM 1546 N SER A 107 -18.050 -25.509 22.936 1.00 0.00 N ATOM 1547 CA SER A 107 -18.216 -25.462 24.384 1.00 0.00 C ATOM 1548 C SER A 107 -19.567 -26.040 24.796 1.00 0.00 C ATOM 1549 O SER A 107 -20.503 -26.086 23.999 1.00 0.00 O ATOM 1550 CB SER A 107 -18.089 -24.023 24.888 1.00 0.00 C ATOM 1551 OG SER A 107 -16.740 -23.588 24.853 1.00 0.00 O ATOM 0 H SER A 107 -18.393 -24.683 22.445 1.00 0.00 H new ATOM 0 HA SER A 107 -17.429 -26.067 24.834 1.00 0.00 H new ATOM 0 HB2 SER A 107 -18.703 -23.364 24.274 1.00 0.00 H new ATOM 0 HB3 SER A 107 -18.470 -23.956 25.907 1.00 0.00 H new ATOM 0 HG SER A 107 -16.685 -22.665 25.178 1.00 0.00 H new ATOM 1557 N GLY A 108 -19.659 -26.480 26.047 1.00 0.00 N ATOM 1558 CA GLY A 108 -20.898 -27.048 26.544 1.00 0.00 C ATOM 1559 C GLY A 108 -21.105 -28.478 26.084 1.00 0.00 C ATOM 1560 O GLY A 108 -20.387 -29.383 26.508 1.00 0.00 O ATOM 0 H GLY A 108 -18.897 -26.453 26.725 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -20.897 -27.016 27.634 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -21.735 -26.436 26.208 1.00 0.00 H new TER 1564 GLY A 108