USER MOD reduce.3.24.130724 H: found=0, std=0, add=874, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 869 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 54 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 63 HIS : no HD1:sc= -0.976 K(o=-0.98,f=-2.4) USER MOD Single : A 1 GLY N :NH3+ -131:sc= 0.0477 (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 23:sc= 0.0916 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 HIS : no HD1:sc= -0.272 X(o=-0.27,f=-0.1) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 39:sc= 0.77 USER MOD Single : A 20 THR OG1 : rot 180:sc= -2.22 USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.154 USER MOD Single : A 27 SER OG : rot 170:sc= -0.0465 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= -0.553 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= -0.124 K(o=-0.12,f=-2!) USER MOD Single : A 43 CYS SG : rot 100:sc= -0.127 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 50 TYR OH : rot -130:sc= -2.82! USER MOD Single : A 51 SER OG : rot -160:sc= 0 USER MOD Single : A 55 GLN : amide:sc= -1.52 K(o=-1.5,f=-0.6) USER MOD Single : A 58 ASN : amide:sc= -1.66 X(o=-1.7,f=-1.3) USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 69 ASN : amide:sc= -0.644 K(o=-0.64,f=-2.2) USER MOD Single : A 72 GLN : amide:sc= -0.6 X(o=-0.6,f=-0.93) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 83 ASN : amide:sc= -1.42! K(o=-1.4!,f=-0.094) USER MOD Single : A 84 HIS : no HE2:sc= 0.635 K(o=0.63,f=-5.9!) USER MOD Single : A 85 SER OG : rot -170:sc= -0.558 USER MOD Single : A 86 TYR OH : rot 30:sc= -0.0988 USER MOD Single : A 93 GLN : amide:sc= -0.204 K(o=-0.2,f=-2.3!) USER MOD Single : A 94 SER OG : rot 178:sc= 0.18 USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 17.649 38.268 7.297 1.00 0.00 N ATOM 2 CA GLY A 1 18.889 38.949 7.618 1.00 0.00 C ATOM 3 C GLY A 1 19.943 38.772 6.543 1.00 0.00 C ATOM 4 O GLY A 1 19.618 38.574 5.372 1.00 0.00 O ATOM 0 H1 GLY A 1 16.850 38.920 7.431 1.00 0.00 H new ATOM 0 H2 GLY A 1 17.674 37.950 6.307 1.00 0.00 H new ATOM 0 H3 GLY A 1 17.533 37.445 7.922 1.00 0.00 H new ATOM 0 HA2 GLY A 1 18.691 40.012 7.757 1.00 0.00 H new ATOM 0 HA3 GLY A 1 19.273 38.570 8.565 1.00 0.00 H new ATOM 8 N SER A 2 21.209 38.844 6.940 1.00 0.00 N ATOM 9 CA SER A 2 22.315 38.696 6.001 1.00 0.00 C ATOM 10 C SER A 2 22.199 37.386 5.227 1.00 0.00 C ATOM 11 O SER A 2 21.584 36.428 5.696 1.00 0.00 O ATOM 12 CB SER A 2 23.652 38.747 6.742 1.00 0.00 C ATOM 13 OG SER A 2 24.707 39.104 5.866 1.00 0.00 O ATOM 0 H SER A 2 21.495 39.004 7.906 1.00 0.00 H new ATOM 0 HA SER A 2 22.270 39.522 5.292 1.00 0.00 H new ATOM 0 HB2 SER A 2 23.592 39.468 7.557 1.00 0.00 H new ATOM 0 HB3 SER A 2 23.860 37.776 7.190 1.00 0.00 H new ATOM 0 HG SER A 2 25.551 39.131 6.364 1.00 0.00 H new ATOM 19 N SER A 3 22.793 37.353 4.039 1.00 0.00 N ATOM 20 CA SER A 3 22.754 36.163 3.197 1.00 0.00 C ATOM 21 C SER A 3 24.141 35.542 3.070 1.00 0.00 C ATOM 22 O SER A 3 25.150 36.184 3.357 1.00 0.00 O ATOM 23 CB SER A 3 22.209 36.512 1.810 1.00 0.00 C ATOM 24 OG SER A 3 22.937 37.581 1.230 1.00 0.00 O ATOM 0 H SER A 3 23.307 38.137 3.637 1.00 0.00 H new ATOM 0 HA SER A 3 22.092 35.436 3.667 1.00 0.00 H new ATOM 0 HB2 SER A 3 22.265 35.637 1.163 1.00 0.00 H new ATOM 0 HB3 SER A 3 21.156 36.784 1.887 1.00 0.00 H new ATOM 0 HG SER A 3 22.571 37.784 0.344 1.00 0.00 H new ATOM 30 N GLY A 4 24.183 34.285 2.636 1.00 0.00 N ATOM 31 CA GLY A 4 25.450 33.597 2.478 1.00 0.00 C ATOM 32 C GLY A 4 25.540 32.345 3.329 1.00 0.00 C ATOM 33 O GLY A 4 25.397 32.405 4.550 1.00 0.00 O ATOM 0 H GLY A 4 23.362 33.732 2.391 1.00 0.00 H new ATOM 0 HA2 GLY A 4 25.587 33.331 1.430 1.00 0.00 H new ATOM 0 HA3 GLY A 4 26.263 34.273 2.744 1.00 0.00 H new ATOM 37 N SER A 5 25.775 31.208 2.683 1.00 0.00 N ATOM 38 CA SER A 5 25.878 29.935 3.388 1.00 0.00 C ATOM 39 C SER A 5 26.945 29.048 2.753 1.00 0.00 C ATOM 40 O SER A 5 27.440 29.335 1.664 1.00 0.00 O ATOM 41 CB SER A 5 24.529 29.214 3.381 1.00 0.00 C ATOM 42 OG SER A 5 24.128 28.893 2.061 1.00 0.00 O ATOM 0 H SER A 5 25.898 31.142 1.673 1.00 0.00 H new ATOM 0 HA SER A 5 26.167 30.140 4.419 1.00 0.00 H new ATOM 0 HB2 SER A 5 24.597 28.303 3.975 1.00 0.00 H new ATOM 0 HB3 SER A 5 23.774 29.845 3.850 1.00 0.00 H new ATOM 0 HG SER A 5 23.264 28.431 2.085 1.00 0.00 H new ATOM 48 N SER A 6 27.294 27.967 3.444 1.00 0.00 N ATOM 49 CA SER A 6 28.305 27.039 2.952 1.00 0.00 C ATOM 50 C SER A 6 27.976 25.608 3.367 1.00 0.00 C ATOM 51 O SER A 6 27.533 25.361 4.488 1.00 0.00 O ATOM 52 CB SER A 6 29.687 27.430 3.478 1.00 0.00 C ATOM 53 OG SER A 6 30.277 28.431 2.667 1.00 0.00 O ATOM 0 H SER A 6 26.891 27.713 4.346 1.00 0.00 H new ATOM 0 HA SER A 6 28.311 27.091 1.863 1.00 0.00 H new ATOM 0 HB2 SER A 6 29.601 27.792 4.503 1.00 0.00 H new ATOM 0 HB3 SER A 6 30.332 26.552 3.504 1.00 0.00 H new ATOM 0 HG SER A 6 29.575 28.920 2.189 1.00 0.00 H new ATOM 59 N GLY A 7 28.197 24.667 2.453 1.00 0.00 N ATOM 60 CA GLY A 7 27.919 23.273 2.742 1.00 0.00 C ATOM 61 C GLY A 7 27.494 22.499 1.510 1.00 0.00 C ATOM 62 O GLY A 7 27.322 23.075 0.436 1.00 0.00 O ATOM 0 H GLY A 7 28.564 24.846 1.518 1.00 0.00 H new ATOM 0 HA2 GLY A 7 28.808 22.810 3.170 1.00 0.00 H new ATOM 0 HA3 GLY A 7 27.134 23.211 3.495 1.00 0.00 H new ATOM 66 N SER A 8 27.327 21.189 1.664 1.00 0.00 N ATOM 67 CA SER A 8 26.925 20.334 0.554 1.00 0.00 C ATOM 68 C SER A 8 25.818 20.991 -0.265 1.00 0.00 C ATOM 69 O SER A 8 25.202 21.964 0.171 1.00 0.00 O ATOM 70 CB SER A 8 26.453 18.975 1.074 1.00 0.00 C ATOM 71 OG SER A 8 27.536 18.227 1.600 1.00 0.00 O ATOM 0 H SER A 8 27.464 20.697 2.547 1.00 0.00 H new ATOM 0 HA SER A 8 27.791 20.187 -0.091 1.00 0.00 H new ATOM 0 HB2 SER A 8 25.698 19.120 1.846 1.00 0.00 H new ATOM 0 HB3 SER A 8 25.980 18.417 0.266 1.00 0.00 H new ATOM 0 HG SER A 8 27.209 17.363 1.928 1.00 0.00 H new ATOM 77 N HIS A 9 25.570 20.451 -1.454 1.00 0.00 N ATOM 78 CA HIS A 9 24.536 20.983 -2.334 1.00 0.00 C ATOM 79 C HIS A 9 23.244 20.182 -2.202 1.00 0.00 C ATOM 80 O HIS A 9 22.599 19.857 -3.199 1.00 0.00 O ATOM 81 CB HIS A 9 25.014 20.966 -3.786 1.00 0.00 C ATOM 82 CG HIS A 9 25.721 22.220 -4.199 1.00 0.00 C ATOM 83 ND1 HIS A 9 26.702 22.246 -5.168 1.00 0.00 N ATOM 84 CD2 HIS A 9 25.584 23.496 -3.770 1.00 0.00 C ATOM 85 CE1 HIS A 9 27.139 23.484 -5.315 1.00 0.00 C ATOM 86 NE2 HIS A 9 26.476 24.262 -4.479 1.00 0.00 N ATOM 0 H HIS A 9 26.071 19.646 -1.830 1.00 0.00 H new ATOM 0 HA HIS A 9 24.336 22.013 -2.037 1.00 0.00 H new ATOM 0 HB2 HIS A 9 25.683 20.118 -3.930 1.00 0.00 H new ATOM 0 HB3 HIS A 9 24.156 20.810 -4.440 1.00 0.00 H new ATOM 0 HD2 HIS A 9 24.900 23.847 -3.011 1.00 0.00 H new ATOM 0 HE1 HIS A 9 27.908 23.805 -6.002 1.00 0.00 H new ATOM 0 HE2 HIS A 9 26.606 25.269 -4.377 1.00 0.00 H new ATOM 94 N ASP A 10 22.873 19.867 -0.966 1.00 0.00 N ATOM 95 CA ASP A 10 21.658 19.105 -0.703 1.00 0.00 C ATOM 96 C ASP A 10 20.448 20.028 -0.598 1.00 0.00 C ATOM 97 O ASP A 10 20.095 20.484 0.489 1.00 0.00 O ATOM 98 CB ASP A 10 21.809 18.293 0.585 1.00 0.00 C ATOM 99 CG ASP A 10 22.075 19.169 1.793 1.00 0.00 C ATOM 100 OD1 ASP A 10 23.044 19.955 1.753 1.00 0.00 O ATOM 101 OD2 ASP A 10 21.316 19.066 2.780 1.00 0.00 O ATOM 0 H ASP A 10 23.396 20.128 -0.130 1.00 0.00 H new ATOM 0 HA ASP A 10 21.499 18.422 -1.538 1.00 0.00 H new ATOM 0 HB2 ASP A 10 20.902 17.712 0.753 1.00 0.00 H new ATOM 0 HB3 ASP A 10 22.626 17.581 0.469 1.00 0.00 H new ATOM 106 N SER A 11 19.818 20.301 -1.736 1.00 0.00 N ATOM 107 CA SER A 11 18.651 21.174 -1.773 1.00 0.00 C ATOM 108 C SER A 11 17.542 20.562 -2.624 1.00 0.00 C ATOM 109 O SER A 11 16.357 20.727 -2.331 1.00 0.00 O ATOM 110 CB SER A 11 19.033 22.548 -2.326 1.00 0.00 C ATOM 111 OG SER A 11 19.712 22.429 -3.564 1.00 0.00 O ATOM 0 H SER A 11 20.096 19.930 -2.645 1.00 0.00 H new ATOM 0 HA SER A 11 18.282 21.290 -0.754 1.00 0.00 H new ATOM 0 HB2 SER A 11 18.136 23.153 -2.457 1.00 0.00 H new ATOM 0 HB3 SER A 11 19.667 23.069 -1.608 1.00 0.00 H new ATOM 0 HG SER A 11 19.944 23.321 -3.897 1.00 0.00 H new ATOM 117 N ARG A 12 17.935 19.855 -3.678 1.00 0.00 N ATOM 118 CA ARG A 12 16.975 19.219 -4.572 1.00 0.00 C ATOM 119 C ARG A 12 16.488 17.893 -3.994 1.00 0.00 C ATOM 120 O ARG A 12 15.678 17.196 -4.606 1.00 0.00 O ATOM 121 CB ARG A 12 17.603 18.987 -5.948 1.00 0.00 C ATOM 122 CG ARG A 12 17.696 20.246 -6.794 1.00 0.00 C ATOM 123 CD ARG A 12 16.377 20.550 -7.487 1.00 0.00 C ATOM 124 NE ARG A 12 15.497 21.366 -6.655 1.00 0.00 N ATOM 125 CZ ARG A 12 14.204 21.542 -6.904 1.00 0.00 C ATOM 126 NH1 ARG A 12 13.644 20.962 -7.957 1.00 0.00 N ATOM 127 NH2 ARG A 12 13.469 22.299 -6.100 1.00 0.00 N ATOM 0 H ARG A 12 18.911 19.708 -3.934 1.00 0.00 H new ATOM 0 HA ARG A 12 16.119 19.886 -4.678 1.00 0.00 H new ATOM 0 HB2 ARG A 12 18.603 18.573 -5.817 1.00 0.00 H new ATOM 0 HB3 ARG A 12 17.017 18.241 -6.485 1.00 0.00 H new ATOM 0 HG2 ARG A 12 17.980 21.089 -6.164 1.00 0.00 H new ATOM 0 HG3 ARG A 12 18.481 20.127 -7.540 1.00 0.00 H new ATOM 0 HD2 ARG A 12 16.572 21.069 -8.426 1.00 0.00 H new ATOM 0 HD3 ARG A 12 15.875 19.615 -7.737 1.00 0.00 H new ATOM 0 HE ARG A 12 15.897 21.826 -5.837 1.00 0.00 H new ATOM 0 HH11 ARG A 12 14.206 20.379 -8.577 1.00 0.00 H new ATOM 0 HH12 ARG A 12 12.651 21.098 -8.146 1.00 0.00 H new ATOM 0 HH21 ARG A 12 13.897 22.747 -5.289 1.00 0.00 H new ATOM 0 HH22 ARG A 12 12.476 22.433 -6.292 1.00 0.00 H new ATOM 141 N LEU A 13 16.987 17.551 -2.811 1.00 0.00 N ATOM 142 CA LEU A 13 16.604 16.309 -2.149 1.00 0.00 C ATOM 143 C LEU A 13 15.095 16.099 -2.216 1.00 0.00 C ATOM 144 O LEU A 13 14.326 17.058 -2.290 1.00 0.00 O ATOM 145 CB LEU A 13 17.065 16.322 -0.691 1.00 0.00 C ATOM 146 CG LEU A 13 18.470 15.781 -0.426 1.00 0.00 C ATOM 147 CD1 LEU A 13 18.419 14.295 -0.103 1.00 0.00 C ATOM 148 CD2 LEU A 13 19.375 16.037 -1.622 1.00 0.00 C ATOM 0 H LEU A 13 17.658 18.117 -2.291 1.00 0.00 H new ATOM 0 HA LEU A 13 17.090 15.484 -2.670 1.00 0.00 H new ATOM 0 HB2 LEU A 13 17.017 17.348 -0.325 1.00 0.00 H new ATOM 0 HB3 LEU A 13 16.356 15.740 -0.102 1.00 0.00 H new ATOM 0 HG LEU A 13 18.883 16.305 0.436 1.00 0.00 H new ATOM 0 HD11 LEU A 13 19.428 13.928 0.083 1.00 0.00 H new ATOM 0 HD12 LEU A 13 17.806 14.136 0.785 1.00 0.00 H new ATOM 0 HD13 LEU A 13 17.985 13.754 -0.944 1.00 0.00 H new ATOM 0 HD21 LEU A 13 20.371 15.645 -1.415 1.00 0.00 H new ATOM 0 HD22 LEU A 13 18.965 15.540 -2.501 1.00 0.00 H new ATOM 0 HD23 LEU A 13 19.438 17.109 -1.807 1.00 0.00 H new ATOM 160 N THR A 14 14.676 14.838 -2.187 1.00 0.00 N ATOM 161 CA THR A 14 13.259 14.502 -2.243 1.00 0.00 C ATOM 162 C THR A 14 12.502 15.113 -1.069 1.00 0.00 C ATOM 163 O THR A 14 12.600 14.634 0.061 1.00 0.00 O ATOM 164 CB THR A 14 13.043 12.977 -2.241 1.00 0.00 C ATOM 165 OG1 THR A 14 13.642 12.398 -1.077 1.00 0.00 O ATOM 166 CG2 THR A 14 13.636 12.345 -3.491 1.00 0.00 C ATOM 0 H THR A 14 15.298 14.032 -2.125 1.00 0.00 H new ATOM 0 HA THR A 14 12.873 14.915 -3.175 1.00 0.00 H new ATOM 0 HB THR A 14 11.970 12.785 -2.230 1.00 0.00 H new ATOM 0 HG1 THR A 14 13.495 12.986 -0.307 1.00 0.00 H new ATOM 0 HG21 THR A 14 13.471 11.268 -3.467 1.00 0.00 H new ATOM 0 HG22 THR A 14 13.156 12.766 -4.374 1.00 0.00 H new ATOM 0 HG23 THR A 14 14.706 12.548 -3.528 1.00 0.00 H new ATOM 174 N ALA A 15 11.747 16.171 -1.344 1.00 0.00 N ATOM 175 CA ALA A 15 10.972 16.845 -0.310 1.00 0.00 C ATOM 176 C ALA A 15 9.480 16.801 -0.626 1.00 0.00 C ATOM 177 O ALA A 15 8.647 16.722 0.276 1.00 0.00 O ATOM 178 CB ALA A 15 11.438 18.286 -0.155 1.00 0.00 C ATOM 0 H ALA A 15 11.656 16.580 -2.274 1.00 0.00 H new ATOM 0 HA ALA A 15 11.134 16.319 0.631 1.00 0.00 H new ATOM 0 HB1 ALA A 15 10.850 18.777 0.621 1.00 0.00 H new ATOM 0 HB2 ALA A 15 12.491 18.300 0.125 1.00 0.00 H new ATOM 0 HB3 ALA A 15 11.306 18.815 -1.099 1.00 0.00 H new ATOM 184 N GLY A 16 9.151 16.853 -1.913 1.00 0.00 N ATOM 185 CA GLY A 16 7.760 16.818 -2.324 1.00 0.00 C ATOM 186 C GLY A 16 7.219 15.406 -2.421 1.00 0.00 C ATOM 187 O GLY A 16 6.244 15.153 -3.129 1.00 0.00 O ATOM 0 H GLY A 16 9.823 16.919 -2.678 1.00 0.00 H new ATOM 0 HA2 GLY A 16 7.160 17.385 -1.613 1.00 0.00 H new ATOM 0 HA3 GLY A 16 7.658 17.310 -3.291 1.00 0.00 H new ATOM 191 N VAL A 17 7.853 14.480 -1.708 1.00 0.00 N ATOM 192 CA VAL A 17 7.431 13.085 -1.717 1.00 0.00 C ATOM 193 C VAL A 17 6.183 12.884 -0.865 1.00 0.00 C ATOM 194 O VAL A 17 5.940 13.603 0.104 1.00 0.00 O ATOM 195 CB VAL A 17 8.546 12.157 -1.201 1.00 0.00 C ATOM 196 CG1 VAL A 17 9.647 12.016 -2.241 1.00 0.00 C ATOM 197 CG2 VAL A 17 9.107 12.679 0.114 1.00 0.00 C ATOM 0 H VAL A 17 8.662 14.672 -1.116 1.00 0.00 H new ATOM 0 HA VAL A 17 7.207 12.829 -2.752 1.00 0.00 H new ATOM 0 HB VAL A 17 8.120 11.170 -1.022 1.00 0.00 H new ATOM 0 HG11 VAL A 17 10.426 11.357 -1.859 1.00 0.00 H new ATOM 0 HG12 VAL A 17 9.231 11.594 -3.156 1.00 0.00 H new ATOM 0 HG13 VAL A 17 10.074 12.996 -2.454 1.00 0.00 H new ATOM 0 HG21 VAL A 17 9.894 12.011 0.464 1.00 0.00 H new ATOM 0 HG22 VAL A 17 9.518 13.677 -0.037 1.00 0.00 H new ATOM 0 HG23 VAL A 17 8.311 12.723 0.857 1.00 0.00 H new ATOM 207 N PRO A 18 5.370 11.882 -1.233 1.00 0.00 N ATOM 208 CA PRO A 18 4.133 11.561 -0.515 1.00 0.00 C ATOM 209 C PRO A 18 4.401 10.968 0.864 1.00 0.00 C ATOM 210 O PRO A 18 5.122 9.979 0.996 1.00 0.00 O ATOM 211 CB PRO A 18 3.456 10.528 -1.419 1.00 0.00 C ATOM 212 CG PRO A 18 4.573 9.902 -2.181 1.00 0.00 C ATOM 213 CD PRO A 18 5.598 10.984 -2.378 1.00 0.00 C ATOM 0 HA PRO A 18 3.527 12.448 -0.330 1.00 0.00 H new ATOM 0 HB2 PRO A 18 2.911 9.787 -0.834 1.00 0.00 H new ATOM 0 HB3 PRO A 18 2.735 10.999 -2.088 1.00 0.00 H new ATOM 0 HG2 PRO A 18 4.995 9.060 -1.633 1.00 0.00 H new ATOM 0 HG3 PRO A 18 4.224 9.516 -3.139 1.00 0.00 H new ATOM 0 HD2 PRO A 18 6.611 10.582 -2.378 1.00 0.00 H new ATOM 0 HD3 PRO A 18 5.460 11.501 -3.328 1.00 0.00 H new ATOM 221 N ASP A 19 3.815 11.579 1.889 1.00 0.00 N ATOM 222 CA ASP A 19 3.989 11.110 3.259 1.00 0.00 C ATOM 223 C ASP A 19 3.293 9.769 3.467 1.00 0.00 C ATOM 224 O ASP A 19 2.367 9.418 2.736 1.00 0.00 O ATOM 225 CB ASP A 19 3.442 12.142 4.247 1.00 0.00 C ATOM 226 CG ASP A 19 4.179 12.123 5.571 1.00 0.00 C ATOM 227 OD1 ASP A 19 5.413 11.926 5.561 1.00 0.00 O ATOM 228 OD2 ASP A 19 3.523 12.307 6.617 1.00 0.00 O ATOM 0 H ASP A 19 3.216 12.399 1.797 1.00 0.00 H new ATOM 0 HA ASP A 19 5.056 10.976 3.439 1.00 0.00 H new ATOM 0 HB2 ASP A 19 3.516 13.137 3.807 1.00 0.00 H new ATOM 0 HB3 ASP A 19 2.383 11.949 4.421 1.00 0.00 H new ATOM 233 N THR A 20 3.746 9.022 4.469 1.00 0.00 N ATOM 234 CA THR A 20 3.169 7.719 4.772 1.00 0.00 C ATOM 235 C THR A 20 1.646 7.774 4.751 1.00 0.00 C ATOM 236 O THR A 20 1.020 8.592 5.426 1.00 0.00 O ATOM 237 CB THR A 20 3.633 7.205 6.148 1.00 0.00 C ATOM 238 OG1 THR A 20 4.996 7.581 6.377 1.00 0.00 O ATOM 239 CG2 THR A 20 3.498 5.692 6.235 1.00 0.00 C ATOM 0 H THR A 20 4.511 9.298 5.084 1.00 0.00 H new ATOM 0 HA THR A 20 3.516 7.033 4.000 1.00 0.00 H new ATOM 0 HB THR A 20 2.999 7.655 6.912 1.00 0.00 H new ATOM 0 HG1 THR A 20 5.283 7.252 7.254 1.00 0.00 H new ATOM 0 HG21 THR A 20 3.832 5.353 7.216 1.00 0.00 H new ATOM 0 HG22 THR A 20 2.455 5.411 6.089 1.00 0.00 H new ATOM 0 HG23 THR A 20 4.110 5.227 5.462 1.00 0.00 H new ATOM 247 N PRO A 21 1.032 6.882 3.958 1.00 0.00 N ATOM 248 CA PRO A 21 -0.427 6.809 3.831 1.00 0.00 C ATOM 249 C PRO A 21 -1.094 6.287 5.100 1.00 0.00 C ATOM 250 O PRO A 21 -0.435 5.719 5.971 1.00 0.00 O ATOM 251 CB PRO A 21 -0.633 5.826 2.676 1.00 0.00 C ATOM 252 CG PRO A 21 0.595 4.982 2.673 1.00 0.00 C ATOM 253 CD PRO A 21 1.714 5.878 3.126 1.00 0.00 C ATOM 0 HA PRO A 21 -0.871 7.790 3.659 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -1.528 5.222 2.825 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -0.756 6.349 1.728 1.00 0.00 H new ATOM 0 HG2 PRO A 21 0.484 4.128 3.342 1.00 0.00 H new ATOM 0 HG3 PRO A 21 0.792 4.584 1.678 1.00 0.00 H new ATOM 0 HD2 PRO A 21 2.464 5.328 3.694 1.00 0.00 H new ATOM 0 HD3 PRO A 21 2.227 6.338 2.282 1.00 0.00 H new ATOM 261 N THR A 22 -2.405 6.483 5.197 1.00 0.00 N ATOM 262 CA THR A 22 -3.161 6.034 6.359 1.00 0.00 C ATOM 263 C THR A 22 -3.415 4.532 6.302 1.00 0.00 C ATOM 264 O THR A 22 -3.162 3.888 5.283 1.00 0.00 O ATOM 265 CB THR A 22 -4.511 6.768 6.470 1.00 0.00 C ATOM 266 OG1 THR A 22 -4.400 8.083 5.914 1.00 0.00 O ATOM 267 CG2 THR A 22 -4.959 6.861 7.920 1.00 0.00 C ATOM 0 H THR A 22 -2.965 6.950 4.484 1.00 0.00 H new ATOM 0 HA THR A 22 -2.558 6.265 7.237 1.00 0.00 H new ATOM 0 HB THR A 22 -5.256 6.200 5.913 1.00 0.00 H new ATOM 0 HG1 THR A 22 -5.262 8.543 5.987 1.00 0.00 H new ATOM 0 HG21 THR A 22 -5.914 7.383 7.973 1.00 0.00 H new ATOM 0 HG22 THR A 22 -5.071 5.858 8.331 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.214 7.409 8.497 1.00 0.00 H new ATOM 275 N ARG A 23 -3.918 3.979 7.401 1.00 0.00 N ATOM 276 CA ARG A 23 -4.206 2.552 7.475 1.00 0.00 C ATOM 277 C ARG A 23 -4.885 2.067 6.197 1.00 0.00 C ATOM 278 O ARG A 23 -5.449 2.860 5.442 1.00 0.00 O ATOM 279 CB ARG A 23 -5.096 2.252 8.683 1.00 0.00 C ATOM 280 CG ARG A 23 -4.544 2.788 9.994 1.00 0.00 C ATOM 281 CD ARG A 23 -5.278 2.200 11.189 1.00 0.00 C ATOM 282 NE ARG A 23 -6.566 2.850 11.414 1.00 0.00 N ATOM 283 CZ ARG A 23 -7.422 2.478 12.359 1.00 0.00 C ATOM 284 NH1 ARG A 23 -7.127 1.466 13.164 1.00 0.00 N ATOM 285 NH2 ARG A 23 -8.575 3.118 12.502 1.00 0.00 N ATOM 0 H ARG A 23 -4.134 4.498 8.252 1.00 0.00 H new ATOM 0 HA ARG A 23 -3.261 2.021 7.587 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -6.083 2.681 8.512 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -5.228 1.173 8.768 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -3.482 2.553 10.066 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -4.632 3.874 10.010 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -5.433 1.133 11.030 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -4.660 2.303 12.081 1.00 0.00 H new ATOM 0 HE ARG A 23 -6.822 3.633 10.812 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -6.241 0.972 13.058 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -7.786 1.182 13.889 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -8.806 3.897 11.886 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -9.231 2.831 13.228 1.00 0.00 H new ATOM 299 N LEU A 24 -4.826 0.761 5.961 1.00 0.00 N ATOM 300 CA LEU A 24 -5.435 0.170 4.774 1.00 0.00 C ATOM 301 C LEU A 24 -6.794 -0.439 5.105 1.00 0.00 C ATOM 302 O LEU A 24 -7.105 -0.694 6.268 1.00 0.00 O ATOM 303 CB LEU A 24 -4.514 -0.900 4.184 1.00 0.00 C ATOM 304 CG LEU A 24 -3.013 -0.668 4.365 1.00 0.00 C ATOM 305 CD1 LEU A 24 -2.221 -1.837 3.802 1.00 0.00 C ATOM 306 CD2 LEU A 24 -2.591 0.634 3.699 1.00 0.00 C ATOM 0 H LEU A 24 -4.363 0.091 6.575 1.00 0.00 H new ATOM 0 HA LEU A 24 -5.582 0.961 4.038 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -4.770 -1.859 4.634 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -4.723 -0.982 3.117 1.00 0.00 H new ATOM 0 HG LEU A 24 -2.802 -0.593 5.432 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.155 -1.654 3.940 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -2.503 -2.752 4.323 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -2.436 -1.944 2.739 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -1.520 0.783 3.838 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.816 0.587 2.633 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -3.134 1.465 4.148 1.00 0.00 H new ATOM 318 N VAL A 25 -7.599 -0.670 4.073 1.00 0.00 N ATOM 319 CA VAL A 25 -8.924 -1.252 4.254 1.00 0.00 C ATOM 320 C VAL A 25 -9.082 -2.525 3.429 1.00 0.00 C ATOM 321 O VAL A 25 -9.064 -2.487 2.199 1.00 0.00 O ATOM 322 CB VAL A 25 -10.032 -0.258 3.859 1.00 0.00 C ATOM 323 CG1 VAL A 25 -11.402 -0.906 3.989 1.00 0.00 C ATOM 324 CG2 VAL A 25 -9.946 1.000 4.710 1.00 0.00 C ATOM 0 H VAL A 25 -7.357 -0.463 3.104 1.00 0.00 H new ATOM 0 HA VAL A 25 -9.022 -1.493 5.312 1.00 0.00 H new ATOM 0 HB VAL A 25 -9.888 0.025 2.816 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -12.172 -0.189 3.706 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -11.457 -1.775 3.334 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -11.560 -1.219 5.021 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.736 1.692 4.418 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -10.064 0.737 5.761 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -8.976 1.474 4.562 1.00 0.00 H new ATOM 334 N PHE A 26 -9.237 -3.653 4.116 1.00 0.00 N ATOM 335 CA PHE A 26 -9.398 -4.939 3.447 1.00 0.00 C ATOM 336 C PHE A 26 -10.867 -5.345 3.397 1.00 0.00 C ATOM 337 O PHE A 26 -11.581 -5.258 4.396 1.00 0.00 O ATOM 338 CB PHE A 26 -8.583 -6.016 4.166 1.00 0.00 C ATOM 339 CG PHE A 26 -7.157 -5.619 4.421 1.00 0.00 C ATOM 340 CD1 PHE A 26 -6.811 -4.927 5.570 1.00 0.00 C ATOM 341 CD2 PHE A 26 -6.162 -5.938 3.511 1.00 0.00 C ATOM 342 CE1 PHE A 26 -5.500 -4.560 5.808 1.00 0.00 C ATOM 343 CE2 PHE A 26 -4.849 -5.574 3.743 1.00 0.00 C ATOM 344 CZ PHE A 26 -4.518 -4.884 4.893 1.00 0.00 C ATOM 0 H PHE A 26 -9.254 -3.702 5.135 1.00 0.00 H new ATOM 0 HA PHE A 26 -9.033 -4.838 2.425 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -9.062 -6.249 5.117 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -8.597 -6.929 3.570 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -7.575 -4.671 6.289 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.415 -6.477 2.610 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -5.244 -4.021 6.708 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.083 -5.829 3.026 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.493 -4.598 5.076 1.00 0.00 H new ATOM 354 N SER A 27 -11.313 -5.790 2.226 1.00 0.00 N ATOM 355 CA SER A 27 -12.698 -6.206 2.043 1.00 0.00 C ATOM 356 C SER A 27 -12.833 -7.720 2.178 1.00 0.00 C ATOM 357 O SER A 27 -13.791 -8.218 2.768 1.00 0.00 O ATOM 358 CB SER A 27 -13.211 -5.757 0.673 1.00 0.00 C ATOM 359 OG SER A 27 -14.608 -5.965 0.558 1.00 0.00 O ATOM 0 H SER A 27 -10.734 -5.871 1.390 1.00 0.00 H new ATOM 0 HA SER A 27 -13.299 -5.734 2.821 1.00 0.00 H new ATOM 0 HB2 SER A 27 -12.984 -4.701 0.524 1.00 0.00 H new ATOM 0 HB3 SER A 27 -12.692 -6.308 -0.111 1.00 0.00 H new ATOM 0 HG SER A 27 -14.938 -5.527 -0.254 1.00 0.00 H new ATOM 365 N ALA A 28 -11.865 -8.445 1.628 1.00 0.00 N ATOM 366 CA ALA A 28 -11.874 -9.901 1.688 1.00 0.00 C ATOM 367 C ALA A 28 -13.085 -10.474 0.959 1.00 0.00 C ATOM 368 O ALA A 28 -13.820 -11.297 1.507 1.00 0.00 O ATOM 369 CB ALA A 28 -11.856 -10.370 3.135 1.00 0.00 C ATOM 0 H ALA A 28 -11.065 -8.048 1.136 1.00 0.00 H new ATOM 0 HA ALA A 28 -10.977 -10.265 1.188 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.863 -11.460 3.164 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -10.956 -9.999 3.626 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -12.736 -9.987 3.652 1.00 0.00 H new ATOM 375 N LEU A 29 -13.287 -10.034 -0.278 1.00 0.00 N ATOM 376 CA LEU A 29 -14.411 -10.503 -1.082 1.00 0.00 C ATOM 377 C LEU A 29 -14.608 -12.006 -0.917 1.00 0.00 C ATOM 378 O LEU A 29 -15.705 -12.524 -1.123 1.00 0.00 O ATOM 379 CB LEU A 29 -14.184 -10.165 -2.557 1.00 0.00 C ATOM 380 CG LEU A 29 -14.001 -8.683 -2.885 1.00 0.00 C ATOM 381 CD1 LEU A 29 -14.762 -7.818 -1.892 1.00 0.00 C ATOM 382 CD2 LEU A 29 -12.524 -8.316 -2.892 1.00 0.00 C ATOM 0 H LEU A 29 -12.688 -9.354 -0.746 1.00 0.00 H new ATOM 0 HA LEU A 29 -15.312 -9.997 -0.734 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -13.302 -10.704 -2.901 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -15.031 -10.542 -3.130 1.00 0.00 H new ATOM 0 HG LEU A 29 -14.405 -8.499 -3.880 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -14.620 -6.767 -2.142 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -15.824 -8.061 -1.936 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -14.389 -8.006 -0.885 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -12.413 -7.257 -3.127 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -12.095 -8.516 -1.910 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -12.005 -8.911 -3.643 1.00 0.00 H new ATOM 394 N GLY A 30 -13.539 -12.701 -0.542 1.00 0.00 N ATOM 395 CA GLY A 30 -13.616 -14.138 -0.354 1.00 0.00 C ATOM 396 C GLY A 30 -12.342 -14.716 0.230 1.00 0.00 C ATOM 397 O GLY A 30 -11.464 -13.991 0.699 1.00 0.00 O ATOM 0 H GLY A 30 -12.620 -12.295 -0.365 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -14.452 -14.371 0.305 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -13.822 -14.616 -1.312 1.00 0.00 H new ATOM 401 N PRO A 31 -12.230 -16.052 0.207 1.00 0.00 N ATOM 402 CA PRO A 31 -11.058 -16.757 0.736 1.00 0.00 C ATOM 403 C PRO A 31 -9.815 -16.540 -0.122 1.00 0.00 C ATOM 404 O PRO A 31 -8.689 -16.591 0.374 1.00 0.00 O ATOM 405 CB PRO A 31 -11.482 -18.227 0.700 1.00 0.00 C ATOM 406 CG PRO A 31 -12.516 -18.297 -0.371 1.00 0.00 C ATOM 407 CD PRO A 31 -13.237 -16.978 -0.336 1.00 0.00 C ATOM 0 HA PRO A 31 -10.783 -16.403 1.730 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -10.636 -18.878 0.477 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -11.885 -18.546 1.661 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -12.058 -18.466 -1.346 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -13.205 -19.123 -0.195 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -13.568 -16.674 -1.329 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -14.124 -17.022 0.296 1.00 0.00 H new ATOM 415 N THR A 32 -10.027 -16.296 -1.411 1.00 0.00 N ATOM 416 CA THR A 32 -8.925 -16.072 -2.338 1.00 0.00 C ATOM 417 C THR A 32 -9.038 -14.707 -3.007 1.00 0.00 C ATOM 418 O THR A 32 -8.453 -14.473 -4.064 1.00 0.00 O ATOM 419 CB THR A 32 -8.874 -17.161 -3.425 1.00 0.00 C ATOM 420 OG1 THR A 32 -10.172 -17.338 -4.003 1.00 0.00 O ATOM 421 CG2 THR A 32 -8.388 -18.481 -2.846 1.00 0.00 C ATOM 0 H THR A 32 -10.953 -16.248 -1.837 1.00 0.00 H new ATOM 0 HA THR A 32 -8.007 -16.112 -1.752 1.00 0.00 H new ATOM 0 HB THR A 32 -8.174 -16.840 -4.196 1.00 0.00 H new ATOM 0 HG1 THR A 32 -10.130 -18.031 -4.695 1.00 0.00 H new ATOM 0 HG21 THR A 32 -8.360 -19.235 -3.633 1.00 0.00 H new ATOM 0 HG22 THR A 32 -7.388 -18.351 -2.433 1.00 0.00 H new ATOM 0 HG23 THR A 32 -9.067 -18.804 -2.057 1.00 0.00 H new ATOM 429 N SER A 33 -9.795 -13.809 -2.385 1.00 0.00 N ATOM 430 CA SER A 33 -9.987 -12.467 -2.923 1.00 0.00 C ATOM 431 C SER A 33 -9.929 -11.423 -1.812 1.00 0.00 C ATOM 432 O SER A 33 -10.310 -11.690 -0.671 1.00 0.00 O ATOM 433 CB SER A 33 -11.328 -12.375 -3.654 1.00 0.00 C ATOM 434 OG SER A 33 -12.339 -13.081 -2.956 1.00 0.00 O ATOM 0 H SER A 33 -10.285 -13.986 -1.508 1.00 0.00 H new ATOM 0 HA SER A 33 -9.181 -12.267 -3.629 1.00 0.00 H new ATOM 0 HB2 SER A 33 -11.617 -11.329 -3.760 1.00 0.00 H new ATOM 0 HB3 SER A 33 -11.226 -12.781 -4.661 1.00 0.00 H new ATOM 0 HG SER A 33 -13.186 -13.005 -3.443 1.00 0.00 H new ATOM 440 N LEU A 34 -9.448 -10.232 -2.153 1.00 0.00 N ATOM 441 CA LEU A 34 -9.339 -9.146 -1.185 1.00 0.00 C ATOM 442 C LEU A 34 -9.354 -7.790 -1.885 1.00 0.00 C ATOM 443 O LEU A 34 -9.222 -7.709 -3.106 1.00 0.00 O ATOM 444 CB LEU A 34 -8.056 -9.295 -0.364 1.00 0.00 C ATOM 445 CG LEU A 34 -8.180 -10.090 0.936 1.00 0.00 C ATOM 446 CD1 LEU A 34 -6.876 -10.808 1.249 1.00 0.00 C ATOM 447 CD2 LEU A 34 -8.577 -9.175 2.085 1.00 0.00 C ATOM 0 H LEU A 34 -9.128 -9.994 -3.092 1.00 0.00 H new ATOM 0 HA LEU A 34 -10.199 -9.199 -0.517 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -7.302 -9.774 -0.989 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -7.685 -8.299 -0.123 1.00 0.00 H new ATOM 0 HG LEU A 34 -8.961 -10.839 0.808 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -6.983 -11.369 2.178 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -6.634 -11.494 0.437 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -6.075 -10.077 1.357 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -8.661 -9.758 3.002 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.819 -8.403 2.214 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -9.537 -8.708 1.863 1.00 0.00 H new ATOM 459 N ARG A 35 -9.512 -6.728 -1.102 1.00 0.00 N ATOM 460 CA ARG A 35 -9.543 -5.376 -1.646 1.00 0.00 C ATOM 461 C ARG A 35 -8.914 -4.384 -0.673 1.00 0.00 C ATOM 462 O ARG A 35 -9.515 -4.024 0.339 1.00 0.00 O ATOM 463 CB ARG A 35 -10.983 -4.960 -1.955 1.00 0.00 C ATOM 464 CG ARG A 35 -11.099 -3.568 -2.553 1.00 0.00 C ATOM 465 CD ARG A 35 -12.525 -3.044 -2.469 1.00 0.00 C ATOM 466 NE ARG A 35 -12.656 -1.718 -3.067 1.00 0.00 N ATOM 467 CZ ARG A 35 -13.815 -1.200 -3.461 1.00 0.00 C ATOM 468 NH1 ARG A 35 -14.936 -1.894 -3.319 1.00 0.00 N ATOM 469 NH2 ARG A 35 -13.853 0.013 -3.996 1.00 0.00 N ATOM 0 H ARG A 35 -9.621 -6.778 -0.089 1.00 0.00 H new ATOM 0 HA ARG A 35 -8.964 -5.370 -2.570 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -11.420 -5.681 -2.646 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -11.569 -5.002 -1.037 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -10.428 -2.888 -2.028 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -10.779 -3.590 -3.595 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -13.197 -3.738 -2.975 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -12.836 -3.003 -1.425 1.00 0.00 H new ATOM 0 HE ARG A 35 -11.812 -1.159 -3.189 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -14.910 -2.827 -2.907 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -15.825 -1.495 -3.622 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -12.992 0.549 -4.105 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -14.743 0.410 -4.298 1.00 0.00 H new ATOM 483 N VAL A 36 -7.698 -3.945 -0.985 1.00 0.00 N ATOM 484 CA VAL A 36 -6.987 -2.994 -0.139 1.00 0.00 C ATOM 485 C VAL A 36 -7.229 -1.561 -0.599 1.00 0.00 C ATOM 486 O VAL A 36 -7.063 -1.240 -1.776 1.00 0.00 O ATOM 487 CB VAL A 36 -5.472 -3.271 -0.135 1.00 0.00 C ATOM 488 CG1 VAL A 36 -4.708 -2.051 0.356 1.00 0.00 C ATOM 489 CG2 VAL A 36 -5.156 -4.488 0.722 1.00 0.00 C ATOM 0 H VAL A 36 -7.185 -4.233 -1.818 1.00 0.00 H new ATOM 0 HA VAL A 36 -7.375 -3.118 0.872 1.00 0.00 H new ATOM 0 HB VAL A 36 -5.156 -3.482 -1.157 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.639 -2.265 0.352 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -4.911 -1.206 -0.301 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -5.025 -1.807 1.370 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -4.081 -4.670 0.714 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -5.486 -4.308 1.745 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -5.674 -5.359 0.322 1.00 0.00 H new ATOM 499 N SER A 37 -7.623 -0.704 0.337 1.00 0.00 N ATOM 500 CA SER A 37 -7.892 0.696 0.028 1.00 0.00 C ATOM 501 C SER A 37 -7.174 1.617 1.009 1.00 0.00 C ATOM 502 O SER A 37 -7.301 1.466 2.225 1.00 0.00 O ATOM 503 CB SER A 37 -9.397 0.968 0.063 1.00 0.00 C ATOM 504 OG SER A 37 -9.662 2.344 0.271 1.00 0.00 O ATOM 0 H SER A 37 -7.763 -0.954 1.316 1.00 0.00 H new ATOM 0 HA SER A 37 -7.517 0.899 -0.975 1.00 0.00 H new ATOM 0 HB2 SER A 37 -9.850 0.645 -0.874 1.00 0.00 H new ATOM 0 HB3 SER A 37 -9.857 0.382 0.858 1.00 0.00 H new ATOM 0 HG SER A 37 -10.631 2.492 0.288 1.00 0.00 H new ATOM 510 N TRP A 38 -6.421 2.570 0.473 1.00 0.00 N ATOM 511 CA TRP A 38 -5.682 3.516 1.302 1.00 0.00 C ATOM 512 C TRP A 38 -6.260 4.921 1.171 1.00 0.00 C ATOM 513 O TRP A 38 -7.282 5.122 0.515 1.00 0.00 O ATOM 514 CB TRP A 38 -4.203 3.522 0.910 1.00 0.00 C ATOM 515 CG TRP A 38 -3.981 3.614 -0.569 1.00 0.00 C ATOM 516 CD1 TRP A 38 -3.606 4.722 -1.275 1.00 0.00 C ATOM 517 CD2 TRP A 38 -4.121 2.556 -1.524 1.00 0.00 C ATOM 518 NE1 TRP A 38 -3.505 4.416 -2.611 1.00 0.00 N ATOM 519 CE2 TRP A 38 -3.815 3.094 -2.790 1.00 0.00 C ATOM 520 CE3 TRP A 38 -4.474 1.207 -1.433 1.00 0.00 C ATOM 521 CZ2 TRP A 38 -3.853 2.329 -3.952 1.00 0.00 C ATOM 522 CZ3 TRP A 38 -4.511 0.449 -2.588 1.00 0.00 C ATOM 523 CH2 TRP A 38 -4.202 1.011 -3.834 1.00 0.00 C ATOM 0 H TRP A 38 -6.306 2.709 -0.531 1.00 0.00 H new ATOM 0 HA TRP A 38 -5.774 3.200 2.341 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -3.709 4.362 1.397 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -3.731 2.614 1.285 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -3.417 5.695 -0.846 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -3.242 5.068 -3.350 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -4.714 0.765 -0.477 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -3.615 2.760 -4.913 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -4.783 -0.595 -2.529 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -4.240 0.392 -4.718 1.00 0.00 H new ATOM 534 N GLN A 39 -5.601 5.888 1.800 1.00 0.00 N ATOM 535 CA GLN A 39 -6.052 7.274 1.754 1.00 0.00 C ATOM 536 C GLN A 39 -4.974 8.178 1.164 1.00 0.00 C ATOM 537 O GLN A 39 -3.851 8.227 1.664 1.00 0.00 O ATOM 538 CB GLN A 39 -6.428 7.757 3.156 1.00 0.00 C ATOM 539 CG GLN A 39 -7.137 9.102 3.166 1.00 0.00 C ATOM 540 CD GLN A 39 -8.642 8.970 3.045 1.00 0.00 C ATOM 541 OE1 GLN A 39 -9.217 7.943 3.404 1.00 0.00 O ATOM 542 NE2 GLN A 39 -9.289 10.012 2.536 1.00 0.00 N ATOM 0 H GLN A 39 -4.753 5.738 2.347 1.00 0.00 H new ATOM 0 HA GLN A 39 -6.932 7.322 1.113 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -7.071 7.013 3.627 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -5.524 7.827 3.762 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -6.896 9.629 4.089 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -6.762 9.712 2.344 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -8.772 10.844 2.251 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -10.303 9.980 2.430 1.00 0.00 H new ATOM 551 N GLU A 40 -5.325 8.891 0.098 1.00 0.00 N ATOM 552 CA GLU A 40 -4.387 9.792 -0.560 1.00 0.00 C ATOM 553 C GLU A 40 -3.639 10.642 0.464 1.00 0.00 C ATOM 554 O GLU A 40 -4.178 11.593 1.031 1.00 0.00 O ATOM 555 CB GLU A 40 -5.123 10.697 -1.550 1.00 0.00 C ATOM 556 CG GLU A 40 -4.204 11.630 -2.321 1.00 0.00 C ATOM 557 CD GLU A 40 -4.902 12.304 -3.486 1.00 0.00 C ATOM 558 OE1 GLU A 40 -5.840 13.091 -3.241 1.00 0.00 O ATOM 559 OE2 GLU A 40 -4.511 12.044 -4.643 1.00 0.00 O ATOM 0 H GLU A 40 -6.251 8.862 -0.328 1.00 0.00 H new ATOM 0 HA GLU A 40 -3.662 9.186 -1.103 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -5.673 10.076 -2.257 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.859 11.291 -1.008 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -3.815 12.392 -1.645 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -3.348 11.066 -2.692 1.00 0.00 H new ATOM 566 N PRO A 41 -2.368 10.291 0.708 1.00 0.00 N ATOM 567 CA PRO A 41 -1.519 11.008 1.664 1.00 0.00 C ATOM 568 C PRO A 41 -1.143 12.402 1.174 1.00 0.00 C ATOM 569 O PRO A 41 -1.391 12.753 0.020 1.00 0.00 O ATOM 570 CB PRO A 41 -0.273 10.123 1.765 1.00 0.00 C ATOM 571 CG PRO A 41 -0.229 9.383 0.473 1.00 0.00 C ATOM 572 CD PRO A 41 -1.661 9.168 0.069 1.00 0.00 C ATOM 0 HA PRO A 41 -2.024 11.168 2.617 1.00 0.00 H new ATOM 0 HB2 PRO A 41 0.627 10.721 1.910 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -0.341 9.439 2.611 1.00 0.00 H new ATOM 0 HG2 PRO A 41 0.309 9.953 -0.285 1.00 0.00 H new ATOM 0 HG3 PRO A 41 0.292 8.432 0.586 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -1.779 9.183 -1.014 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -2.037 8.206 0.418 1.00 0.00 H new ATOM 580 N ARG A 42 -0.543 13.193 2.057 1.00 0.00 N ATOM 581 CA ARG A 42 -0.134 14.550 1.714 1.00 0.00 C ATOM 582 C ARG A 42 1.065 14.534 0.770 1.00 0.00 C ATOM 583 O ARG A 42 1.979 13.723 0.926 1.00 0.00 O ATOM 584 CB ARG A 42 0.209 15.338 2.980 1.00 0.00 C ATOM 585 CG ARG A 42 1.525 14.921 3.618 1.00 0.00 C ATOM 586 CD ARG A 42 1.935 15.880 4.724 1.00 0.00 C ATOM 587 NE ARG A 42 3.361 15.789 5.026 1.00 0.00 N ATOM 588 CZ ARG A 42 3.942 16.436 6.031 1.00 0.00 C ATOM 589 NH1 ARG A 42 3.223 17.216 6.826 1.00 0.00 N ATOM 590 NH2 ARG A 42 5.246 16.302 6.241 1.00 0.00 N ATOM 0 H ARG A 42 -0.329 12.918 3.016 1.00 0.00 H new ATOM 0 HA ARG A 42 -0.967 15.037 1.207 1.00 0.00 H new ATOM 0 HB2 ARG A 42 0.253 16.400 2.737 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -0.594 15.211 3.706 1.00 0.00 H new ATOM 0 HG2 ARG A 42 1.431 13.914 4.024 1.00 0.00 H new ATOM 0 HG3 ARG A 42 2.305 14.886 2.857 1.00 0.00 H new ATOM 0 HD2 ARG A 42 1.691 16.900 4.428 1.00 0.00 H new ATOM 0 HD3 ARG A 42 1.359 15.663 5.624 1.00 0.00 H new ATOM 0 HE ARG A 42 3.943 15.197 4.433 1.00 0.00 H new ATOM 0 HH11 ARG A 42 2.221 17.321 6.667 1.00 0.00 H new ATOM 0 HH12 ARG A 42 3.672 17.711 7.596 1.00 0.00 H new ATOM 0 HH21 ARG A 42 5.802 15.703 5.631 1.00 0.00 H new ATOM 0 HH22 ARG A 42 5.692 16.799 7.012 1.00 0.00 H new ATOM 604 N CYS A 43 1.054 15.434 -0.206 1.00 0.00 N ATOM 605 CA CYS A 43 2.141 15.523 -1.176 1.00 0.00 C ATOM 606 C CYS A 43 2.064 16.828 -1.960 1.00 0.00 C ATOM 607 O CYS A 43 1.106 17.067 -2.695 1.00 0.00 O ATOM 608 CB CYS A 43 2.093 14.333 -2.136 1.00 0.00 C ATOM 609 SG CYS A 43 0.563 14.218 -3.094 1.00 0.00 S ATOM 0 H CYS A 43 0.306 16.112 -0.347 1.00 0.00 H new ATOM 0 HA CYS A 43 3.085 15.503 -0.631 1.00 0.00 H new ATOM 0 HB2 CYS A 43 2.936 14.401 -2.824 1.00 0.00 H new ATOM 0 HB3 CYS A 43 2.221 13.414 -1.565 1.00 0.00 H new ATOM 0 HG CYS A 43 0.763 14.689 -4.289 1.00 0.00 H new ATOM 615 N GLU A 44 3.079 17.671 -1.797 1.00 0.00 N ATOM 616 CA GLU A 44 3.125 18.954 -2.488 1.00 0.00 C ATOM 617 C GLU A 44 3.039 18.762 -3.999 1.00 0.00 C ATOM 618 O GLU A 44 2.579 19.645 -4.723 1.00 0.00 O ATOM 619 CB GLU A 44 4.408 19.706 -2.130 1.00 0.00 C ATOM 620 CG GLU A 44 4.392 20.310 -0.736 1.00 0.00 C ATOM 621 CD GLU A 44 5.782 20.463 -0.150 1.00 0.00 C ATOM 622 OE1 GLU A 44 6.510 21.382 -0.579 1.00 0.00 O ATOM 623 OE2 GLU A 44 6.141 19.662 0.739 1.00 0.00 O ATOM 0 H GLU A 44 3.880 17.488 -1.193 1.00 0.00 H new ATOM 0 HA GLU A 44 2.266 19.542 -2.165 1.00 0.00 H new ATOM 0 HB2 GLU A 44 5.254 19.023 -2.211 1.00 0.00 H new ATOM 0 HB3 GLU A 44 4.569 20.500 -2.859 1.00 0.00 H new ATOM 0 HG2 GLU A 44 3.908 21.286 -0.773 1.00 0.00 H new ATOM 0 HG3 GLU A 44 3.792 19.681 -0.079 1.00 0.00 H new ATOM 630 N ARG A 45 3.487 17.601 -4.468 1.00 0.00 N ATOM 631 CA ARG A 45 3.463 17.292 -5.893 1.00 0.00 C ATOM 632 C ARG A 45 2.372 16.274 -6.210 1.00 0.00 C ATOM 633 O ARG A 45 1.978 15.467 -5.368 1.00 0.00 O ATOM 634 CB ARG A 45 4.823 16.755 -6.342 1.00 0.00 C ATOM 635 CG ARG A 45 5.966 17.733 -6.126 1.00 0.00 C ATOM 636 CD ARG A 45 5.851 18.938 -7.048 1.00 0.00 C ATOM 637 NE ARG A 45 7.086 19.715 -7.090 1.00 0.00 N ATOM 638 CZ ARG A 45 7.232 20.825 -7.805 1.00 0.00 C ATOM 639 NH1 ARG A 45 6.224 21.287 -8.532 1.00 0.00 N ATOM 640 NH2 ARG A 45 8.388 21.477 -7.792 1.00 0.00 N ATOM 0 H ARG A 45 3.871 16.860 -3.882 1.00 0.00 H new ATOM 0 HA ARG A 45 3.246 18.212 -6.436 1.00 0.00 H new ATOM 0 HB2 ARG A 45 5.037 15.834 -5.800 1.00 0.00 H new ATOM 0 HB3 ARG A 45 4.771 16.498 -7.400 1.00 0.00 H new ATOM 0 HG2 ARG A 45 5.970 18.067 -5.088 1.00 0.00 H new ATOM 0 HG3 ARG A 45 6.916 17.228 -6.302 1.00 0.00 H new ATOM 0 HD2 ARG A 45 5.600 18.602 -8.054 1.00 0.00 H new ATOM 0 HD3 ARG A 45 5.033 19.575 -6.711 1.00 0.00 H new ATOM 0 HE ARG A 45 7.880 19.388 -6.540 1.00 0.00 H new ATOM 0 HH11 ARG A 45 5.333 20.790 -8.543 1.00 0.00 H new ATOM 0 HH12 ARG A 45 6.339 22.140 -9.080 1.00 0.00 H new ATOM 0 HH21 ARG A 45 9.165 21.126 -7.233 1.00 0.00 H new ATOM 0 HH22 ARG A 45 8.499 22.329 -8.341 1.00 0.00 H new ATOM 654 N PRO A 46 1.871 16.312 -7.454 1.00 0.00 N ATOM 655 CA PRO A 46 0.818 15.400 -7.911 1.00 0.00 C ATOM 656 C PRO A 46 1.315 13.965 -8.050 1.00 0.00 C ATOM 657 O PRO A 46 2.290 13.700 -8.754 1.00 0.00 O ATOM 658 CB PRO A 46 0.429 15.965 -9.280 1.00 0.00 C ATOM 659 CG PRO A 46 1.641 16.696 -9.746 1.00 0.00 C ATOM 660 CD PRO A 46 2.293 17.248 -8.509 1.00 0.00 C ATOM 0 HA PRO A 46 -0.011 15.348 -7.205 1.00 0.00 H new ATOM 0 HB2 PRO A 46 0.155 15.170 -9.973 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -0.430 16.631 -9.204 1.00 0.00 H new ATOM 0 HG2 PRO A 46 2.318 16.029 -10.279 1.00 0.00 H new ATOM 0 HG3 PRO A 46 1.373 17.496 -10.436 1.00 0.00 H new ATOM 0 HD2 PRO A 46 3.378 17.280 -8.607 1.00 0.00 H new ATOM 0 HD3 PRO A 46 1.962 18.265 -8.300 1.00 0.00 H new ATOM 668 N LEU A 47 0.638 13.042 -7.375 1.00 0.00 N ATOM 669 CA LEU A 47 1.011 11.632 -7.423 1.00 0.00 C ATOM 670 C LEU A 47 0.852 11.075 -8.834 1.00 0.00 C ATOM 671 O LEU A 47 -0.038 11.487 -9.577 1.00 0.00 O ATOM 672 CB LEU A 47 0.156 10.825 -6.445 1.00 0.00 C ATOM 673 CG LEU A 47 0.084 11.362 -5.015 1.00 0.00 C ATOM 674 CD1 LEU A 47 -1.151 10.828 -4.306 1.00 0.00 C ATOM 675 CD2 LEU A 47 1.344 10.995 -4.244 1.00 0.00 C ATOM 0 H LEU A 47 -0.172 13.244 -6.788 1.00 0.00 H new ATOM 0 HA LEU A 47 2.059 11.548 -7.135 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -0.858 10.768 -6.842 1.00 0.00 H new ATOM 0 HB3 LEU A 47 0.543 9.807 -6.410 1.00 0.00 H new ATOM 0 HG LEU A 47 0.012 12.449 -5.058 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.185 11.221 -3.290 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -2.044 11.141 -4.846 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -1.109 9.739 -4.273 1.00 0.00 H new ATOM 0 HD21 LEU A 47 1.276 11.385 -3.228 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.447 9.910 -4.210 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.213 11.426 -4.741 1.00 0.00 H new ATOM 687 N GLN A 48 1.721 10.137 -9.195 1.00 0.00 N ATOM 688 CA GLN A 48 1.676 9.522 -10.517 1.00 0.00 C ATOM 689 C GLN A 48 1.004 8.154 -10.459 1.00 0.00 C ATOM 690 O GLN A 48 0.498 7.657 -11.464 1.00 0.00 O ATOM 691 CB GLN A 48 3.089 9.386 -11.088 1.00 0.00 C ATOM 692 CG GLN A 48 3.853 10.699 -11.140 1.00 0.00 C ATOM 693 CD GLN A 48 3.656 11.438 -12.449 1.00 0.00 C ATOM 694 OE1 GLN A 48 2.585 11.989 -12.709 1.00 0.00 O ATOM 695 NE2 GLN A 48 4.689 11.453 -13.282 1.00 0.00 N ATOM 0 H GLN A 48 2.465 9.786 -8.591 1.00 0.00 H new ATOM 0 HA GLN A 48 1.088 10.167 -11.170 1.00 0.00 H new ATOM 0 HB2 GLN A 48 3.649 8.673 -10.483 1.00 0.00 H new ATOM 0 HB3 GLN A 48 3.027 8.971 -12.094 1.00 0.00 H new ATOM 0 HG2 GLN A 48 3.530 11.335 -10.316 1.00 0.00 H new ATOM 0 HG3 GLN A 48 4.915 10.503 -10.994 1.00 0.00 H new ATOM 0 HE21 GLN A 48 5.558 10.983 -13.026 1.00 0.00 H new ATOM 0 HE22 GLN A 48 4.614 11.934 -14.178 1.00 0.00 H new ATOM 704 N GLY A 49 1.004 7.550 -9.274 1.00 0.00 N ATOM 705 CA GLY A 49 0.392 6.245 -9.108 1.00 0.00 C ATOM 706 C GLY A 49 0.554 5.704 -7.701 1.00 0.00 C ATOM 707 O GLY A 49 0.752 6.467 -6.754 1.00 0.00 O ATOM 0 H GLY A 49 1.417 7.941 -8.427 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -0.669 6.311 -9.349 1.00 0.00 H new ATOM 0 HA3 GLY A 49 0.836 5.546 -9.816 1.00 0.00 H new ATOM 711 N TYR A 50 0.468 4.386 -7.562 1.00 0.00 N ATOM 712 CA TYR A 50 0.602 3.745 -6.259 1.00 0.00 C ATOM 713 C TYR A 50 1.199 2.348 -6.399 1.00 0.00 C ATOM 714 O TYR A 50 1.239 1.784 -7.492 1.00 0.00 O ATOM 715 CB TYR A 50 -0.759 3.662 -5.566 1.00 0.00 C ATOM 716 CG TYR A 50 -1.177 4.953 -4.898 1.00 0.00 C ATOM 717 CD1 TYR A 50 -0.808 5.231 -3.588 1.00 0.00 C ATOM 718 CD2 TYR A 50 -1.943 5.893 -5.577 1.00 0.00 C ATOM 719 CE1 TYR A 50 -1.189 6.409 -2.974 1.00 0.00 C ATOM 720 CE2 TYR A 50 -2.327 7.073 -4.971 1.00 0.00 C ATOM 721 CZ TYR A 50 -1.947 7.327 -3.670 1.00 0.00 C ATOM 722 OH TYR A 50 -2.329 8.501 -3.062 1.00 0.00 O ATOM 0 H TYR A 50 0.306 3.741 -8.335 1.00 0.00 H new ATOM 0 HA TYR A 50 1.275 4.350 -5.652 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -1.515 3.381 -6.300 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -0.729 2.869 -4.819 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -0.214 4.515 -3.040 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -2.243 5.697 -6.596 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -0.895 6.610 -1.954 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -2.922 7.793 -5.513 1.00 0.00 H new ATOM 0 HH TYR A 50 -3.293 8.633 -3.182 1.00 0.00 H new ATOM 732 N SER A 51 1.664 1.795 -5.283 1.00 0.00 N ATOM 733 CA SER A 51 2.263 0.466 -5.279 1.00 0.00 C ATOM 734 C SER A 51 1.755 -0.356 -4.098 1.00 0.00 C ATOM 735 O SER A 51 1.872 0.057 -2.944 1.00 0.00 O ATOM 736 CB SER A 51 3.788 0.571 -5.224 1.00 0.00 C ATOM 737 OG SER A 51 4.396 -0.675 -5.518 1.00 0.00 O ATOM 0 H SER A 51 1.637 2.248 -4.369 1.00 0.00 H new ATOM 0 HA SER A 51 1.974 -0.038 -6.201 1.00 0.00 H new ATOM 0 HB2 SER A 51 4.130 1.323 -5.935 1.00 0.00 H new ATOM 0 HB3 SER A 51 4.097 0.905 -4.234 1.00 0.00 H new ATOM 0 HG SER A 51 5.315 -0.679 -5.178 1.00 0.00 H new ATOM 743 N VAL A 52 1.190 -1.521 -4.396 1.00 0.00 N ATOM 744 CA VAL A 52 0.664 -2.403 -3.360 1.00 0.00 C ATOM 745 C VAL A 52 1.421 -3.726 -3.328 1.00 0.00 C ATOM 746 O VAL A 52 1.140 -4.632 -4.111 1.00 0.00 O ATOM 747 CB VAL A 52 -0.835 -2.687 -3.572 1.00 0.00 C ATOM 748 CG1 VAL A 52 -1.379 -3.553 -2.447 1.00 0.00 C ATOM 749 CG2 VAL A 52 -1.614 -1.385 -3.678 1.00 0.00 C ATOM 0 H VAL A 52 1.084 -1.877 -5.346 1.00 0.00 H new ATOM 0 HA VAL A 52 0.798 -1.888 -2.409 1.00 0.00 H new ATOM 0 HB VAL A 52 -0.955 -3.233 -4.508 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -2.439 -3.743 -2.614 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -0.840 -4.500 -2.424 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -1.248 -3.038 -1.495 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.671 -1.605 -3.828 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.489 -0.811 -2.760 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -1.241 -0.805 -4.522 1.00 0.00 H new ATOM 759 N GLU A 53 2.384 -3.828 -2.417 1.00 0.00 N ATOM 760 CA GLU A 53 3.182 -5.041 -2.283 1.00 0.00 C ATOM 761 C GLU A 53 2.626 -5.941 -1.183 1.00 0.00 C ATOM 762 O GLU A 53 2.401 -5.496 -0.057 1.00 0.00 O ATOM 763 CB GLU A 53 4.640 -4.688 -1.980 1.00 0.00 C ATOM 764 CG GLU A 53 5.496 -4.517 -3.223 1.00 0.00 C ATOM 765 CD GLU A 53 6.685 -3.604 -2.992 1.00 0.00 C ATOM 766 OE1 GLU A 53 7.522 -3.928 -2.124 1.00 0.00 O ATOM 767 OE2 GLU A 53 6.777 -2.565 -3.679 1.00 0.00 O ATOM 0 H GLU A 53 2.630 -3.086 -1.762 1.00 0.00 H new ATOM 0 HA GLU A 53 3.135 -5.582 -3.228 1.00 0.00 H new ATOM 0 HB2 GLU A 53 4.669 -3.766 -1.400 1.00 0.00 H new ATOM 0 HB3 GLU A 53 5.072 -5.470 -1.356 1.00 0.00 H new ATOM 0 HG2 GLU A 53 5.851 -5.494 -3.552 1.00 0.00 H new ATOM 0 HG3 GLU A 53 4.883 -4.113 -4.029 1.00 0.00 H new ATOM 774 N TYR A 54 2.405 -7.207 -1.518 1.00 0.00 N ATOM 775 CA TYR A 54 1.872 -8.169 -0.561 1.00 0.00 C ATOM 776 C TYR A 54 2.639 -9.486 -0.627 1.00 0.00 C ATOM 777 O TYR A 54 3.101 -9.894 -1.693 1.00 0.00 O ATOM 778 CB TYR A 54 0.386 -8.417 -0.828 1.00 0.00 C ATOM 779 CG TYR A 54 0.126 -9.294 -2.032 1.00 0.00 C ATOM 780 CD1 TYR A 54 0.342 -10.665 -1.976 1.00 0.00 C ATOM 781 CD2 TYR A 54 -0.335 -8.752 -3.225 1.00 0.00 C ATOM 782 CE1 TYR A 54 0.107 -11.471 -3.073 1.00 0.00 C ATOM 783 CE2 TYR A 54 -0.575 -9.550 -4.327 1.00 0.00 C ATOM 784 CZ TYR A 54 -0.352 -10.909 -4.246 1.00 0.00 C ATOM 785 OH TYR A 54 -0.589 -11.707 -5.342 1.00 0.00 O ATOM 0 H TYR A 54 2.587 -7.591 -2.445 1.00 0.00 H new ATOM 0 HA TYR A 54 1.990 -7.751 0.439 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -0.060 -8.880 0.052 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -0.114 -7.459 -0.972 1.00 0.00 H new ATOM 0 HD1 TYR A 54 0.700 -11.109 -1.059 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -0.509 -7.688 -3.292 1.00 0.00 H new ATOM 0 HE1 TYR A 54 0.282 -12.535 -3.013 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -0.935 -9.112 -5.246 1.00 0.00 H new ATOM 0 HH TYR A 54 -0.909 -11.155 -6.086 1.00 0.00 H new ATOM 795 N GLN A 55 2.769 -10.146 0.519 1.00 0.00 N ATOM 796 CA GLN A 55 3.479 -11.417 0.591 1.00 0.00 C ATOM 797 C GLN A 55 3.199 -12.123 1.914 1.00 0.00 C ATOM 798 O GLN A 55 2.905 -11.480 2.923 1.00 0.00 O ATOM 799 CB GLN A 55 4.984 -11.195 0.428 1.00 0.00 C ATOM 800 CG GLN A 55 5.693 -10.848 1.728 1.00 0.00 C ATOM 801 CD GLN A 55 7.106 -10.347 1.506 1.00 0.00 C ATOM 802 OE1 GLN A 55 7.486 -9.287 2.006 1.00 0.00 O ATOM 803 NE2 GLN A 55 7.893 -11.107 0.754 1.00 0.00 N ATOM 0 H GLN A 55 2.392 -9.822 1.410 1.00 0.00 H new ATOM 0 HA GLN A 55 3.122 -12.050 -0.221 1.00 0.00 H new ATOM 0 HB2 GLN A 55 5.432 -12.096 0.009 1.00 0.00 H new ATOM 0 HB3 GLN A 55 5.149 -10.393 -0.291 1.00 0.00 H new ATOM 0 HG2 GLN A 55 5.121 -10.086 2.258 1.00 0.00 H new ATOM 0 HG3 GLN A 55 5.720 -11.729 2.369 1.00 0.00 H new ATOM 0 HE21 GLN A 55 7.536 -11.978 0.360 1.00 0.00 H new ATOM 0 HE22 GLN A 55 8.855 -10.820 0.570 1.00 0.00 H new ATOM 812 N LEU A 56 3.291 -13.448 1.903 1.00 0.00 N ATOM 813 CA LEU A 56 3.047 -14.242 3.102 1.00 0.00 C ATOM 814 C LEU A 56 3.758 -13.640 4.309 1.00 0.00 C ATOM 815 O LEU A 56 4.986 -13.538 4.332 1.00 0.00 O ATOM 816 CB LEU A 56 3.513 -15.683 2.887 1.00 0.00 C ATOM 817 CG LEU A 56 2.578 -16.577 2.072 1.00 0.00 C ATOM 818 CD1 LEU A 56 3.264 -17.889 1.723 1.00 0.00 C ATOM 819 CD2 LEU A 56 1.287 -16.835 2.835 1.00 0.00 C ATOM 0 H LEU A 56 3.533 -13.995 1.077 1.00 0.00 H new ATOM 0 HA LEU A 56 1.975 -14.239 3.297 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.484 -15.660 2.392 1.00 0.00 H new ATOM 0 HB3 LEU A 56 3.664 -16.144 3.863 1.00 0.00 H new ATOM 0 HG LEU A 56 2.331 -16.061 1.144 1.00 0.00 H new ATOM 0 HD11 LEU A 56 2.583 -18.512 1.143 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.160 -17.686 1.136 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.541 -18.410 2.640 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.634 -17.473 2.240 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.515 -17.330 3.779 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.786 -15.887 3.033 1.00 0.00 H new ATOM 831 N LEU A 57 2.981 -13.244 5.310 1.00 0.00 N ATOM 832 CA LEU A 57 3.537 -12.653 6.523 1.00 0.00 C ATOM 833 C LEU A 57 4.791 -13.400 6.967 1.00 0.00 C ATOM 834 O LEU A 57 5.836 -12.794 7.198 1.00 0.00 O ATOM 835 CB LEU A 57 2.497 -12.668 7.644 1.00 0.00 C ATOM 836 CG LEU A 57 2.649 -11.588 8.716 1.00 0.00 C ATOM 837 CD1 LEU A 57 2.508 -10.204 8.101 1.00 0.00 C ATOM 838 CD2 LEU A 57 1.626 -11.788 9.824 1.00 0.00 C ATOM 0 H LEU A 57 1.964 -13.321 5.307 1.00 0.00 H new ATOM 0 HA LEU A 57 3.810 -11.621 6.303 1.00 0.00 H new ATOM 0 HB2 LEU A 57 1.508 -12.570 7.196 1.00 0.00 H new ATOM 0 HB3 LEU A 57 2.531 -13.642 8.131 1.00 0.00 H new ATOM 0 HG LEU A 57 3.645 -11.671 9.150 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.619 -9.448 8.878 1.00 0.00 H new ATOM 0 HD12 LEU A 57 3.279 -10.062 7.344 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.525 -10.109 7.640 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.749 -11.010 10.578 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.621 -11.732 9.406 1.00 0.00 H new ATOM 0 HD23 LEU A 57 1.774 -12.765 10.284 1.00 0.00 H new ATOM 850 N ASN A 58 4.679 -14.719 7.081 1.00 0.00 N ATOM 851 CA ASN A 58 5.804 -15.549 7.495 1.00 0.00 C ATOM 852 C ASN A 58 6.992 -15.364 6.555 1.00 0.00 C ATOM 853 O ASN A 58 8.128 -15.203 6.998 1.00 0.00 O ATOM 854 CB ASN A 58 5.393 -17.022 7.531 1.00 0.00 C ATOM 855 CG ASN A 58 4.855 -17.505 6.198 1.00 0.00 C ATOM 856 OD1 ASN A 58 5.609 -17.972 5.344 1.00 0.00 O ATOM 857 ND2 ASN A 58 3.545 -17.394 6.013 1.00 0.00 N ATOM 0 H ASN A 58 3.820 -15.236 6.892 1.00 0.00 H new ATOM 0 HA ASN A 58 6.103 -15.238 8.496 1.00 0.00 H new ATOM 0 HB2 ASN A 58 6.253 -17.629 7.814 1.00 0.00 H new ATOM 0 HB3 ASN A 58 4.634 -17.166 8.300 1.00 0.00 H new ATOM 0 HD21 ASN A 58 3.126 -17.702 5.136 1.00 0.00 H new ATOM 0 HD22 ASN A 58 2.958 -17.001 6.748 1.00 0.00 H new ATOM 864 N GLY A 59 6.719 -15.387 5.254 1.00 0.00 N ATOM 865 CA GLY A 59 7.774 -15.220 4.272 1.00 0.00 C ATOM 866 C GLY A 59 7.626 -16.165 3.096 1.00 0.00 C ATOM 867 O GLY A 59 7.940 -17.350 3.200 1.00 0.00 O ATOM 0 H GLY A 59 5.786 -15.518 4.863 1.00 0.00 H new ATOM 0 HA2 GLY A 59 7.770 -14.192 3.911 1.00 0.00 H new ATOM 0 HA3 GLY A 59 8.740 -15.387 4.749 1.00 0.00 H new ATOM 871 N GLY A 60 7.145 -15.640 1.973 1.00 0.00 N ATOM 872 CA GLY A 60 6.962 -16.460 0.790 1.00 0.00 C ATOM 873 C GLY A 60 7.213 -15.691 -0.492 1.00 0.00 C ATOM 874 O GLY A 60 8.324 -15.219 -0.732 1.00 0.00 O ATOM 0 H GLY A 60 6.879 -14.662 1.862 1.00 0.00 H new ATOM 0 HA2 GLY A 60 7.637 -17.314 0.836 1.00 0.00 H new ATOM 0 HA3 GLY A 60 5.947 -16.856 0.780 1.00 0.00 H new ATOM 878 N GLU A 61 6.179 -15.567 -1.318 1.00 0.00 N ATOM 879 CA GLU A 61 6.294 -14.852 -2.583 1.00 0.00 C ATOM 880 C GLU A 61 5.791 -13.418 -2.446 1.00 0.00 C ATOM 881 O GLU A 61 4.730 -13.172 -1.872 1.00 0.00 O ATOM 882 CB GLU A 61 5.507 -15.577 -3.678 1.00 0.00 C ATOM 883 CG GLU A 61 5.805 -15.070 -5.079 1.00 0.00 C ATOM 884 CD GLU A 61 5.468 -16.087 -6.151 1.00 0.00 C ATOM 885 OE1 GLU A 61 6.144 -17.136 -6.208 1.00 0.00 O ATOM 886 OE2 GLU A 61 4.528 -15.835 -6.934 1.00 0.00 O ATOM 0 H GLU A 61 5.253 -15.952 -1.134 1.00 0.00 H new ATOM 0 HA GLU A 61 7.348 -14.824 -2.860 1.00 0.00 H new ATOM 0 HB2 GLU A 61 5.732 -16.642 -3.631 1.00 0.00 H new ATOM 0 HB3 GLU A 61 4.441 -15.468 -3.480 1.00 0.00 H new ATOM 0 HG2 GLU A 61 5.238 -14.157 -5.259 1.00 0.00 H new ATOM 0 HG3 GLU A 61 6.861 -14.809 -5.150 1.00 0.00 H new ATOM 893 N LEU A 62 6.562 -12.474 -2.975 1.00 0.00 N ATOM 894 CA LEU A 62 6.196 -11.063 -2.912 1.00 0.00 C ATOM 895 C LEU A 62 5.670 -10.576 -4.258 1.00 0.00 C ATOM 896 O LEU A 62 6.373 -10.630 -5.268 1.00 0.00 O ATOM 897 CB LEU A 62 7.402 -10.222 -2.488 1.00 0.00 C ATOM 898 CG LEU A 62 7.238 -8.707 -2.605 1.00 0.00 C ATOM 899 CD1 LEU A 62 7.319 -8.272 -4.060 1.00 0.00 C ATOM 900 CD2 LEU A 62 5.919 -8.264 -1.987 1.00 0.00 C ATOM 0 H LEU A 62 7.444 -12.660 -3.452 1.00 0.00 H new ATOM 0 HA LEU A 62 5.404 -10.951 -2.172 1.00 0.00 H new ATOM 0 HB2 LEU A 62 7.641 -10.462 -1.452 1.00 0.00 H new ATOM 0 HB3 LEU A 62 8.259 -10.522 -3.091 1.00 0.00 H new ATOM 0 HG LEU A 62 8.051 -8.230 -2.058 1.00 0.00 H new ATOM 0 HD11 LEU A 62 7.200 -7.190 -4.124 1.00 0.00 H new ATOM 0 HD12 LEU A 62 8.288 -8.555 -4.471 1.00 0.00 H new ATOM 0 HD13 LEU A 62 6.527 -8.758 -4.630 1.00 0.00 H new ATOM 0 HD21 LEU A 62 5.819 -7.183 -2.079 1.00 0.00 H new ATOM 0 HD22 LEU A 62 5.093 -8.750 -2.506 1.00 0.00 H new ATOM 0 HD23 LEU A 62 5.900 -8.542 -0.933 1.00 0.00 H new ATOM 912 N HIS A 63 4.430 -10.098 -4.265 1.00 0.00 N ATOM 913 CA HIS A 63 3.810 -9.598 -5.487 1.00 0.00 C ATOM 914 C HIS A 63 3.638 -8.083 -5.429 1.00 0.00 C ATOM 915 O HIS A 63 2.946 -7.560 -4.555 1.00 0.00 O ATOM 916 CB HIS A 63 2.454 -10.268 -5.708 1.00 0.00 C ATOM 917 CG HIS A 63 2.546 -11.746 -5.930 1.00 0.00 C ATOM 918 ND1 HIS A 63 2.237 -12.347 -7.132 1.00 0.00 N ATOM 919 CD2 HIS A 63 2.917 -12.746 -5.096 1.00 0.00 C ATOM 920 CE1 HIS A 63 2.412 -13.653 -7.027 1.00 0.00 C ATOM 921 NE2 HIS A 63 2.825 -13.920 -5.801 1.00 0.00 N ATOM 0 H HIS A 63 3.835 -10.046 -3.438 1.00 0.00 H new ATOM 0 HA HIS A 63 4.467 -9.840 -6.323 1.00 0.00 H new ATOM 0 HB2 HIS A 63 1.819 -10.078 -4.843 1.00 0.00 H new ATOM 0 HB3 HIS A 63 1.967 -9.809 -6.569 1.00 0.00 H new ATOM 0 HD2 HIS A 63 3.228 -12.640 -4.067 1.00 0.00 H new ATOM 0 HE1 HIS A 63 2.246 -14.378 -7.810 1.00 0.00 H new ATOM 0 HE2 HIS A 63 3.041 -14.848 -5.437 1.00 0.00 H new ATOM 929 N ARG A 64 4.274 -7.383 -6.363 1.00 0.00 N ATOM 930 CA ARG A 64 4.193 -5.929 -6.416 1.00 0.00 C ATOM 931 C ARG A 64 3.140 -5.479 -7.425 1.00 0.00 C ATOM 932 O ARG A 64 3.208 -5.824 -8.605 1.00 0.00 O ATOM 933 CB ARG A 64 5.553 -5.334 -6.784 1.00 0.00 C ATOM 934 CG ARG A 64 5.559 -3.815 -6.840 1.00 0.00 C ATOM 935 CD ARG A 64 6.721 -3.292 -7.670 1.00 0.00 C ATOM 936 NE ARG A 64 7.053 -1.909 -7.338 1.00 0.00 N ATOM 937 CZ ARG A 64 7.856 -1.149 -8.073 1.00 0.00 C ATOM 938 NH1 ARG A 64 8.406 -1.635 -9.178 1.00 0.00 N ATOM 939 NH2 ARG A 64 8.110 0.100 -7.705 1.00 0.00 N ATOM 0 H ARG A 64 4.851 -7.800 -7.093 1.00 0.00 H new ATOM 0 HA ARG A 64 3.902 -5.571 -5.428 1.00 0.00 H new ATOM 0 HB2 ARG A 64 6.294 -5.665 -6.056 1.00 0.00 H new ATOM 0 HB3 ARG A 64 5.861 -5.726 -7.753 1.00 0.00 H new ATOM 0 HG2 ARG A 64 4.619 -3.462 -7.265 1.00 0.00 H new ATOM 0 HG3 ARG A 64 5.623 -3.413 -5.829 1.00 0.00 H new ATOM 0 HD2 ARG A 64 7.595 -3.923 -7.508 1.00 0.00 H new ATOM 0 HD3 ARG A 64 6.470 -3.360 -8.728 1.00 0.00 H new ATOM 0 HE ARG A 64 6.645 -1.505 -6.495 1.00 0.00 H new ATOM 0 HH11 ARG A 64 8.212 -2.595 -9.465 1.00 0.00 H new ATOM 0 HH12 ARG A 64 9.023 -1.049 -9.741 1.00 0.00 H new ATOM 0 HH21 ARG A 64 7.688 0.477 -6.856 1.00 0.00 H new ATOM 0 HH22 ARG A 64 8.727 0.683 -8.271 1.00 0.00 H new ATOM 953 N LEU A 65 2.167 -4.708 -6.952 1.00 0.00 N ATOM 954 CA LEU A 65 1.098 -4.211 -7.812 1.00 0.00 C ATOM 955 C LEU A 65 1.251 -2.714 -8.061 1.00 0.00 C ATOM 956 O LEU A 65 1.275 -1.919 -7.123 1.00 0.00 O ATOM 957 CB LEU A 65 -0.266 -4.499 -7.182 1.00 0.00 C ATOM 958 CG LEU A 65 -0.545 -5.959 -6.823 1.00 0.00 C ATOM 959 CD1 LEU A 65 -1.774 -6.064 -5.934 1.00 0.00 C ATOM 960 CD2 LEU A 65 -0.723 -6.794 -8.083 1.00 0.00 C ATOM 0 H LEU A 65 2.096 -4.413 -5.978 1.00 0.00 H new ATOM 0 HA LEU A 65 1.165 -4.728 -8.769 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -0.360 -3.899 -6.277 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.040 -4.161 -7.870 1.00 0.00 H new ATOM 0 HG LEU A 65 0.311 -6.348 -6.272 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -1.957 -7.110 -5.689 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -1.609 -5.500 -5.016 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -2.639 -5.658 -6.459 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -0.921 -7.830 -7.808 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.561 -6.406 -8.661 1.00 0.00 H new ATOM 0 HD23 LEU A 65 0.185 -6.745 -8.683 1.00 0.00 H new ATOM 972 N ASN A 66 1.352 -2.338 -9.331 1.00 0.00 N ATOM 973 CA ASN A 66 1.500 -0.935 -9.704 1.00 0.00 C ATOM 974 C ASN A 66 0.157 -0.335 -10.109 1.00 0.00 C ATOM 975 O ASN A 66 -0.664 -0.997 -10.744 1.00 0.00 O ATOM 976 CB ASN A 66 2.502 -0.794 -10.851 1.00 0.00 C ATOM 977 CG ASN A 66 3.931 -1.030 -10.404 1.00 0.00 C ATOM 978 OD1 ASN A 66 4.433 -0.350 -9.508 1.00 0.00 O ATOM 979 ND2 ASN A 66 4.594 -1.997 -11.027 1.00 0.00 N ATOM 0 H ASN A 66 1.334 -2.984 -10.120 1.00 0.00 H new ATOM 0 HA ASN A 66 1.873 -0.391 -8.836 1.00 0.00 H new ATOM 0 HB2 ASN A 66 2.249 -1.503 -11.639 1.00 0.00 H new ATOM 0 HB3 ASN A 66 2.419 0.204 -11.281 1.00 0.00 H new ATOM 0 HD21 ASN A 66 5.559 -2.202 -10.769 1.00 0.00 H new ATOM 0 HD22 ASN A 66 4.138 -2.535 -11.764 1.00 0.00 H new ATOM 986 N ILE A 67 -0.059 0.922 -9.737 1.00 0.00 N ATOM 987 CA ILE A 67 -1.300 1.612 -10.064 1.00 0.00 C ATOM 988 C ILE A 67 -1.054 2.756 -11.042 1.00 0.00 C ATOM 989 O ILE A 67 -0.530 3.811 -10.683 1.00 0.00 O ATOM 990 CB ILE A 67 -1.983 2.170 -8.801 1.00 0.00 C ATOM 991 CG1 ILE A 67 -1.928 1.143 -7.669 1.00 0.00 C ATOM 992 CG2 ILE A 67 -3.423 2.557 -9.104 1.00 0.00 C ATOM 993 CD1 ILE A 67 -2.798 -0.071 -7.911 1.00 0.00 C ATOM 0 H ILE A 67 0.609 1.483 -9.209 1.00 0.00 H new ATOM 0 HA ILE A 67 -1.956 0.876 -10.528 1.00 0.00 H new ATOM 0 HB ILE A 67 -1.447 3.064 -8.481 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -0.896 0.819 -7.533 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -2.237 1.622 -6.740 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -3.892 2.949 -8.202 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -3.439 3.320 -9.882 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -3.972 1.679 -9.445 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -2.709 -0.756 -7.068 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -3.837 0.241 -8.017 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -2.475 -0.574 -8.823 1.00 0.00 H new ATOM 1005 N PRO A 68 -1.440 2.544 -12.309 1.00 0.00 N ATOM 1006 CA PRO A 68 -1.273 3.547 -13.365 1.00 0.00 C ATOM 1007 C PRO A 68 -2.198 4.744 -13.179 1.00 0.00 C ATOM 1008 O PRO A 68 -2.226 5.654 -14.008 1.00 0.00 O ATOM 1009 CB PRO A 68 -1.637 2.783 -14.640 1.00 0.00 C ATOM 1010 CG PRO A 68 -2.543 1.692 -14.183 1.00 0.00 C ATOM 1011 CD PRO A 68 -2.070 1.311 -12.808 1.00 0.00 C ATOM 0 HA PRO A 68 -0.266 3.965 -13.375 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -2.132 3.432 -15.363 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -0.749 2.382 -15.128 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -3.579 2.029 -14.160 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -2.500 0.839 -14.861 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -2.897 0.997 -12.172 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -1.362 0.483 -12.842 1.00 0.00 H new ATOM 1019 N ASN A 69 -2.954 4.738 -12.086 1.00 0.00 N ATOM 1020 CA ASN A 69 -3.882 5.825 -11.792 1.00 0.00 C ATOM 1021 C ASN A 69 -3.656 6.366 -10.384 1.00 0.00 C ATOM 1022 O ASN A 69 -3.876 5.680 -9.385 1.00 0.00 O ATOM 1023 CB ASN A 69 -5.327 5.344 -11.940 1.00 0.00 C ATOM 1024 CG ASN A 69 -6.317 6.492 -11.979 1.00 0.00 C ATOM 1025 OD1 ASN A 69 -6.024 7.561 -12.515 1.00 0.00 O ATOM 1026 ND2 ASN A 69 -7.497 6.275 -11.409 1.00 0.00 N ATOM 0 H ASN A 69 -2.943 3.993 -11.389 1.00 0.00 H new ATOM 0 HA ASN A 69 -3.699 6.629 -12.505 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -5.420 4.757 -12.853 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -5.574 4.683 -11.109 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -8.204 7.010 -11.404 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -7.696 5.373 -10.976 1.00 0.00 H new ATOM 1033 N PRO A 70 -3.207 7.628 -10.300 1.00 0.00 N ATOM 1034 CA PRO A 70 -2.942 8.290 -9.019 1.00 0.00 C ATOM 1035 C PRO A 70 -4.222 8.591 -8.247 1.00 0.00 C ATOM 1036 O PRO A 70 -4.176 9.037 -7.101 1.00 0.00 O ATOM 1037 CB PRO A 70 -2.247 9.591 -9.429 1.00 0.00 C ATOM 1038 CG PRO A 70 -2.723 9.854 -10.816 1.00 0.00 C ATOM 1039 CD PRO A 70 -2.923 8.504 -11.449 1.00 0.00 C ATOM 0 HA PRO A 70 -2.348 7.665 -8.352 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -2.510 10.409 -8.758 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -1.162 9.488 -9.396 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -3.653 10.423 -10.808 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -1.994 10.442 -11.374 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -3.748 8.512 -12.162 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -2.036 8.179 -11.992 1.00 0.00 H new ATOM 1047 N ALA A 71 -5.363 8.344 -8.882 1.00 0.00 N ATOM 1048 CA ALA A 71 -6.655 8.586 -8.253 1.00 0.00 C ATOM 1049 C ALA A 71 -7.212 7.309 -7.633 1.00 0.00 C ATOM 1050 O ALA A 71 -7.975 7.358 -6.669 1.00 0.00 O ATOM 1051 CB ALA A 71 -7.637 9.154 -9.267 1.00 0.00 C ATOM 0 H ALA A 71 -5.419 7.976 -9.832 1.00 0.00 H new ATOM 0 HA ALA A 71 -6.512 9.314 -7.454 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -8.598 9.330 -8.784 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -7.251 10.094 -9.660 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -7.767 8.445 -10.085 1.00 0.00 H new ATOM 1057 N GLN A 72 -6.825 6.167 -8.193 1.00 0.00 N ATOM 1058 CA GLN A 72 -7.288 4.877 -7.695 1.00 0.00 C ATOM 1059 C GLN A 72 -6.607 4.527 -6.376 1.00 0.00 C ATOM 1060 O GLN A 72 -5.467 4.061 -6.358 1.00 0.00 O ATOM 1061 CB GLN A 72 -7.019 3.782 -8.728 1.00 0.00 C ATOM 1062 CG GLN A 72 -7.206 2.374 -8.185 1.00 0.00 C ATOM 1063 CD GLN A 72 -6.593 1.316 -9.081 1.00 0.00 C ATOM 1064 OE1 GLN A 72 -6.426 1.525 -10.283 1.00 0.00 O ATOM 1065 NE2 GLN A 72 -6.252 0.172 -8.499 1.00 0.00 N ATOM 0 H GLN A 72 -6.193 6.109 -8.991 1.00 0.00 H new ATOM 0 HA GLN A 72 -8.362 4.947 -7.521 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -7.685 3.926 -9.579 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -6.000 3.887 -9.099 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -6.758 2.309 -7.193 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -8.271 2.173 -8.068 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -6.408 0.042 -7.500 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -5.834 -0.576 -9.051 1.00 0.00 H new ATOM 1074 N THR A 73 -7.312 4.755 -5.272 1.00 0.00 N ATOM 1075 CA THR A 73 -6.775 4.465 -3.949 1.00 0.00 C ATOM 1076 C THR A 73 -7.316 3.144 -3.413 1.00 0.00 C ATOM 1077 O THR A 73 -7.495 2.979 -2.207 1.00 0.00 O ATOM 1078 CB THR A 73 -7.111 5.587 -2.948 1.00 0.00 C ATOM 1079 OG1 THR A 73 -8.530 5.702 -2.800 1.00 0.00 O ATOM 1080 CG2 THR A 73 -6.535 6.916 -3.413 1.00 0.00 C ATOM 0 H THR A 73 -8.257 5.140 -5.269 1.00 0.00 H new ATOM 0 HA THR A 73 -5.693 4.395 -4.056 1.00 0.00 H new ATOM 0 HB THR A 73 -6.666 5.332 -1.986 1.00 0.00 H new ATOM 0 HG1 THR A 73 -8.735 6.416 -2.161 1.00 0.00 H new ATOM 0 HG21 THR A 73 -6.785 7.693 -2.691 1.00 0.00 H new ATOM 0 HG22 THR A 73 -5.451 6.833 -3.497 1.00 0.00 H new ATOM 0 HG23 THR A 73 -6.956 7.175 -4.385 1.00 0.00 H new ATOM 1088 N SER A 74 -7.572 2.205 -4.318 1.00 0.00 N ATOM 1089 CA SER A 74 -8.095 0.898 -3.936 1.00 0.00 C ATOM 1090 C SER A 74 -7.802 -0.141 -5.015 1.00 0.00 C ATOM 1091 O SER A 74 -8.000 0.110 -6.204 1.00 0.00 O ATOM 1092 CB SER A 74 -9.603 0.981 -3.689 1.00 0.00 C ATOM 1093 OG SER A 74 -10.263 1.618 -4.769 1.00 0.00 O ATOM 0 H SER A 74 -7.426 2.324 -5.320 1.00 0.00 H new ATOM 0 HA SER A 74 -7.599 0.591 -3.015 1.00 0.00 H new ATOM 0 HB2 SER A 74 -10.008 -0.022 -3.552 1.00 0.00 H new ATOM 0 HB3 SER A 74 -9.794 1.531 -2.767 1.00 0.00 H new ATOM 0 HG SER A 74 -11.225 1.657 -4.587 1.00 0.00 H new ATOM 1099 N VAL A 75 -7.330 -1.308 -4.590 1.00 0.00 N ATOM 1100 CA VAL A 75 -7.010 -2.386 -5.518 1.00 0.00 C ATOM 1101 C VAL A 75 -7.494 -3.731 -4.986 1.00 0.00 C ATOM 1102 O VAL A 75 -7.460 -3.983 -3.782 1.00 0.00 O ATOM 1103 CB VAL A 75 -5.495 -2.468 -5.784 1.00 0.00 C ATOM 1104 CG1 VAL A 75 -4.749 -2.839 -4.511 1.00 0.00 C ATOM 1105 CG2 VAL A 75 -5.202 -3.465 -6.894 1.00 0.00 C ATOM 0 H VAL A 75 -7.161 -1.531 -3.609 1.00 0.00 H new ATOM 0 HA VAL A 75 -7.524 -2.161 -6.453 1.00 0.00 H new ATOM 0 HB VAL A 75 -5.147 -1.487 -6.108 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -3.680 -2.892 -4.718 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -4.934 -2.083 -3.748 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.098 -3.808 -4.154 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -4.127 -3.510 -7.068 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -5.564 -4.451 -6.602 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.705 -3.150 -7.808 1.00 0.00 H new ATOM 1115 N VAL A 76 -7.945 -4.592 -5.893 1.00 0.00 N ATOM 1116 CA VAL A 76 -8.436 -5.912 -5.516 1.00 0.00 C ATOM 1117 C VAL A 76 -7.348 -6.969 -5.676 1.00 0.00 C ATOM 1118 O VAL A 76 -6.826 -7.176 -6.771 1.00 0.00 O ATOM 1119 CB VAL A 76 -9.659 -6.319 -6.358 1.00 0.00 C ATOM 1120 CG1 VAL A 76 -10.058 -7.756 -6.062 1.00 0.00 C ATOM 1121 CG2 VAL A 76 -10.821 -5.371 -6.102 1.00 0.00 C ATOM 0 H VAL A 76 -7.980 -4.399 -6.894 1.00 0.00 H new ATOM 0 HA VAL A 76 -8.730 -5.852 -4.468 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.390 -6.252 -7.412 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -10.924 -8.025 -6.667 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -9.228 -8.421 -6.301 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -10.308 -7.854 -5.006 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -11.677 -5.673 -6.705 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -11.091 -5.403 -5.047 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -10.528 -4.356 -6.371 1.00 0.00 H new ATOM 1131 N VAL A 77 -7.011 -7.635 -4.576 1.00 0.00 N ATOM 1132 CA VAL A 77 -5.987 -8.672 -4.594 1.00 0.00 C ATOM 1133 C VAL A 77 -6.612 -10.062 -4.573 1.00 0.00 C ATOM 1134 O VAL A 77 -7.358 -10.404 -3.656 1.00 0.00 O ATOM 1135 CB VAL A 77 -5.027 -8.534 -3.397 1.00 0.00 C ATOM 1136 CG1 VAL A 77 -3.947 -9.603 -3.453 1.00 0.00 C ATOM 1137 CG2 VAL A 77 -4.412 -7.144 -3.365 1.00 0.00 C ATOM 0 H VAL A 77 -7.433 -7.475 -3.661 1.00 0.00 H new ATOM 0 HA VAL A 77 -5.424 -8.544 -5.518 1.00 0.00 H new ATOM 0 HB VAL A 77 -5.597 -8.675 -2.478 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.278 -9.490 -2.600 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.410 -10.590 -3.423 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -3.378 -9.497 -4.377 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -3.737 -7.064 -2.513 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -3.856 -6.971 -4.286 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.202 -6.399 -3.273 1.00 0.00 H new ATOM 1147 N GLU A 78 -6.301 -10.860 -5.590 1.00 0.00 N ATOM 1148 CA GLU A 78 -6.833 -12.214 -5.688 1.00 0.00 C ATOM 1149 C GLU A 78 -5.710 -13.226 -5.898 1.00 0.00 C ATOM 1150 O GLU A 78 -4.536 -12.862 -5.961 1.00 0.00 O ATOM 1151 CB GLU A 78 -7.840 -12.309 -6.836 1.00 0.00 C ATOM 1152 CG GLU A 78 -9.020 -11.362 -6.690 1.00 0.00 C ATOM 1153 CD GLU A 78 -10.193 -11.753 -7.568 1.00 0.00 C ATOM 1154 OE1 GLU A 78 -10.955 -12.659 -7.170 1.00 0.00 O ATOM 1155 OE2 GLU A 78 -10.350 -11.153 -8.652 1.00 0.00 O ATOM 0 H GLU A 78 -5.684 -10.592 -6.357 1.00 0.00 H new ATOM 0 HA GLU A 78 -7.338 -12.446 -4.751 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -7.329 -12.097 -7.775 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -8.211 -13.332 -6.899 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -9.340 -11.345 -5.648 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -8.703 -10.350 -6.943 1.00 0.00 H new ATOM 1162 N ASP A 79 -6.080 -14.498 -6.003 1.00 0.00 N ATOM 1163 CA ASP A 79 -5.106 -15.563 -6.206 1.00 0.00 C ATOM 1164 C ASP A 79 -4.250 -15.762 -4.959 1.00 0.00 C ATOM 1165 O ASP A 79 -3.043 -15.988 -5.051 1.00 0.00 O ATOM 1166 CB ASP A 79 -4.213 -15.246 -7.407 1.00 0.00 C ATOM 1167 CG ASP A 79 -5.012 -14.852 -8.634 1.00 0.00 C ATOM 1168 OD1 ASP A 79 -6.182 -15.274 -8.741 1.00 0.00 O ATOM 1169 OD2 ASP A 79 -4.466 -14.121 -9.487 1.00 0.00 O ATOM 0 H ASP A 79 -7.048 -14.816 -5.951 1.00 0.00 H new ATOM 0 HA ASP A 79 -5.651 -16.486 -6.402 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -3.531 -14.437 -7.146 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -3.600 -16.117 -7.640 1.00 0.00 H new ATOM 1174 N LEU A 80 -4.882 -15.675 -3.794 1.00 0.00 N ATOM 1175 CA LEU A 80 -4.179 -15.843 -2.527 1.00 0.00 C ATOM 1176 C LEU A 80 -4.446 -17.224 -1.936 1.00 0.00 C ATOM 1177 O LEU A 80 -5.209 -18.013 -2.494 1.00 0.00 O ATOM 1178 CB LEU A 80 -4.607 -14.760 -1.535 1.00 0.00 C ATOM 1179 CG LEU A 80 -4.495 -13.317 -2.029 1.00 0.00 C ATOM 1180 CD1 LEU A 80 -5.548 -12.443 -1.366 1.00 0.00 C ATOM 1181 CD2 LEU A 80 -3.101 -12.769 -1.764 1.00 0.00 C ATOM 0 H LEU A 80 -5.881 -15.489 -3.700 1.00 0.00 H new ATOM 0 HA LEU A 80 -3.110 -15.749 -2.718 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -5.642 -14.946 -1.249 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -4.004 -14.862 -0.633 1.00 0.00 H new ATOM 0 HG LEU A 80 -4.669 -13.307 -3.105 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -5.453 -11.420 -1.730 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -6.541 -12.823 -1.607 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -5.406 -12.459 -0.285 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -3.040 -11.741 -2.122 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -2.898 -12.793 -0.693 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -2.365 -13.380 -2.286 1.00 0.00 H new ATOM 1193 N LEU A 81 -3.816 -17.508 -0.801 1.00 0.00 N ATOM 1194 CA LEU A 81 -3.987 -18.793 -0.132 1.00 0.00 C ATOM 1195 C LEU A 81 -4.872 -18.650 1.102 1.00 0.00 C ATOM 1196 O LEU A 81 -4.777 -17.682 1.856 1.00 0.00 O ATOM 1197 CB LEU A 81 -2.626 -19.368 0.266 1.00 0.00 C ATOM 1198 CG LEU A 81 -1.746 -19.865 -0.881 1.00 0.00 C ATOM 1199 CD1 LEU A 81 -0.294 -19.956 -0.439 1.00 0.00 C ATOM 1200 CD2 LEU A 81 -2.238 -21.215 -1.383 1.00 0.00 C ATOM 0 H LEU A 81 -3.182 -16.866 -0.325 1.00 0.00 H new ATOM 0 HA LEU A 81 -4.473 -19.476 -0.828 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.076 -18.602 0.813 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -2.791 -20.196 0.956 1.00 0.00 H new ATOM 0 HG LEU A 81 -1.811 -19.149 -1.700 1.00 0.00 H new ATOM 0 HD11 LEU A 81 0.317 -20.311 -1.269 1.00 0.00 H new ATOM 0 HD12 LEU A 81 0.054 -18.971 -0.128 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -0.211 -20.651 0.397 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -1.600 -21.554 -2.199 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -2.203 -21.940 -0.570 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -3.264 -21.119 -1.740 1.00 0.00 H new ATOM 1212 N PRO A 82 -5.754 -19.638 1.315 1.00 0.00 N ATOM 1213 CA PRO A 82 -6.672 -19.647 2.458 1.00 0.00 C ATOM 1214 C PRO A 82 -5.948 -19.875 3.781 1.00 0.00 C ATOM 1215 O PRO A 82 -4.948 -20.589 3.837 1.00 0.00 O ATOM 1216 CB PRO A 82 -7.608 -20.818 2.152 1.00 0.00 C ATOM 1217 CG PRO A 82 -6.812 -21.720 1.273 1.00 0.00 C ATOM 1218 CD PRO A 82 -5.923 -20.823 0.457 1.00 0.00 C ATOM 0 HA PRO A 82 -7.186 -18.693 2.576 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -7.917 -21.327 3.065 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -8.516 -20.479 1.653 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -6.222 -22.421 1.864 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -7.463 -22.313 0.631 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -4.967 -21.298 0.235 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -6.380 -20.565 -0.498 1.00 0.00 H new ATOM 1226 N ASN A 83 -6.461 -19.263 4.844 1.00 0.00 N ATOM 1227 CA ASN A 83 -5.862 -19.400 6.167 1.00 0.00 C ATOM 1228 C ASN A 83 -4.384 -19.023 6.137 1.00 0.00 C ATOM 1229 O ASN A 83 -3.548 -19.700 6.736 1.00 0.00 O ATOM 1230 CB ASN A 83 -6.025 -20.833 6.677 1.00 0.00 C ATOM 1231 CG ASN A 83 -7.456 -21.150 7.065 1.00 0.00 C ATOM 1232 OD1 ASN A 83 -7.724 -21.600 8.179 1.00 0.00 O ATOM 1233 ND2 ASN A 83 -8.384 -20.917 6.143 1.00 0.00 N ATOM 0 H ASN A 83 -7.289 -18.668 4.815 1.00 0.00 H new ATOM 0 HA ASN A 83 -6.378 -18.720 6.845 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -5.698 -21.530 5.905 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -5.376 -20.985 7.539 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -9.364 -21.112 6.346 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -8.116 -20.543 5.233 1.00 0.00 H new ATOM 1240 N HIS A 84 -4.070 -17.938 5.436 1.00 0.00 N ATOM 1241 CA HIS A 84 -2.693 -17.470 5.329 1.00 0.00 C ATOM 1242 C HIS A 84 -2.622 -15.953 5.476 1.00 0.00 C ATOM 1243 O HIS A 84 -3.429 -15.225 4.898 1.00 0.00 O ATOM 1244 CB HIS A 84 -2.091 -17.893 3.989 1.00 0.00 C ATOM 1245 CG HIS A 84 -1.545 -19.288 3.991 1.00 0.00 C ATOM 1246 ND1 HIS A 84 -2.336 -20.405 4.156 1.00 0.00 N ATOM 1247 CD2 HIS A 84 -0.278 -19.743 3.846 1.00 0.00 C ATOM 1248 CE1 HIS A 84 -1.579 -21.487 4.113 1.00 0.00 C ATOM 1249 NE2 HIS A 84 -0.327 -21.113 3.926 1.00 0.00 N ATOM 0 H HIS A 84 -4.750 -17.367 4.934 1.00 0.00 H new ATOM 0 HA HIS A 84 -2.117 -17.923 6.136 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -2.854 -17.812 3.215 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -1.293 -17.200 3.724 1.00 0.00 H new ATOM 0 HD1 HIS A 84 -3.347 -20.397 4.290 1.00 0.00 H new ATOM 0 HD2 HIS A 84 0.606 -19.141 3.696 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -1.926 -22.505 4.214 1.00 0.00 H new ATOM 1257 N SER A 85 -1.651 -15.483 6.253 1.00 0.00 N ATOM 1258 CA SER A 85 -1.478 -14.053 6.479 1.00 0.00 C ATOM 1259 C SER A 85 -0.625 -13.428 5.379 1.00 0.00 C ATOM 1260 O SER A 85 0.332 -14.036 4.899 1.00 0.00 O ATOM 1261 CB SER A 85 -0.830 -13.806 7.843 1.00 0.00 C ATOM 1262 OG SER A 85 0.330 -14.601 8.009 1.00 0.00 O ATOM 0 H SER A 85 -0.972 -16.072 6.736 1.00 0.00 H new ATOM 0 HA SER A 85 -2.463 -13.586 6.461 1.00 0.00 H new ATOM 0 HB2 SER A 85 -0.569 -12.752 7.939 1.00 0.00 H new ATOM 0 HB3 SER A 85 -1.545 -14.031 8.635 1.00 0.00 H new ATOM 0 HG SER A 85 0.634 -14.545 8.939 1.00 0.00 H new ATOM 1268 N TYR A 86 -0.981 -12.211 4.984 1.00 0.00 N ATOM 1269 CA TYR A 86 -0.251 -11.503 3.938 1.00 0.00 C ATOM 1270 C TYR A 86 -0.022 -10.045 4.325 1.00 0.00 C ATOM 1271 O TYR A 86 -0.969 -9.306 4.596 1.00 0.00 O ATOM 1272 CB TYR A 86 -1.015 -11.577 2.615 1.00 0.00 C ATOM 1273 CG TYR A 86 -0.882 -12.910 1.913 1.00 0.00 C ATOM 1274 CD1 TYR A 86 0.244 -13.212 1.158 1.00 0.00 C ATOM 1275 CD2 TYR A 86 -1.884 -13.869 2.007 1.00 0.00 C ATOM 1276 CE1 TYR A 86 0.368 -14.428 0.515 1.00 0.00 C ATOM 1277 CE2 TYR A 86 -1.768 -15.088 1.369 1.00 0.00 C ATOM 1278 CZ TYR A 86 -0.640 -15.363 0.624 1.00 0.00 C ATOM 1279 OH TYR A 86 -0.519 -16.576 -0.014 1.00 0.00 O ATOM 0 H TYR A 86 -1.770 -11.694 5.372 1.00 0.00 H new ATOM 0 HA TYR A 86 0.719 -11.985 3.817 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -2.070 -11.378 2.803 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -0.655 -10.790 1.953 1.00 0.00 H new ATOM 0 HD1 TYR A 86 1.036 -12.483 1.072 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -2.769 -13.657 2.589 1.00 0.00 H new ATOM 0 HE1 TYR A 86 1.249 -14.646 -0.070 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -2.556 -15.822 1.453 1.00 0.00 H new ATOM 0 HH TYR A 86 0.428 -16.819 -0.077 1.00 0.00 H new ATOM 1289 N VAL A 87 1.243 -9.638 4.347 1.00 0.00 N ATOM 1290 CA VAL A 87 1.599 -8.268 4.699 1.00 0.00 C ATOM 1291 C VAL A 87 1.416 -7.330 3.510 1.00 0.00 C ATOM 1292 O VAL A 87 2.238 -7.304 2.594 1.00 0.00 O ATOM 1293 CB VAL A 87 3.055 -8.175 5.192 1.00 0.00 C ATOM 1294 CG1 VAL A 87 4.011 -8.712 4.137 1.00 0.00 C ATOM 1295 CG2 VAL A 87 3.403 -6.740 5.557 1.00 0.00 C ATOM 0 H VAL A 87 2.038 -10.237 4.125 1.00 0.00 H new ATOM 0 HA VAL A 87 0.930 -7.964 5.505 1.00 0.00 H new ATOM 0 HB VAL A 87 3.157 -8.788 6.087 1.00 0.00 H new ATOM 0 HG11 VAL A 87 5.035 -8.638 4.503 1.00 0.00 H new ATOM 0 HG12 VAL A 87 3.774 -9.755 3.929 1.00 0.00 H new ATOM 0 HG13 VAL A 87 3.909 -8.127 3.223 1.00 0.00 H new ATOM 0 HG21 VAL A 87 4.435 -6.693 5.903 1.00 0.00 H new ATOM 0 HG22 VAL A 87 3.285 -6.103 4.681 1.00 0.00 H new ATOM 0 HG23 VAL A 87 2.739 -6.395 6.349 1.00 0.00 H new ATOM 1305 N PHE A 88 0.332 -6.562 3.532 1.00 0.00 N ATOM 1306 CA PHE A 88 0.039 -5.622 2.456 1.00 0.00 C ATOM 1307 C PHE A 88 0.624 -4.246 2.762 1.00 0.00 C ATOM 1308 O PHE A 88 0.098 -3.507 3.594 1.00 0.00 O ATOM 1309 CB PHE A 88 -1.472 -5.511 2.244 1.00 0.00 C ATOM 1310 CG PHE A 88 -2.063 -6.684 1.517 1.00 0.00 C ATOM 1311 CD1 PHE A 88 -2.483 -7.807 2.212 1.00 0.00 C ATOM 1312 CD2 PHE A 88 -2.200 -6.665 0.138 1.00 0.00 C ATOM 1313 CE1 PHE A 88 -3.026 -8.889 1.545 1.00 0.00 C ATOM 1314 CE2 PHE A 88 -2.743 -7.743 -0.534 1.00 0.00 C ATOM 1315 CZ PHE A 88 -3.158 -8.856 0.171 1.00 0.00 C ATOM 0 H PHE A 88 -0.358 -6.572 4.283 1.00 0.00 H new ATOM 0 HA PHE A 88 0.500 -5.998 1.543 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -1.960 -5.411 3.213 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -1.686 -4.601 1.684 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -2.385 -7.837 3.287 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -1.878 -5.797 -0.418 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -3.347 -9.759 2.098 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -2.843 -7.716 -1.609 1.00 0.00 H new ATOM 0 HZ PHE A 88 -3.585 -9.699 -0.352 1.00 0.00 H new ATOM 1325 N ARG A 89 1.716 -3.909 2.083 1.00 0.00 N ATOM 1326 CA ARG A 89 2.373 -2.624 2.283 1.00 0.00 C ATOM 1327 C ARG A 89 2.106 -1.688 1.108 1.00 0.00 C ATOM 1328 O ARG A 89 2.710 -1.822 0.043 1.00 0.00 O ATOM 1329 CB ARG A 89 3.880 -2.820 2.459 1.00 0.00 C ATOM 1330 CG ARG A 89 4.249 -3.631 3.691 1.00 0.00 C ATOM 1331 CD ARG A 89 5.620 -3.245 4.222 1.00 0.00 C ATOM 1332 NE ARG A 89 6.188 -4.283 5.077 1.00 0.00 N ATOM 1333 CZ ARG A 89 6.748 -5.394 4.611 1.00 0.00 C ATOM 1334 NH1 ARG A 89 6.815 -5.609 3.305 1.00 0.00 N ATOM 1335 NH2 ARG A 89 7.243 -6.293 5.453 1.00 0.00 N ATOM 0 H ARG A 89 2.164 -4.508 1.390 1.00 0.00 H new ATOM 0 HA ARG A 89 1.964 -2.172 3.186 1.00 0.00 H new ATOM 0 HB2 ARG A 89 4.279 -3.317 1.575 1.00 0.00 H new ATOM 0 HB3 ARG A 89 4.360 -1.843 2.520 1.00 0.00 H new ATOM 0 HG2 ARG A 89 3.500 -3.476 4.468 1.00 0.00 H new ATOM 0 HG3 ARG A 89 4.239 -4.693 3.445 1.00 0.00 H new ATOM 0 HD2 ARG A 89 6.293 -3.056 3.385 1.00 0.00 H new ATOM 0 HD3 ARG A 89 5.542 -2.315 4.784 1.00 0.00 H new ATOM 0 HE ARG A 89 6.153 -4.148 6.087 1.00 0.00 H new ATOM 0 HH11 ARG A 89 6.436 -4.921 2.655 1.00 0.00 H new ATOM 0 HH12 ARG A 89 7.246 -6.463 2.950 1.00 0.00 H new ATOM 0 HH21 ARG A 89 7.194 -6.131 6.459 1.00 0.00 H new ATOM 0 HH22 ARG A 89 7.673 -7.146 5.094 1.00 0.00 H new ATOM 1349 N VAL A 90 1.195 -0.740 1.308 1.00 0.00 N ATOM 1350 CA VAL A 90 0.848 0.219 0.266 1.00 0.00 C ATOM 1351 C VAL A 90 1.802 1.408 0.272 1.00 0.00 C ATOM 1352 O VAL A 90 2.165 1.919 1.332 1.00 0.00 O ATOM 1353 CB VAL A 90 -0.595 0.731 0.434 1.00 0.00 C ATOM 1354 CG1 VAL A 90 -0.892 1.830 -0.575 1.00 0.00 C ATOM 1355 CG2 VAL A 90 -1.587 -0.414 0.295 1.00 0.00 C ATOM 0 H VAL A 90 0.684 -0.616 2.182 1.00 0.00 H new ATOM 0 HA VAL A 90 0.932 -0.304 -0.687 1.00 0.00 H new ATOM 0 HB VAL A 90 -0.699 1.151 1.434 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -1.916 2.180 -0.441 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -0.202 2.660 -0.422 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -0.771 1.439 -1.585 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -2.601 -0.034 0.417 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -1.485 -0.866 -0.692 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -1.387 -1.164 1.060 1.00 0.00 H new ATOM 1365 N ARG A 91 2.204 1.843 -0.917 1.00 0.00 N ATOM 1366 CA ARG A 91 3.117 2.972 -1.049 1.00 0.00 C ATOM 1367 C ARG A 91 2.638 3.935 -2.131 1.00 0.00 C ATOM 1368 O ARG A 91 1.876 3.556 -3.020 1.00 0.00 O ATOM 1369 CB ARG A 91 4.527 2.479 -1.377 1.00 0.00 C ATOM 1370 CG ARG A 91 5.600 3.542 -1.204 1.00 0.00 C ATOM 1371 CD ARG A 91 6.995 2.948 -1.313 1.00 0.00 C ATOM 1372 NE ARG A 91 7.170 2.184 -2.546 1.00 0.00 N ATOM 1373 CZ ARG A 91 8.152 1.310 -2.736 1.00 0.00 C ATOM 1374 NH1 ARG A 91 9.044 1.092 -1.779 1.00 0.00 N ATOM 1375 NH2 ARG A 91 8.244 0.653 -3.885 1.00 0.00 N ATOM 0 H ARG A 91 1.912 1.431 -1.803 1.00 0.00 H new ATOM 0 HA ARG A 91 3.138 3.504 -0.098 1.00 0.00 H new ATOM 0 HB2 ARG A 91 4.763 1.629 -0.737 1.00 0.00 H new ATOM 0 HB3 ARG A 91 4.547 2.119 -2.406 1.00 0.00 H new ATOM 0 HG2 ARG A 91 5.473 4.316 -1.961 1.00 0.00 H new ATOM 0 HG3 ARG A 91 5.483 4.024 -0.233 1.00 0.00 H new ATOM 0 HD2 ARG A 91 7.734 3.748 -1.275 1.00 0.00 H new ATOM 0 HD3 ARG A 91 7.181 2.301 -0.456 1.00 0.00 H new ATOM 0 HE ARG A 91 6.501 2.330 -3.302 1.00 0.00 H new ATOM 0 HH11 ARG A 91 8.977 1.596 -0.895 1.00 0.00 H new ATOM 0 HH12 ARG A 91 9.797 0.420 -1.927 1.00 0.00 H new ATOM 0 HH21 ARG A 91 7.560 0.819 -4.623 1.00 0.00 H new ATOM 0 HH22 ARG A 91 8.999 -0.018 -4.030 1.00 0.00 H new ATOM 1389 N ALA A 92 3.090 5.182 -2.048 1.00 0.00 N ATOM 1390 CA ALA A 92 2.709 6.199 -3.021 1.00 0.00 C ATOM 1391 C ALA A 92 3.928 6.725 -3.771 1.00 0.00 C ATOM 1392 O ALA A 92 5.045 6.692 -3.256 1.00 0.00 O ATOM 1393 CB ALA A 92 1.977 7.341 -2.332 1.00 0.00 C ATOM 0 H ALA A 92 3.720 5.512 -1.317 1.00 0.00 H new ATOM 0 HA ALA A 92 2.039 5.739 -3.747 1.00 0.00 H new ATOM 0 HB1 ALA A 92 1.699 8.093 -3.070 1.00 0.00 H new ATOM 0 HB2 ALA A 92 1.079 6.958 -1.848 1.00 0.00 H new ATOM 0 HB3 ALA A 92 2.629 7.792 -1.583 1.00 0.00 H new ATOM 1399 N GLN A 93 3.704 7.210 -4.988 1.00 0.00 N ATOM 1400 CA GLN A 93 4.786 7.742 -5.808 1.00 0.00 C ATOM 1401 C GLN A 93 4.382 9.065 -6.450 1.00 0.00 C ATOM 1402 O GLN A 93 3.285 9.194 -6.993 1.00 0.00 O ATOM 1403 CB GLN A 93 5.176 6.735 -6.891 1.00 0.00 C ATOM 1404 CG GLN A 93 6.249 7.246 -7.840 1.00 0.00 C ATOM 1405 CD GLN A 93 6.173 6.599 -9.209 1.00 0.00 C ATOM 1406 OE1 GLN A 93 5.283 6.903 -10.003 1.00 0.00 O ATOM 1407 NE2 GLN A 93 7.109 5.702 -9.493 1.00 0.00 N ATOM 0 H GLN A 93 2.784 7.246 -5.428 1.00 0.00 H new ATOM 0 HA GLN A 93 5.645 7.920 -5.161 1.00 0.00 H new ATOM 0 HB2 GLN A 93 5.530 5.821 -6.415 1.00 0.00 H new ATOM 0 HB3 GLN A 93 4.289 6.472 -7.467 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.150 8.326 -7.947 1.00 0.00 H new ATOM 0 HG3 GLN A 93 7.231 7.057 -7.407 1.00 0.00 H new ATOM 0 HE21 GLN A 93 7.828 5.480 -8.805 1.00 0.00 H new ATOM 0 HE22 GLN A 93 7.109 5.234 -10.400 1.00 0.00 H new ATOM 1416 N SER A 94 5.276 10.047 -6.383 1.00 0.00 N ATOM 1417 CA SER A 94 5.011 11.362 -6.954 1.00 0.00 C ATOM 1418 C SER A 94 6.176 11.820 -7.827 1.00 0.00 C ATOM 1419 O SER A 94 7.249 11.218 -7.813 1.00 0.00 O ATOM 1420 CB SER A 94 4.761 12.383 -5.842 1.00 0.00 C ATOM 1421 OG SER A 94 5.975 12.963 -5.399 1.00 0.00 O ATOM 0 H SER A 94 6.190 9.956 -5.939 1.00 0.00 H new ATOM 0 HA SER A 94 4.120 11.287 -7.577 1.00 0.00 H new ATOM 0 HB2 SER A 94 4.093 13.164 -6.205 1.00 0.00 H new ATOM 0 HB3 SER A 94 4.260 11.898 -5.005 1.00 0.00 H new ATOM 0 HG SER A 94 5.785 13.636 -4.713 1.00 0.00 H new ATOM 1427 N GLN A 95 5.954 12.889 -8.585 1.00 0.00 N ATOM 1428 CA GLN A 95 6.984 13.427 -9.466 1.00 0.00 C ATOM 1429 C GLN A 95 8.356 13.364 -8.802 1.00 0.00 C ATOM 1430 O GLN A 95 9.378 13.260 -9.478 1.00 0.00 O ATOM 1431 CB GLN A 95 6.655 14.872 -9.847 1.00 0.00 C ATOM 1432 CG GLN A 95 7.788 15.584 -10.569 1.00 0.00 C ATOM 1433 CD GLN A 95 7.384 16.951 -11.084 1.00 0.00 C ATOM 1434 OE1 GLN A 95 6.501 17.602 -10.524 1.00 0.00 O ATOM 1435 NE2 GLN A 95 8.029 17.395 -12.156 1.00 0.00 N ATOM 0 H GLN A 95 5.071 13.399 -8.607 1.00 0.00 H new ATOM 0 HA GLN A 95 7.009 12.817 -10.369 1.00 0.00 H new ATOM 0 HB2 GLN A 95 5.769 14.879 -10.482 1.00 0.00 H new ATOM 0 HB3 GLN A 95 6.404 15.429 -8.944 1.00 0.00 H new ATOM 0 HG2 GLN A 95 8.635 15.691 -9.891 1.00 0.00 H new ATOM 0 HG3 GLN A 95 8.124 14.970 -11.405 1.00 0.00 H new ATOM 0 HE21 GLN A 95 8.754 16.823 -12.588 1.00 0.00 H new ATOM 0 HE22 GLN A 95 7.800 18.309 -12.547 1.00 0.00 H new ATOM 1444 N GLU A 96 8.368 13.427 -7.474 1.00 0.00 N ATOM 1445 CA GLU A 96 9.615 13.378 -6.719 1.00 0.00 C ATOM 1446 C GLU A 96 10.155 11.952 -6.653 1.00 0.00 C ATOM 1447 O GLU A 96 11.186 11.639 -7.245 1.00 0.00 O ATOM 1448 CB GLU A 96 9.403 13.921 -5.305 1.00 0.00 C ATOM 1449 CG GLU A 96 9.377 15.439 -5.233 1.00 0.00 C ATOM 1450 CD GLU A 96 10.682 16.066 -5.685 1.00 0.00 C ATOM 1451 OE1 GLU A 96 10.901 16.160 -6.911 1.00 0.00 O ATOM 1452 OE2 GLU A 96 11.483 16.463 -4.813 1.00 0.00 O ATOM 0 H GLU A 96 7.530 13.512 -6.899 1.00 0.00 H new ATOM 0 HA GLU A 96 10.346 14.002 -7.233 1.00 0.00 H new ATOM 0 HB2 GLU A 96 8.464 13.531 -4.912 1.00 0.00 H new ATOM 0 HB3 GLU A 96 10.198 13.549 -4.659 1.00 0.00 H new ATOM 0 HG2 GLU A 96 8.563 15.815 -5.853 1.00 0.00 H new ATOM 0 HG3 GLU A 96 9.165 15.747 -4.209 1.00 0.00 H new ATOM 1459 N GLY A 97 9.449 11.092 -5.925 1.00 0.00 N ATOM 1460 CA GLY A 97 9.872 9.710 -5.793 1.00 0.00 C ATOM 1461 C GLY A 97 9.000 8.926 -4.832 1.00 0.00 C ATOM 1462 O GLY A 97 7.952 9.406 -4.402 1.00 0.00 O ATOM 0 H GLY A 97 8.592 11.328 -5.425 1.00 0.00 H new ATOM 0 HA2 GLY A 97 9.850 9.231 -6.772 1.00 0.00 H new ATOM 0 HA3 GLY A 97 10.905 9.681 -5.447 1.00 0.00 H new ATOM 1466 N TRP A 98 9.433 7.716 -4.497 1.00 0.00 N ATOM 1467 CA TRP A 98 8.683 6.863 -3.581 1.00 0.00 C ATOM 1468 C TRP A 98 8.847 7.334 -2.141 1.00 0.00 C ATOM 1469 O TRP A 98 9.963 7.433 -1.633 1.00 0.00 O ATOM 1470 CB TRP A 98 9.145 5.411 -3.712 1.00 0.00 C ATOM 1471 CG TRP A 98 8.809 4.797 -5.037 1.00 0.00 C ATOM 1472 CD1 TRP A 98 9.659 4.596 -6.087 1.00 0.00 C ATOM 1473 CD2 TRP A 98 7.530 4.307 -5.455 1.00 0.00 C ATOM 1474 NE1 TRP A 98 8.986 4.010 -7.132 1.00 0.00 N ATOM 1475 CE2 TRP A 98 7.679 3.822 -6.769 1.00 0.00 C ATOM 1476 CE3 TRP A 98 6.275 4.228 -4.846 1.00 0.00 C ATOM 1477 CZ2 TRP A 98 6.619 3.268 -7.482 1.00 0.00 C ATOM 1478 CZ3 TRP A 98 5.224 3.679 -5.556 1.00 0.00 C ATOM 1479 CH2 TRP A 98 5.401 3.204 -6.862 1.00 0.00 C ATOM 0 H TRP A 98 10.298 7.303 -4.845 1.00 0.00 H new ATOM 0 HA TRP A 98 7.628 6.927 -3.846 1.00 0.00 H new ATOM 0 HB2 TRP A 98 10.224 5.366 -3.562 1.00 0.00 H new ATOM 0 HB3 TRP A 98 8.688 4.819 -2.919 1.00 0.00 H new ATOM 0 HD1 TRP A 98 10.706 4.859 -6.095 1.00 0.00 H new ATOM 0 HE1 TRP A 98 9.394 3.756 -8.032 1.00 0.00 H new ATOM 0 HE3 TRP A 98 6.129 4.589 -3.839 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 6.754 2.902 -8.489 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 4.249 3.615 -5.096 1.00 0.00 H new ATOM 0 HH2 TRP A 98 4.560 2.779 -7.390 1.00 0.00 H new ATOM 1490 N GLY A 99 7.726 7.624 -1.486 1.00 0.00 N ATOM 1491 CA GLY A 99 7.768 8.081 -0.110 1.00 0.00 C ATOM 1492 C GLY A 99 7.703 6.938 0.883 1.00 0.00 C ATOM 1493 O GLY A 99 8.462 5.974 0.781 1.00 0.00 O ATOM 0 H GLY A 99 6.790 7.550 -1.885 1.00 0.00 H new ATOM 0 HA2 GLY A 99 8.684 8.648 0.053 1.00 0.00 H new ATOM 0 HA3 GLY A 99 6.936 8.762 0.069 1.00 0.00 H new ATOM 1497 N ARG A 100 6.795 7.045 1.848 1.00 0.00 N ATOM 1498 CA ARG A 100 6.635 6.013 2.865 1.00 0.00 C ATOM 1499 C ARG A 100 5.515 5.047 2.489 1.00 0.00 C ATOM 1500 O ARG A 100 4.752 5.300 1.558 1.00 0.00 O ATOM 1501 CB ARG A 100 6.341 6.649 4.225 1.00 0.00 C ATOM 1502 CG ARG A 100 7.571 7.226 4.907 1.00 0.00 C ATOM 1503 CD ARG A 100 8.472 6.128 5.451 1.00 0.00 C ATOM 1504 NE ARG A 100 9.850 6.584 5.617 1.00 0.00 N ATOM 1505 CZ ARG A 100 10.726 6.651 4.621 1.00 0.00 C ATOM 1506 NH1 ARG A 100 10.370 6.294 3.395 1.00 0.00 N ATOM 1507 NH2 ARG A 100 11.962 7.076 4.851 1.00 0.00 N ATOM 0 H ARG A 100 6.159 7.836 1.947 1.00 0.00 H new ATOM 0 HA ARG A 100 7.568 5.452 2.928 1.00 0.00 H new ATOM 0 HB2 ARG A 100 5.604 7.441 4.094 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.892 5.900 4.877 1.00 0.00 H new ATOM 0 HG2 ARG A 100 8.128 7.838 4.198 1.00 0.00 H new ATOM 0 HG3 ARG A 100 7.263 7.882 5.721 1.00 0.00 H new ATOM 0 HD2 ARG A 100 8.086 5.784 6.410 1.00 0.00 H new ATOM 0 HD3 ARG A 100 8.452 5.274 4.774 1.00 0.00 H new ATOM 0 HE ARG A 100 10.156 6.866 6.548 1.00 0.00 H new ATOM 0 HH11 ARG A 100 9.421 5.967 3.214 1.00 0.00 H new ATOM 0 HH12 ARG A 100 11.045 6.347 2.632 1.00 0.00 H new ATOM 0 HH21 ARG A 100 12.240 7.351 5.793 1.00 0.00 H new ATOM 0 HH22 ARG A 100 12.634 7.127 4.086 1.00 0.00 H new ATOM 1521 N GLU A 101 5.424 3.941 3.221 1.00 0.00 N ATOM 1522 CA GLU A 101 4.398 2.938 2.963 1.00 0.00 C ATOM 1523 C GLU A 101 3.790 2.433 4.268 1.00 0.00 C ATOM 1524 O GLU A 101 4.491 2.256 5.264 1.00 0.00 O ATOM 1525 CB GLU A 101 4.986 1.766 2.175 1.00 0.00 C ATOM 1526 CG GLU A 101 5.906 0.879 2.998 1.00 0.00 C ATOM 1527 CD GLU A 101 6.770 -0.022 2.138 1.00 0.00 C ATOM 1528 OE1 GLU A 101 6.210 -0.742 1.284 1.00 0.00 O ATOM 1529 OE2 GLU A 101 8.005 -0.010 2.318 1.00 0.00 O ATOM 0 H GLU A 101 6.048 3.717 3.996 1.00 0.00 H new ATOM 0 HA GLU A 101 3.610 3.405 2.372 1.00 0.00 H new ATOM 0 HB2 GLU A 101 4.171 1.161 1.778 1.00 0.00 H new ATOM 0 HB3 GLU A 101 5.539 2.155 1.320 1.00 0.00 H new ATOM 0 HG2 GLU A 101 6.546 1.504 3.620 1.00 0.00 H new ATOM 0 HG3 GLU A 101 5.307 0.266 3.672 1.00 0.00 H new ATOM 1536 N ARG A 102 2.481 2.204 4.254 1.00 0.00 N ATOM 1537 CA ARG A 102 1.777 1.722 5.437 1.00 0.00 C ATOM 1538 C ARG A 102 1.713 0.197 5.447 1.00 0.00 C ATOM 1539 O ARG A 102 1.474 -0.430 4.416 1.00 0.00 O ATOM 1540 CB ARG A 102 0.363 2.303 5.488 1.00 0.00 C ATOM 1541 CG ARG A 102 -0.483 1.750 6.623 1.00 0.00 C ATOM 1542 CD ARG A 102 -0.022 2.282 7.971 1.00 0.00 C ATOM 1543 NE ARG A 102 -0.514 3.634 8.223 1.00 0.00 N ATOM 1544 CZ ARG A 102 -0.491 4.213 9.418 1.00 0.00 C ATOM 1545 NH1 ARG A 102 -0.002 3.562 10.465 1.00 0.00 N ATOM 1546 NH2 ARG A 102 -0.957 5.446 9.568 1.00 0.00 N ATOM 0 H ARG A 102 1.886 2.344 3.437 1.00 0.00 H new ATOM 0 HA ARG A 102 2.329 2.052 6.317 1.00 0.00 H new ATOM 0 HB2 ARG A 102 0.428 3.386 5.589 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -0.138 2.101 4.541 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -1.528 2.017 6.463 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -0.428 0.661 6.622 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -0.369 1.617 8.761 1.00 0.00 H new ATOM 0 HD3 ARG A 102 1.067 2.280 8.008 1.00 0.00 H new ATOM 0 HE ARG A 102 -0.896 4.162 7.438 1.00 0.00 H new ATOM 0 HH11 ARG A 102 0.358 2.614 10.354 1.00 0.00 H new ATOM 0 HH12 ARG A 102 0.014 4.009 11.382 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -1.333 5.950 8.765 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -0.939 5.890 10.486 1.00 0.00 H new ATOM 1560 N GLU A 103 1.928 -0.391 6.620 1.00 0.00 N ATOM 1561 CA GLU A 103 1.895 -1.842 6.763 1.00 0.00 C ATOM 1562 C GLU A 103 0.513 -2.314 7.206 1.00 0.00 C ATOM 1563 O GLU A 103 -0.101 -1.724 8.094 1.00 0.00 O ATOM 1564 CB GLU A 103 2.951 -2.301 7.770 1.00 0.00 C ATOM 1565 CG GLU A 103 3.333 -3.765 7.627 1.00 0.00 C ATOM 1566 CD GLU A 103 3.787 -4.380 8.937 1.00 0.00 C ATOM 1567 OE1 GLU A 103 3.135 -4.121 9.970 1.00 0.00 O ATOM 1568 OE2 GLU A 103 4.793 -5.119 8.928 1.00 0.00 O ATOM 0 H GLU A 103 2.127 0.114 7.484 1.00 0.00 H new ATOM 0 HA GLU A 103 2.115 -2.283 5.791 1.00 0.00 H new ATOM 0 HB2 GLU A 103 3.844 -1.688 7.652 1.00 0.00 H new ATOM 0 HB3 GLU A 103 2.577 -2.129 8.779 1.00 0.00 H new ATOM 0 HG2 GLU A 103 2.479 -4.324 7.244 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.131 -3.858 6.890 1.00 0.00 H new ATOM 1575 N GLY A 104 0.030 -3.383 6.580 1.00 0.00 N ATOM 1576 CA GLY A 104 -1.275 -3.916 6.923 1.00 0.00 C ATOM 1577 C GLY A 104 -1.426 -5.374 6.536 1.00 0.00 C ATOM 1578 O GLY A 104 -1.613 -5.697 5.362 1.00 0.00 O ATOM 0 H GLY A 104 0.519 -3.889 5.842 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -1.437 -3.809 7.996 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -2.046 -3.329 6.424 1.00 0.00 H new ATOM 1582 N VAL A 105 -1.342 -6.259 7.524 1.00 0.00 N ATOM 1583 CA VAL A 105 -1.470 -7.691 7.281 1.00 0.00 C ATOM 1584 C VAL A 105 -2.899 -8.164 7.520 1.00 0.00 C ATOM 1585 O VAL A 105 -3.581 -7.679 8.424 1.00 0.00 O ATOM 1586 CB VAL A 105 -0.516 -8.500 8.180 1.00 0.00 C ATOM 1587 CG1 VAL A 105 -0.716 -8.129 9.642 1.00 0.00 C ATOM 1588 CG2 VAL A 105 -0.722 -9.992 7.968 1.00 0.00 C ATOM 0 H VAL A 105 -1.186 -6.009 8.501 1.00 0.00 H new ATOM 0 HA VAL A 105 -1.205 -7.860 6.237 1.00 0.00 H new ATOM 0 HB VAL A 105 0.510 -8.255 7.905 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -0.033 -8.711 10.262 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -0.514 -7.067 9.779 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -1.744 -8.344 9.935 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -0.040 -10.548 8.611 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -1.750 -10.256 8.215 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -0.524 -10.242 6.926 1.00 0.00 H new ATOM 1598 N ILE A 106 -3.347 -9.113 6.706 1.00 0.00 N ATOM 1599 CA ILE A 106 -4.695 -9.653 6.830 1.00 0.00 C ATOM 1600 C ILE A 106 -4.667 -11.167 7.011 1.00 0.00 C ATOM 1601 O ILE A 106 -3.799 -11.853 6.469 1.00 0.00 O ATOM 1602 CB ILE A 106 -5.554 -9.311 5.599 1.00 0.00 C ATOM 1603 CG1 ILE A 106 -7.008 -9.727 5.832 1.00 0.00 C ATOM 1604 CG2 ILE A 106 -4.996 -9.990 4.357 1.00 0.00 C ATOM 1605 CD1 ILE A 106 -7.787 -8.749 6.684 1.00 0.00 C ATOM 0 H ILE A 106 -2.796 -9.524 5.953 1.00 0.00 H new ATOM 0 HA ILE A 106 -5.139 -9.192 7.712 1.00 0.00 H new ATOM 0 HB ILE A 106 -5.525 -8.233 5.444 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -7.506 -9.834 4.868 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -7.025 -10.707 6.310 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -5.615 -9.738 3.496 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -3.976 -9.649 4.183 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -4.998 -11.070 4.501 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -8.809 -9.108 6.808 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -7.313 -8.660 7.661 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -7.801 -7.774 6.198 1.00 0.00 H new ATOM 1617 N THR A 107 -5.624 -11.684 7.776 1.00 0.00 N ATOM 1618 CA THR A 107 -5.709 -13.117 8.028 1.00 0.00 C ATOM 1619 C THR A 107 -6.956 -13.715 7.385 1.00 0.00 C ATOM 1620 O THR A 107 -8.066 -13.548 7.890 1.00 0.00 O ATOM 1621 CB THR A 107 -5.728 -13.421 9.538 1.00 0.00 C ATOM 1622 OG1 THR A 107 -4.485 -13.030 10.132 1.00 0.00 O ATOM 1623 CG2 THR A 107 -5.972 -14.902 9.788 1.00 0.00 C ATOM 0 H THR A 107 -6.351 -11.132 8.231 1.00 0.00 H new ATOM 0 HA THR A 107 -4.822 -13.570 7.585 1.00 0.00 H new ATOM 0 HB THR A 107 -6.541 -12.853 9.991 1.00 0.00 H new ATOM 0 HG1 THR A 107 -4.506 -13.225 11.092 1.00 0.00 H new ATOM 0 HG21 THR A 107 -5.981 -15.093 10.861 1.00 0.00 H new ATOM 0 HG22 THR A 107 -6.932 -15.190 9.360 1.00 0.00 H new ATOM 0 HG23 THR A 107 -5.178 -15.485 9.322 1.00 0.00 H new ATOM 1631 N ILE A 108 -6.764 -14.412 6.271 1.00 0.00 N ATOM 1632 CA ILE A 108 -7.873 -15.036 5.560 1.00 0.00 C ATOM 1633 C ILE A 108 -8.683 -15.937 6.487 1.00 0.00 C ATOM 1634 O ILE A 108 -8.190 -16.962 6.957 1.00 0.00 O ATOM 1635 CB ILE A 108 -7.379 -15.865 4.361 1.00 0.00 C ATOM 1636 CG1 ILE A 108 -6.524 -15.000 3.432 1.00 0.00 C ATOM 1637 CG2 ILE A 108 -8.558 -16.458 3.604 1.00 0.00 C ATOM 1638 CD1 ILE A 108 -7.323 -13.982 2.650 1.00 0.00 C ATOM 0 H ILE A 108 -5.851 -14.559 5.841 1.00 0.00 H new ATOM 0 HA ILE A 108 -8.508 -14.228 5.195 1.00 0.00 H new ATOM 0 HB ILE A 108 -6.763 -16.683 4.734 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -5.770 -14.481 4.024 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -5.992 -15.647 2.734 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -8.192 -17.041 2.759 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -9.130 -17.104 4.270 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -9.198 -15.654 3.240 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -6.653 -13.405 2.013 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -8.059 -14.495 2.031 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -7.834 -13.311 3.341 1.00 0.00 H new ATOM 1650 N GLU A 109 -9.927 -15.547 6.745 1.00 0.00 N ATOM 1651 CA GLU A 109 -10.805 -16.320 7.615 1.00 0.00 C ATOM 1652 C GLU A 109 -12.067 -16.749 6.873 1.00 0.00 C ATOM 1653 O GLU A 109 -12.938 -15.930 6.582 1.00 0.00 O ATOM 1654 CB GLU A 109 -11.181 -15.503 8.853 1.00 0.00 C ATOM 1655 CG GLU A 109 -10.068 -15.410 9.883 1.00 0.00 C ATOM 1656 CD GLU A 109 -10.565 -14.949 11.239 1.00 0.00 C ATOM 1657 OE1 GLU A 109 -11.296 -13.938 11.290 1.00 0.00 O ATOM 1658 OE2 GLU A 109 -10.223 -15.599 12.249 1.00 0.00 O ATOM 0 H GLU A 109 -10.349 -14.700 6.364 1.00 0.00 H new ATOM 0 HA GLU A 109 -10.267 -17.215 7.928 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -11.462 -14.497 8.542 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -12.059 -15.949 9.319 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -9.592 -16.385 9.987 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -9.304 -14.719 9.526 1.00 0.00 H new ATOM 1665 N SER A 110 -12.157 -18.040 6.568 1.00 0.00 N ATOM 1666 CA SER A 110 -13.309 -18.579 5.856 1.00 0.00 C ATOM 1667 C SER A 110 -14.244 -19.315 6.812 1.00 0.00 C ATOM 1668 O SER A 110 -13.851 -19.684 7.918 1.00 0.00 O ATOM 1669 CB SER A 110 -12.852 -19.524 4.743 1.00 0.00 C ATOM 1670 OG SER A 110 -13.897 -19.766 3.818 1.00 0.00 O ATOM 0 H SER A 110 -11.445 -18.732 6.803 1.00 0.00 H new ATOM 0 HA SER A 110 -13.853 -17.745 5.413 1.00 0.00 H new ATOM 0 HB2 SER A 110 -11.996 -19.093 4.224 1.00 0.00 H new ATOM 0 HB3 SER A 110 -12.520 -20.467 5.176 1.00 0.00 H new ATOM 0 HG SER A 110 -13.579 -20.371 3.116 1.00 0.00 H new ATOM 1676 N GLN A 111 -15.481 -19.524 6.375 1.00 0.00 N ATOM 1677 CA GLN A 111 -16.472 -20.215 7.191 1.00 0.00 C ATOM 1678 C GLN A 111 -16.803 -19.410 8.443 1.00 0.00 C ATOM 1679 O GLN A 111 -16.851 -19.951 9.548 1.00 0.00 O ATOM 1680 CB GLN A 111 -15.963 -21.603 7.583 1.00 0.00 C ATOM 1681 CG GLN A 111 -17.058 -22.539 8.068 1.00 0.00 C ATOM 1682 CD GLN A 111 -16.514 -23.854 8.591 1.00 0.00 C ATOM 1683 OE1 GLN A 111 -16.288 -24.793 7.827 1.00 0.00 O ATOM 1684 NE2 GLN A 111 -16.300 -23.928 9.899 1.00 0.00 N ATOM 0 H GLN A 111 -15.821 -19.225 5.461 1.00 0.00 H new ATOM 0 HA GLN A 111 -17.381 -20.323 6.599 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -15.465 -22.054 6.725 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -15.213 -21.498 8.367 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -17.628 -22.047 8.856 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -17.750 -22.737 7.250 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -16.501 -23.125 10.495 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -15.934 -24.788 10.308 1.00 0.00 H new ATOM 1693 N VAL A 112 -17.031 -18.113 8.264 1.00 0.00 N ATOM 1694 CA VAL A 112 -17.359 -17.232 9.379 1.00 0.00 C ATOM 1695 C VAL A 112 -18.537 -16.328 9.037 1.00 0.00 C ATOM 1696 O VAL A 112 -18.447 -15.484 8.146 1.00 0.00 O ATOM 1697 CB VAL A 112 -16.154 -16.359 9.777 1.00 0.00 C ATOM 1698 CG1 VAL A 112 -16.525 -15.426 10.919 1.00 0.00 C ATOM 1699 CG2 VAL A 112 -14.966 -17.231 10.154 1.00 0.00 C ATOM 0 H VAL A 112 -16.995 -17.648 7.357 1.00 0.00 H new ATOM 0 HA VAL A 112 -17.628 -17.872 10.220 1.00 0.00 H new ATOM 0 HB VAL A 112 -15.870 -15.749 8.919 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -15.661 -14.817 11.187 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -17.344 -14.777 10.608 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -16.836 -16.014 11.783 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -14.124 -16.598 10.432 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -15.235 -17.868 10.997 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -14.687 -17.853 9.304 1.00 0.00 H new ATOM 1709 N SER A 113 -19.643 -16.510 9.752 1.00 0.00 N ATOM 1710 CA SER A 113 -20.842 -15.712 9.523 1.00 0.00 C ATOM 1711 C SER A 113 -21.071 -14.734 10.671 1.00 0.00 C ATOM 1712 O SER A 113 -22.197 -14.556 11.134 1.00 0.00 O ATOM 1713 CB SER A 113 -22.061 -16.621 9.360 1.00 0.00 C ATOM 1714 OG SER A 113 -22.174 -17.522 10.448 1.00 0.00 O ATOM 0 H SER A 113 -19.733 -17.203 10.495 1.00 0.00 H new ATOM 0 HA SER A 113 -20.699 -15.140 8.606 1.00 0.00 H new ATOM 0 HB2 SER A 113 -22.964 -16.015 9.291 1.00 0.00 H new ATOM 0 HB3 SER A 113 -21.980 -17.180 8.428 1.00 0.00 H new ATOM 0 HG SER A 113 -22.962 -18.091 10.321 1.00 0.00 H new ATOM 1720 N GLY A 114 -19.994 -14.102 11.127 1.00 0.00 N ATOM 1721 CA GLY A 114 -20.098 -13.150 12.217 1.00 0.00 C ATOM 1722 C GLY A 114 -20.761 -13.744 13.444 1.00 0.00 C ATOM 1723 O GLY A 114 -20.789 -14.960 13.633 1.00 0.00 O ATOM 0 H GLY A 114 -19.051 -14.232 10.761 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -19.102 -12.795 12.482 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -20.667 -12.282 11.884 1.00 0.00 H new ATOM 1727 N PRO A 115 -21.308 -12.874 14.306 1.00 0.00 N ATOM 1728 CA PRO A 115 -21.982 -13.296 15.537 1.00 0.00 C ATOM 1729 C PRO A 115 -23.304 -14.004 15.260 1.00 0.00 C ATOM 1730 O PRO A 115 -23.694 -14.183 14.106 1.00 0.00 O ATOM 1731 CB PRO A 115 -22.225 -11.980 16.278 1.00 0.00 C ATOM 1732 CG PRO A 115 -22.266 -10.944 15.208 1.00 0.00 C ATOM 1733 CD PRO A 115 -21.311 -11.410 14.144 1.00 0.00 C ATOM 0 HA PRO A 115 -21.388 -14.015 16.101 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -23.160 -12.008 16.838 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -21.430 -11.777 16.995 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -23.274 -10.836 14.808 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -21.972 -9.969 15.597 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -21.644 -11.117 13.149 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -20.316 -10.988 14.284 1.00 0.00 H new ATOM 1741 N SER A 116 -23.990 -14.404 16.326 1.00 0.00 N ATOM 1742 CA SER A 116 -25.268 -15.095 16.197 1.00 0.00 C ATOM 1743 C SER A 116 -26.247 -14.633 17.272 1.00 0.00 C ATOM 1744 O SER A 116 -26.093 -14.960 18.449 1.00 0.00 O ATOM 1745 CB SER A 116 -25.065 -16.609 16.293 1.00 0.00 C ATOM 1746 OG SER A 116 -26.304 -17.294 16.242 1.00 0.00 O ATOM 0 H SER A 116 -23.683 -14.262 17.288 1.00 0.00 H new ATOM 0 HA SER A 116 -25.687 -14.852 15.220 1.00 0.00 H new ATOM 0 HB2 SER A 116 -24.426 -16.946 15.477 1.00 0.00 H new ATOM 0 HB3 SER A 116 -24.550 -16.852 17.222 1.00 0.00 H new ATOM 0 HG SER A 116 -26.147 -18.259 16.304 1.00 0.00 H new ATOM 1752 N SER A 117 -27.253 -13.870 16.858 1.00 0.00 N ATOM 1753 CA SER A 117 -28.256 -13.359 17.786 1.00 0.00 C ATOM 1754 C SER A 117 -29.086 -14.497 18.370 1.00 0.00 C ATOM 1755 O SER A 117 -29.497 -15.411 17.656 1.00 0.00 O ATOM 1756 CB SER A 117 -29.171 -12.356 17.079 1.00 0.00 C ATOM 1757 OG SER A 117 -30.110 -11.799 17.982 1.00 0.00 O ATOM 0 H SER A 117 -27.396 -13.592 15.887 1.00 0.00 H new ATOM 0 HA SER A 117 -27.737 -12.855 18.602 1.00 0.00 H new ATOM 0 HB2 SER A 117 -28.571 -11.561 16.637 1.00 0.00 H new ATOM 0 HB3 SER A 117 -29.696 -12.851 16.262 1.00 0.00 H new ATOM 0 HG SER A 117 -30.682 -11.160 17.507 1.00 0.00 H new ATOM 1763 N GLY A 118 -29.329 -14.434 19.676 1.00 0.00 N ATOM 1764 CA GLY A 118 -30.109 -15.465 20.336 1.00 0.00 C ATOM 1765 C GLY A 118 -30.538 -15.063 21.733 1.00 0.00 C ATOM 1766 O GLY A 118 -31.581 -15.500 22.219 1.00 0.00 O ATOM 0 H GLY A 118 -29.000 -13.688 20.288 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -30.993 -15.687 19.738 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -29.522 -16.382 20.389 1.00 0.00 H new TER 1770 GLY A 118