USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 687 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 35 SER OG : rot 17:sc= 0.848 USER MOD Set 1.2: A 58 GLN : amide:sc= -0.278 K(o=0.57,f=-2.1!) USER MOD Set 2.1: A 8 SER OG : rot 59:sc= 0.123 USER MOD Set 2.2: A 10 THR OG1 : rot 180:sc= 0.0144 USER MOD Single : A 1 GLY N :NH3+ -110:sc= 0.0411 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.00188 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.107 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= 1.68 K(o=1.7,f=-1.2) USER MOD Single : A 24 SER OG : rot 69:sc= 0.399 USER MOD Single : A 28 SER OG : rot 67:sc= 1.26 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= -0.274 K(o=-0.27,f=-1.1) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot -2:sc= 0.408 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= 1.16 K(o=1.2,f=-0.0084) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.286 -8.099 -14.915 1.00 0.00 N ATOM 2 CA GLY A 1 7.020 -7.985 -13.632 1.00 0.00 C ATOM 3 C GLY A 1 6.832 -6.618 -12.983 1.00 0.00 C ATOM 4 O GLY A 1 6.574 -5.626 -13.669 1.00 0.00 O ATOM 0 H1 GLY A 1 5.487 -8.755 -14.801 1.00 0.00 H new ATOM 0 H2 GLY A 1 5.928 -7.163 -15.195 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.927 -8.459 -15.651 1.00 0.00 H new ATOM 0 HA2 GLY A 1 6.676 -8.761 -12.948 1.00 0.00 H new ATOM 0 HA3 GLY A 1 8.082 -8.161 -13.805 1.00 0.00 H new ATOM 10 N SER A 2 6.963 -6.550 -11.655 1.00 0.00 N ATOM 11 CA SER A 2 6.793 -5.323 -10.850 1.00 0.00 C ATOM 12 C SER A 2 8.006 -4.379 -10.920 1.00 0.00 C ATOM 13 O SER A 2 9.098 -4.769 -11.347 1.00 0.00 O ATOM 14 CB SER A 2 6.517 -5.700 -9.386 1.00 0.00 C ATOM 15 OG SER A 2 5.410 -6.585 -9.294 1.00 0.00 O ATOM 0 H SER A 2 7.197 -7.366 -11.089 1.00 0.00 H new ATOM 0 HA SER A 2 5.947 -4.782 -11.274 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.401 -6.169 -8.954 1.00 0.00 H new ATOM 0 HB3 SER A 2 6.318 -4.799 -8.805 1.00 0.00 H new ATOM 0 HG SER A 2 5.252 -6.814 -8.354 1.00 0.00 H new ATOM 21 N GLU A 3 7.829 -3.130 -10.478 1.00 0.00 N ATOM 22 CA GLU A 3 8.891 -2.110 -10.398 1.00 0.00 C ATOM 23 C GLU A 3 9.938 -2.388 -9.293 1.00 0.00 C ATOM 24 O GLU A 3 9.795 -3.312 -8.484 1.00 0.00 O ATOM 25 CB GLU A 3 8.273 -0.699 -10.284 1.00 0.00 C ATOM 26 CG GLU A 3 7.501 -0.388 -8.990 1.00 0.00 C ATOM 27 CD GLU A 3 6.065 -0.946 -9.007 1.00 0.00 C ATOM 28 OE1 GLU A 3 5.867 -2.113 -8.590 1.00 0.00 O ATOM 29 OE2 GLU A 3 5.133 -0.226 -9.440 1.00 0.00 O ATOM 0 H GLU A 3 6.923 -2.787 -10.157 1.00 0.00 H new ATOM 0 HA GLU A 3 9.454 -2.164 -11.330 1.00 0.00 H new ATOM 0 HB2 GLU A 3 9.074 0.033 -10.387 1.00 0.00 H new ATOM 0 HB3 GLU A 3 7.598 -0.554 -11.127 1.00 0.00 H new ATOM 0 HG2 GLU A 3 8.040 -0.808 -8.140 1.00 0.00 H new ATOM 0 HG3 GLU A 3 7.465 0.691 -8.843 1.00 0.00 H new ATOM 36 N THR A 4 11.005 -1.584 -9.243 1.00 0.00 N ATOM 37 CA THR A 4 12.138 -1.761 -8.312 1.00 0.00 C ATOM 38 C THR A 4 11.757 -1.575 -6.833 1.00 0.00 C ATOM 39 O THR A 4 10.832 -0.832 -6.498 1.00 0.00 O ATOM 40 CB THR A 4 13.313 -0.829 -8.683 1.00 0.00 C ATOM 41 OG1 THR A 4 12.875 0.497 -8.920 1.00 0.00 O ATOM 42 CG2 THR A 4 14.011 -1.303 -9.958 1.00 0.00 C ATOM 0 H THR A 4 11.113 -0.776 -9.857 1.00 0.00 H new ATOM 0 HA THR A 4 12.451 -2.799 -8.424 1.00 0.00 H new ATOM 0 HB THR A 4 13.997 -0.854 -7.834 1.00 0.00 H new ATOM 0 HG1 THR A 4 13.644 1.059 -9.150 1.00 0.00 H new ATOM 0 HG21 THR A 4 14.834 -0.628 -10.195 1.00 0.00 H new ATOM 0 HG22 THR A 4 14.400 -2.310 -9.807 1.00 0.00 H new ATOM 0 HG23 THR A 4 13.298 -1.309 -10.782 1.00 0.00 H new ATOM 50 N ARG A 5 12.509 -2.248 -5.944 1.00 0.00 N ATOM 51 CA ARG A 5 12.366 -2.181 -4.468 1.00 0.00 C ATOM 52 C ARG A 5 13.578 -1.553 -3.757 1.00 0.00 C ATOM 53 O ARG A 5 13.422 -0.983 -2.675 1.00 0.00 O ATOM 54 CB ARG A 5 12.047 -3.585 -3.902 1.00 0.00 C ATOM 55 CG ARG A 5 10.543 -3.860 -3.715 1.00 0.00 C ATOM 56 CD ARG A 5 9.750 -3.961 -5.023 1.00 0.00 C ATOM 57 NE ARG A 5 8.300 -4.082 -4.763 1.00 0.00 N ATOM 58 CZ ARG A 5 7.326 -3.721 -5.582 1.00 0.00 C ATOM 59 NH1 ARG A 5 7.558 -3.339 -6.800 1.00 0.00 N ATOM 60 NH2 ARG A 5 6.083 -3.732 -5.195 1.00 0.00 N ATOM 0 H ARG A 5 13.258 -2.875 -6.236 1.00 0.00 H new ATOM 0 HA ARG A 5 11.532 -1.510 -4.263 1.00 0.00 H new ATOM 0 HB2 ARG A 5 12.463 -4.338 -4.571 1.00 0.00 H new ATOM 0 HB3 ARG A 5 12.549 -3.701 -2.941 1.00 0.00 H new ATOM 0 HG2 ARG A 5 10.423 -4.790 -3.159 1.00 0.00 H new ATOM 0 HG3 ARG A 5 10.114 -3.065 -3.105 1.00 0.00 H new ATOM 0 HD2 ARG A 5 9.940 -3.079 -5.635 1.00 0.00 H new ATOM 0 HD3 ARG A 5 10.093 -4.824 -5.593 1.00 0.00 H new ATOM 0 HE ARG A 5 8.024 -4.482 -3.866 1.00 0.00 H new ATOM 0 HH11 ARG A 5 8.515 -3.311 -7.152 1.00 0.00 H new ATOM 0 HH12 ARG A 5 6.783 -3.067 -7.405 1.00 0.00 H new ATOM 0 HH21 ARG A 5 5.847 -4.022 -4.246 1.00 0.00 H new ATOM 0 HH22 ARG A 5 5.345 -3.450 -5.841 1.00 0.00 H new ATOM 74 N THR A 6 14.765 -1.627 -4.365 1.00 0.00 N ATOM 75 CA THR A 6 16.015 -1.004 -3.880 1.00 0.00 C ATOM 76 C THR A 6 16.248 0.393 -4.494 1.00 0.00 C ATOM 77 O THR A 6 15.413 0.904 -5.246 1.00 0.00 O ATOM 78 CB THR A 6 17.194 -1.979 -4.080 1.00 0.00 C ATOM 79 OG1 THR A 6 18.307 -1.564 -3.318 1.00 0.00 O ATOM 80 CG2 THR A 6 17.647 -2.131 -5.534 1.00 0.00 C ATOM 0 H THR A 6 14.894 -2.138 -5.238 1.00 0.00 H new ATOM 0 HA THR A 6 15.928 -0.818 -2.809 1.00 0.00 H new ATOM 0 HB THR A 6 16.818 -2.948 -3.751 1.00 0.00 H new ATOM 0 HG1 THR A 6 19.048 -2.192 -3.452 1.00 0.00 H new ATOM 0 HG21 THR A 6 18.479 -2.834 -5.584 1.00 0.00 H new ATOM 0 HG22 THR A 6 16.819 -2.505 -6.136 1.00 0.00 H new ATOM 0 HG23 THR A 6 17.966 -1.162 -5.919 1.00 0.00 H new ATOM 88 N ILE A 7 17.388 1.012 -4.173 1.00 0.00 N ATOM 89 CA ILE A 7 17.874 2.290 -4.697 1.00 0.00 C ATOM 90 C ILE A 7 19.069 2.024 -5.634 1.00 0.00 C ATOM 91 O ILE A 7 19.905 1.166 -5.335 1.00 0.00 O ATOM 92 CB ILE A 7 18.277 3.229 -3.533 1.00 0.00 C ATOM 93 CG1 ILE A 7 17.208 3.360 -2.420 1.00 0.00 C ATOM 94 CG2 ILE A 7 18.572 4.641 -4.081 1.00 0.00 C ATOM 95 CD1 ILE A 7 17.183 2.249 -1.357 1.00 0.00 C ATOM 0 H ILE A 7 18.036 0.607 -3.497 1.00 0.00 H new ATOM 0 HA ILE A 7 17.083 2.784 -5.261 1.00 0.00 H new ATOM 0 HB ILE A 7 19.158 2.772 -3.083 1.00 0.00 H new ATOM 0 HG12 ILE A 7 17.358 4.313 -1.913 1.00 0.00 H new ATOM 0 HG13 ILE A 7 16.227 3.402 -2.893 1.00 0.00 H new ATOM 0 HG21 ILE A 7 18.855 5.298 -3.259 1.00 0.00 H new ATOM 0 HG22 ILE A 7 19.388 4.588 -4.801 1.00 0.00 H new ATOM 0 HG23 ILE A 7 17.681 5.035 -4.570 1.00 0.00 H new ATOM 0 HD11 ILE A 7 16.393 2.454 -0.635 1.00 0.00 H new ATOM 0 HD12 ILE A 7 16.995 1.289 -1.838 1.00 0.00 H new ATOM 0 HD13 ILE A 7 18.144 2.215 -0.843 1.00 0.00 H new ATOM 107 N SER A 8 19.173 2.757 -6.751 1.00 0.00 N ATOM 108 CA SER A 8 20.335 2.696 -7.660 1.00 0.00 C ATOM 109 C SER A 8 21.672 2.913 -6.923 1.00 0.00 C ATOM 110 O SER A 8 21.757 3.712 -5.986 1.00 0.00 O ATOM 111 CB SER A 8 20.179 3.730 -8.784 1.00 0.00 C ATOM 112 OG SER A 8 21.323 3.752 -9.623 1.00 0.00 O ATOM 0 H SER A 8 18.453 3.413 -7.054 1.00 0.00 H new ATOM 0 HA SER A 8 20.360 1.692 -8.084 1.00 0.00 H new ATOM 0 HB2 SER A 8 19.295 3.496 -9.377 1.00 0.00 H new ATOM 0 HB3 SER A 8 20.022 4.719 -8.353 1.00 0.00 H new ATOM 0 HG SER A 8 21.458 2.864 -10.015 1.00 0.00 H new ATOM 118 N SER A 9 22.728 2.235 -7.388 1.00 0.00 N ATOM 119 CA SER A 9 24.107 2.385 -6.887 1.00 0.00 C ATOM 120 C SER A 9 25.033 3.125 -7.860 1.00 0.00 C ATOM 121 O SER A 9 26.233 3.250 -7.617 1.00 0.00 O ATOM 122 CB SER A 9 24.714 1.027 -6.528 1.00 0.00 C ATOM 123 OG SER A 9 23.822 0.201 -5.792 1.00 0.00 O ATOM 0 H SER A 9 22.650 1.550 -8.140 1.00 0.00 H new ATOM 0 HA SER A 9 24.028 2.999 -5.990 1.00 0.00 H new ATOM 0 HB2 SER A 9 25.007 0.512 -7.443 1.00 0.00 H new ATOM 0 HB3 SER A 9 25.622 1.183 -5.945 1.00 0.00 H new ATOM 0 HG SER A 9 24.258 -0.653 -5.591 1.00 0.00 H new ATOM 129 N THR A 10 24.466 3.604 -8.969 1.00 0.00 N ATOM 130 CA THR A 10 25.165 4.308 -10.051 1.00 0.00 C ATOM 131 C THR A 10 24.599 5.708 -10.229 1.00 0.00 C ATOM 132 O THR A 10 25.219 6.669 -9.787 1.00 0.00 O ATOM 133 CB THR A 10 25.133 3.503 -11.364 1.00 0.00 C ATOM 134 OG1 THR A 10 23.812 3.108 -11.678 1.00 0.00 O ATOM 135 CG2 THR A 10 25.958 2.226 -11.249 1.00 0.00 C ATOM 0 H THR A 10 23.466 3.509 -9.147 1.00 0.00 H new ATOM 0 HA THR A 10 26.214 4.406 -9.771 1.00 0.00 H new ATOM 0 HB THR A 10 25.541 4.154 -12.137 1.00 0.00 H new ATOM 0 HG1 THR A 10 23.813 2.600 -12.516 1.00 0.00 H new ATOM 0 HG21 THR A 10 25.916 1.680 -12.191 1.00 0.00 H new ATOM 0 HG22 THR A 10 26.993 2.481 -11.023 1.00 0.00 H new ATOM 0 HG23 THR A 10 25.555 1.603 -10.450 1.00 0.00 H new ATOM 143 N ALA A 11 23.395 5.842 -10.787 1.00 0.00 N ATOM 144 CA ALA A 11 22.821 7.130 -11.186 1.00 0.00 C ATOM 145 C ALA A 11 22.419 7.994 -9.980 1.00 0.00 C ATOM 146 O ALA A 11 22.624 9.206 -9.991 1.00 0.00 O ATOM 147 CB ALA A 11 21.629 6.854 -12.112 1.00 0.00 C ATOM 0 H ALA A 11 22.782 5.049 -10.977 1.00 0.00 H new ATOM 0 HA ALA A 11 23.577 7.710 -11.716 1.00 0.00 H new ATOM 0 HB1 ALA A 11 21.184 7.799 -12.423 1.00 0.00 H new ATOM 0 HB2 ALA A 11 21.970 6.307 -12.991 1.00 0.00 H new ATOM 0 HB3 ALA A 11 20.885 6.260 -11.581 1.00 0.00 H new ATOM 153 N GLN A 12 21.908 7.361 -8.915 1.00 0.00 N ATOM 154 CA GLN A 12 21.573 8.036 -7.651 1.00 0.00 C ATOM 155 C GLN A 12 22.794 8.142 -6.709 1.00 0.00 C ATOM 156 O GLN A 12 22.814 8.990 -5.818 1.00 0.00 O ATOM 157 CB GLN A 12 20.345 7.335 -7.039 1.00 0.00 C ATOM 158 CG GLN A 12 19.742 7.961 -5.766 1.00 0.00 C ATOM 159 CD GLN A 12 19.436 9.456 -5.851 1.00 0.00 C ATOM 160 OE1 GLN A 12 18.361 9.895 -6.239 1.00 0.00 O ATOM 161 NE2 GLN A 12 20.368 10.292 -5.461 1.00 0.00 N ATOM 0 H GLN A 12 21.714 6.360 -8.905 1.00 0.00 H new ATOM 0 HA GLN A 12 21.302 9.076 -7.833 1.00 0.00 H new ATOM 0 HB2 GLN A 12 19.565 7.295 -7.799 1.00 0.00 H new ATOM 0 HB3 GLN A 12 20.621 6.305 -6.812 1.00 0.00 H new ATOM 0 HG2 GLN A 12 18.820 7.432 -5.523 1.00 0.00 H new ATOM 0 HG3 GLN A 12 20.432 7.795 -4.939 1.00 0.00 H new ATOM 0 HE21 GLN A 12 21.267 9.938 -5.136 1.00 0.00 H new ATOM 0 HE22 GLN A 12 20.193 11.297 -5.483 1.00 0.00 H new ATOM 170 N GLU A 13 23.848 7.347 -6.924 1.00 0.00 N ATOM 171 CA GLU A 13 25.104 7.449 -6.161 1.00 0.00 C ATOM 172 C GLU A 13 26.011 8.578 -6.688 1.00 0.00 C ATOM 173 O GLU A 13 26.462 9.421 -5.917 1.00 0.00 O ATOM 174 CB GLU A 13 25.790 6.072 -6.174 1.00 0.00 C ATOM 175 CG GLU A 13 27.038 5.967 -5.289 1.00 0.00 C ATOM 176 CD GLU A 13 26.671 5.902 -3.793 1.00 0.00 C ATOM 177 OE1 GLU A 13 26.454 4.782 -3.270 1.00 0.00 O ATOM 178 OE2 GLU A 13 26.599 6.964 -3.130 1.00 0.00 O ATOM 0 H GLU A 13 23.858 6.613 -7.632 1.00 0.00 H new ATOM 0 HA GLU A 13 24.888 7.724 -5.129 1.00 0.00 H new ATOM 0 HB2 GLU A 13 25.070 5.320 -5.853 1.00 0.00 H new ATOM 0 HB3 GLU A 13 26.068 5.830 -7.200 1.00 0.00 H new ATOM 0 HG2 GLU A 13 27.605 5.078 -5.564 1.00 0.00 H new ATOM 0 HG3 GLU A 13 27.685 6.826 -5.468 1.00 0.00 H new ATOM 185 N ARG A 14 26.248 8.653 -8.007 1.00 0.00 N ATOM 186 CA ARG A 14 27.204 9.621 -8.587 1.00 0.00 C ATOM 187 C ARG A 14 26.803 11.075 -8.332 1.00 0.00 C ATOM 188 O ARG A 14 27.667 11.876 -7.985 1.00 0.00 O ATOM 189 CB ARG A 14 27.522 9.348 -10.070 1.00 0.00 C ATOM 190 CG ARG A 14 26.342 9.407 -11.060 1.00 0.00 C ATOM 191 CD ARG A 14 26.700 10.137 -12.359 1.00 0.00 C ATOM 192 NE ARG A 14 26.482 11.585 -12.223 1.00 0.00 N ATOM 193 CZ ARG A 14 25.466 12.289 -12.680 1.00 0.00 C ATOM 194 NH1 ARG A 14 24.440 11.775 -13.293 1.00 0.00 N ATOM 195 NH2 ARG A 14 25.426 13.558 -12.480 1.00 0.00 N ATOM 0 H ARG A 14 25.792 8.056 -8.696 1.00 0.00 H new ATOM 0 HA ARG A 14 28.139 9.463 -8.050 1.00 0.00 H new ATOM 0 HB2 ARG A 14 28.273 10.069 -10.394 1.00 0.00 H new ATOM 0 HB3 ARG A 14 27.977 8.360 -10.143 1.00 0.00 H new ATOM 0 HG2 ARG A 14 26.018 8.393 -11.295 1.00 0.00 H new ATOM 0 HG3 ARG A 14 25.499 9.909 -10.586 1.00 0.00 H new ATOM 0 HD2 ARG A 14 27.742 9.944 -12.614 1.00 0.00 H new ATOM 0 HD3 ARG A 14 26.094 9.749 -13.178 1.00 0.00 H new ATOM 0 HE ARG A 14 27.200 12.104 -11.717 1.00 0.00 H new ATOM 0 HH11 ARG A 14 24.389 10.768 -13.445 1.00 0.00 H new ATOM 0 HH12 ARG A 14 23.687 12.379 -13.622 1.00 0.00 H new ATOM 0 HH21 ARG A 14 26.179 14.018 -11.969 1.00 0.00 H new ATOM 0 HH22 ARG A 14 24.641 14.105 -12.833 1.00 0.00 H new ATOM 209 N VAL A 15 25.495 11.374 -8.366 1.00 0.00 N ATOM 210 CA VAL A 15 24.955 12.706 -8.022 1.00 0.00 C ATOM 211 C VAL A 15 25.271 13.122 -6.580 1.00 0.00 C ATOM 212 O VAL A 15 25.343 14.315 -6.296 1.00 0.00 O ATOM 213 CB VAL A 15 23.446 12.852 -8.300 1.00 0.00 C ATOM 214 CG1 VAL A 15 23.144 12.768 -9.799 1.00 0.00 C ATOM 215 CG2 VAL A 15 22.586 11.825 -7.560 1.00 0.00 C ATOM 0 H VAL A 15 24.778 10.700 -8.633 1.00 0.00 H new ATOM 0 HA VAL A 15 25.475 13.389 -8.694 1.00 0.00 H new ATOM 0 HB VAL A 15 23.182 13.839 -7.921 1.00 0.00 H new ATOM 0 HG11 VAL A 15 22.071 12.875 -9.961 1.00 0.00 H new ATOM 0 HG12 VAL A 15 23.671 13.566 -10.322 1.00 0.00 H new ATOM 0 HG13 VAL A 15 23.475 11.803 -10.183 1.00 0.00 H new ATOM 0 HG21 VAL A 15 21.536 11.987 -7.803 1.00 0.00 H new ATOM 0 HG22 VAL A 15 22.877 10.820 -7.864 1.00 0.00 H new ATOM 0 HG23 VAL A 15 22.731 11.935 -6.485 1.00 0.00 H new ATOM 225 N ASP A 16 25.509 12.175 -5.667 1.00 0.00 N ATOM 226 CA ASP A 16 25.906 12.494 -4.287 1.00 0.00 C ATOM 227 C ASP A 16 27.346 13.045 -4.229 1.00 0.00 C ATOM 228 O ASP A 16 27.631 14.004 -3.512 1.00 0.00 O ATOM 229 CB ASP A 16 25.756 11.234 -3.423 1.00 0.00 C ATOM 230 CG ASP A 16 25.841 11.530 -1.920 1.00 0.00 C ATOM 231 OD1 ASP A 16 26.959 11.499 -1.351 1.00 0.00 O ATOM 232 OD2 ASP A 16 24.771 11.736 -1.296 1.00 0.00 O ATOM 0 H ASP A 16 25.434 11.176 -5.858 1.00 0.00 H new ATOM 0 HA ASP A 16 25.255 13.277 -3.898 1.00 0.00 H new ATOM 0 HB2 ASP A 16 24.799 10.761 -3.642 1.00 0.00 H new ATOM 0 HB3 ASP A 16 26.534 10.520 -3.692 1.00 0.00 H new ATOM 237 N LEU A 17 28.252 12.488 -5.042 1.00 0.00 N ATOM 238 CA LEU A 17 29.685 12.793 -5.004 1.00 0.00 C ATOM 239 C LEU A 17 29.981 14.197 -5.546 1.00 0.00 C ATOM 240 O LEU A 17 30.728 14.966 -4.945 1.00 0.00 O ATOM 241 CB LEU A 17 30.449 11.706 -5.759 1.00 0.00 C ATOM 242 CG LEU A 17 30.250 10.280 -5.204 1.00 0.00 C ATOM 243 CD1 LEU A 17 31.420 9.448 -5.697 1.00 0.00 C ATOM 244 CD2 LEU A 17 30.241 10.160 -3.675 1.00 0.00 C ATOM 0 H LEU A 17 28.005 11.802 -5.755 1.00 0.00 H new ATOM 0 HA LEU A 17 30.023 12.798 -3.968 1.00 0.00 H new ATOM 0 HB2 LEU A 17 30.140 11.722 -6.804 1.00 0.00 H new ATOM 0 HB3 LEU A 17 31.512 11.945 -5.737 1.00 0.00 H new ATOM 0 HG LEU A 17 29.268 9.953 -5.547 1.00 0.00 H new ATOM 0 HD11 LEU A 17 31.322 8.427 -5.328 1.00 0.00 H new ATOM 0 HD12 LEU A 17 31.427 9.440 -6.787 1.00 0.00 H new ATOM 0 HD13 LEU A 17 32.352 9.878 -5.331 1.00 0.00 H new ATOM 0 HD21 LEU A 17 30.095 9.117 -3.393 1.00 0.00 H new ATOM 0 HD22 LEU A 17 31.192 10.514 -3.277 1.00 0.00 H new ATOM 0 HD23 LEU A 17 29.430 10.763 -3.267 1.00 0.00 H new ATOM 256 N GLU A 18 29.317 14.563 -6.640 1.00 0.00 N ATOM 257 CA GLU A 18 29.305 15.930 -7.177 1.00 0.00 C ATOM 258 C GLU A 18 28.597 16.924 -6.241 1.00 0.00 C ATOM 259 O GLU A 18 29.051 18.059 -6.118 1.00 0.00 O ATOM 260 CB GLU A 18 28.725 15.957 -8.600 1.00 0.00 C ATOM 261 CG GLU A 18 27.386 15.237 -8.761 1.00 0.00 C ATOM 262 CD GLU A 18 27.251 14.752 -10.217 1.00 0.00 C ATOM 263 OE1 GLU A 18 26.897 15.555 -11.104 1.00 0.00 O ATOM 264 OE2 GLU A 18 27.485 13.558 -10.512 1.00 0.00 O ATOM 0 H GLU A 18 28.761 13.909 -7.191 1.00 0.00 H new ATOM 0 HA GLU A 18 30.341 16.263 -7.237 1.00 0.00 H new ATOM 0 HB2 GLU A 18 28.602 16.996 -8.907 1.00 0.00 H new ATOM 0 HB3 GLU A 18 29.448 15.507 -9.280 1.00 0.00 H new ATOM 0 HG2 GLU A 18 27.328 14.392 -8.075 1.00 0.00 H new ATOM 0 HG3 GLU A 18 26.565 15.908 -8.510 1.00 0.00 H new ATOM 271 N ALA A 19 27.569 16.513 -5.489 1.00 0.00 N ATOM 272 CA ALA A 19 26.987 17.358 -4.442 1.00 0.00 C ATOM 273 C ALA A 19 27.983 17.639 -3.294 1.00 0.00 C ATOM 274 O ALA A 19 28.067 18.772 -2.822 1.00 0.00 O ATOM 275 CB ALA A 19 25.677 16.720 -3.972 1.00 0.00 C ATOM 0 H ALA A 19 27.124 15.600 -5.587 1.00 0.00 H new ATOM 0 HA ALA A 19 26.761 18.343 -4.850 1.00 0.00 H new ATOM 0 HB1 ALA A 19 25.231 17.337 -3.192 1.00 0.00 H new ATOM 0 HB2 ALA A 19 24.988 16.643 -4.813 1.00 0.00 H new ATOM 0 HB3 ALA A 19 25.879 15.725 -3.576 1.00 0.00 H new ATOM 281 N VAL A 20 28.812 16.660 -2.902 1.00 0.00 N ATOM 282 CA VAL A 20 29.922 16.840 -1.935 1.00 0.00 C ATOM 283 C VAL A 20 31.059 17.688 -2.525 1.00 0.00 C ATOM 284 O VAL A 20 31.624 18.543 -1.836 1.00 0.00 O ATOM 285 CB VAL A 20 30.425 15.472 -1.416 1.00 0.00 C ATOM 286 CG1 VAL A 20 31.678 15.590 -0.536 1.00 0.00 C ATOM 287 CG2 VAL A 20 29.348 14.791 -0.562 1.00 0.00 C ATOM 0 H VAL A 20 28.735 15.704 -3.249 1.00 0.00 H new ATOM 0 HA VAL A 20 29.535 17.394 -1.080 1.00 0.00 H new ATOM 0 HB VAL A 20 30.662 14.892 -2.308 1.00 0.00 H new ATOM 0 HG11 VAL A 20 31.983 14.598 -0.202 1.00 0.00 H new ATOM 0 HG12 VAL A 20 32.485 16.043 -1.111 1.00 0.00 H new ATOM 0 HG13 VAL A 20 31.456 16.212 0.331 1.00 0.00 H new ATOM 0 HG21 VAL A 20 29.720 13.830 -0.206 1.00 0.00 H new ATOM 0 HG22 VAL A 20 29.105 15.425 0.291 1.00 0.00 H new ATOM 0 HG23 VAL A 20 28.453 14.633 -1.163 1.00 0.00 H new ATOM 297 N ARG A 21 31.355 17.549 -3.824 1.00 0.00 N ATOM 298 CA ARG A 21 32.286 18.444 -4.530 1.00 0.00 C ATOM 299 C ARG A 21 31.794 19.890 -4.494 1.00 0.00 C ATOM 300 O ARG A 21 32.562 20.760 -4.118 1.00 0.00 O ATOM 301 CB ARG A 21 32.529 17.916 -5.955 1.00 0.00 C ATOM 302 CG ARG A 21 33.585 18.698 -6.756 1.00 0.00 C ATOM 303 CD ARG A 21 34.939 18.885 -6.055 1.00 0.00 C ATOM 304 NE ARG A 21 35.538 17.600 -5.636 1.00 0.00 N ATOM 305 CZ ARG A 21 36.601 17.435 -4.868 1.00 0.00 C ATOM 306 NH1 ARG A 21 37.282 18.444 -4.402 1.00 0.00 N ATOM 307 NH2 ARG A 21 37.006 16.239 -4.550 1.00 0.00 N ATOM 0 H ARG A 21 30.959 16.817 -4.414 1.00 0.00 H new ATOM 0 HA ARG A 21 33.249 18.450 -4.019 1.00 0.00 H new ATOM 0 HB2 ARG A 21 32.838 16.872 -5.894 1.00 0.00 H new ATOM 0 HB3 ARG A 21 31.587 17.938 -6.502 1.00 0.00 H new ATOM 0 HG2 ARG A 21 33.753 18.184 -7.702 1.00 0.00 H new ATOM 0 HG3 ARG A 21 33.180 19.681 -6.995 1.00 0.00 H new ATOM 0 HD2 ARG A 21 35.625 19.401 -6.727 1.00 0.00 H new ATOM 0 HD3 ARG A 21 34.808 19.524 -5.182 1.00 0.00 H new ATOM 0 HE ARG A 21 35.083 16.752 -5.975 1.00 0.00 H new ATOM 0 HH11 ARG A 21 36.999 19.398 -4.627 1.00 0.00 H new ATOM 0 HH12 ARG A 21 38.098 18.280 -3.812 1.00 0.00 H new ATOM 0 HH21 ARG A 21 36.502 15.422 -4.894 1.00 0.00 H new ATOM 0 HH22 ARG A 21 37.827 16.120 -3.957 1.00 0.00 H new ATOM 321 N LEU A 22 30.513 20.157 -4.745 1.00 0.00 N ATOM 322 CA LEU A 22 29.915 21.491 -4.599 1.00 0.00 C ATOM 323 C LEU A 22 29.853 21.950 -3.147 1.00 0.00 C ATOM 324 O LEU A 22 30.096 23.122 -2.917 1.00 0.00 O ATOM 325 CB LEU A 22 28.553 21.589 -5.292 1.00 0.00 C ATOM 326 CG LEU A 22 28.695 22.020 -6.762 1.00 0.00 C ATOM 327 CD1 LEU A 22 29.167 20.906 -7.689 1.00 0.00 C ATOM 328 CD2 LEU A 22 27.346 22.518 -7.242 1.00 0.00 C ATOM 0 H LEU A 22 29.851 19.448 -5.059 1.00 0.00 H new ATOM 0 HA LEU A 22 30.583 22.184 -5.111 1.00 0.00 H new ATOM 0 HB2 LEU A 22 28.049 20.624 -5.242 1.00 0.00 H new ATOM 0 HB3 LEU A 22 27.925 22.305 -4.761 1.00 0.00 H new ATOM 0 HG LEU A 22 29.460 22.796 -6.797 1.00 0.00 H new ATOM 0 HD11 LEU A 22 29.242 21.287 -8.707 1.00 0.00 H new ATOM 0 HD12 LEU A 22 30.144 20.550 -7.362 1.00 0.00 H new ATOM 0 HD13 LEU A 22 28.453 20.083 -7.662 1.00 0.00 H new ATOM 0 HD21 LEU A 22 27.423 22.830 -8.284 1.00 0.00 H new ATOM 0 HD22 LEU A 22 26.611 21.718 -7.156 1.00 0.00 H new ATOM 0 HD23 LEU A 22 27.033 23.365 -6.632 1.00 0.00 H new ATOM 340 N ALA A 23 29.648 21.083 -2.159 1.00 0.00 N ATOM 341 CA ALA A 23 29.814 21.476 -0.755 1.00 0.00 C ATOM 342 C ALA A 23 31.243 22.003 -0.498 1.00 0.00 C ATOM 343 O ALA A 23 31.427 22.992 0.211 1.00 0.00 O ATOM 344 CB ALA A 23 29.429 20.283 0.121 1.00 0.00 C ATOM 0 H ALA A 23 29.369 20.112 -2.298 1.00 0.00 H new ATOM 0 HA ALA A 23 29.156 22.306 -0.499 1.00 0.00 H new ATOM 0 HB1 ALA A 23 29.544 20.551 1.171 1.00 0.00 H new ATOM 0 HB2 ALA A 23 28.392 20.010 -0.072 1.00 0.00 H new ATOM 0 HB3 ALA A 23 30.076 19.437 -0.111 1.00 0.00 H new ATOM 350 N SER A 24 32.235 21.430 -1.188 1.00 0.00 N ATOM 351 CA SER A 24 33.617 21.931 -1.218 1.00 0.00 C ATOM 352 C SER A 24 33.777 23.229 -2.038 1.00 0.00 C ATOM 353 O SER A 24 34.512 24.119 -1.599 1.00 0.00 O ATOM 354 CB SER A 24 34.593 20.844 -1.703 1.00 0.00 C ATOM 355 OG SER A 24 34.363 19.594 -1.061 1.00 0.00 O ATOM 0 H SER A 24 32.100 20.591 -1.752 1.00 0.00 H new ATOM 0 HA SER A 24 33.869 22.188 -0.189 1.00 0.00 H new ATOM 0 HB2 SER A 24 34.492 20.721 -2.781 1.00 0.00 H new ATOM 0 HB3 SER A 24 35.617 21.166 -1.513 1.00 0.00 H new ATOM 0 HG SER A 24 33.505 19.226 -1.360 1.00 0.00 H new ATOM 361 N ILE A 25 33.088 23.414 -3.183 1.00 0.00 N ATOM 362 CA ILE A 25 33.220 24.669 -3.948 1.00 0.00 C ATOM 363 C ILE A 25 32.504 25.830 -3.236 1.00 0.00 C ATOM 364 O ILE A 25 32.998 26.957 -3.217 1.00 0.00 O ATOM 365 CB ILE A 25 32.717 24.530 -5.400 1.00 0.00 C ATOM 366 CG1 ILE A 25 33.110 23.231 -6.137 1.00 0.00 C ATOM 367 CG2 ILE A 25 33.221 25.740 -6.201 1.00 0.00 C ATOM 368 CD1 ILE A 25 34.555 22.742 -6.013 1.00 0.00 C ATOM 0 H ILE A 25 32.451 22.729 -3.589 1.00 0.00 H new ATOM 0 HA ILE A 25 34.285 24.894 -3.996 1.00 0.00 H new ATOM 0 HB ILE A 25 31.630 24.486 -5.331 1.00 0.00 H new ATOM 0 HG12 ILE A 25 32.457 22.435 -5.781 1.00 0.00 H new ATOM 0 HG13 ILE A 25 32.895 23.370 -7.196 1.00 0.00 H new ATOM 0 HG21 ILE A 25 32.877 25.663 -7.232 1.00 0.00 H new ATOM 0 HG22 ILE A 25 32.834 26.657 -5.757 1.00 0.00 H new ATOM 0 HG23 ILE A 25 34.311 25.760 -6.183 1.00 0.00 H new ATOM 0 HD11 ILE A 25 34.678 21.821 -6.583 1.00 0.00 H new ATOM 0 HD12 ILE A 25 35.231 23.503 -6.402 1.00 0.00 H new ATOM 0 HD13 ILE A 25 34.786 22.553 -4.965 1.00 0.00 H new ATOM 380 N VAL A 26 31.373 25.549 -2.590 1.00 0.00 N ATOM 381 CA VAL A 26 30.616 26.504 -1.774 1.00 0.00 C ATOM 382 C VAL A 26 31.439 26.877 -0.544 1.00 0.00 C ATOM 383 O VAL A 26 31.646 28.062 -0.346 1.00 0.00 O ATOM 384 CB VAL A 26 29.246 25.933 -1.377 1.00 0.00 C ATOM 385 CG1 VAL A 26 28.481 26.892 -0.459 1.00 0.00 C ATOM 386 CG2 VAL A 26 28.358 25.673 -2.609 1.00 0.00 C ATOM 0 H VAL A 26 30.944 24.624 -2.619 1.00 0.00 H new ATOM 0 HA VAL A 26 30.427 27.403 -2.361 1.00 0.00 H new ATOM 0 HB VAL A 26 29.454 24.997 -0.859 1.00 0.00 H new ATOM 0 HG11 VAL A 26 27.517 26.455 -0.199 1.00 0.00 H new ATOM 0 HG12 VAL A 26 29.058 27.064 0.449 1.00 0.00 H new ATOM 0 HG13 VAL A 26 28.323 27.840 -0.974 1.00 0.00 H new ATOM 0 HG21 VAL A 26 27.398 25.270 -2.287 1.00 0.00 H new ATOM 0 HG22 VAL A 26 28.197 26.608 -3.145 1.00 0.00 H new ATOM 0 HG23 VAL A 26 28.850 24.957 -3.267 1.00 0.00 H new ATOM 396 N ASP A 27 32.015 25.935 0.211 1.00 0.00 N ATOM 397 CA ASP A 27 32.962 26.262 1.291 1.00 0.00 C ATOM 398 C ASP A 27 34.116 27.158 0.804 1.00 0.00 C ATOM 399 O ASP A 27 34.439 28.165 1.438 1.00 0.00 O ATOM 400 CB ASP A 27 33.526 24.974 1.899 1.00 0.00 C ATOM 401 CG ASP A 27 34.660 25.277 2.893 1.00 0.00 C ATOM 402 OD1 ASP A 27 34.395 25.910 3.942 1.00 0.00 O ATOM 403 OD2 ASP A 27 35.815 24.871 2.618 1.00 0.00 O ATOM 0 H ASP A 27 31.843 24.936 0.096 1.00 0.00 H new ATOM 0 HA ASP A 27 32.411 26.820 2.048 1.00 0.00 H new ATOM 0 HB2 ASP A 27 32.730 24.430 2.407 1.00 0.00 H new ATOM 0 HB3 ASP A 27 33.898 24.327 1.105 1.00 0.00 H new ATOM 408 N SER A 28 34.677 26.858 -0.374 1.00 0.00 N ATOM 409 CA SER A 28 35.727 27.680 -0.996 1.00 0.00 C ATOM 410 C SER A 28 35.251 29.117 -1.283 1.00 0.00 C ATOM 411 O SER A 28 36.022 30.065 -1.136 1.00 0.00 O ATOM 412 CB SER A 28 36.251 27.026 -2.284 1.00 0.00 C ATOM 413 OG SER A 28 36.717 25.705 -2.045 1.00 0.00 O ATOM 0 H SER A 28 34.417 26.039 -0.924 1.00 0.00 H new ATOM 0 HA SER A 28 36.543 27.742 -0.276 1.00 0.00 H new ATOM 0 HB2 SER A 28 35.457 27.003 -3.031 1.00 0.00 H new ATOM 0 HB3 SER A 28 37.060 27.629 -2.697 1.00 0.00 H new ATOM 0 HG SER A 28 35.961 25.130 -1.802 1.00 0.00 H new ATOM 419 N ARG A 29 33.963 29.303 -1.607 1.00 0.00 N ATOM 420 CA ARG A 29 33.295 30.610 -1.764 1.00 0.00 C ATOM 421 C ARG A 29 32.914 31.262 -0.428 1.00 0.00 C ATOM 422 O ARG A 29 33.036 32.479 -0.306 1.00 0.00 O ATOM 423 CB ARG A 29 32.074 30.401 -2.679 1.00 0.00 C ATOM 424 CG ARG A 29 31.339 31.685 -3.073 1.00 0.00 C ATOM 425 CD ARG A 29 32.134 32.629 -3.977 1.00 0.00 C ATOM 426 NE ARG A 29 31.256 33.706 -4.487 1.00 0.00 N ATOM 427 CZ ARG A 29 31.497 34.510 -5.507 1.00 0.00 C ATOM 428 NH1 ARG A 29 32.643 34.507 -6.128 1.00 0.00 N ATOM 429 NH2 ARG A 29 30.593 35.345 -5.926 1.00 0.00 N ATOM 0 H ARG A 29 33.331 28.520 -1.774 1.00 0.00 H new ATOM 0 HA ARG A 29 33.991 31.316 -2.217 1.00 0.00 H new ATOM 0 HB2 ARG A 29 32.401 29.893 -3.586 1.00 0.00 H new ATOM 0 HB3 ARG A 29 31.371 29.736 -2.177 1.00 0.00 H new ATOM 0 HG2 ARG A 29 30.412 31.415 -3.579 1.00 0.00 H new ATOM 0 HG3 ARG A 29 31.062 32.221 -2.165 1.00 0.00 H new ATOM 0 HD2 ARG A 29 32.967 33.061 -3.422 1.00 0.00 H new ATOM 0 HD3 ARG A 29 32.561 32.072 -4.811 1.00 0.00 H new ATOM 0 HE ARG A 29 30.371 33.842 -3.999 1.00 0.00 H new ATOM 0 HH11 ARG A 29 33.383 33.872 -5.829 1.00 0.00 H new ATOM 0 HH12 ARG A 29 32.800 35.140 -6.913 1.00 0.00 H new ATOM 0 HH21 ARG A 29 29.684 35.385 -5.466 1.00 0.00 H new ATOM 0 HH22 ARG A 29 30.793 35.960 -6.715 1.00 0.00 H new ATOM 443 N LEU A 30 32.523 30.497 0.594 1.00 0.00 N ATOM 444 CA LEU A 30 32.249 31.030 1.937 1.00 0.00 C ATOM 445 C LEU A 30 33.529 31.568 2.610 1.00 0.00 C ATOM 446 O LEU A 30 33.480 32.577 3.314 1.00 0.00 O ATOM 447 CB LEU A 30 31.534 29.981 2.814 1.00 0.00 C ATOM 448 CG LEU A 30 30.156 29.505 2.308 1.00 0.00 C ATOM 449 CD1 LEU A 30 29.509 28.503 3.272 1.00 0.00 C ATOM 450 CD2 LEU A 30 29.172 30.664 2.115 1.00 0.00 C ATOM 0 H LEU A 30 32.386 29.489 0.517 1.00 0.00 H new ATOM 0 HA LEU A 30 31.573 31.878 1.825 1.00 0.00 H new ATOM 0 HB2 LEU A 30 32.184 29.112 2.909 1.00 0.00 H new ATOM 0 HB3 LEU A 30 31.409 30.397 3.814 1.00 0.00 H new ATOM 0 HG LEU A 30 30.354 29.029 1.347 1.00 0.00 H new ATOM 0 HD11 LEU A 30 28.541 28.193 2.879 1.00 0.00 H new ATOM 0 HD12 LEU A 30 30.154 27.631 3.377 1.00 0.00 H new ATOM 0 HD13 LEU A 30 29.372 28.972 4.246 1.00 0.00 H new ATOM 0 HD21 LEU A 30 28.218 30.276 1.758 1.00 0.00 H new ATOM 0 HD22 LEU A 30 29.023 31.176 3.065 1.00 0.00 H new ATOM 0 HD23 LEU A 30 29.575 31.365 1.384 1.00 0.00 H new ATOM 462 N ILE A 31 34.683 30.959 2.320 1.00 0.00 N ATOM 463 CA ILE A 31 36.018 31.461 2.691 1.00 0.00 C ATOM 464 C ILE A 31 36.448 32.626 1.772 1.00 0.00 C ATOM 465 O ILE A 31 37.080 33.582 2.227 1.00 0.00 O ATOM 466 CB ILE A 31 37.024 30.281 2.659 1.00 0.00 C ATOM 467 CG1 ILE A 31 36.656 29.235 3.740 1.00 0.00 C ATOM 468 CG2 ILE A 31 38.476 30.755 2.865 1.00 0.00 C ATOM 469 CD1 ILE A 31 37.382 27.893 3.584 1.00 0.00 C ATOM 0 H ILE A 31 34.720 30.078 1.807 1.00 0.00 H new ATOM 0 HA ILE A 31 35.993 31.866 3.703 1.00 0.00 H new ATOM 0 HB ILE A 31 36.959 29.825 1.671 1.00 0.00 H new ATOM 0 HG12 ILE A 31 36.885 29.648 4.723 1.00 0.00 H new ATOM 0 HG13 ILE A 31 35.581 29.060 3.710 1.00 0.00 H new ATOM 0 HG21 ILE A 31 39.147 29.896 2.835 1.00 0.00 H new ATOM 0 HG22 ILE A 31 38.746 31.454 2.074 1.00 0.00 H new ATOM 0 HG23 ILE A 31 38.563 31.250 3.832 1.00 0.00 H new ATOM 0 HD11 ILE A 31 37.070 27.216 4.379 1.00 0.00 H new ATOM 0 HD12 ILE A 31 37.134 27.456 2.617 1.00 0.00 H new ATOM 0 HD13 ILE A 31 38.459 28.052 3.645 1.00 0.00 H new ATOM 481 N GLY A 32 36.085 32.571 0.483 1.00 0.00 N ATOM 482 CA GLY A 32 36.527 33.496 -0.566 1.00 0.00 C ATOM 483 C GLY A 32 35.888 34.880 -0.512 1.00 0.00 C ATOM 484 O GLY A 32 36.548 35.891 -0.763 1.00 0.00 O ATOM 0 H GLY A 32 35.452 31.853 0.131 1.00 0.00 H new ATOM 0 HA2 GLY A 32 37.609 33.608 -0.499 1.00 0.00 H new ATOM 0 HA3 GLY A 32 36.313 33.050 -1.537 1.00 0.00 H new ATOM 488 N THR A 33 34.596 34.919 -0.180 1.00 0.00 N ATOM 489 CA THR A 33 33.818 36.166 -0.019 1.00 0.00 C ATOM 490 C THR A 33 32.649 36.070 0.979 1.00 0.00 C ATOM 491 O THR A 33 32.312 37.066 1.623 1.00 0.00 O ATOM 492 CB THR A 33 33.333 36.647 -1.400 1.00 0.00 C ATOM 493 OG1 THR A 33 32.773 37.939 -1.328 1.00 0.00 O ATOM 494 CG2 THR A 33 32.294 35.716 -2.022 1.00 0.00 C ATOM 0 H THR A 33 34.046 34.077 -0.011 1.00 0.00 H new ATOM 0 HA THR A 33 34.494 36.899 0.422 1.00 0.00 H new ATOM 0 HB THR A 33 34.222 36.653 -2.030 1.00 0.00 H new ATOM 0 HG1 THR A 33 32.476 38.217 -2.220 1.00 0.00 H new ATOM 0 HG21 THR A 33 31.990 36.107 -2.993 1.00 0.00 H new ATOM 0 HG22 THR A 33 32.725 34.723 -2.149 1.00 0.00 H new ATOM 0 HG23 THR A 33 31.424 35.653 -1.368 1.00 0.00 H new ATOM 502 N GLY A 34 32.056 34.878 1.169 1.00 0.00 N ATOM 503 CA GLY A 34 31.016 34.641 2.188 1.00 0.00 C ATOM 504 C GLY A 34 29.582 34.501 1.686 1.00 0.00 C ATOM 505 O GLY A 34 28.645 34.438 2.482 1.00 0.00 O ATOM 0 H GLY A 34 32.284 34.050 0.619 1.00 0.00 H new ATOM 0 HA2 GLY A 34 31.275 33.734 2.734 1.00 0.00 H new ATOM 0 HA3 GLY A 34 31.047 35.463 2.903 1.00 0.00 H new ATOM 509 N SER A 35 29.371 34.426 0.374 1.00 0.00 N ATOM 510 CA SER A 35 28.081 34.115 -0.271 1.00 0.00 C ATOM 511 C SER A 35 28.313 33.567 -1.683 1.00 0.00 C ATOM 512 O SER A 35 29.256 33.979 -2.360 1.00 0.00 O ATOM 513 CB SER A 35 27.189 35.364 -0.350 1.00 0.00 C ATOM 514 OG SER A 35 26.734 35.729 0.942 1.00 0.00 O ATOM 0 H SER A 35 30.118 34.585 -0.302 1.00 0.00 H new ATOM 0 HA SER A 35 27.577 33.362 0.335 1.00 0.00 H new ATOM 0 HB2 SER A 35 27.747 36.189 -0.793 1.00 0.00 H new ATOM 0 HB3 SER A 35 26.337 35.169 -1.001 1.00 0.00 H new ATOM 0 HG SER A 35 27.284 35.285 1.620 1.00 0.00 H new ATOM 520 N VAL A 36 27.475 32.630 -2.128 1.00 0.00 N ATOM 521 CA VAL A 36 27.571 31.970 -3.448 1.00 0.00 C ATOM 522 C VAL A 36 26.392 32.370 -4.338 1.00 0.00 C ATOM 523 O VAL A 36 25.273 32.561 -3.858 1.00 0.00 O ATOM 524 CB VAL A 36 27.715 30.445 -3.282 1.00 0.00 C ATOM 525 CG1 VAL A 36 26.435 29.764 -2.801 1.00 0.00 C ATOM 526 CG2 VAL A 36 28.154 29.772 -4.584 1.00 0.00 C ATOM 0 H VAL A 36 26.688 32.294 -1.573 1.00 0.00 H new ATOM 0 HA VAL A 36 28.472 32.313 -3.957 1.00 0.00 H new ATOM 0 HB VAL A 36 28.481 30.321 -2.517 1.00 0.00 H new ATOM 0 HG11 VAL A 36 26.607 28.692 -2.706 1.00 0.00 H new ATOM 0 HG12 VAL A 36 26.147 30.173 -1.832 1.00 0.00 H new ATOM 0 HG13 VAL A 36 25.636 29.941 -3.521 1.00 0.00 H new ATOM 0 HG21 VAL A 36 28.244 28.697 -4.426 1.00 0.00 H new ATOM 0 HG22 VAL A 36 27.413 29.963 -5.360 1.00 0.00 H new ATOM 0 HG23 VAL A 36 29.118 30.175 -4.895 1.00 0.00 H new ATOM 536 N ASP A 37 26.642 32.508 -5.640 1.00 0.00 N ATOM 537 CA ASP A 37 25.692 33.022 -6.628 1.00 0.00 C ATOM 538 C ASP A 37 25.605 32.070 -7.830 1.00 0.00 C ATOM 539 O ASP A 37 26.523 31.286 -8.075 1.00 0.00 O ATOM 540 CB ASP A 37 26.126 34.429 -7.083 1.00 0.00 C ATOM 541 CG ASP A 37 26.614 35.333 -5.932 1.00 0.00 C ATOM 542 OD1 ASP A 37 27.833 35.323 -5.621 1.00 0.00 O ATOM 543 OD2 ASP A 37 25.780 36.072 -5.355 1.00 0.00 O ATOM 0 H ASP A 37 27.541 32.257 -6.050 1.00 0.00 H new ATOM 0 HA ASP A 37 24.704 33.088 -6.172 1.00 0.00 H new ATOM 0 HB2 ASP A 37 26.923 34.332 -7.820 1.00 0.00 H new ATOM 0 HB3 ASP A 37 25.287 34.914 -7.583 1.00 0.00 H new ATOM 548 N GLU A 38 24.523 32.155 -8.608 1.00 0.00 N ATOM 549 CA GLU A 38 24.243 31.238 -9.726 1.00 0.00 C ATOM 550 C GLU A 38 25.406 31.120 -10.730 1.00 0.00 C ATOM 551 O GLU A 38 25.738 30.025 -11.191 1.00 0.00 O ATOM 552 CB GLU A 38 22.975 31.735 -10.445 1.00 0.00 C ATOM 553 CG GLU A 38 22.235 30.600 -11.154 1.00 0.00 C ATOM 554 CD GLU A 38 21.204 31.128 -12.170 1.00 0.00 C ATOM 555 OE1 GLU A 38 20.349 31.974 -11.818 1.00 0.00 O ATOM 556 OE2 GLU A 38 21.304 30.740 -13.362 1.00 0.00 O ATOM 0 H GLU A 38 23.806 32.869 -8.481 1.00 0.00 H new ATOM 0 HA GLU A 38 24.103 30.239 -9.313 1.00 0.00 H new ATOM 0 HB2 GLU A 38 22.309 32.205 -9.722 1.00 0.00 H new ATOM 0 HB3 GLU A 38 23.247 32.500 -11.172 1.00 0.00 H new ATOM 0 HG2 GLU A 38 22.955 29.962 -11.667 1.00 0.00 H new ATOM 0 HG3 GLU A 38 21.730 29.979 -10.414 1.00 0.00 H new ATOM 563 N ASP A 39 26.084 32.236 -11.009 1.00 0.00 N ATOM 564 CA ASP A 39 27.228 32.300 -11.926 1.00 0.00 C ATOM 565 C ASP A 39 28.523 31.685 -11.372 1.00 0.00 C ATOM 566 O ASP A 39 29.421 31.380 -12.157 1.00 0.00 O ATOM 567 CB ASP A 39 27.460 33.745 -12.392 1.00 0.00 C ATOM 568 CG ASP A 39 26.188 34.387 -12.961 1.00 0.00 C ATOM 569 OD1 ASP A 39 25.680 33.880 -13.990 1.00 0.00 O ATOM 570 OD2 ASP A 39 25.691 35.385 -12.384 1.00 0.00 O ATOM 0 H ASP A 39 25.850 33.139 -10.596 1.00 0.00 H new ATOM 0 HA ASP A 39 26.960 31.678 -12.780 1.00 0.00 H new ATOM 0 HB2 ASP A 39 27.821 34.341 -11.554 1.00 0.00 H new ATOM 0 HB3 ASP A 39 28.241 33.758 -13.152 1.00 0.00 H new ATOM 575 N PHE A 40 28.622 31.446 -10.057 1.00 0.00 N ATOM 576 CA PHE A 40 29.736 30.696 -9.467 1.00 0.00 C ATOM 577 C PHE A 40 29.486 29.177 -9.454 1.00 0.00 C ATOM 578 O PHE A 40 30.443 28.413 -9.351 1.00 0.00 O ATOM 579 CB PHE A 40 30.026 31.248 -8.061 1.00 0.00 C ATOM 580 CG PHE A 40 31.425 30.939 -7.560 1.00 0.00 C ATOM 581 CD1 PHE A 40 32.508 31.720 -8.008 1.00 0.00 C ATOM 582 CD2 PHE A 40 31.658 29.878 -6.662 1.00 0.00 C ATOM 583 CE1 PHE A 40 33.814 31.449 -7.561 1.00 0.00 C ATOM 584 CE2 PHE A 40 32.966 29.609 -6.215 1.00 0.00 C ATOM 585 CZ PHE A 40 34.042 30.394 -6.661 1.00 0.00 C ATOM 0 H PHE A 40 27.934 31.766 -9.376 1.00 0.00 H new ATOM 0 HA PHE A 40 30.618 30.836 -10.093 1.00 0.00 H new ATOM 0 HB2 PHE A 40 29.883 32.329 -8.068 1.00 0.00 H new ATOM 0 HB3 PHE A 40 29.300 30.835 -7.361 1.00 0.00 H new ATOM 0 HD1 PHE A 40 32.335 32.532 -8.699 1.00 0.00 H new ATOM 0 HD2 PHE A 40 30.834 29.272 -6.317 1.00 0.00 H new ATOM 0 HE1 PHE A 40 34.640 32.051 -7.909 1.00 0.00 H new ATOM 0 HE2 PHE A 40 33.143 28.796 -5.526 1.00 0.00 H new ATOM 0 HZ PHE A 40 35.043 30.187 -6.313 1.00 0.00 H new ATOM 595 N LEU A 41 28.225 28.730 -9.588 1.00 0.00 N ATOM 596 CA LEU A 41 27.796 27.318 -9.532 1.00 0.00 C ATOM 597 C LEU A 41 27.586 26.680 -10.911 1.00 0.00 C ATOM 598 O LEU A 41 27.908 25.502 -11.081 1.00 0.00 O ATOM 599 CB LEU A 41 26.525 27.228 -8.661 1.00 0.00 C ATOM 600 CG LEU A 41 26.763 27.505 -7.166 1.00 0.00 C ATOM 601 CD1 LEU A 41 25.435 27.417 -6.413 1.00 0.00 C ATOM 602 CD2 LEU A 41 27.747 26.516 -6.528 1.00 0.00 C ATOM 0 H LEU A 41 27.444 29.367 -9.745 1.00 0.00 H new ATOM 0 HA LEU A 41 28.602 26.738 -9.083 1.00 0.00 H new ATOM 0 HB2 LEU A 41 25.789 27.938 -9.038 1.00 0.00 H new ATOM 0 HB3 LEU A 41 26.093 26.233 -8.770 1.00 0.00 H new ATOM 0 HG LEU A 41 27.195 28.503 -7.095 1.00 0.00 H new ATOM 0 HD11 LEU A 41 25.603 27.613 -5.354 1.00 0.00 H new ATOM 0 HD12 LEU A 41 24.740 28.156 -6.813 1.00 0.00 H new ATOM 0 HD13 LEU A 41 25.013 26.419 -6.535 1.00 0.00 H new ATOM 0 HD21 LEU A 41 27.876 26.760 -5.474 1.00 0.00 H new ATOM 0 HD22 LEU A 41 27.356 25.503 -6.621 1.00 0.00 H new ATOM 0 HD23 LEU A 41 28.709 26.581 -7.036 1.00 0.00 H new ATOM 614 N ARG A 42 27.149 27.432 -11.932 1.00 0.00 N ATOM 615 CA ARG A 42 27.025 26.901 -13.312 1.00 0.00 C ATOM 616 C ARG A 42 28.353 26.423 -13.922 1.00 0.00 C ATOM 617 O ARG A 42 28.363 25.585 -14.816 1.00 0.00 O ATOM 618 CB ARG A 42 26.308 27.919 -14.209 1.00 0.00 C ATOM 619 CG ARG A 42 27.134 29.172 -14.539 1.00 0.00 C ATOM 620 CD ARG A 42 26.438 30.071 -15.571 1.00 0.00 C ATOM 621 NE ARG A 42 25.554 31.087 -14.966 1.00 0.00 N ATOM 622 CZ ARG A 42 24.275 30.997 -14.660 1.00 0.00 C ATOM 623 NH1 ARG A 42 23.536 29.945 -14.841 1.00 0.00 N ATOM 624 NH2 ARG A 42 23.676 32.017 -14.143 1.00 0.00 N ATOM 0 H ARG A 42 26.874 28.410 -11.836 1.00 0.00 H new ATOM 0 HA ARG A 42 26.416 25.999 -13.247 1.00 0.00 H new ATOM 0 HB2 ARG A 42 26.028 27.429 -15.141 1.00 0.00 H new ATOM 0 HB3 ARG A 42 25.384 28.227 -13.720 1.00 0.00 H new ATOM 0 HG2 ARG A 42 27.310 29.740 -13.625 1.00 0.00 H new ATOM 0 HG3 ARG A 42 28.110 28.872 -14.921 1.00 0.00 H new ATOM 0 HD2 ARG A 42 27.195 30.572 -16.174 1.00 0.00 H new ATOM 0 HD3 ARG A 42 25.853 29.448 -16.248 1.00 0.00 H new ATOM 0 HE ARG A 42 25.994 31.983 -14.756 1.00 0.00 H new ATOM 0 HH11 ARG A 42 23.940 29.102 -15.249 1.00 0.00 H new ATOM 0 HH12 ARG A 42 22.551 29.961 -14.575 1.00 0.00 H new ATOM 0 HH21 ARG A 42 24.192 32.881 -13.975 1.00 0.00 H new ATOM 0 HH22 ARG A 42 22.687 31.959 -13.902 1.00 0.00 H new ATOM 638 N GLU A 43 29.473 26.908 -13.384 1.00 0.00 N ATOM 639 CA GLU A 43 30.838 26.489 -13.748 1.00 0.00 C ATOM 640 C GLU A 43 31.308 25.219 -13.015 1.00 0.00 C ATOM 641 O GLU A 43 32.429 24.765 -13.243 1.00 0.00 O ATOM 642 CB GLU A 43 31.831 27.635 -13.484 1.00 0.00 C ATOM 643 CG GLU A 43 31.371 28.974 -14.068 1.00 0.00 C ATOM 644 CD GLU A 43 32.554 29.944 -14.252 1.00 0.00 C ATOM 645 OE1 GLU A 43 33.162 30.379 -13.243 1.00 0.00 O ATOM 646 OE2 GLU A 43 32.893 30.275 -15.416 1.00 0.00 O ATOM 0 H GLU A 43 29.461 27.626 -12.660 1.00 0.00 H new ATOM 0 HA GLU A 43 30.809 26.247 -14.810 1.00 0.00 H new ATOM 0 HB2 GLU A 43 31.974 27.744 -12.409 1.00 0.00 H new ATOM 0 HB3 GLU A 43 32.800 27.374 -13.909 1.00 0.00 H new ATOM 0 HG2 GLU A 43 30.884 28.806 -15.029 1.00 0.00 H new ATOM 0 HG3 GLU A 43 30.629 29.424 -13.409 1.00 0.00 H new ATOM 653 N GLN A 44 30.486 24.644 -12.125 1.00 0.00 N ATOM 654 CA GLN A 44 30.874 23.562 -11.201 1.00 0.00 C ATOM 655 C GLN A 44 30.087 22.262 -11.412 1.00 0.00 C ATOM 656 O GLN A 44 30.559 21.201 -11.007 1.00 0.00 O ATOM 657 CB GLN A 44 30.691 24.001 -9.737 1.00 0.00 C ATOM 658 CG GLN A 44 31.168 25.426 -9.451 1.00 0.00 C ATOM 659 CD GLN A 44 32.630 25.718 -9.794 1.00 0.00 C ATOM 660 OE1 GLN A 44 33.484 24.851 -9.927 1.00 0.00 O ATOM 661 NE2 GLN A 44 32.957 26.984 -9.911 1.00 0.00 N ATOM 0 H GLN A 44 29.510 24.923 -12.023 1.00 0.00 H new ATOM 0 HA GLN A 44 31.923 23.361 -11.420 1.00 0.00 H new ATOM 0 HB2 GLN A 44 29.636 23.922 -9.474 1.00 0.00 H new ATOM 0 HB3 GLN A 44 31.233 23.311 -9.091 1.00 0.00 H new ATOM 0 HG2 GLN A 44 30.538 26.119 -10.008 1.00 0.00 H new ATOM 0 HG3 GLN A 44 31.014 25.636 -8.393 1.00 0.00 H new ATOM 0 HE21 GLN A 44 32.246 27.707 -9.800 1.00 0.00 H new ATOM 0 HE22 GLN A 44 33.922 27.245 -10.113 1.00 0.00 H new ATOM 670 N ILE A 45 28.898 22.337 -12.033 1.00 0.00 N ATOM 671 CA ILE A 45 28.042 21.171 -12.324 1.00 0.00 C ATOM 672 C ILE A 45 28.802 20.046 -13.035 1.00 0.00 C ATOM 673 O ILE A 45 28.853 18.925 -12.529 1.00 0.00 O ATOM 674 CB ILE A 45 26.790 21.536 -13.164 1.00 0.00 C ATOM 675 CG1 ILE A 45 26.917 22.771 -14.085 1.00 0.00 C ATOM 676 CG2 ILE A 45 25.601 21.736 -12.226 1.00 0.00 C ATOM 677 CD1 ILE A 45 25.887 22.790 -15.224 1.00 0.00 C ATOM 0 H ILE A 45 28.498 23.219 -12.352 1.00 0.00 H new ATOM 0 HA ILE A 45 27.716 20.818 -11.345 1.00 0.00 H new ATOM 0 HB ILE A 45 26.656 20.694 -13.843 1.00 0.00 H new ATOM 0 HG12 ILE A 45 26.803 23.675 -13.486 1.00 0.00 H new ATOM 0 HG13 ILE A 45 27.920 22.796 -14.511 1.00 0.00 H new ATOM 0 HG21 ILE A 45 24.717 21.993 -12.809 1.00 0.00 H new ATOM 0 HG22 ILE A 45 25.416 20.816 -11.672 1.00 0.00 H new ATOM 0 HG23 ILE A 45 25.821 22.542 -11.526 1.00 0.00 H new ATOM 0 HD11 ILE A 45 26.033 23.683 -15.831 1.00 0.00 H new ATOM 0 HD12 ILE A 45 26.015 21.904 -15.845 1.00 0.00 H new ATOM 0 HD13 ILE A 45 24.881 22.797 -14.805 1.00 0.00 H new ATOM 689 N ARG A 46 29.363 20.332 -14.218 1.00 0.00 N ATOM 690 CA ARG A 46 30.171 19.448 -15.084 1.00 0.00 C ATOM 691 C ARG A 46 29.500 18.200 -15.668 1.00 0.00 C ATOM 692 O ARG A 46 29.971 17.680 -16.680 1.00 0.00 O ATOM 693 CB ARG A 46 31.544 19.115 -14.457 1.00 0.00 C ATOM 694 CG ARG A 46 32.376 20.319 -13.990 1.00 0.00 C ATOM 695 CD ARG A 46 32.774 21.280 -15.115 1.00 0.00 C ATOM 696 NE ARG A 46 33.449 22.467 -14.555 1.00 0.00 N ATOM 697 CZ ARG A 46 34.736 22.662 -14.335 1.00 0.00 C ATOM 698 NH1 ARG A 46 35.650 21.800 -14.679 1.00 0.00 N ATOM 699 NH2 ARG A 46 35.108 23.758 -13.742 1.00 0.00 N ATOM 0 H ARG A 46 29.258 21.259 -14.631 1.00 0.00 H new ATOM 0 HA ARG A 46 30.310 20.072 -15.967 1.00 0.00 H new ATOM 0 HB2 ARG A 46 31.382 18.456 -13.604 1.00 0.00 H new ATOM 0 HB3 ARG A 46 32.129 18.554 -15.186 1.00 0.00 H new ATOM 0 HG2 ARG A 46 31.808 20.870 -13.240 1.00 0.00 H new ATOM 0 HG3 ARG A 46 33.280 19.955 -13.502 1.00 0.00 H new ATOM 0 HD2 ARG A 46 33.435 20.774 -15.818 1.00 0.00 H new ATOM 0 HD3 ARG A 46 31.889 21.585 -15.673 1.00 0.00 H new ATOM 0 HE ARG A 46 32.837 23.243 -14.303 1.00 0.00 H new ATOM 0 HH11 ARG A 46 35.383 20.930 -15.139 1.00 0.00 H new ATOM 0 HH12 ARG A 46 36.633 21.995 -14.488 1.00 0.00 H new ATOM 0 HH21 ARG A 46 34.411 24.446 -13.457 1.00 0.00 H new ATOM 0 HH22 ARG A 46 36.097 23.930 -13.562 1.00 0.00 H new ATOM 713 N ASP A 47 28.397 17.750 -15.083 1.00 0.00 N ATOM 714 CA ASP A 47 27.646 16.564 -15.545 1.00 0.00 C ATOM 715 C ASP A 47 26.160 16.577 -15.134 1.00 0.00 C ATOM 716 O ASP A 47 25.318 15.998 -15.825 1.00 0.00 O ATOM 717 CB ASP A 47 28.321 15.297 -14.990 1.00 0.00 C ATOM 718 CG ASP A 47 27.840 14.002 -15.676 1.00 0.00 C ATOM 719 OD1 ASP A 47 27.617 13.999 -16.912 1.00 0.00 O ATOM 720 OD2 ASP A 47 27.750 12.958 -14.989 1.00 0.00 O ATOM 0 H ASP A 47 27.985 18.196 -14.264 1.00 0.00 H new ATOM 0 HA ASP A 47 27.666 16.578 -16.635 1.00 0.00 H new ATOM 0 HB2 ASP A 47 29.401 15.385 -15.112 1.00 0.00 H new ATOM 0 HB3 ASP A 47 28.125 15.228 -13.920 1.00 0.00 H new ATOM 725 N ALA A 48 25.820 17.269 -14.040 1.00 0.00 N ATOM 726 CA ALA A 48 24.441 17.477 -13.604 1.00 0.00 C ATOM 727 C ALA A 48 23.736 18.629 -14.346 1.00 0.00 C ATOM 728 O ALA A 48 24.384 19.511 -14.917 1.00 0.00 O ATOM 729 CB ALA A 48 24.437 17.691 -12.092 1.00 0.00 C ATOM 0 H ALA A 48 26.508 17.705 -13.426 1.00 0.00 H new ATOM 0 HA ALA A 48 23.864 16.587 -13.855 1.00 0.00 H new ATOM 0 HB1 ALA A 48 23.414 17.848 -11.749 1.00 0.00 H new ATOM 0 HB2 ALA A 48 24.854 16.813 -11.599 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.040 18.565 -11.847 1.00 0.00 H new ATOM 735 N ARG A 49 22.395 18.635 -14.307 1.00 0.00 N ATOM 736 CA ARG A 49 21.559 19.628 -15.007 1.00 0.00 C ATOM 737 C ARG A 49 21.387 20.925 -14.202 1.00 0.00 C ATOM 738 O ARG A 49 21.592 22.009 -14.746 1.00 0.00 O ATOM 739 CB ARG A 49 20.213 18.969 -15.382 1.00 0.00 C ATOM 740 CG ARG A 49 19.446 19.712 -16.485 1.00 0.00 C ATOM 741 CD ARG A 49 20.069 19.538 -17.878 1.00 0.00 C ATOM 742 NE ARG A 49 19.247 20.195 -18.914 1.00 0.00 N ATOM 743 CZ ARG A 49 19.248 21.472 -19.263 1.00 0.00 C ATOM 744 NH1 ARG A 49 20.022 22.354 -18.691 1.00 0.00 N ATOM 745 NH2 ARG A 49 18.457 21.892 -20.207 1.00 0.00 N ATOM 0 H ARG A 49 21.854 17.946 -13.785 1.00 0.00 H new ATOM 0 HA ARG A 49 22.063 19.938 -15.922 1.00 0.00 H new ATOM 0 HB2 ARG A 49 20.398 17.945 -15.708 1.00 0.00 H new ATOM 0 HB3 ARG A 49 19.586 18.912 -14.492 1.00 0.00 H new ATOM 0 HG2 ARG A 49 18.417 19.354 -16.507 1.00 0.00 H new ATOM 0 HG3 ARG A 49 19.409 20.774 -16.241 1.00 0.00 H new ATOM 0 HD2 ARG A 49 21.074 19.960 -17.885 1.00 0.00 H new ATOM 0 HD3 ARG A 49 20.167 18.477 -18.106 1.00 0.00 H new ATOM 0 HE ARG A 49 18.600 19.592 -19.422 1.00 0.00 H new ATOM 0 HH11 ARG A 49 20.657 22.068 -17.945 1.00 0.00 H new ATOM 0 HH12 ARG A 49 19.992 23.329 -18.990 1.00 0.00 H new ATOM 0 HH21 ARG A 49 17.834 21.237 -20.680 1.00 0.00 H new ATOM 0 HH22 ARG A 49 18.460 22.876 -20.474 1.00 0.00 H new ATOM 759 N TYR A 50 21.042 20.808 -12.916 1.00 0.00 N ATOM 760 CA TYR A 50 20.710 21.912 -12.011 1.00 0.00 C ATOM 761 C TYR A 50 21.484 21.801 -10.686 1.00 0.00 C ATOM 762 O TYR A 50 21.539 20.717 -10.104 1.00 0.00 O ATOM 763 CB TYR A 50 19.190 21.860 -11.722 1.00 0.00 C ATOM 764 CG TYR A 50 18.271 21.585 -12.905 1.00 0.00 C ATOM 765 CD1 TYR A 50 18.392 22.341 -14.085 1.00 0.00 C ATOM 766 CD2 TYR A 50 17.246 20.622 -12.804 1.00 0.00 C ATOM 767 CE1 TYR A 50 17.478 22.172 -15.141 1.00 0.00 C ATOM 768 CE2 TYR A 50 16.343 20.426 -13.870 1.00 0.00 C ATOM 769 CZ TYR A 50 16.452 21.211 -15.039 1.00 0.00 C ATOM 770 OH TYR A 50 15.571 21.051 -16.062 1.00 0.00 O ATOM 0 H TYR A 50 20.984 19.899 -12.457 1.00 0.00 H new ATOM 0 HA TYR A 50 20.987 22.855 -12.483 1.00 0.00 H new ATOM 0 HB2 TYR A 50 19.014 21.091 -10.970 1.00 0.00 H new ATOM 0 HB3 TYR A 50 18.897 22.812 -11.279 1.00 0.00 H new ATOM 0 HD1 TYR A 50 19.194 23.058 -14.181 1.00 0.00 H new ATOM 0 HD2 TYR A 50 17.152 20.031 -11.905 1.00 0.00 H new ATOM 0 HE1 TYR A 50 17.563 22.779 -16.030 1.00 0.00 H new ATOM 0 HE2 TYR A 50 15.569 19.677 -13.792 1.00 0.00 H new ATOM 0 HH TYR A 50 14.928 20.348 -15.833 1.00 0.00 H new ATOM 780 N ALA A 51 22.060 22.897 -10.171 1.00 0.00 N ATOM 781 CA ALA A 51 22.618 22.959 -8.809 1.00 0.00 C ATOM 782 C ALA A 51 21.794 23.939 -7.947 1.00 0.00 C ATOM 783 O ALA A 51 21.331 24.960 -8.450 1.00 0.00 O ATOM 784 CB ALA A 51 24.099 23.348 -8.870 1.00 0.00 C ATOM 0 H ALA A 51 22.153 23.771 -10.689 1.00 0.00 H new ATOM 0 HA ALA A 51 22.556 21.978 -8.339 1.00 0.00 H new ATOM 0 HB1 ALA A 51 24.506 23.392 -7.860 1.00 0.00 H new ATOM 0 HB2 ALA A 51 24.647 22.605 -9.449 1.00 0.00 H new ATOM 0 HB3 ALA A 51 24.200 24.324 -9.344 1.00 0.00 H new ATOM 790 N VAL A 52 21.582 23.633 -6.666 1.00 0.00 N ATOM 791 CA VAL A 52 20.645 24.350 -5.778 1.00 0.00 C ATOM 792 C VAL A 52 21.255 24.500 -4.387 1.00 0.00 C ATOM 793 O VAL A 52 21.854 23.555 -3.869 1.00 0.00 O ATOM 794 CB VAL A 52 19.288 23.609 -5.727 1.00 0.00 C ATOM 795 CG1 VAL A 52 18.344 24.168 -4.652 1.00 0.00 C ATOM 796 CG2 VAL A 52 18.566 23.666 -7.080 1.00 0.00 C ATOM 0 H VAL A 52 22.064 22.864 -6.200 1.00 0.00 H new ATOM 0 HA VAL A 52 20.464 25.349 -6.174 1.00 0.00 H new ATOM 0 HB VAL A 52 19.532 22.577 -5.475 1.00 0.00 H new ATOM 0 HG11 VAL A 52 17.408 23.609 -4.663 1.00 0.00 H new ATOM 0 HG12 VAL A 52 18.812 24.073 -3.672 1.00 0.00 H new ATOM 0 HG13 VAL A 52 18.141 25.219 -4.857 1.00 0.00 H new ATOM 0 HG21 VAL A 52 17.616 23.136 -7.008 1.00 0.00 H new ATOM 0 HG22 VAL A 52 18.381 24.706 -7.350 1.00 0.00 H new ATOM 0 HG23 VAL A 52 19.187 23.197 -7.844 1.00 0.00 H new ATOM 806 N ILE A 53 21.103 25.669 -3.757 1.00 0.00 N ATOM 807 CA ILE A 53 21.768 26.006 -2.493 1.00 0.00 C ATOM 808 C ILE A 53 20.825 26.425 -1.364 1.00 0.00 C ATOM 809 O ILE A 53 19.933 27.242 -1.558 1.00 0.00 O ATOM 810 CB ILE A 53 22.856 27.078 -2.785 1.00 0.00 C ATOM 811 CG1 ILE A 53 24.248 26.430 -2.773 1.00 0.00 C ATOM 812 CG2 ILE A 53 22.852 28.321 -1.862 1.00 0.00 C ATOM 813 CD1 ILE A 53 24.579 25.727 -1.452 1.00 0.00 C ATOM 0 H ILE A 53 20.508 26.417 -4.114 1.00 0.00 H new ATOM 0 HA ILE A 53 22.227 25.096 -2.107 1.00 0.00 H new ATOM 0 HB ILE A 53 22.601 27.463 -3.772 1.00 0.00 H new ATOM 0 HG12 ILE A 53 24.312 25.708 -3.587 1.00 0.00 H new ATOM 0 HG13 ILE A 53 24.999 27.196 -2.967 1.00 0.00 H new ATOM 0 HG21 ILE A 53 23.653 28.998 -2.160 1.00 0.00 H new ATOM 0 HG22 ILE A 53 21.894 28.833 -1.946 1.00 0.00 H new ATOM 0 HG23 ILE A 53 23.007 28.008 -0.829 1.00 0.00 H new ATOM 0 HD11 ILE A 53 25.576 25.291 -1.512 1.00 0.00 H new ATOM 0 HD12 ILE A 53 24.547 26.450 -0.637 1.00 0.00 H new ATOM 0 HD13 ILE A 53 23.849 24.939 -1.266 1.00 0.00 H new ATOM 825 N ARG A 54 21.091 25.908 -0.158 1.00 0.00 N ATOM 826 CA ARG A 54 20.473 26.319 1.115 1.00 0.00 C ATOM 827 C ARG A 54 21.578 26.552 2.158 1.00 0.00 C ATOM 828 O ARG A 54 21.982 25.634 2.865 1.00 0.00 O ATOM 829 CB ARG A 54 19.444 25.263 1.583 1.00 0.00 C ATOM 830 CG ARG A 54 18.191 25.121 0.697 1.00 0.00 C ATOM 831 CD ARG A 54 18.342 24.094 -0.437 1.00 0.00 C ATOM 832 NE ARG A 54 17.083 23.954 -1.199 1.00 0.00 N ATOM 833 CZ ARG A 54 16.157 23.015 -1.076 1.00 0.00 C ATOM 834 NH1 ARG A 54 16.245 22.060 -0.194 1.00 0.00 N ATOM 835 NH2 ARG A 54 15.110 23.019 -1.848 1.00 0.00 N ATOM 0 H ARG A 54 21.772 25.159 -0.034 1.00 0.00 H new ATOM 0 HA ARG A 54 19.928 27.253 0.980 1.00 0.00 H new ATOM 0 HB2 ARG A 54 19.942 24.295 1.637 1.00 0.00 H new ATOM 0 HB3 ARG A 54 19.126 25.514 2.595 1.00 0.00 H new ATOM 0 HG2 ARG A 54 17.346 24.834 1.323 1.00 0.00 H new ATOM 0 HG3 ARG A 54 17.952 26.093 0.264 1.00 0.00 H new ATOM 0 HD2 ARG A 54 19.144 24.403 -1.107 1.00 0.00 H new ATOM 0 HD3 ARG A 54 18.628 23.128 -0.021 1.00 0.00 H new ATOM 0 HE ARG A 54 16.906 24.668 -1.906 1.00 0.00 H new ATOM 0 HH11 ARG A 54 17.048 22.017 0.433 1.00 0.00 H new ATOM 0 HH12 ARG A 54 15.510 21.355 -0.131 1.00 0.00 H new ATOM 0 HH21 ARG A 54 14.999 23.748 -2.553 1.00 0.00 H new ATOM 0 HH22 ARG A 54 14.400 22.293 -1.749 1.00 0.00 H new ATOM 849 N ILE A 55 22.108 27.775 2.238 1.00 0.00 N ATOM 850 CA ILE A 55 23.079 28.207 3.269 1.00 0.00 C ATOM 851 C ILE A 55 22.349 29.030 4.352 1.00 0.00 C ATOM 852 O ILE A 55 21.581 29.925 3.990 1.00 0.00 O ATOM 853 CB ILE A 55 24.208 29.035 2.607 1.00 0.00 C ATOM 854 CG1 ILE A 55 25.048 28.180 1.638 1.00 0.00 C ATOM 855 CG2 ILE A 55 25.150 29.698 3.629 1.00 0.00 C ATOM 856 CD1 ILE A 55 25.526 28.965 0.426 1.00 0.00 C ATOM 0 H ILE A 55 21.874 28.516 1.577 1.00 0.00 H new ATOM 0 HA ILE A 55 23.528 27.335 3.744 1.00 0.00 H new ATOM 0 HB ILE A 55 23.697 29.823 2.054 1.00 0.00 H new ATOM 0 HG12 ILE A 55 25.911 27.778 2.169 1.00 0.00 H new ATOM 0 HG13 ILE A 55 24.455 27.329 1.304 1.00 0.00 H new ATOM 0 HG21 ILE A 55 25.919 30.263 3.102 1.00 0.00 H new ATOM 0 HG22 ILE A 55 24.578 30.371 4.267 1.00 0.00 H new ATOM 0 HG23 ILE A 55 25.621 28.929 4.242 1.00 0.00 H new ATOM 0 HD11 ILE A 55 26.112 28.313 -0.222 1.00 0.00 H new ATOM 0 HD12 ILE A 55 24.665 29.344 -0.124 1.00 0.00 H new ATOM 0 HD13 ILE A 55 26.144 29.801 0.754 1.00 0.00 H new ATOM 868 N PRO A 56 22.588 28.804 5.659 1.00 0.00 N ATOM 869 CA PRO A 56 21.999 29.633 6.715 1.00 0.00 C ATOM 870 C PRO A 56 22.501 31.087 6.643 1.00 0.00 C ATOM 871 O PRO A 56 23.701 31.347 6.525 1.00 0.00 O ATOM 872 CB PRO A 56 22.370 28.945 8.035 1.00 0.00 C ATOM 873 CG PRO A 56 23.653 28.187 7.698 1.00 0.00 C ATOM 874 CD PRO A 56 23.430 27.768 6.248 1.00 0.00 C ATOM 0 HA PRO A 56 20.917 29.711 6.611 1.00 0.00 H new ATOM 0 HB2 PRO A 56 22.531 29.670 8.833 1.00 0.00 H new ATOM 0 HB3 PRO A 56 21.582 28.270 8.371 1.00 0.00 H new ATOM 0 HG2 PRO A 56 24.535 28.818 7.805 1.00 0.00 H new ATOM 0 HG3 PRO A 56 23.796 27.325 8.350 1.00 0.00 H new ATOM 0 HD2 PRO A 56 24.377 27.684 5.715 1.00 0.00 H new ATOM 0 HD3 PRO A 56 22.946 26.793 6.193 1.00 0.00 H new ATOM 882 N GLY A 57 21.572 32.047 6.714 1.00 0.00 N ATOM 883 CA GLY A 57 21.854 33.490 6.704 1.00 0.00 C ATOM 884 C GLY A 57 21.886 34.155 5.320 1.00 0.00 C ATOM 885 O GLY A 57 22.076 35.371 5.249 1.00 0.00 O ATOM 0 H GLY A 57 20.576 31.838 6.782 1.00 0.00 H new ATOM 0 HA2 GLY A 57 21.100 33.993 7.310 1.00 0.00 H new ATOM 0 HA3 GLY A 57 22.816 33.656 7.189 1.00 0.00 H new ATOM 889 N GLN A 58 21.681 33.406 4.226 1.00 0.00 N ATOM 890 CA GLN A 58 21.535 33.952 2.863 1.00 0.00 C ATOM 891 C GLN A 58 20.399 33.262 2.074 1.00 0.00 C ATOM 892 O GLN A 58 20.039 32.124 2.391 1.00 0.00 O ATOM 893 CB GLN A 58 22.900 33.909 2.153 1.00 0.00 C ATOM 894 CG GLN A 58 23.315 32.540 1.602 1.00 0.00 C ATOM 895 CD GLN A 58 24.803 32.520 1.237 1.00 0.00 C ATOM 896 OE1 GLN A 58 25.207 32.343 0.095 1.00 0.00 O ATOM 897 NE2 GLN A 58 25.673 32.704 2.209 1.00 0.00 N ATOM 0 H GLN A 58 21.611 32.389 4.261 1.00 0.00 H new ATOM 0 HA GLN A 58 21.225 34.995 2.922 1.00 0.00 H new ATOM 0 HB2 GLN A 58 22.884 34.623 1.329 1.00 0.00 H new ATOM 0 HB3 GLN A 58 23.665 34.246 2.853 1.00 0.00 H new ATOM 0 HG2 GLN A 58 23.109 31.768 2.344 1.00 0.00 H new ATOM 0 HG3 GLN A 58 22.718 32.303 0.721 1.00 0.00 H new ATOM 0 HE21 GLN A 58 25.347 32.852 3.164 1.00 0.00 H new ATOM 0 HE22 GLN A 58 26.673 32.698 2.007 1.00 0.00 H new ATOM 906 N PRO A 59 19.810 33.918 1.057 1.00 0.00 N ATOM 907 CA PRO A 59 18.691 33.360 0.299 1.00 0.00 C ATOM 908 C PRO A 59 19.107 32.164 -0.577 1.00 0.00 C ATOM 909 O PRO A 59 20.224 32.104 -1.101 1.00 0.00 O ATOM 910 CB PRO A 59 18.148 34.523 -0.540 1.00 0.00 C ATOM 911 CG PRO A 59 19.375 35.410 -0.748 1.00 0.00 C ATOM 912 CD PRO A 59 20.134 35.253 0.570 1.00 0.00 C ATOM 0 HA PRO A 59 17.930 32.954 0.966 1.00 0.00 H new ATOM 0 HB2 PRO A 59 17.736 34.177 -1.488 1.00 0.00 H new ATOM 0 HB3 PRO A 59 17.350 35.055 -0.021 1.00 0.00 H new ATOM 0 HG2 PRO A 59 19.971 35.082 -1.600 1.00 0.00 H new ATOM 0 HG3 PRO A 59 19.097 36.448 -0.934 1.00 0.00 H new ATOM 0 HD2 PRO A 59 21.208 35.364 0.419 1.00 0.00 H new ATOM 0 HD3 PRO A 59 19.832 36.015 1.288 1.00 0.00 H new ATOM 920 N VAL A 60 18.174 31.226 -0.771 1.00 0.00 N ATOM 921 CA VAL A 60 18.299 30.116 -1.736 1.00 0.00 C ATOM 922 C VAL A 60 18.574 30.638 -3.150 1.00 0.00 C ATOM 923 O VAL A 60 17.934 31.583 -3.617 1.00 0.00 O ATOM 924 CB VAL A 60 17.057 29.183 -1.698 1.00 0.00 C ATOM 925 CG1 VAL A 60 15.715 29.933 -1.714 1.00 0.00 C ATOM 926 CG2 VAL A 60 17.002 28.167 -2.852 1.00 0.00 C ATOM 0 H VAL A 60 17.294 31.212 -0.256 1.00 0.00 H new ATOM 0 HA VAL A 60 19.158 29.516 -1.438 1.00 0.00 H new ATOM 0 HB VAL A 60 17.189 28.665 -0.748 1.00 0.00 H new ATOM 0 HG11 VAL A 60 14.896 29.214 -1.686 1.00 0.00 H new ATOM 0 HG12 VAL A 60 15.654 30.588 -0.845 1.00 0.00 H new ATOM 0 HG13 VAL A 60 15.643 30.530 -2.623 1.00 0.00 H new ATOM 0 HG21 VAL A 60 16.106 27.553 -2.754 1.00 0.00 H new ATOM 0 HG22 VAL A 60 16.976 28.698 -3.803 1.00 0.00 H new ATOM 0 HG23 VAL A 60 17.885 27.529 -2.817 1.00 0.00 H new ATOM 936 N VAL A 61 19.519 29.993 -3.841 1.00 0.00 N ATOM 937 CA VAL A 61 19.797 30.194 -5.270 1.00 0.00 C ATOM 938 C VAL A 61 19.721 28.867 -6.034 1.00 0.00 C ATOM 939 O VAL A 61 20.052 27.808 -5.498 1.00 0.00 O ATOM 940 CB VAL A 61 21.127 30.947 -5.445 1.00 0.00 C ATOM 941 CG1 VAL A 61 22.360 30.127 -5.064 1.00 0.00 C ATOM 942 CG2 VAL A 61 21.310 31.488 -6.865 1.00 0.00 C ATOM 0 H VAL A 61 20.129 29.297 -3.412 1.00 0.00 H new ATOM 0 HA VAL A 61 19.027 30.825 -5.713 1.00 0.00 H new ATOM 0 HB VAL A 61 21.051 31.780 -4.746 1.00 0.00 H new ATOM 0 HG11 VAL A 61 23.257 30.727 -5.215 1.00 0.00 H new ATOM 0 HG12 VAL A 61 22.292 29.833 -4.017 1.00 0.00 H new ATOM 0 HG13 VAL A 61 22.411 29.235 -5.688 1.00 0.00 H new ATOM 0 HG21 VAL A 61 22.264 32.011 -6.935 1.00 0.00 H new ATOM 0 HG22 VAL A 61 21.297 30.660 -7.574 1.00 0.00 H new ATOM 0 HG23 VAL A 61 20.500 32.179 -7.098 1.00 0.00 H new ATOM 952 N GLU A 62 19.256 28.931 -7.283 1.00 0.00 N ATOM 953 CA GLU A 62 18.997 27.775 -8.153 1.00 0.00 C ATOM 954 C GLU A 62 19.597 28.019 -9.546 1.00 0.00 C ATOM 955 O GLU A 62 19.297 29.027 -10.190 1.00 0.00 O ATOM 956 CB GLU A 62 17.482 27.520 -8.266 1.00 0.00 C ATOM 957 CG GLU A 62 16.780 27.319 -6.916 1.00 0.00 C ATOM 958 CD GLU A 62 15.286 26.997 -7.106 1.00 0.00 C ATOM 959 OE1 GLU A 62 14.492 27.932 -7.372 1.00 0.00 O ATOM 960 OE2 GLU A 62 14.896 25.812 -6.974 1.00 0.00 O ATOM 0 H GLU A 62 19.041 29.819 -7.736 1.00 0.00 H new ATOM 0 HA GLU A 62 19.467 26.895 -7.715 1.00 0.00 H new ATOM 0 HB2 GLU A 62 17.020 28.361 -8.782 1.00 0.00 H new ATOM 0 HB3 GLU A 62 17.318 26.637 -8.884 1.00 0.00 H new ATOM 0 HG2 GLU A 62 17.262 26.509 -6.370 1.00 0.00 H new ATOM 0 HG3 GLU A 62 16.886 28.219 -6.311 1.00 0.00 H new ATOM 967 N VAL A 63 20.439 27.101 -10.027 1.00 0.00 N ATOM 968 CA VAL A 63 21.114 27.152 -11.334 1.00 0.00 C ATOM 969 C VAL A 63 20.329 26.346 -12.371 1.00 0.00 C ATOM 970 O VAL A 63 19.727 25.324 -12.039 1.00 0.00 O ATOM 971 CB VAL A 63 22.537 26.581 -11.192 1.00 0.00 C ATOM 972 CG1 VAL A 63 23.391 26.797 -12.439 1.00 0.00 C ATOM 973 CG2 VAL A 63 23.327 27.181 -10.029 1.00 0.00 C ATOM 0 H VAL A 63 20.682 26.264 -9.496 1.00 0.00 H new ATOM 0 HA VAL A 63 21.167 28.188 -11.670 1.00 0.00 H new ATOM 0 HB VAL A 63 22.359 25.520 -11.018 1.00 0.00 H new ATOM 0 HG11 VAL A 63 24.383 26.373 -12.279 1.00 0.00 H new ATOM 0 HG12 VAL A 63 22.921 26.307 -13.292 1.00 0.00 H new ATOM 0 HG13 VAL A 63 23.480 27.865 -12.638 1.00 0.00 H new ATOM 0 HG21 VAL A 63 24.319 26.730 -9.992 1.00 0.00 H new ATOM 0 HG22 VAL A 63 23.422 28.257 -10.171 1.00 0.00 H new ATOM 0 HG23 VAL A 63 22.804 26.983 -9.093 1.00 0.00 H new ATOM 983 N GLY A 64 20.378 26.744 -13.645 1.00 0.00 N ATOM 984 CA GLY A 64 19.743 26.001 -14.736 1.00 0.00 C ATOM 985 C GLY A 64 18.227 26.217 -14.775 1.00 0.00 C ATOM 986 O GLY A 64 17.762 27.216 -15.327 1.00 0.00 O ATOM 0 H GLY A 64 20.859 27.591 -13.949 1.00 0.00 H new ATOM 0 HA2 GLY A 64 20.177 26.311 -15.686 1.00 0.00 H new ATOM 0 HA3 GLY A 64 19.954 24.938 -14.621 1.00 0.00 H new ATOM 990 N THR A 65 17.432 25.288 -14.231 1.00 0.00 N ATOM 991 CA THR A 65 15.959 25.409 -14.140 1.00 0.00 C ATOM 992 C THR A 65 15.415 24.585 -12.964 1.00 0.00 C ATOM 993 O THR A 65 15.938 23.526 -12.637 1.00 0.00 O ATOM 994 CB THR A 65 15.278 24.971 -15.460 1.00 0.00 C ATOM 995 OG1 THR A 65 15.752 25.754 -16.537 1.00 0.00 O ATOM 996 CG2 THR A 65 13.756 25.138 -15.471 1.00 0.00 C ATOM 0 H THR A 65 17.790 24.419 -13.835 1.00 0.00 H new ATOM 0 HA THR A 65 15.725 26.460 -13.967 1.00 0.00 H new ATOM 0 HB THR A 65 15.523 23.913 -15.553 1.00 0.00 H new ATOM 0 HG1 THR A 65 16.379 26.428 -16.201 1.00 0.00 H new ATOM 0 HG21 THR A 65 13.361 24.808 -16.432 1.00 0.00 H new ATOM 0 HG22 THR A 65 13.318 24.538 -14.673 1.00 0.00 H new ATOM 0 HG23 THR A 65 13.504 26.187 -15.316 1.00 0.00 H new ATOM 1004 N LYS A 66 14.351 25.058 -12.311 1.00 0.00 N ATOM 1005 CA LYS A 66 13.699 24.368 -11.186 1.00 0.00 C ATOM 1006 C LYS A 66 12.993 23.072 -11.650 1.00 0.00 C ATOM 1007 O LYS A 66 12.148 23.141 -12.549 1.00 0.00 O ATOM 1008 CB LYS A 66 12.727 25.336 -10.490 1.00 0.00 C ATOM 1009 CG LYS A 66 12.047 24.702 -9.265 1.00 0.00 C ATOM 1010 CD LYS A 66 11.144 25.718 -8.555 1.00 0.00 C ATOM 1011 CE LYS A 66 10.439 25.057 -7.364 1.00 0.00 C ATOM 1012 NZ LYS A 66 9.530 26.008 -6.669 1.00 0.00 N ATOM 0 H LYS A 66 13.908 25.945 -12.550 1.00 0.00 H new ATOM 0 HA LYS A 66 14.458 24.062 -10.466 1.00 0.00 H new ATOM 0 HB2 LYS A 66 13.268 26.230 -10.180 1.00 0.00 H new ATOM 0 HB3 LYS A 66 11.965 25.655 -11.201 1.00 0.00 H new ATOM 0 HG2 LYS A 66 11.457 23.840 -9.577 1.00 0.00 H new ATOM 0 HG3 LYS A 66 12.805 24.336 -8.572 1.00 0.00 H new ATOM 0 HD2 LYS A 66 11.737 26.565 -8.211 1.00 0.00 H new ATOM 0 HD3 LYS A 66 10.404 26.109 -9.254 1.00 0.00 H new ATOM 0 HE2 LYS A 66 9.869 24.195 -7.711 1.00 0.00 H new ATOM 0 HE3 LYS A 66 11.184 24.685 -6.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 9.070 25.527 -5.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 10.079 26.818 -6.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 8.805 26.344 -7.334 1.00 0.00 H new ATOM 1026 N PRO A 67 13.296 21.905 -11.050 1.00 0.00 N ATOM 1027 CA PRO A 67 12.728 20.612 -11.435 1.00 0.00 C ATOM 1028 C PRO A 67 11.333 20.316 -10.859 1.00 0.00 C ATOM 1029 O PRO A 67 10.896 20.910 -9.871 1.00 0.00 O ATOM 1030 CB PRO A 67 13.723 19.576 -10.948 1.00 0.00 C ATOM 1031 CG PRO A 67 14.329 20.229 -9.715 1.00 0.00 C ATOM 1032 CD PRO A 67 14.357 21.709 -10.075 1.00 0.00 C ATOM 0 HA PRO A 67 12.574 20.603 -12.514 1.00 0.00 H new ATOM 0 HB2 PRO A 67 13.235 18.632 -10.705 1.00 0.00 H new ATOM 0 HB3 PRO A 67 14.480 19.359 -11.702 1.00 0.00 H new ATOM 0 HG2 PRO A 67 13.727 20.043 -8.825 1.00 0.00 H new ATOM 0 HG3 PRO A 67 15.329 19.847 -9.509 1.00 0.00 H new ATOM 0 HD2 PRO A 67 14.195 22.328 -9.193 1.00 0.00 H new ATOM 0 HD3 PRO A 67 15.325 21.991 -10.490 1.00 0.00 H new ATOM 1040 N THR A 68 10.669 19.331 -11.480 1.00 0.00 N ATOM 1041 CA THR A 68 9.231 19.064 -11.229 1.00 0.00 C ATOM 1042 C THR A 68 8.896 17.866 -10.326 1.00 0.00 C ATOM 1043 O THR A 68 7.907 17.917 -9.590 1.00 0.00 O ATOM 1044 CB THR A 68 8.504 18.989 -12.582 1.00 0.00 C ATOM 1045 OG1 THR A 68 7.104 18.946 -12.421 1.00 0.00 O ATOM 1046 CG2 THR A 68 8.931 17.785 -13.417 1.00 0.00 C ATOM 0 H THR A 68 11.097 18.703 -12.160 1.00 0.00 H new ATOM 0 HA THR A 68 8.871 19.902 -10.632 1.00 0.00 H new ATOM 0 HB THR A 68 8.788 19.899 -13.110 1.00 0.00 H new ATOM 0 HG1 THR A 68 6.675 18.900 -13.301 1.00 0.00 H new ATOM 0 HG21 THR A 68 8.385 17.784 -14.360 1.00 0.00 H new ATOM 0 HG22 THR A 68 10.001 17.842 -13.617 1.00 0.00 H new ATOM 0 HG23 THR A 68 8.712 16.867 -12.871 1.00 0.00 H new ATOM 1054 N GLY A 69 9.708 16.800 -10.333 1.00 0.00 N ATOM 1055 CA GLY A 69 9.465 15.596 -9.511 1.00 0.00 C ATOM 1056 C GLY A 69 9.970 14.279 -10.104 1.00 0.00 C ATOM 1057 O GLY A 69 10.396 13.390 -9.364 1.00 0.00 O ATOM 0 H GLY A 69 10.551 16.743 -10.905 1.00 0.00 H new ATOM 0 HA2 GLY A 69 9.936 15.740 -8.539 1.00 0.00 H new ATOM 0 HA3 GLY A 69 8.393 15.508 -9.336 1.00 0.00 H new ATOM 1061 N ASP A 70 10.005 14.167 -11.433 1.00 0.00 N ATOM 1062 CA ASP A 70 10.663 13.063 -12.155 1.00 0.00 C ATOM 1063 C ASP A 70 12.157 13.371 -12.346 1.00 0.00 C ATOM 1064 O ASP A 70 12.691 13.404 -13.457 1.00 0.00 O ATOM 1065 CB ASP A 70 9.953 12.661 -13.459 1.00 0.00 C ATOM 1066 CG ASP A 70 9.672 13.775 -14.487 1.00 0.00 C ATOM 1067 OD1 ASP A 70 10.050 14.953 -14.287 1.00 0.00 O ATOM 1068 OD2 ASP A 70 9.038 13.458 -15.525 1.00 0.00 O ATOM 0 H ASP A 70 9.571 14.850 -12.054 1.00 0.00 H new ATOM 0 HA ASP A 70 10.580 12.173 -11.531 1.00 0.00 H new ATOM 0 HB2 ASP A 70 10.555 11.896 -13.948 1.00 0.00 H new ATOM 0 HB3 ASP A 70 9.002 12.198 -13.196 1.00 0.00 H new ATOM 1073 N VAL A 71 12.835 13.626 -11.222 1.00 0.00 N ATOM 1074 CA VAL A 71 14.252 13.995 -11.146 1.00 0.00 C ATOM 1075 C VAL A 71 14.980 13.187 -10.056 1.00 0.00 C ATOM 1076 O VAL A 71 14.360 12.659 -9.132 1.00 0.00 O ATOM 1077 CB VAL A 71 14.421 15.521 -10.944 1.00 0.00 C ATOM 1078 CG1 VAL A 71 13.770 16.352 -12.075 1.00 0.00 C ATOM 1079 CG2 VAL A 71 13.895 16.003 -9.586 1.00 0.00 C ATOM 0 H VAL A 71 12.394 13.579 -10.304 1.00 0.00 H new ATOM 0 HA VAL A 71 14.718 13.742 -12.098 1.00 0.00 H new ATOM 0 HB VAL A 71 15.498 15.686 -10.973 1.00 0.00 H new ATOM 0 HG11 VAL A 71 13.921 17.414 -11.879 1.00 0.00 H new ATOM 0 HG12 VAL A 71 14.228 16.090 -13.029 1.00 0.00 H new ATOM 0 HG13 VAL A 71 12.702 16.138 -12.115 1.00 0.00 H new ATOM 0 HG21 VAL A 71 14.040 17.080 -9.501 1.00 0.00 H new ATOM 0 HG22 VAL A 71 12.833 15.772 -9.505 1.00 0.00 H new ATOM 0 HG23 VAL A 71 14.438 15.500 -8.786 1.00 0.00 H new ATOM 1089 N LEU A 72 16.299 13.066 -10.185 1.00 0.00 N ATOM 1090 CA LEU A 72 17.233 12.537 -9.185 1.00 0.00 C ATOM 1091 C LEU A 72 17.682 13.673 -8.276 1.00 0.00 C ATOM 1092 O LEU A 72 17.751 14.817 -8.729 1.00 0.00 O ATOM 1093 CB LEU A 72 18.482 11.978 -9.892 1.00 0.00 C ATOM 1094 CG LEU A 72 18.177 10.766 -10.773 1.00 0.00 C ATOM 1095 CD1 LEU A 72 19.343 10.455 -11.707 1.00 0.00 C ATOM 1096 CD2 LEU A 72 17.894 9.539 -9.916 1.00 0.00 C ATOM 0 H LEU A 72 16.776 13.351 -11.040 1.00 0.00 H new ATOM 0 HA LEU A 72 16.738 11.753 -8.612 1.00 0.00 H new ATOM 0 HB2 LEU A 72 18.928 12.762 -10.504 1.00 0.00 H new ATOM 0 HB3 LEU A 72 19.223 11.699 -9.143 1.00 0.00 H new ATOM 0 HG LEU A 72 17.298 11.011 -11.369 1.00 0.00 H new ATOM 0 HD11 LEU A 72 19.097 9.589 -12.321 1.00 0.00 H new ATOM 0 HD12 LEU A 72 19.532 11.314 -12.351 1.00 0.00 H new ATOM 0 HD13 LEU A 72 20.234 10.240 -11.117 1.00 0.00 H new ATOM 0 HD21 LEU A 72 17.679 8.687 -10.561 1.00 0.00 H new ATOM 0 HD22 LEU A 72 18.765 9.317 -9.299 1.00 0.00 H new ATOM 0 HD23 LEU A 72 17.035 9.734 -9.274 1.00 0.00 H new ATOM 1108 N GLN A 73 18.059 13.372 -7.034 1.00 0.00 N ATOM 1109 CA GLN A 73 18.552 14.382 -6.088 1.00 0.00 C ATOM 1110 C GLN A 73 19.889 13.955 -5.464 1.00 0.00 C ATOM 1111 O GLN A 73 19.950 12.963 -4.740 1.00 0.00 O ATOM 1112 CB GLN A 73 17.492 14.624 -4.999 1.00 0.00 C ATOM 1113 CG GLN A 73 16.226 15.293 -5.557 1.00 0.00 C ATOM 1114 CD GLN A 73 15.298 15.813 -4.460 1.00 0.00 C ATOM 1115 OE1 GLN A 73 15.084 15.193 -3.425 1.00 0.00 O ATOM 1116 NE2 GLN A 73 14.708 16.974 -4.644 1.00 0.00 N ATOM 0 H GLN A 73 18.033 12.426 -6.653 1.00 0.00 H new ATOM 0 HA GLN A 73 18.729 15.312 -6.629 1.00 0.00 H new ATOM 0 HB2 GLN A 73 17.225 13.673 -4.537 1.00 0.00 H new ATOM 0 HB3 GLN A 73 17.916 15.251 -4.215 1.00 0.00 H new ATOM 0 HG2 GLN A 73 16.514 16.121 -6.206 1.00 0.00 H new ATOM 0 HG3 GLN A 73 15.685 14.577 -6.175 1.00 0.00 H new ATOM 0 HE21 GLN A 73 14.876 17.502 -5.501 1.00 0.00 H new ATOM 0 HE22 GLN A 73 14.082 17.347 -3.930 1.00 0.00 H new ATOM 1125 N GLY A 74 20.962 14.696 -5.744 1.00 0.00 N ATOM 1126 CA GLY A 74 22.264 14.582 -5.076 1.00 0.00 C ATOM 1127 C GLY A 74 22.316 15.608 -3.949 1.00 0.00 C ATOM 1128 O GLY A 74 21.807 16.711 -4.132 1.00 0.00 O ATOM 0 H GLY A 74 20.951 15.417 -6.466 1.00 0.00 H new ATOM 0 HA2 GLY A 74 22.401 13.576 -4.680 1.00 0.00 H new ATOM 0 HA3 GLY A 74 23.072 14.757 -5.786 1.00 0.00 H new ATOM 1132 N ARG A 75 22.895 15.290 -2.790 1.00 0.00 N ATOM 1133 CA ARG A 75 22.796 16.131 -1.578 1.00 0.00 C ATOM 1134 C ARG A 75 24.032 16.029 -0.677 1.00 0.00 C ATOM 1135 O ARG A 75 24.637 14.966 -0.563 1.00 0.00 O ATOM 1136 CB ARG A 75 21.505 15.737 -0.827 1.00 0.00 C ATOM 1137 CG ARG A 75 21.170 16.644 0.368 1.00 0.00 C ATOM 1138 CD ARG A 75 19.826 16.241 0.985 1.00 0.00 C ATOM 1139 NE ARG A 75 19.539 17.011 2.213 1.00 0.00 N ATOM 1140 CZ ARG A 75 18.466 16.899 2.976 1.00 0.00 C ATOM 1141 NH1 ARG A 75 17.493 16.081 2.685 1.00 0.00 N ATOM 1142 NH2 ARG A 75 18.345 17.612 4.060 1.00 0.00 N ATOM 0 H ARG A 75 23.448 14.443 -2.657 1.00 0.00 H new ATOM 0 HA ARG A 75 22.752 17.178 -1.877 1.00 0.00 H new ATOM 0 HB2 ARG A 75 20.670 15.755 -1.528 1.00 0.00 H new ATOM 0 HB3 ARG A 75 21.602 14.710 -0.474 1.00 0.00 H new ATOM 0 HG2 ARG A 75 21.958 16.573 1.118 1.00 0.00 H new ATOM 0 HG3 ARG A 75 21.131 17.684 0.044 1.00 0.00 H new ATOM 0 HD2 ARG A 75 19.029 16.402 0.259 1.00 0.00 H new ATOM 0 HD3 ARG A 75 19.836 15.176 1.217 1.00 0.00 H new ATOM 0 HE ARG A 75 20.238 17.696 2.500 1.00 0.00 H new ATOM 0 HH11 ARG A 75 17.546 15.503 1.846 1.00 0.00 H new ATOM 0 HH12 ARG A 75 16.679 16.019 3.296 1.00 0.00 H new ATOM 0 HH21 ARG A 75 19.083 18.264 4.326 1.00 0.00 H new ATOM 0 HH22 ARG A 75 17.513 17.518 4.642 1.00 0.00 H new ATOM 1156 N ALA A 76 24.390 17.143 -0.035 1.00 0.00 N ATOM 1157 CA ALA A 76 25.550 17.243 0.858 1.00 0.00 C ATOM 1158 C ALA A 76 25.401 18.326 1.938 1.00 0.00 C ATOM 1159 O ALA A 76 24.630 19.273 1.781 1.00 0.00 O ATOM 1160 CB ALA A 76 26.778 17.516 -0.018 1.00 0.00 C ATOM 0 H ALA A 76 23.873 18.018 -0.122 1.00 0.00 H new ATOM 0 HA ALA A 76 25.649 16.306 1.407 1.00 0.00 H new ATOM 0 HB1 ALA A 76 27.664 17.597 0.612 1.00 0.00 H new ATOM 0 HB2 ALA A 76 26.910 16.697 -0.725 1.00 0.00 H new ATOM 0 HB3 ALA A 76 26.635 18.448 -0.565 1.00 0.00 H new ATOM 1166 N THR A 77 26.206 18.212 2.997 1.00 0.00 N ATOM 1167 CA THR A 77 26.364 19.226 4.054 1.00 0.00 C ATOM 1168 C THR A 77 27.783 19.797 3.991 1.00 0.00 C ATOM 1169 O THR A 77 28.758 19.041 4.001 1.00 0.00 O ATOM 1170 CB THR A 77 26.078 18.633 5.443 1.00 0.00 C ATOM 1171 OG1 THR A 77 24.773 18.089 5.480 1.00 0.00 O ATOM 1172 CG2 THR A 77 26.162 19.676 6.560 1.00 0.00 C ATOM 0 H THR A 77 26.786 17.387 3.152 1.00 0.00 H new ATOM 0 HA THR A 77 25.642 20.025 3.889 1.00 0.00 H new ATOM 0 HB THR A 77 26.839 17.871 5.608 1.00 0.00 H new ATOM 0 HG1 THR A 77 24.601 17.712 6.368 1.00 0.00 H new ATOM 0 HG21 THR A 77 25.951 19.201 7.518 1.00 0.00 H new ATOM 0 HG22 THR A 77 27.163 20.107 6.581 1.00 0.00 H new ATOM 0 HG23 THR A 77 25.432 20.464 6.377 1.00 0.00 H new ATOM 1180 N GLY A 78 27.905 21.121 3.897 1.00 0.00 N ATOM 1181 CA GLY A 78 29.186 21.825 3.789 1.00 0.00 C ATOM 1182 C GLY A 78 29.836 22.199 5.129 1.00 0.00 C ATOM 1183 O GLY A 78 29.313 21.923 6.212 1.00 0.00 O ATOM 0 H GLY A 78 27.101 21.748 3.894 1.00 0.00 H new ATOM 0 HA2 GLY A 78 29.881 21.200 3.227 1.00 0.00 H new ATOM 0 HA3 GLY A 78 29.035 22.735 3.209 1.00 0.00 H new ATOM 1187 N GLU A 79 31.017 22.814 5.039 1.00 0.00 N ATOM 1188 CA GLU A 79 31.903 23.059 6.185 1.00 0.00 C ATOM 1189 C GLU A 79 31.603 24.326 7.016 1.00 0.00 C ATOM 1190 O GLU A 79 32.123 24.428 8.131 1.00 0.00 O ATOM 1191 CB GLU A 79 33.370 22.976 5.734 1.00 0.00 C ATOM 1192 CG GLU A 79 33.781 21.528 5.429 1.00 0.00 C ATOM 1193 CD GLU A 79 35.275 21.422 5.074 1.00 0.00 C ATOM 1194 OE1 GLU A 79 36.132 21.566 5.982 1.00 0.00 O ATOM 1195 OE2 GLU A 79 35.607 21.152 3.894 1.00 0.00 O ATOM 0 H GLU A 79 31.393 23.162 4.157 1.00 0.00 H new ATOM 0 HA GLU A 79 31.694 22.261 6.898 1.00 0.00 H new ATOM 0 HB2 GLU A 79 33.515 23.592 4.846 1.00 0.00 H new ATOM 0 HB3 GLU A 79 34.015 23.383 6.513 1.00 0.00 H new ATOM 0 HG2 GLU A 79 33.567 20.899 6.293 1.00 0.00 H new ATOM 0 HG3 GLU A 79 33.183 21.147 4.602 1.00 0.00 H new ATOM 1202 N GLU A 80 30.750 25.256 6.559 1.00 0.00 N ATOM 1203 CA GLU A 80 30.254 26.356 7.412 1.00 0.00 C ATOM 1204 C GLU A 80 28.872 26.035 8.014 1.00 0.00 C ATOM 1205 O GLU A 80 28.271 26.860 8.710 1.00 0.00 O ATOM 1206 CB GLU A 80 30.179 27.652 6.616 1.00 0.00 C ATOM 1207 CG GLU A 80 31.533 28.115 6.088 1.00 0.00 C ATOM 1208 CD GLU A 80 32.445 28.650 7.211 1.00 0.00 C ATOM 1209 OE1 GLU A 80 32.278 29.825 7.619 1.00 0.00 O ATOM 1210 OE2 GLU A 80 33.337 27.913 7.699 1.00 0.00 O ATOM 0 H GLU A 80 30.388 25.271 5.606 1.00 0.00 H new ATOM 0 HA GLU A 80 30.961 26.474 8.233 1.00 0.00 H new ATOM 0 HB2 GLU A 80 29.497 27.516 5.777 1.00 0.00 H new ATOM 0 HB3 GLU A 80 29.756 28.434 7.247 1.00 0.00 H new ATOM 0 HG2 GLU A 80 32.028 27.284 5.585 1.00 0.00 H new ATOM 0 HG3 GLU A 80 31.383 28.895 5.342 1.00 0.00 H new ATOM 1217 N GLY A 81 28.367 24.829 7.752 1.00 0.00 N ATOM 1218 CA GLY A 81 27.077 24.305 8.216 1.00 0.00 C ATOM 1219 C GLY A 81 25.936 24.444 7.202 1.00 0.00 C ATOM 1220 O GLY A 81 24.766 24.396 7.585 1.00 0.00 O ATOM 0 H GLY A 81 28.873 24.153 7.179 1.00 0.00 H new ATOM 0 HA2 GLY A 81 27.196 23.251 8.469 1.00 0.00 H new ATOM 0 HA3 GLY A 81 26.797 24.823 9.133 1.00 0.00 H new ATOM 1224 N GLU A 82 26.247 24.643 5.920 1.00 0.00 N ATOM 1225 CA GLU A 82 25.292 24.773 4.823 1.00 0.00 C ATOM 1226 C GLU A 82 24.814 23.437 4.230 1.00 0.00 C ATOM 1227 O GLU A 82 25.388 22.381 4.499 1.00 0.00 O ATOM 1228 CB GLU A 82 25.914 25.653 3.727 1.00 0.00 C ATOM 1229 CG GLU A 82 27.008 25.037 2.830 1.00 0.00 C ATOM 1230 CD GLU A 82 28.447 25.132 3.379 1.00 0.00 C ATOM 1231 OE1 GLU A 82 28.648 25.036 4.611 1.00 0.00 O ATOM 1232 OE2 GLU A 82 29.387 25.207 2.554 1.00 0.00 O ATOM 0 H GLU A 82 27.214 24.721 5.606 1.00 0.00 H new ATOM 0 HA GLU A 82 24.396 25.234 5.239 1.00 0.00 H new ATOM 0 HB2 GLU A 82 25.108 25.998 3.079 1.00 0.00 H new ATOM 0 HB3 GLU A 82 26.336 26.535 4.208 1.00 0.00 H new ATOM 0 HG2 GLU A 82 26.769 23.986 2.665 1.00 0.00 H new ATOM 0 HG3 GLU A 82 26.975 25.528 1.857 1.00 0.00 H new ATOM 1239 N THR A 83 23.818 23.501 3.342 1.00 0.00 N ATOM 1240 CA THR A 83 23.247 22.345 2.629 1.00 0.00 C ATOM 1241 C THR A 83 23.282 22.586 1.119 1.00 0.00 C ATOM 1242 O THR A 83 22.883 23.644 0.630 1.00 0.00 O ATOM 1243 CB THR A 83 21.814 22.051 3.108 1.00 0.00 C ATOM 1244 OG1 THR A 83 21.809 21.778 4.494 1.00 0.00 O ATOM 1245 CG2 THR A 83 21.191 20.830 2.421 1.00 0.00 C ATOM 0 H THR A 83 23.371 24.382 3.089 1.00 0.00 H new ATOM 0 HA THR A 83 23.855 21.468 2.853 1.00 0.00 H new ATOM 0 HB THR A 83 21.234 22.940 2.861 1.00 0.00 H new ATOM 0 HG1 THR A 83 20.892 21.594 4.788 1.00 0.00 H new ATOM 0 HG21 THR A 83 20.181 20.675 2.801 1.00 0.00 H new ATOM 0 HG22 THR A 83 21.152 20.999 1.345 1.00 0.00 H new ATOM 0 HG23 THR A 83 21.796 19.948 2.628 1.00 0.00 H new ATOM 1253 N VAL A 84 23.739 21.583 0.368 1.00 0.00 N ATOM 1254 CA VAL A 84 23.875 21.600 -1.097 1.00 0.00 C ATOM 1255 C VAL A 84 22.972 20.540 -1.711 1.00 0.00 C ATOM 1256 O VAL A 84 22.862 19.438 -1.176 1.00 0.00 O ATOM 1257 CB VAL A 84 25.335 21.352 -1.518 1.00 0.00 C ATOM 1258 CG1 VAL A 84 25.545 21.461 -3.034 1.00 0.00 C ATOM 1259 CG2 VAL A 84 26.273 22.352 -0.842 1.00 0.00 C ATOM 0 H VAL A 84 24.038 20.698 0.777 1.00 0.00 H new ATOM 0 HA VAL A 84 23.578 22.585 -1.458 1.00 0.00 H new ATOM 0 HB VAL A 84 25.562 20.333 -1.205 1.00 0.00 H new ATOM 0 HG11 VAL A 84 26.593 21.276 -3.270 1.00 0.00 H new ATOM 0 HG12 VAL A 84 24.923 20.723 -3.541 1.00 0.00 H new ATOM 0 HG13 VAL A 84 25.268 22.461 -3.369 1.00 0.00 H new ATOM 0 HG21 VAL A 84 27.299 22.157 -1.155 1.00 0.00 H new ATOM 0 HG22 VAL A 84 25.992 23.365 -1.129 1.00 0.00 H new ATOM 0 HG23 VAL A 84 26.197 22.247 0.240 1.00 0.00 H new ATOM 1269 N LEU A 85 22.372 20.866 -2.854 1.00 0.00 N ATOM 1270 CA LEU A 85 21.517 19.979 -3.634 1.00 0.00 C ATOM 1271 C LEU A 85 21.883 20.040 -5.134 1.00 0.00 C ATOM 1272 O LEU A 85 22.300 21.073 -5.656 1.00 0.00 O ATOM 1273 CB LEU A 85 20.052 20.361 -3.336 1.00 0.00 C ATOM 1274 CG LEU A 85 18.979 19.456 -3.971 1.00 0.00 C ATOM 1275 CD1 LEU A 85 18.823 18.123 -3.241 1.00 0.00 C ATOM 1276 CD2 LEU A 85 17.625 20.148 -3.921 1.00 0.00 C ATOM 0 H LEU A 85 22.473 21.789 -3.276 1.00 0.00 H new ATOM 0 HA LEU A 85 21.664 18.937 -3.351 1.00 0.00 H new ATOM 0 HB2 LEU A 85 19.909 20.359 -2.255 1.00 0.00 H new ATOM 0 HB3 LEU A 85 19.886 21.383 -3.677 1.00 0.00 H new ATOM 0 HG LEU A 85 19.307 19.268 -4.993 1.00 0.00 H new ATOM 0 HD11 LEU A 85 18.054 17.527 -3.732 1.00 0.00 H new ATOM 0 HD12 LEU A 85 19.770 17.583 -3.263 1.00 0.00 H new ATOM 0 HD13 LEU A 85 18.534 18.307 -2.206 1.00 0.00 H new ATOM 0 HD21 LEU A 85 16.870 19.503 -4.371 1.00 0.00 H new ATOM 0 HD22 LEU A 85 17.358 20.350 -2.884 1.00 0.00 H new ATOM 0 HD23 LEU A 85 17.676 21.087 -4.472 1.00 0.00 H new ATOM 1288 N VAL A 86 21.707 18.921 -5.829 1.00 0.00 N ATOM 1289 CA VAL A 86 21.936 18.730 -7.272 1.00 0.00 C ATOM 1290 C VAL A 86 20.744 17.982 -7.842 1.00 0.00 C ATOM 1291 O VAL A 86 20.311 17.010 -7.229 1.00 0.00 O ATOM 1292 CB VAL A 86 23.213 17.911 -7.540 1.00 0.00 C ATOM 1293 CG1 VAL A 86 23.383 17.647 -9.040 1.00 0.00 C ATOM 1294 CG2 VAL A 86 24.466 18.626 -7.020 1.00 0.00 C ATOM 0 H VAL A 86 21.381 18.066 -5.379 1.00 0.00 H new ATOM 0 HA VAL A 86 22.058 19.706 -7.741 1.00 0.00 H new ATOM 0 HB VAL A 86 23.100 16.967 -7.007 1.00 0.00 H new ATOM 0 HG11 VAL A 86 24.291 17.067 -9.207 1.00 0.00 H new ATOM 0 HG12 VAL A 86 22.523 17.089 -9.411 1.00 0.00 H new ATOM 0 HG13 VAL A 86 23.456 18.596 -9.571 1.00 0.00 H new ATOM 0 HG21 VAL A 86 25.345 18.017 -7.228 1.00 0.00 H new ATOM 0 HG22 VAL A 86 24.567 19.591 -7.517 1.00 0.00 H new ATOM 0 HG23 VAL A 86 24.377 18.780 -5.945 1.00 0.00 H new ATOM 1304 N GLU A 87 20.215 18.392 -8.997 1.00 0.00 N ATOM 1305 CA GLU A 87 19.017 17.774 -9.574 1.00 0.00 C ATOM 1306 C GLU A 87 19.117 17.578 -11.098 1.00 0.00 C ATOM 1307 O GLU A 87 19.615 18.441 -11.823 1.00 0.00 O ATOM 1308 CB GLU A 87 17.750 18.549 -9.152 1.00 0.00 C ATOM 1309 CG GLU A 87 17.634 18.700 -7.623 1.00 0.00 C ATOM 1310 CD GLU A 87 16.279 19.269 -7.170 1.00 0.00 C ATOM 1311 OE1 GLU A 87 15.343 18.470 -6.919 1.00 0.00 O ATOM 1312 OE2 GLU A 87 16.161 20.510 -7.026 1.00 0.00 O ATOM 0 H GLU A 87 20.600 19.154 -9.555 1.00 0.00 H new ATOM 0 HA GLU A 87 18.939 16.766 -9.165 1.00 0.00 H new ATOM 0 HB2 GLU A 87 17.762 19.537 -9.612 1.00 0.00 H new ATOM 0 HB3 GLU A 87 16.868 18.032 -9.531 1.00 0.00 H new ATOM 0 HG2 GLU A 87 17.786 17.727 -7.156 1.00 0.00 H new ATOM 0 HG3 GLU A 87 18.432 19.352 -7.268 1.00 0.00 H new ATOM 1319 N GLU A 88 18.664 16.415 -11.577 1.00 0.00 N ATOM 1320 CA GLU A 88 18.669 16.049 -13.002 1.00 0.00 C ATOM 1321 C GLU A 88 17.567 15.035 -13.377 1.00 0.00 C ATOM 1322 O GLU A 88 17.126 14.291 -12.505 1.00 0.00 O ATOM 1323 CB GLU A 88 20.063 15.528 -13.374 1.00 0.00 C ATOM 1324 CG GLU A 88 20.585 14.406 -12.476 1.00 0.00 C ATOM 1325 CD GLU A 88 21.900 13.874 -13.052 1.00 0.00 C ATOM 1326 OE1 GLU A 88 22.943 14.533 -12.868 1.00 0.00 O ATOM 1327 OE2 GLU A 88 21.920 12.802 -13.700 1.00 0.00 O ATOM 0 H GLU A 88 18.276 15.687 -10.977 1.00 0.00 H new ATOM 0 HA GLU A 88 18.440 16.944 -13.580 1.00 0.00 H new ATOM 0 HB2 GLU A 88 20.040 15.170 -14.403 1.00 0.00 H new ATOM 0 HB3 GLU A 88 20.768 16.359 -13.341 1.00 0.00 H new ATOM 0 HG2 GLU A 88 20.741 14.777 -11.463 1.00 0.00 H new ATOM 0 HG3 GLU A 88 19.851 13.603 -12.412 1.00 0.00 H new ATOM 1334 N PRO A 89 17.085 14.984 -14.635 1.00 0.00 N ATOM 1335 CA PRO A 89 15.916 14.180 -15.014 1.00 0.00 C ATOM 1336 C PRO A 89 16.104 12.659 -14.841 1.00 0.00 C ATOM 1337 O PRO A 89 17.173 12.100 -15.115 1.00 0.00 O ATOM 1338 CB PRO A 89 15.594 14.565 -16.461 1.00 0.00 C ATOM 1339 CG PRO A 89 16.927 15.082 -16.998 1.00 0.00 C ATOM 1340 CD PRO A 89 17.540 15.763 -15.778 1.00 0.00 C ATOM 0 HA PRO A 89 15.087 14.399 -14.341 1.00 0.00 H new ATOM 0 HB2 PRO A 89 15.235 13.710 -17.034 1.00 0.00 H new ATOM 0 HB3 PRO A 89 14.818 15.329 -16.510 1.00 0.00 H new ATOM 0 HG2 PRO A 89 17.556 14.272 -17.368 1.00 0.00 H new ATOM 0 HG3 PRO A 89 16.787 15.780 -17.824 1.00 0.00 H new ATOM 0 HD2 PRO A 89 18.628 15.774 -15.839 1.00 0.00 H new ATOM 0 HD3 PRO A 89 17.215 16.801 -15.702 1.00 0.00 H new ATOM 1348 N ARG A 90 15.022 12.004 -14.395 1.00 0.00 N ATOM 1349 CA ARG A 90 14.937 10.581 -14.014 1.00 0.00 C ATOM 1350 C ARG A 90 14.320 9.693 -15.103 1.00 0.00 C ATOM 1351 O ARG A 90 14.950 8.667 -15.450 1.00 0.00 O ATOM 1352 CB ARG A 90 14.204 10.467 -12.664 1.00 0.00 C ATOM 1353 CG ARG A 90 14.486 9.151 -11.930 1.00 0.00 C ATOM 1354 CD ARG A 90 13.904 9.231 -10.515 1.00 0.00 C ATOM 1355 NE ARG A 90 12.429 9.167 -10.503 1.00 0.00 N ATOM 1356 CZ ARG A 90 11.588 9.998 -9.915 1.00 0.00 C ATOM 1357 NH1 ARG A 90 11.976 11.044 -9.245 1.00 0.00 N ATOM 1358 NH2 ARG A 90 10.307 9.807 -10.010 1.00 0.00 N ATOM 1359 OXT ARG A 90 13.220 10.013 -15.608 1.00 0.00 O ATOM 0 H ARG A 90 14.127 12.480 -14.283 1.00 0.00 H new ATOM 0 HA ARG A 90 15.950 10.196 -13.901 1.00 0.00 H new ATOM 0 HB2 ARG A 90 14.499 11.301 -12.027 1.00 0.00 H new ATOM 0 HB3 ARG A 90 13.131 10.558 -12.832 1.00 0.00 H new ATOM 0 HG2 ARG A 90 14.043 8.316 -12.472 1.00 0.00 H new ATOM 0 HG3 ARG A 90 15.560 8.968 -11.885 1.00 0.00 H new ATOM 0 HD2 ARG A 90 14.304 8.414 -9.915 1.00 0.00 H new ATOM 0 HD3 ARG A 90 14.227 10.160 -10.045 1.00 0.00 H new ATOM 0 HE ARG A 90 12.009 8.387 -11.010 1.00 0.00 H new ATOM 0 HH11 ARG A 90 12.970 11.253 -9.156 1.00 0.00 H new ATOM 0 HH12 ARG A 90 11.286 11.655 -8.809 1.00 0.00 H new ATOM 0 HH21 ARG A 90 9.948 9.013 -10.540 1.00 0.00 H new ATOM 0 HH22 ARG A 90 9.660 10.451 -9.555 1.00 0.00 H new TER 1373 ARG A 90