USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 802 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 52 SER OG : rot 180:sc= -0.949 USER MOD Set 1.2: A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 43:sc= 0.377 USER MOD Single : A 3 SER OG : rot 1:sc= 0.696 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 14 CYS SG : rot 180:sc= -0.925 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 LYS NZ :NH3+ -152:sc= -5.4! (180deg=-7.85!) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc= 0 X(o=0,f=-0.036) USER MOD Single : A 37 ASN : amide:sc= 0.377 K(o=0.38,f=-3.1!) USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.0881! USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 ASN : amide:sc= -2.43 K(o=-2.4,f=-9.9!) USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 GLN : amide:sc= -0.0141 K(o=-0.014,f=-0.77) USER MOD Single : A 76 SER OG : rot 180:sc= 0.0443 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 HIS : no HE2:sc= -3.85 K(o=-3.8,f=-10!) USER MOD Single : A 87 GLN : amide:sc= -1.53 X(o=-1.5,f=-1.3) USER MOD Single : A 91 SER OG : rot -86:sc= 0.137 USER MOD Single : A 95 THR OG1 : rot 73:sc= 0.87 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 CYS SG : rot 4:sc= 0.238 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -4.123 24.345 -7.193 1.00 0.00 N ATOM 2 CA GLY A 1 -4.671 24.686 -8.492 1.00 0.00 C ATOM 3 C GLY A 1 -6.123 25.115 -8.415 1.00 0.00 C ATOM 4 O GLY A 1 -6.444 26.284 -8.625 1.00 0.00 O ATOM 0 H1 GLY A 1 -3.129 24.059 -7.300 1.00 0.00 H new ATOM 0 H2 GLY A 1 -4.179 25.172 -6.565 1.00 0.00 H new ATOM 0 H3 GLY A 1 -4.667 23.560 -6.782 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -4.081 25.490 -8.932 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -4.584 23.826 -9.156 1.00 0.00 H new ATOM 8 N SER A 2 -7.003 24.166 -8.115 1.00 0.00 N ATOM 9 CA SER A 2 -8.430 24.450 -8.016 1.00 0.00 C ATOM 10 C SER A 2 -8.902 24.365 -6.567 1.00 0.00 C ATOM 11 O SER A 2 -9.093 23.275 -6.028 1.00 0.00 O ATOM 12 CB SER A 2 -9.228 23.473 -8.882 1.00 0.00 C ATOM 13 OG SER A 2 -8.874 22.131 -8.595 1.00 0.00 O ATOM 0 H SER A 2 -6.753 23.193 -7.936 1.00 0.00 H new ATOM 0 HA SER A 2 -8.599 25.465 -8.376 1.00 0.00 H new ATOM 0 HB2 SER A 2 -10.295 23.616 -8.709 1.00 0.00 H new ATOM 0 HB3 SER A 2 -9.045 23.683 -9.936 1.00 0.00 H new ATOM 0 HG SER A 2 -8.797 22.013 -7.625 1.00 0.00 H new ATOM 19 N SER A 3 -9.088 25.523 -5.943 1.00 0.00 N ATOM 20 CA SER A 3 -9.534 25.582 -4.556 1.00 0.00 C ATOM 21 C SER A 3 -10.765 24.705 -4.344 1.00 0.00 C ATOM 22 O SER A 3 -11.796 24.897 -4.986 1.00 0.00 O ATOM 23 CB SER A 3 -9.848 27.025 -4.159 1.00 0.00 C ATOM 24 OG SER A 3 -11.092 27.443 -4.693 1.00 0.00 O ATOM 0 H SER A 3 -8.937 26.434 -6.376 1.00 0.00 H new ATOM 0 HA SER A 3 -8.728 25.207 -3.925 1.00 0.00 H new ATOM 0 HB2 SER A 3 -9.868 27.110 -3.073 1.00 0.00 H new ATOM 0 HB3 SER A 3 -9.056 27.684 -4.515 1.00 0.00 H new ATOM 0 HG SER A 3 -11.498 26.705 -5.193 1.00 0.00 H new ATOM 30 N GLY A 4 -10.647 23.740 -3.436 1.00 0.00 N ATOM 31 CA GLY A 4 -11.756 22.848 -3.154 1.00 0.00 C ATOM 32 C GLY A 4 -11.334 21.634 -2.350 1.00 0.00 C ATOM 33 O GLY A 4 -11.688 20.504 -2.687 1.00 0.00 O ATOM 0 H GLY A 4 -9.803 23.561 -2.891 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -12.526 23.392 -2.607 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -12.203 22.521 -4.093 1.00 0.00 H new ATOM 37 N SER A 5 -10.573 21.867 -1.286 1.00 0.00 N ATOM 38 CA SER A 5 -10.097 20.783 -0.435 1.00 0.00 C ATOM 39 C SER A 5 -11.258 20.118 0.298 1.00 0.00 C ATOM 40 O SER A 5 -12.020 20.777 1.005 1.00 0.00 O ATOM 41 CB SER A 5 -9.076 21.310 0.576 1.00 0.00 C ATOM 42 OG SER A 5 -7.814 21.515 -0.035 1.00 0.00 O ATOM 0 H SER A 5 -10.273 22.797 -0.993 1.00 0.00 H new ATOM 0 HA SER A 5 -9.617 20.039 -1.071 1.00 0.00 H new ATOM 0 HB2 SER A 5 -9.433 22.247 1.004 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.975 20.602 1.399 1.00 0.00 H new ATOM 0 HG SER A 5 -7.179 21.853 0.631 1.00 0.00 H new ATOM 48 N SER A 6 -11.386 18.806 0.124 1.00 0.00 N ATOM 49 CA SER A 6 -12.456 18.051 0.765 1.00 0.00 C ATOM 50 C SER A 6 -11.886 16.984 1.695 1.00 0.00 C ATOM 51 O SER A 6 -11.843 15.803 1.351 1.00 0.00 O ATOM 52 CB SER A 6 -13.351 17.398 -0.290 1.00 0.00 C ATOM 53 OG SER A 6 -14.165 18.362 -0.936 1.00 0.00 O ATOM 0 H SER A 6 -10.762 18.244 -0.455 1.00 0.00 H new ATOM 0 HA SER A 6 -13.052 18.745 1.358 1.00 0.00 H new ATOM 0 HB2 SER A 6 -12.734 16.885 -1.028 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.980 16.642 0.180 1.00 0.00 H new ATOM 0 HG SER A 6 -14.726 17.920 -1.607 1.00 0.00 H new ATOM 59 N GLY A 7 -11.448 17.410 2.876 1.00 0.00 N ATOM 60 CA GLY A 7 -10.886 16.480 3.838 1.00 0.00 C ATOM 61 C GLY A 7 -9.374 16.555 3.902 1.00 0.00 C ATOM 62 O GLY A 7 -8.708 16.934 2.938 1.00 0.00 O ATOM 0 H GLY A 7 -11.472 18.382 3.184 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -11.299 16.689 4.825 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -11.186 15.465 3.575 1.00 0.00 H new ATOM 66 N PRO A 8 -8.808 16.191 5.062 1.00 0.00 N ATOM 67 CA PRO A 8 -7.358 16.212 5.277 1.00 0.00 C ATOM 68 C PRO A 8 -6.638 15.134 4.474 1.00 0.00 C ATOM 69 O PRO A 8 -7.248 14.157 4.040 1.00 0.00 O ATOM 70 CB PRO A 8 -7.217 15.944 6.777 1.00 0.00 C ATOM 71 CG PRO A 8 -8.453 15.198 7.146 1.00 0.00 C ATOM 72 CD PRO A 8 -9.540 15.729 6.254 1.00 0.00 C ATOM 0 HA PRO A 8 -6.912 17.153 4.955 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -6.323 15.359 6.992 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -7.133 16.874 7.339 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -8.319 14.126 7.002 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -8.701 15.350 8.196 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -10.268 14.957 6.004 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -10.088 16.542 6.729 1.00 0.00 H new ATOM 80 N GLY A 9 -5.335 15.318 4.280 1.00 0.00 N ATOM 81 CA GLY A 9 -4.553 14.353 3.529 1.00 0.00 C ATOM 82 C GLY A 9 -3.062 14.525 3.739 1.00 0.00 C ATOM 83 O GLY A 9 -2.342 13.551 3.964 1.00 0.00 O ATOM 0 H GLY A 9 -4.807 16.118 4.630 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -4.844 13.345 3.825 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -4.781 14.452 2.468 1.00 0.00 H new ATOM 87 N LEU A 10 -2.596 15.767 3.665 1.00 0.00 N ATOM 88 CA LEU A 10 -1.179 16.064 3.847 1.00 0.00 C ATOM 89 C LEU A 10 -0.827 16.148 5.329 1.00 0.00 C ATOM 90 O LEU A 10 -0.046 17.004 5.743 1.00 0.00 O ATOM 91 CB LEU A 10 -0.819 17.377 3.150 1.00 0.00 C ATOM 92 CG LEU A 10 -1.772 18.549 3.393 1.00 0.00 C ATOM 93 CD1 LEU A 10 -2.919 18.520 2.395 1.00 0.00 C ATOM 94 CD2 LEU A 10 -2.303 18.517 4.819 1.00 0.00 C ATOM 0 H LEU A 10 -3.178 16.584 3.480 1.00 0.00 H new ATOM 0 HA LEU A 10 -0.603 15.254 3.401 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.179 17.674 3.471 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -0.767 17.193 2.077 1.00 0.00 H new ATOM 0 HG LEU A 10 -1.219 19.478 3.253 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -3.586 19.361 2.583 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -2.522 18.591 1.382 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.472 17.587 2.503 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -2.979 19.358 4.974 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -2.840 17.583 4.986 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.470 18.587 5.519 1.00 0.00 H new ATOM 106 N ARG A 11 -1.406 15.252 6.121 1.00 0.00 N ATOM 107 CA ARG A 11 -1.152 15.224 7.557 1.00 0.00 C ATOM 108 C ARG A 11 -0.370 13.973 7.946 1.00 0.00 C ATOM 109 O ARG A 11 -0.518 12.920 7.328 1.00 0.00 O ATOM 110 CB ARG A 11 -2.471 15.276 8.330 1.00 0.00 C ATOM 111 CG ARG A 11 -3.201 16.603 8.202 1.00 0.00 C ATOM 112 CD ARG A 11 -4.538 16.575 8.925 1.00 0.00 C ATOM 113 NE ARG A 11 -4.390 16.806 10.359 1.00 0.00 N ATOM 114 CZ ARG A 11 -5.415 16.990 11.184 1.00 0.00 C ATOM 115 NH1 ARG A 11 -6.656 16.969 10.719 1.00 0.00 N ATOM 116 NH2 ARG A 11 -5.199 17.195 12.477 1.00 0.00 N ATOM 0 H ARG A 11 -2.054 14.536 5.793 1.00 0.00 H new ATOM 0 HA ARG A 11 -0.554 16.099 7.813 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -3.122 14.477 7.975 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -2.273 15.081 9.384 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -2.582 17.401 8.611 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -3.361 16.832 7.148 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -5.195 17.335 8.501 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -5.019 15.611 8.761 1.00 0.00 H new ATOM 0 HE ARG A 11 -3.448 16.827 10.749 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -6.826 16.811 9.726 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -7.441 17.111 11.354 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -4.245 17.211 12.838 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -5.987 17.336 13.110 1.00 0.00 H new ATOM 130 N GLU A 12 0.462 14.099 8.975 1.00 0.00 N ATOM 131 CA GLU A 12 1.269 12.978 9.446 1.00 0.00 C ATOM 132 C GLU A 12 0.381 11.836 9.931 1.00 0.00 C ATOM 133 O GLU A 12 -0.296 11.952 10.954 1.00 0.00 O ATOM 134 CB GLU A 12 2.200 13.429 10.572 1.00 0.00 C ATOM 135 CG GLU A 12 3.211 12.373 10.986 1.00 0.00 C ATOM 136 CD GLU A 12 3.969 12.752 12.243 1.00 0.00 C ATOM 137 OE1 GLU A 12 3.343 12.793 13.323 1.00 0.00 O ATOM 138 OE2 GLU A 12 5.188 13.007 12.148 1.00 0.00 O ATOM 0 H GLU A 12 0.595 14.964 9.498 1.00 0.00 H new ATOM 0 HA GLU A 12 1.870 12.619 8.611 1.00 0.00 H new ATOM 0 HB2 GLU A 12 2.733 14.325 10.254 1.00 0.00 H new ATOM 0 HB3 GLU A 12 1.600 13.705 11.439 1.00 0.00 H new ATOM 0 HG2 GLU A 12 2.696 11.426 11.148 1.00 0.00 H new ATOM 0 HG3 GLU A 12 3.919 12.215 10.173 1.00 0.00 H new ATOM 145 N LEU A 13 0.389 10.733 9.191 1.00 0.00 N ATOM 146 CA LEU A 13 -0.415 9.568 9.545 1.00 0.00 C ATOM 147 C LEU A 13 0.474 8.393 9.940 1.00 0.00 C ATOM 148 O LEU A 13 1.664 8.369 9.626 1.00 0.00 O ATOM 149 CB LEU A 13 -1.315 9.170 8.373 1.00 0.00 C ATOM 150 CG LEU A 13 -2.541 10.053 8.139 1.00 0.00 C ATOM 151 CD1 LEU A 13 -3.065 9.875 6.723 1.00 0.00 C ATOM 152 CD2 LEU A 13 -3.628 9.736 9.156 1.00 0.00 C ATOM 0 H LEU A 13 0.943 10.621 8.342 1.00 0.00 H new ATOM 0 HA LEU A 13 -1.037 9.832 10.400 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.714 9.169 7.464 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.654 8.146 8.533 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.245 11.094 8.266 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.938 10.511 6.575 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.289 10.153 6.010 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -3.345 8.833 6.567 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -4.493 10.374 8.975 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -3.922 8.691 9.061 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -3.249 9.916 10.162 1.00 0.00 H new ATOM 164 N CYS A 14 -0.113 7.420 10.628 1.00 0.00 N ATOM 165 CA CYS A 14 0.625 6.240 11.065 1.00 0.00 C ATOM 166 C CYS A 14 -0.226 4.983 10.923 1.00 0.00 C ATOM 167 O CYS A 14 -1.456 5.049 10.932 1.00 0.00 O ATOM 168 CB CYS A 14 1.076 6.404 12.518 1.00 0.00 C ATOM 169 SG CYS A 14 1.398 8.116 13.002 1.00 0.00 S ATOM 0 H CYS A 14 -1.097 7.425 10.895 1.00 0.00 H new ATOM 0 HA CYS A 14 1.504 6.135 10.429 1.00 0.00 H new ATOM 0 HB2 CYS A 14 0.310 5.990 13.174 1.00 0.00 H new ATOM 0 HB3 CYS A 14 1.981 5.817 12.675 1.00 0.00 H new ATOM 0 HG CYS A 14 1.771 8.152 14.247 1.00 0.00 H new ATOM 175 N ILE A 15 0.436 3.838 10.790 1.00 0.00 N ATOM 176 CA ILE A 15 -0.260 2.566 10.645 1.00 0.00 C ATOM 177 C ILE A 15 0.160 1.582 11.731 1.00 0.00 C ATOM 178 O ILE A 15 1.280 1.072 11.719 1.00 0.00 O ATOM 179 CB ILE A 15 0.004 1.934 9.265 1.00 0.00 C ATOM 180 CG1 ILE A 15 -0.481 2.865 8.152 1.00 0.00 C ATOM 181 CG2 ILE A 15 -0.678 0.578 9.164 1.00 0.00 C ATOM 182 CD1 ILE A 15 -0.085 2.407 6.766 1.00 0.00 C ATOM 0 H ILE A 15 1.453 3.766 10.780 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.325 2.777 10.742 1.00 0.00 H new ATOM 0 HB ILE A 15 1.078 1.788 9.148 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -1.567 2.944 8.203 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -0.080 3.864 8.324 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -0.482 0.144 8.183 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -0.289 -0.084 9.938 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -1.753 0.700 9.298 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -0.462 3.114 6.027 1.00 0.00 H new ATOM 0 HD12 ILE A 15 1.002 2.355 6.697 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -0.509 1.421 6.574 1.00 0.00 H new ATOM 194 N GLN A 16 -0.746 1.320 12.667 1.00 0.00 N ATOM 195 CA GLN A 16 -0.469 0.396 13.760 1.00 0.00 C ATOM 196 C GLN A 16 -0.738 -1.045 13.337 1.00 0.00 C ATOM 197 O GLN A 16 -1.877 -1.418 13.055 1.00 0.00 O ATOM 198 CB GLN A 16 -1.319 0.748 14.982 1.00 0.00 C ATOM 199 CG GLN A 16 -0.626 1.689 15.955 1.00 0.00 C ATOM 200 CD GLN A 16 -1.603 2.547 16.733 1.00 0.00 C ATOM 201 OE1 GLN A 16 -1.824 2.332 17.925 1.00 0.00 O ATOM 202 NE2 GLN A 16 -2.196 3.528 16.061 1.00 0.00 N ATOM 0 H GLN A 16 -1.678 1.734 12.690 1.00 0.00 H new ATOM 0 HA GLN A 16 0.585 0.488 14.021 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.250 1.206 14.647 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -1.586 -0.170 15.505 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -0.025 1.106 16.653 1.00 0.00 H new ATOM 0 HG3 GLN A 16 0.060 2.334 15.405 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -1.984 3.671 15.074 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -2.864 4.138 16.533 1.00 0.00 H new ATOM 211 N LYS A 17 0.318 -1.851 13.295 1.00 0.00 N ATOM 212 CA LYS A 17 0.196 -3.251 12.907 1.00 0.00 C ATOM 213 C LYS A 17 0.790 -4.165 13.974 1.00 0.00 C ATOM 214 O LYS A 17 1.432 -3.699 14.915 1.00 0.00 O ATOM 215 CB LYS A 17 0.895 -3.493 11.567 1.00 0.00 C ATOM 216 CG LYS A 17 2.365 -3.851 11.704 1.00 0.00 C ATOM 217 CD LYS A 17 3.158 -3.430 10.477 1.00 0.00 C ATOM 218 CE LYS A 17 3.396 -1.928 10.456 1.00 0.00 C ATOM 219 NZ LYS A 17 4.663 -1.558 11.145 1.00 0.00 N ATOM 0 H LYS A 17 1.268 -1.558 13.525 1.00 0.00 H new ATOM 0 HA LYS A 17 -0.864 -3.482 12.804 1.00 0.00 H new ATOM 0 HB2 LYS A 17 0.382 -4.296 11.039 1.00 0.00 H new ATOM 0 HB3 LYS A 17 0.803 -2.598 10.952 1.00 0.00 H new ATOM 0 HG2 LYS A 17 2.778 -3.366 12.589 1.00 0.00 H new ATOM 0 HG3 LYS A 17 2.466 -4.926 11.853 1.00 0.00 H new ATOM 0 HD2 LYS A 17 4.115 -3.951 10.464 1.00 0.00 H new ATOM 0 HD3 LYS A 17 2.621 -3.727 9.576 1.00 0.00 H new ATOM 0 HE2 LYS A 17 3.429 -1.580 9.424 1.00 0.00 H new ATOM 0 HE3 LYS A 17 2.560 -1.421 10.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.581 -0.595 11.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 4.844 -2.226 11.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 5.450 -1.593 10.466 1.00 0.00 H new ATOM 233 N ALA A 18 0.573 -5.466 13.820 1.00 0.00 N ATOM 234 CA ALA A 18 1.089 -6.445 14.769 1.00 0.00 C ATOM 235 C ALA A 18 2.548 -6.161 15.111 1.00 0.00 C ATOM 236 O ALA A 18 3.216 -5.352 14.466 1.00 0.00 O ATOM 237 CB ALA A 18 0.941 -7.852 14.209 1.00 0.00 C ATOM 0 H ALA A 18 0.043 -5.867 13.047 1.00 0.00 H new ATOM 0 HA ALA A 18 0.506 -6.368 15.686 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.330 -8.573 14.928 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -0.112 -8.060 14.021 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.499 -7.933 13.276 1.00 0.00 H new ATOM 243 N PRO A 19 3.056 -6.839 16.150 1.00 0.00 N ATOM 244 CA PRO A 19 4.441 -6.676 16.601 1.00 0.00 C ATOM 245 C PRO A 19 5.446 -7.251 15.609 1.00 0.00 C ATOM 246 O PRO A 19 6.651 -7.244 15.856 1.00 0.00 O ATOM 247 CB PRO A 19 4.481 -7.459 17.916 1.00 0.00 C ATOM 248 CG PRO A 19 3.395 -8.470 17.787 1.00 0.00 C ATOM 249 CD PRO A 19 2.318 -7.819 16.964 1.00 0.00 C ATOM 0 HA PRO A 19 4.714 -5.626 16.705 1.00 0.00 H new ATOM 0 HB2 PRO A 19 5.450 -7.935 18.064 1.00 0.00 H new ATOM 0 HB3 PRO A 19 4.314 -6.805 18.772 1.00 0.00 H new ATOM 0 HG2 PRO A 19 3.761 -9.376 17.304 1.00 0.00 H new ATOM 0 HG3 PRO A 19 3.015 -8.762 18.766 1.00 0.00 H new ATOM 0 HD2 PRO A 19 1.794 -8.545 16.342 1.00 0.00 H new ATOM 0 HD3 PRO A 19 1.569 -7.337 17.592 1.00 0.00 H new ATOM 257 N GLY A 20 4.941 -7.749 14.484 1.00 0.00 N ATOM 258 CA GLY A 20 5.809 -8.321 13.471 1.00 0.00 C ATOM 259 C GLY A 20 5.059 -8.690 12.206 1.00 0.00 C ATOM 260 O GLY A 20 5.308 -9.739 11.613 1.00 0.00 O ATOM 0 H GLY A 20 3.947 -7.766 14.256 1.00 0.00 H new ATOM 0 HA2 GLY A 20 6.597 -7.608 13.228 1.00 0.00 H new ATOM 0 HA3 GLY A 20 6.296 -9.209 13.873 1.00 0.00 H new ATOM 264 N GLU A 21 4.136 -7.826 11.794 1.00 0.00 N ATOM 265 CA GLU A 21 3.346 -8.069 10.592 1.00 0.00 C ATOM 266 C GLU A 21 3.783 -7.147 9.458 1.00 0.00 C ATOM 267 O GLU A 21 4.195 -6.010 9.691 1.00 0.00 O ATOM 268 CB GLU A 21 1.858 -7.867 10.884 1.00 0.00 C ATOM 269 CG GLU A 21 0.979 -7.944 9.648 1.00 0.00 C ATOM 270 CD GLU A 21 1.175 -9.232 8.872 1.00 0.00 C ATOM 271 OE1 GLU A 21 1.530 -10.253 9.496 1.00 0.00 O ATOM 272 OE2 GLU A 21 0.974 -9.218 7.639 1.00 0.00 O ATOM 0 H GLU A 21 3.917 -6.953 12.274 1.00 0.00 H new ATOM 0 HA GLU A 21 3.511 -9.101 10.282 1.00 0.00 H new ATOM 0 HB2 GLU A 21 1.531 -8.622 11.599 1.00 0.00 H new ATOM 0 HB3 GLU A 21 1.718 -6.896 11.359 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -0.066 -7.858 9.944 1.00 0.00 H new ATOM 0 HG3 GLU A 21 1.197 -7.096 8.998 1.00 0.00 H new ATOM 279 N ARG A 22 3.691 -7.645 8.229 1.00 0.00 N ATOM 280 CA ARG A 22 4.078 -6.868 7.058 1.00 0.00 C ATOM 281 C ARG A 22 2.936 -5.961 6.606 1.00 0.00 C ATOM 282 O ARG A 22 1.833 -6.429 6.321 1.00 0.00 O ATOM 283 CB ARG A 22 4.488 -7.797 5.915 1.00 0.00 C ATOM 284 CG ARG A 22 5.929 -8.272 6.004 1.00 0.00 C ATOM 285 CD ARG A 22 6.907 -7.118 5.847 1.00 0.00 C ATOM 286 NE ARG A 22 8.279 -7.583 5.667 1.00 0.00 N ATOM 287 CZ ARG A 22 9.021 -8.081 6.651 1.00 0.00 C ATOM 288 NH1 ARG A 22 8.524 -8.179 7.876 1.00 0.00 N ATOM 289 NH2 ARG A 22 10.262 -8.484 6.409 1.00 0.00 N ATOM 0 H ARG A 22 3.352 -8.584 8.019 1.00 0.00 H new ATOM 0 HA ARG A 22 4.929 -6.244 7.332 1.00 0.00 H new ATOM 0 HB2 ARG A 22 3.828 -8.664 5.908 1.00 0.00 H new ATOM 0 HB3 ARG A 22 4.343 -7.279 4.967 1.00 0.00 H new ATOM 0 HG2 ARG A 22 6.093 -8.761 6.964 1.00 0.00 H new ATOM 0 HG3 ARG A 22 6.116 -9.017 5.230 1.00 0.00 H new ATOM 0 HD2 ARG A 22 6.615 -6.510 4.991 1.00 0.00 H new ATOM 0 HD3 ARG A 22 6.854 -6.476 6.726 1.00 0.00 H new ATOM 0 HE ARG A 22 8.691 -7.522 4.736 1.00 0.00 H new ATOM 0 HH11 ARG A 22 7.570 -7.872 8.065 1.00 0.00 H new ATOM 0 HH12 ARG A 22 9.096 -8.562 8.629 1.00 0.00 H new ATOM 0 HH21 ARG A 22 10.647 -8.412 5.467 1.00 0.00 H new ATOM 0 HH22 ARG A 22 10.831 -8.866 7.165 1.00 0.00 H new ATOM 303 N LEU A 23 3.209 -4.662 6.544 1.00 0.00 N ATOM 304 CA LEU A 23 2.205 -3.689 6.127 1.00 0.00 C ATOM 305 C LEU A 23 1.270 -4.286 5.079 1.00 0.00 C ATOM 306 O LEU A 23 0.050 -4.167 5.181 1.00 0.00 O ATOM 307 CB LEU A 23 2.882 -2.436 5.568 1.00 0.00 C ATOM 308 CG LEU A 23 2.127 -1.121 5.767 1.00 0.00 C ATOM 309 CD1 LEU A 23 0.652 -1.298 5.443 1.00 0.00 C ATOM 310 CD2 LEU A 23 2.306 -0.613 7.190 1.00 0.00 C ATOM 0 H LEU A 23 4.116 -4.259 6.777 1.00 0.00 H new ATOM 0 HA LEU A 23 1.614 -3.416 7.001 1.00 0.00 H new ATOM 0 HB2 LEU A 23 3.865 -2.341 6.030 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.044 -2.581 4.500 1.00 0.00 H new ATOM 0 HG LEU A 23 2.541 -0.380 5.084 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.131 -0.352 5.590 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.543 -1.615 4.406 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.223 -2.054 6.100 1.00 0.00 H new ATOM 0 HD21 LEU A 23 1.762 0.323 7.313 1.00 0.00 H new ATOM 0 HD22 LEU A 23 1.919 -1.352 7.892 1.00 0.00 H new ATOM 0 HD23 LEU A 23 3.365 -0.446 7.386 1.00 0.00 H new ATOM 322 N GLY A 24 1.852 -4.930 4.072 1.00 0.00 N ATOM 323 CA GLY A 24 1.057 -5.538 3.022 1.00 0.00 C ATOM 324 C GLY A 24 0.572 -4.526 2.002 1.00 0.00 C ATOM 325 O GLY A 24 -0.576 -4.582 1.560 1.00 0.00 O ATOM 0 H GLY A 24 2.860 -5.041 3.965 1.00 0.00 H new ATOM 0 HA2 GLY A 24 1.649 -6.302 2.518 1.00 0.00 H new ATOM 0 HA3 GLY A 24 0.198 -6.042 3.466 1.00 0.00 H new ATOM 329 N ILE A 25 1.448 -3.599 1.630 1.00 0.00 N ATOM 330 CA ILE A 25 1.102 -2.570 0.657 1.00 0.00 C ATOM 331 C ILE A 25 2.036 -2.615 -0.547 1.00 0.00 C ATOM 332 O ILE A 25 3.077 -3.271 -0.514 1.00 0.00 O ATOM 333 CB ILE A 25 1.156 -1.163 1.282 1.00 0.00 C ATOM 334 CG1 ILE A 25 2.373 -1.037 2.201 1.00 0.00 C ATOM 335 CG2 ILE A 25 -0.126 -0.873 2.047 1.00 0.00 C ATOM 336 CD1 ILE A 25 2.857 0.386 2.370 1.00 0.00 C ATOM 0 H ILE A 25 2.402 -3.539 1.987 1.00 0.00 H new ATOM 0 HA ILE A 25 0.082 -2.775 0.331 1.00 0.00 H new ATOM 0 HB ILE A 25 1.251 -0.429 0.482 1.00 0.00 H new ATOM 0 HG12 ILE A 25 2.123 -1.446 3.180 1.00 0.00 H new ATOM 0 HG13 ILE A 25 3.185 -1.643 1.800 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -0.072 0.125 2.483 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -0.976 -0.926 1.366 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -0.250 -1.609 2.841 1.00 0.00 H new ATOM 0 HD11 ILE A 25 3.722 0.400 3.034 1.00 0.00 H new ATOM 0 HD12 ILE A 25 3.139 0.792 1.399 1.00 0.00 H new ATOM 0 HD13 ILE A 25 2.060 0.993 2.800 1.00 0.00 H new ATOM 348 N SER A 26 1.657 -1.913 -1.610 1.00 0.00 N ATOM 349 CA SER A 26 2.460 -1.875 -2.827 1.00 0.00 C ATOM 350 C SER A 26 2.674 -0.437 -3.292 1.00 0.00 C ATOM 351 O SER A 26 1.830 0.431 -3.068 1.00 0.00 O ATOM 352 CB SER A 26 1.785 -2.686 -3.935 1.00 0.00 C ATOM 353 OG SER A 26 2.747 -3.296 -4.778 1.00 0.00 O ATOM 0 H SER A 26 0.799 -1.363 -1.653 1.00 0.00 H new ATOM 0 HA SER A 26 3.432 -2.316 -2.605 1.00 0.00 H new ATOM 0 HB2 SER A 26 1.147 -3.451 -3.493 1.00 0.00 H new ATOM 0 HB3 SER A 26 1.140 -2.035 -4.525 1.00 0.00 H new ATOM 0 HG SER A 26 2.291 -3.810 -5.477 1.00 0.00 H new ATOM 359 N ILE A 27 3.809 -0.194 -3.940 1.00 0.00 N ATOM 360 CA ILE A 27 4.134 1.137 -4.437 1.00 0.00 C ATOM 361 C ILE A 27 4.801 1.064 -5.806 1.00 0.00 C ATOM 362 O ILE A 27 5.501 0.099 -6.116 1.00 0.00 O ATOM 363 CB ILE A 27 5.061 1.890 -3.465 1.00 0.00 C ATOM 364 CG1 ILE A 27 6.443 1.235 -3.434 1.00 0.00 C ATOM 365 CG2 ILE A 27 4.453 1.923 -2.071 1.00 0.00 C ATOM 366 CD1 ILE A 27 7.449 1.986 -2.590 1.00 0.00 C ATOM 0 H ILE A 27 4.518 -0.901 -4.133 1.00 0.00 H new ATOM 0 HA ILE A 27 3.193 1.681 -4.523 1.00 0.00 H new ATOM 0 HB ILE A 27 5.174 2.916 -3.815 1.00 0.00 H new ATOM 0 HG12 ILE A 27 6.346 0.219 -3.051 1.00 0.00 H new ATOM 0 HG13 ILE A 27 6.822 1.157 -4.453 1.00 0.00 H new ATOM 0 HG21 ILE A 27 5.120 2.459 -1.396 1.00 0.00 H new ATOM 0 HG22 ILE A 27 3.489 2.430 -2.106 1.00 0.00 H new ATOM 0 HG23 ILE A 27 4.314 0.904 -1.711 1.00 0.00 H new ATOM 0 HD11 ILE A 27 8.406 1.464 -2.614 1.00 0.00 H new ATOM 0 HD12 ILE A 27 7.575 2.994 -2.985 1.00 0.00 H new ATOM 0 HD13 ILE A 27 7.092 2.042 -1.562 1.00 0.00 H new ATOM 378 N ARG A 28 4.583 2.091 -6.620 1.00 0.00 N ATOM 379 CA ARG A 28 5.164 2.144 -7.956 1.00 0.00 C ATOM 380 C ARG A 28 5.842 3.489 -8.201 1.00 0.00 C ATOM 381 O ARG A 28 5.374 4.526 -7.733 1.00 0.00 O ATOM 382 CB ARG A 28 4.085 1.905 -9.015 1.00 0.00 C ATOM 383 CG ARG A 28 2.956 2.922 -8.975 1.00 0.00 C ATOM 384 CD ARG A 28 1.955 2.687 -10.095 1.00 0.00 C ATOM 385 NE ARG A 28 2.542 2.918 -11.412 1.00 0.00 N ATOM 386 CZ ARG A 28 3.208 1.992 -12.093 1.00 0.00 C ATOM 387 NH1 ARG A 28 3.370 0.779 -11.584 1.00 0.00 N ATOM 388 NH2 ARG A 28 3.713 2.279 -13.286 1.00 0.00 N ATOM 0 H ARG A 28 4.008 2.898 -6.378 1.00 0.00 H new ATOM 0 HA ARG A 28 5.916 1.358 -8.029 1.00 0.00 H new ATOM 0 HB2 ARG A 28 4.546 1.926 -10.002 1.00 0.00 H new ATOM 0 HB3 ARG A 28 3.669 0.907 -8.878 1.00 0.00 H new ATOM 0 HG2 ARG A 28 2.447 2.865 -8.013 1.00 0.00 H new ATOM 0 HG3 ARG A 28 3.368 3.928 -9.059 1.00 0.00 H new ATOM 0 HD2 ARG A 28 1.582 1.664 -10.039 1.00 0.00 H new ATOM 0 HD3 ARG A 28 1.098 3.347 -9.959 1.00 0.00 H new ATOM 0 HE ARG A 28 2.435 3.841 -11.832 1.00 0.00 H new ATOM 0 HH11 ARG A 28 2.983 0.555 -10.667 1.00 0.00 H new ATOM 0 HH12 ARG A 28 3.882 0.070 -12.109 1.00 0.00 H new ATOM 0 HH21 ARG A 28 3.590 3.211 -13.681 1.00 0.00 H new ATOM 0 HH22 ARG A 28 4.224 1.567 -13.808 1.00 0.00 H new ATOM 402 N GLY A 29 6.949 3.463 -8.938 1.00 0.00 N ATOM 403 CA GLY A 29 7.674 4.685 -9.231 1.00 0.00 C ATOM 404 C GLY A 29 9.134 4.603 -8.832 1.00 0.00 C ATOM 405 O GLY A 29 9.703 3.515 -8.753 1.00 0.00 O ATOM 0 H GLY A 29 7.356 2.617 -9.337 1.00 0.00 H new ATOM 0 HA2 GLY A 29 7.604 4.899 -10.298 1.00 0.00 H new ATOM 0 HA3 GLY A 29 7.204 5.517 -8.707 1.00 0.00 H new ATOM 409 N GLY A 30 9.744 5.758 -8.583 1.00 0.00 N ATOM 410 CA GLY A 30 11.142 5.790 -8.195 1.00 0.00 C ATOM 411 C GLY A 30 11.740 7.179 -8.296 1.00 0.00 C ATOM 412 O GLY A 30 11.023 8.177 -8.230 1.00 0.00 O ATOM 0 H GLY A 30 9.295 6.672 -8.643 1.00 0.00 H new ATOM 0 HA2 GLY A 30 11.240 5.429 -7.171 1.00 0.00 H new ATOM 0 HA3 GLY A 30 11.708 5.107 -8.829 1.00 0.00 H new ATOM 416 N ALA A 31 13.058 7.244 -8.456 1.00 0.00 N ATOM 417 CA ALA A 31 13.752 8.521 -8.567 1.00 0.00 C ATOM 418 C ALA A 31 14.664 8.546 -9.788 1.00 0.00 C ATOM 419 O ALA A 31 15.246 9.579 -10.119 1.00 0.00 O ATOM 420 CB ALA A 31 14.551 8.799 -7.302 1.00 0.00 C ATOM 0 H ALA A 31 13.666 6.427 -8.512 1.00 0.00 H new ATOM 0 HA ALA A 31 13.004 9.304 -8.690 1.00 0.00 H new ATOM 0 HB1 ALA A 31 15.064 9.756 -7.399 1.00 0.00 H new ATOM 0 HB2 ALA A 31 13.877 8.834 -6.446 1.00 0.00 H new ATOM 0 HB3 ALA A 31 15.285 8.007 -7.154 1.00 0.00 H new ATOM 426 N ARG A 32 14.786 7.402 -10.453 1.00 0.00 N ATOM 427 CA ARG A 32 15.630 7.293 -11.637 1.00 0.00 C ATOM 428 C ARG A 32 14.897 6.567 -12.762 1.00 0.00 C ATOM 429 O ARG A 32 15.001 6.943 -13.929 1.00 0.00 O ATOM 430 CB ARG A 32 16.926 6.554 -11.299 1.00 0.00 C ATOM 431 CG ARG A 32 17.885 7.368 -10.446 1.00 0.00 C ATOM 432 CD ARG A 32 18.792 8.238 -11.302 1.00 0.00 C ATOM 433 NE ARG A 32 19.986 8.663 -10.577 1.00 0.00 N ATOM 434 CZ ARG A 32 21.118 9.023 -11.172 1.00 0.00 C ATOM 435 NH1 ARG A 32 21.209 9.009 -12.494 1.00 0.00 N ATOM 436 NH2 ARG A 32 22.162 9.399 -10.443 1.00 0.00 N ATOM 0 H ARG A 32 14.311 6.538 -10.192 1.00 0.00 H new ATOM 0 HA ARG A 32 15.872 8.301 -11.974 1.00 0.00 H new ATOM 0 HB2 ARG A 32 16.682 5.630 -10.775 1.00 0.00 H new ATOM 0 HB3 ARG A 32 17.426 6.272 -12.226 1.00 0.00 H new ATOM 0 HG2 ARG A 32 17.318 7.997 -9.759 1.00 0.00 H new ATOM 0 HG3 ARG A 32 18.491 6.697 -9.837 1.00 0.00 H new ATOM 0 HD2 ARG A 32 19.087 7.686 -12.194 1.00 0.00 H new ATOM 0 HD3 ARG A 32 18.240 9.116 -11.638 1.00 0.00 H new ATOM 0 HE ARG A 32 19.949 8.685 -9.558 1.00 0.00 H new ATOM 0 HH11 ARG A 32 20.409 8.721 -13.057 1.00 0.00 H new ATOM 0 HH12 ARG A 32 22.079 9.286 -12.948 1.00 0.00 H new ATOM 0 HH21 ARG A 32 22.095 9.412 -9.425 1.00 0.00 H new ATOM 0 HH22 ARG A 32 23.031 9.675 -10.901 1.00 0.00 H new ATOM 450 N GLY A 33 14.155 5.523 -12.402 1.00 0.00 N ATOM 451 CA GLY A 33 13.417 4.761 -13.392 1.00 0.00 C ATOM 452 C GLY A 33 11.925 5.019 -13.327 1.00 0.00 C ATOM 453 O GLY A 33 11.455 6.090 -13.712 1.00 0.00 O ATOM 0 H GLY A 33 14.052 5.192 -11.443 1.00 0.00 H new ATOM 0 HA2 GLY A 33 13.783 5.013 -14.387 1.00 0.00 H new ATOM 0 HA3 GLY A 33 13.606 3.698 -13.243 1.00 0.00 H new ATOM 457 N HIS A 34 11.176 4.034 -12.840 1.00 0.00 N ATOM 458 CA HIS A 34 9.727 4.159 -12.727 1.00 0.00 C ATOM 459 C HIS A 34 9.339 5.549 -12.233 1.00 0.00 C ATOM 460 O HIS A 34 9.867 6.032 -11.232 1.00 0.00 O ATOM 461 CB HIS A 34 9.174 3.095 -11.779 1.00 0.00 C ATOM 462 CG HIS A 34 9.098 1.730 -12.391 1.00 0.00 C ATOM 463 ND1 HIS A 34 10.184 0.885 -12.485 1.00 0.00 N ATOM 464 CD2 HIS A 34 8.056 1.062 -12.939 1.00 0.00 C ATOM 465 CE1 HIS A 34 9.813 -0.242 -13.067 1.00 0.00 C ATOM 466 NE2 HIS A 34 8.526 -0.160 -13.352 1.00 0.00 N ATOM 0 H HIS A 34 11.549 3.141 -12.518 1.00 0.00 H new ATOM 0 HA HIS A 34 9.296 4.011 -13.717 1.00 0.00 H new ATOM 0 HB2 HIS A 34 9.802 3.051 -10.889 1.00 0.00 H new ATOM 0 HB3 HIS A 34 8.178 3.394 -11.452 1.00 0.00 H new ATOM 0 HD2 HIS A 34 7.043 1.423 -13.034 1.00 0.00 H new ATOM 0 HE1 HIS A 34 10.453 -1.087 -13.274 1.00 0.00 H new ATOM 0 HE2 HIS A 34 7.972 -0.886 -13.805 1.00 0.00 H new ATOM 475 N ALA A 35 8.412 6.187 -12.941 1.00 0.00 N ATOM 476 CA ALA A 35 7.953 7.520 -12.573 1.00 0.00 C ATOM 477 C ALA A 35 6.643 7.454 -11.796 1.00 0.00 C ATOM 478 O ALA A 35 6.268 8.404 -11.109 1.00 0.00 O ATOM 479 CB ALA A 35 7.788 8.383 -13.815 1.00 0.00 C ATOM 0 H ALA A 35 7.965 5.802 -13.773 1.00 0.00 H new ATOM 0 HA ALA A 35 8.706 7.971 -11.927 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.445 9.376 -13.525 1.00 0.00 H new ATOM 0 HB2 ALA A 35 8.745 8.466 -14.330 1.00 0.00 H new ATOM 0 HB3 ALA A 35 7.056 7.926 -14.481 1.00 0.00 H new ATOM 485 N GLY A 36 5.949 6.325 -11.909 1.00 0.00 N ATOM 486 CA GLY A 36 4.687 6.157 -11.211 1.00 0.00 C ATOM 487 C GLY A 36 3.492 6.440 -12.099 1.00 0.00 C ATOM 488 O GLY A 36 2.476 5.751 -12.022 1.00 0.00 O ATOM 0 H GLY A 36 6.238 5.524 -12.471 1.00 0.00 H new ATOM 0 HA2 GLY A 36 4.619 5.138 -10.829 1.00 0.00 H new ATOM 0 HA3 GLY A 36 4.661 6.823 -10.348 1.00 0.00 H new ATOM 492 N ASN A 37 3.612 7.460 -12.943 1.00 0.00 N ATOM 493 CA ASN A 37 2.531 7.835 -13.848 1.00 0.00 C ATOM 494 C ASN A 37 2.920 7.568 -15.299 1.00 0.00 C ATOM 495 O ASN A 37 3.969 8.001 -15.777 1.00 0.00 O ATOM 496 CB ASN A 37 2.175 9.312 -13.666 1.00 0.00 C ATOM 497 CG ASN A 37 3.400 10.178 -13.442 1.00 0.00 C ATOM 498 OD1 ASN A 37 4.517 9.795 -13.789 1.00 0.00 O ATOM 499 ND2 ASN A 37 3.194 11.353 -12.858 1.00 0.00 N ATOM 0 H ASN A 37 4.447 8.041 -13.019 1.00 0.00 H new ATOM 0 HA ASN A 37 1.660 7.226 -13.606 1.00 0.00 H new ATOM 0 HB2 ASN A 37 1.640 9.665 -14.547 1.00 0.00 H new ATOM 0 HB3 ASN A 37 1.498 9.418 -12.818 1.00 0.00 H new ATOM 0 HD21 ASN A 37 3.980 11.979 -12.680 1.00 0.00 H new ATOM 0 HD22 ASN A 37 2.250 11.629 -12.587 1.00 0.00 H new ATOM 506 N PRO A 38 2.054 6.839 -16.019 1.00 0.00 N ATOM 507 CA PRO A 38 2.284 6.499 -17.426 1.00 0.00 C ATOM 508 C PRO A 38 2.173 7.714 -18.341 1.00 0.00 C ATOM 509 O PRO A 38 2.326 7.602 -19.558 1.00 0.00 O ATOM 510 CB PRO A 38 1.172 5.494 -17.734 1.00 0.00 C ATOM 511 CG PRO A 38 0.091 5.814 -16.761 1.00 0.00 C ATOM 512 CD PRO A 38 0.784 6.290 -15.514 1.00 0.00 C ATOM 0 HA PRO A 38 3.288 6.109 -17.593 1.00 0.00 H new ATOM 0 HB2 PRO A 38 0.822 5.594 -18.761 1.00 0.00 H new ATOM 0 HB3 PRO A 38 1.521 4.468 -17.614 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -0.574 6.582 -17.155 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -0.522 4.936 -16.556 1.00 0.00 H new ATOM 0 HD2 PRO A 38 0.198 7.047 -14.992 1.00 0.00 H new ATOM 0 HD3 PRO A 38 0.950 5.474 -14.810 1.00 0.00 H new ATOM 520 N ARG A 39 1.906 8.873 -17.749 1.00 0.00 N ATOM 521 CA ARG A 39 1.774 10.108 -18.511 1.00 0.00 C ATOM 522 C ARG A 39 3.142 10.637 -18.932 1.00 0.00 C ATOM 523 O ARG A 39 3.477 10.648 -20.117 1.00 0.00 O ATOM 524 CB ARG A 39 1.039 11.166 -17.686 1.00 0.00 C ATOM 525 CG ARG A 39 0.327 12.210 -18.530 1.00 0.00 C ATOM 526 CD ARG A 39 -0.780 12.899 -17.747 1.00 0.00 C ATOM 527 NE ARG A 39 -1.311 14.060 -18.456 1.00 0.00 N ATOM 528 CZ ARG A 39 -2.509 14.583 -18.217 1.00 0.00 C ATOM 529 NH1 ARG A 39 -3.295 14.051 -17.292 1.00 0.00 N ATOM 530 NH2 ARG A 39 -2.921 15.641 -18.904 1.00 0.00 N ATOM 0 H ARG A 39 1.777 8.982 -16.743 1.00 0.00 H new ATOM 0 HA ARG A 39 1.196 9.890 -19.409 1.00 0.00 H new ATOM 0 HB2 ARG A 39 0.310 10.672 -17.044 1.00 0.00 H new ATOM 0 HB3 ARG A 39 1.754 11.666 -17.032 1.00 0.00 H new ATOM 0 HG2 ARG A 39 1.046 12.953 -18.875 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -0.094 11.737 -19.417 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -1.586 12.190 -17.558 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -0.396 13.212 -16.776 1.00 0.00 H new ATOM 0 HE ARG A 39 -0.730 14.493 -19.174 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -2.981 13.238 -16.762 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -4.214 14.454 -17.110 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -2.318 16.053 -19.616 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -3.841 16.042 -18.720 1.00 0.00 H new ATOM 544 N ASP A 40 3.928 11.073 -17.954 1.00 0.00 N ATOM 545 CA ASP A 40 5.260 11.602 -18.222 1.00 0.00 C ATOM 546 C ASP A 40 6.303 10.922 -17.341 1.00 0.00 C ATOM 547 O ASP A 40 6.330 11.096 -16.122 1.00 0.00 O ATOM 548 CB ASP A 40 5.288 13.114 -17.992 1.00 0.00 C ATOM 549 CG ASP A 40 4.227 13.842 -18.795 1.00 0.00 C ATOM 550 OD1 ASP A 40 4.365 13.911 -20.034 1.00 0.00 O ATOM 551 OD2 ASP A 40 3.259 14.340 -18.184 1.00 0.00 O ATOM 0 H ASP A 40 3.666 11.071 -16.968 1.00 0.00 H new ATOM 0 HA ASP A 40 5.502 11.396 -19.265 1.00 0.00 H new ATOM 0 HB2 ASP A 40 5.142 13.320 -16.932 1.00 0.00 H new ATOM 0 HB3 ASP A 40 6.271 13.501 -18.259 1.00 0.00 H new ATOM 556 N PRO A 41 7.182 10.127 -17.969 1.00 0.00 N ATOM 557 CA PRO A 41 8.242 9.404 -17.261 1.00 0.00 C ATOM 558 C PRO A 41 9.322 10.338 -16.724 1.00 0.00 C ATOM 559 O PRO A 41 10.305 9.892 -16.130 1.00 0.00 O ATOM 560 CB PRO A 41 8.821 8.481 -18.336 1.00 0.00 C ATOM 561 CG PRO A 41 8.518 9.163 -19.625 1.00 0.00 C ATOM 562 CD PRO A 41 7.209 9.874 -19.419 1.00 0.00 C ATOM 0 HA PRO A 41 7.861 8.877 -16.386 1.00 0.00 H new ATOM 0 HB2 PRO A 41 9.894 8.344 -18.204 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.366 7.492 -18.295 1.00 0.00 H new ATOM 0 HG2 PRO A 41 9.307 9.867 -19.889 1.00 0.00 H new ATOM 0 HG3 PRO A 41 8.447 8.443 -20.440 1.00 0.00 H new ATOM 0 HD2 PRO A 41 7.162 10.802 -19.990 1.00 0.00 H new ATOM 0 HD3 PRO A 41 6.365 9.261 -19.736 1.00 0.00 H new ATOM 570 N THR A 42 9.133 11.637 -16.934 1.00 0.00 N ATOM 571 CA THR A 42 10.090 12.634 -16.472 1.00 0.00 C ATOM 572 C THR A 42 10.129 12.694 -14.949 1.00 0.00 C ATOM 573 O THR A 42 11.120 12.312 -14.328 1.00 0.00 O ATOM 574 CB THR A 42 9.755 14.033 -17.022 1.00 0.00 C ATOM 575 OG1 THR A 42 8.538 14.510 -16.437 1.00 0.00 O ATOM 576 CG2 THR A 42 9.616 14.000 -18.536 1.00 0.00 C ATOM 0 H THR A 42 8.325 12.023 -17.422 1.00 0.00 H new ATOM 0 HA THR A 42 11.068 12.330 -16.846 1.00 0.00 H new ATOM 0 HB THR A 42 10.572 14.707 -16.763 1.00 0.00 H new ATOM 0 HG1 THR A 42 8.332 15.401 -16.790 1.00 0.00 H new ATOM 0 HG21 THR A 42 9.379 14.999 -18.902 1.00 0.00 H new ATOM 0 HG22 THR A 42 10.553 13.664 -18.980 1.00 0.00 H new ATOM 0 HG23 THR A 42 8.816 13.313 -18.813 1.00 0.00 H new ATOM 584 N ASP A 43 9.043 13.176 -14.354 1.00 0.00 N ATOM 585 CA ASP A 43 8.952 13.285 -12.902 1.00 0.00 C ATOM 586 C ASP A 43 9.006 11.907 -12.249 1.00 0.00 C ATOM 587 O ASP A 43 8.091 11.100 -12.408 1.00 0.00 O ATOM 588 CB ASP A 43 7.662 14.002 -12.503 1.00 0.00 C ATOM 589 CG ASP A 43 7.673 14.450 -11.055 1.00 0.00 C ATOM 590 OD1 ASP A 43 8.021 13.628 -10.182 1.00 0.00 O ATOM 591 OD2 ASP A 43 7.332 15.623 -10.794 1.00 0.00 O ATOM 0 H ASP A 43 8.214 13.497 -14.854 1.00 0.00 H new ATOM 0 HA ASP A 43 9.805 13.867 -12.552 1.00 0.00 H new ATOM 0 HB2 ASP A 43 7.517 14.869 -13.147 1.00 0.00 H new ATOM 0 HB3 ASP A 43 6.814 13.337 -12.668 1.00 0.00 H new ATOM 596 N GLU A 44 10.084 11.647 -11.517 1.00 0.00 N ATOM 597 CA GLU A 44 10.257 10.365 -10.842 1.00 0.00 C ATOM 598 C GLU A 44 9.484 10.334 -9.527 1.00 0.00 C ATOM 599 O GLU A 44 10.065 10.451 -8.449 1.00 0.00 O ATOM 600 CB GLU A 44 11.741 10.098 -10.580 1.00 0.00 C ATOM 601 CG GLU A 44 12.629 10.360 -11.785 1.00 0.00 C ATOM 602 CD GLU A 44 12.494 9.291 -12.852 1.00 0.00 C ATOM 603 OE1 GLU A 44 12.254 8.120 -12.491 1.00 0.00 O ATOM 604 OE2 GLU A 44 12.629 9.626 -14.048 1.00 0.00 O ATOM 0 H GLU A 44 10.850 12.305 -11.376 1.00 0.00 H new ATOM 0 HA GLU A 44 9.864 9.584 -11.493 1.00 0.00 H new ATOM 0 HB2 GLU A 44 12.073 10.724 -9.752 1.00 0.00 H new ATOM 0 HB3 GLU A 44 11.865 9.062 -10.266 1.00 0.00 H new ATOM 0 HG2 GLU A 44 12.377 11.330 -12.214 1.00 0.00 H new ATOM 0 HG3 GLU A 44 13.668 10.415 -11.461 1.00 0.00 H new ATOM 611 N GLY A 45 8.167 10.176 -9.625 1.00 0.00 N ATOM 612 CA GLY A 45 7.334 10.133 -8.438 1.00 0.00 C ATOM 613 C GLY A 45 7.094 8.719 -7.949 1.00 0.00 C ATOM 614 O GLY A 45 7.425 7.753 -8.637 1.00 0.00 O ATOM 0 H GLY A 45 7.663 10.077 -10.506 1.00 0.00 H new ATOM 0 HA2 GLY A 45 7.806 10.713 -7.645 1.00 0.00 H new ATOM 0 HA3 GLY A 45 6.376 10.607 -8.653 1.00 0.00 H new ATOM 618 N ILE A 46 6.520 8.596 -6.757 1.00 0.00 N ATOM 619 CA ILE A 46 6.238 7.289 -6.177 1.00 0.00 C ATOM 620 C ILE A 46 4.884 7.280 -5.475 1.00 0.00 C ATOM 621 O ILE A 46 4.675 7.997 -4.497 1.00 0.00 O ATOM 622 CB ILE A 46 7.327 6.872 -5.171 1.00 0.00 C ATOM 623 CG1 ILE A 46 8.712 6.980 -5.812 1.00 0.00 C ATOM 624 CG2 ILE A 46 7.076 5.456 -4.675 1.00 0.00 C ATOM 625 CD1 ILE A 46 9.848 6.796 -4.830 1.00 0.00 C ATOM 0 H ILE A 46 6.241 9.385 -6.174 1.00 0.00 H new ATOM 0 HA ILE A 46 6.223 6.575 -7.001 1.00 0.00 H new ATOM 0 HB ILE A 46 7.289 7.547 -4.316 1.00 0.00 H new ATOM 0 HG12 ILE A 46 8.798 6.231 -6.600 1.00 0.00 H new ATOM 0 HG13 ILE A 46 8.808 7.956 -6.288 1.00 0.00 H new ATOM 0 HG21 ILE A 46 7.854 5.176 -3.965 1.00 0.00 H new ATOM 0 HG22 ILE A 46 6.104 5.409 -4.185 1.00 0.00 H new ATOM 0 HG23 ILE A 46 7.090 4.767 -5.519 1.00 0.00 H new ATOM 0 HD11 ILE A 46 10.800 6.885 -5.354 1.00 0.00 H new ATOM 0 HD12 ILE A 46 9.787 7.561 -4.056 1.00 0.00 H new ATOM 0 HD13 ILE A 46 9.777 5.809 -4.372 1.00 0.00 H new ATOM 637 N PHE A 47 3.967 6.461 -5.981 1.00 0.00 N ATOM 638 CA PHE A 47 2.633 6.358 -5.402 1.00 0.00 C ATOM 639 C PHE A 47 2.223 4.897 -5.238 1.00 0.00 C ATOM 640 O PHE A 47 2.732 4.017 -5.933 1.00 0.00 O ATOM 641 CB PHE A 47 1.615 7.089 -6.280 1.00 0.00 C ATOM 642 CG PHE A 47 2.069 8.453 -6.715 1.00 0.00 C ATOM 643 CD1 PHE A 47 3.195 8.602 -7.509 1.00 0.00 C ATOM 644 CD2 PHE A 47 1.370 9.586 -6.330 1.00 0.00 C ATOM 645 CE1 PHE A 47 3.615 9.856 -7.911 1.00 0.00 C ATOM 646 CE2 PHE A 47 1.785 10.842 -6.729 1.00 0.00 C ATOM 647 CZ PHE A 47 2.910 10.977 -7.520 1.00 0.00 C ATOM 0 H PHE A 47 4.124 5.860 -6.790 1.00 0.00 H new ATOM 0 HA PHE A 47 2.655 6.824 -4.417 1.00 0.00 H new ATOM 0 HB2 PHE A 47 1.409 6.485 -7.163 1.00 0.00 H new ATOM 0 HB3 PHE A 47 0.677 7.184 -5.733 1.00 0.00 H new ATOM 0 HD1 PHE A 47 3.751 7.729 -7.817 1.00 0.00 H new ATOM 0 HD2 PHE A 47 0.491 9.486 -5.711 1.00 0.00 H new ATOM 0 HE1 PHE A 47 4.494 9.959 -8.530 1.00 0.00 H new ATOM 0 HE2 PHE A 47 1.231 11.717 -6.423 1.00 0.00 H new ATOM 0 HZ PHE A 47 3.237 11.958 -7.832 1.00 0.00 H new ATOM 657 N ILE A 48 1.301 4.648 -4.314 1.00 0.00 N ATOM 658 CA ILE A 48 0.822 3.295 -4.059 1.00 0.00 C ATOM 659 C ILE A 48 0.214 2.681 -5.315 1.00 0.00 C ATOM 660 O ILE A 48 -0.631 3.291 -5.970 1.00 0.00 O ATOM 661 CB ILE A 48 -0.225 3.272 -2.930 1.00 0.00 C ATOM 662 CG1 ILE A 48 0.426 3.630 -1.593 1.00 0.00 C ATOM 663 CG2 ILE A 48 -0.890 1.905 -2.853 1.00 0.00 C ATOM 664 CD1 ILE A 48 -0.570 3.995 -0.515 1.00 0.00 C ATOM 0 H ILE A 48 0.871 5.365 -3.730 1.00 0.00 H new ATOM 0 HA ILE A 48 1.687 2.706 -3.753 1.00 0.00 H new ATOM 0 HB ILE A 48 -0.991 4.016 -3.149 1.00 0.00 H new ATOM 0 HG12 ILE A 48 1.025 2.786 -1.252 1.00 0.00 H new ATOM 0 HG13 ILE A 48 1.109 4.466 -1.743 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -1.628 1.904 -2.050 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -1.384 1.687 -3.800 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -0.136 1.144 -2.653 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -0.038 4.237 0.405 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -1.153 4.859 -0.835 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -1.238 3.153 -0.337 1.00 0.00 H new ATOM 676 N SER A 49 0.647 1.468 -5.644 1.00 0.00 N ATOM 677 CA SER A 49 0.146 0.771 -6.823 1.00 0.00 C ATOM 678 C SER A 49 -0.844 -0.321 -6.429 1.00 0.00 C ATOM 679 O SER A 49 -1.561 -0.859 -7.272 1.00 0.00 O ATOM 680 CB SER A 49 1.306 0.162 -7.613 1.00 0.00 C ATOM 681 OG SER A 49 1.689 -1.091 -7.072 1.00 0.00 O ATOM 0 H SER A 49 1.344 0.948 -5.111 1.00 0.00 H new ATOM 0 HA SER A 49 -0.371 1.497 -7.451 1.00 0.00 H new ATOM 0 HB2 SER A 49 1.014 0.038 -8.656 1.00 0.00 H new ATOM 0 HB3 SER A 49 2.157 0.843 -7.599 1.00 0.00 H new ATOM 0 HG SER A 49 2.431 -1.460 -7.595 1.00 0.00 H new ATOM 687 N LYS A 50 -0.878 -0.643 -5.140 1.00 0.00 N ATOM 688 CA LYS A 50 -1.780 -1.669 -4.631 1.00 0.00 C ATOM 689 C LYS A 50 -1.725 -1.735 -3.108 1.00 0.00 C ATOM 690 O LYS A 50 -0.790 -1.228 -2.488 1.00 0.00 O ATOM 691 CB LYS A 50 -1.420 -3.033 -5.224 1.00 0.00 C ATOM 692 CG LYS A 50 -2.008 -4.204 -4.456 1.00 0.00 C ATOM 693 CD LYS A 50 -1.591 -5.534 -5.062 1.00 0.00 C ATOM 694 CE LYS A 50 -2.281 -6.701 -4.373 1.00 0.00 C ATOM 695 NZ LYS A 50 -2.473 -7.855 -5.295 1.00 0.00 N ATOM 0 H LYS A 50 -0.291 -0.208 -4.429 1.00 0.00 H new ATOM 0 HA LYS A 50 -2.795 -1.406 -4.929 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -1.768 -3.075 -6.256 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -0.335 -3.134 -5.249 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -1.683 -4.159 -3.417 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -3.095 -4.129 -4.453 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -1.833 -5.543 -6.125 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -0.510 -5.649 -4.980 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -1.689 -7.017 -3.514 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -3.249 -6.376 -3.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -2.946 -8.630 -4.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -3.059 -7.561 -6.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -1.548 -8.181 -5.640 1.00 0.00 H new ATOM 709 N VAL A 51 -2.732 -2.363 -2.511 1.00 0.00 N ATOM 710 CA VAL A 51 -2.797 -2.497 -1.060 1.00 0.00 C ATOM 711 C VAL A 51 -3.529 -3.773 -0.658 1.00 0.00 C ATOM 712 O VAL A 51 -4.601 -4.077 -1.182 1.00 0.00 O ATOM 713 CB VAL A 51 -3.503 -1.289 -0.416 1.00 0.00 C ATOM 714 CG1 VAL A 51 -3.638 -1.488 1.086 1.00 0.00 C ATOM 715 CG2 VAL A 51 -2.748 -0.005 -0.726 1.00 0.00 C ATOM 0 H VAL A 51 -3.514 -2.787 -3.009 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.769 -2.542 -0.700 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.504 -1.207 -0.839 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -4.139 -0.625 1.524 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -4.224 -2.386 1.283 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -2.648 -1.596 1.529 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.260 0.839 -0.264 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -1.734 -0.075 -0.332 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -2.708 0.142 -1.805 1.00 0.00 H new ATOM 725 N SER A 52 -2.944 -4.515 0.276 1.00 0.00 N ATOM 726 CA SER A 52 -3.539 -5.760 0.746 1.00 0.00 C ATOM 727 C SER A 52 -4.718 -5.483 1.673 1.00 0.00 C ATOM 728 O SER A 52 -4.704 -4.549 2.476 1.00 0.00 O ATOM 729 CB SER A 52 -2.492 -6.607 1.473 1.00 0.00 C ATOM 730 OG SER A 52 -2.941 -7.942 1.638 1.00 0.00 O ATOM 0 H SER A 52 -2.059 -4.276 0.722 1.00 0.00 H new ATOM 0 HA SER A 52 -3.903 -6.310 -0.122 1.00 0.00 H new ATOM 0 HB2 SER A 52 -1.559 -6.601 0.909 1.00 0.00 H new ATOM 0 HB3 SER A 52 -2.278 -6.169 2.448 1.00 0.00 H new ATOM 0 HG SER A 52 -2.254 -8.463 2.103 1.00 0.00 H new ATOM 736 N PRO A 53 -5.766 -6.313 1.562 1.00 0.00 N ATOM 737 CA PRO A 53 -6.973 -6.178 2.381 1.00 0.00 C ATOM 738 C PRO A 53 -6.724 -6.533 3.844 1.00 0.00 C ATOM 739 O PRO A 53 -7.449 -6.088 4.734 1.00 0.00 O ATOM 740 CB PRO A 53 -7.945 -7.177 1.748 1.00 0.00 C ATOM 741 CG PRO A 53 -7.073 -8.191 1.092 1.00 0.00 C ATOM 742 CD PRO A 53 -5.852 -7.447 0.626 1.00 0.00 C ATOM 0 HA PRO A 53 -7.342 -5.153 2.395 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -8.588 -7.635 2.500 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -8.598 -6.689 1.025 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -6.804 -8.984 1.789 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -7.586 -8.663 0.254 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -4.960 -8.072 0.669 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -5.956 -7.110 -0.405 1.00 0.00 H new ATOM 750 N THR A 54 -5.692 -7.336 4.086 1.00 0.00 N ATOM 751 CA THR A 54 -5.348 -7.750 5.440 1.00 0.00 C ATOM 752 C THR A 54 -4.137 -6.983 5.958 1.00 0.00 C ATOM 753 O THR A 54 -3.852 -6.987 7.155 1.00 0.00 O ATOM 754 CB THR A 54 -5.051 -9.260 5.507 1.00 0.00 C ATOM 755 OG1 THR A 54 -3.930 -9.577 4.675 1.00 0.00 O ATOM 756 CG2 THR A 54 -6.262 -10.069 5.065 1.00 0.00 C ATOM 0 H THR A 54 -5.080 -7.712 3.362 1.00 0.00 H new ATOM 0 HA THR A 54 -6.211 -7.528 6.067 1.00 0.00 H new ATOM 0 HB THR A 54 -4.819 -9.517 6.541 1.00 0.00 H new ATOM 0 HG1 THR A 54 -3.747 -10.538 4.725 1.00 0.00 H new ATOM 0 HG21 THR A 54 -6.029 -11.132 5.120 1.00 0.00 H new ATOM 0 HG22 THR A 54 -7.106 -9.848 5.719 1.00 0.00 H new ATOM 0 HG23 THR A 54 -6.520 -9.807 4.039 1.00 0.00 H new ATOM 764 N GLY A 55 -3.426 -6.323 5.048 1.00 0.00 N ATOM 765 CA GLY A 55 -2.253 -5.560 5.434 1.00 0.00 C ATOM 766 C GLY A 55 -2.566 -4.501 6.472 1.00 0.00 C ATOM 767 O GLY A 55 -3.702 -4.038 6.573 1.00 0.00 O ATOM 0 H GLY A 55 -3.641 -6.303 4.051 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -1.496 -6.238 5.828 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -1.826 -5.084 4.551 1.00 0.00 H new ATOM 771 N ALA A 56 -1.557 -4.119 7.248 1.00 0.00 N ATOM 772 CA ALA A 56 -1.731 -3.109 8.284 1.00 0.00 C ATOM 773 C ALA A 56 -2.499 -1.904 7.753 1.00 0.00 C ATOM 774 O ALA A 56 -3.263 -1.272 8.482 1.00 0.00 O ATOM 775 CB ALA A 56 -0.379 -2.676 8.831 1.00 0.00 C ATOM 0 H ALA A 56 -0.611 -4.494 7.179 1.00 0.00 H new ATOM 0 HA ALA A 56 -2.314 -3.550 9.093 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -0.524 -1.921 9.604 1.00 0.00 H new ATOM 0 HB2 ALA A 56 0.134 -3.538 9.257 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.223 -2.258 8.024 1.00 0.00 H new ATOM 781 N ALA A 57 -2.290 -1.590 6.478 1.00 0.00 N ATOM 782 CA ALA A 57 -2.964 -0.461 5.849 1.00 0.00 C ATOM 783 C ALA A 57 -4.423 -0.789 5.552 1.00 0.00 C ATOM 784 O ALA A 57 -5.333 -0.131 6.055 1.00 0.00 O ATOM 785 CB ALA A 57 -2.240 -0.059 4.572 1.00 0.00 C ATOM 0 H ALA A 57 -1.659 -2.102 5.861 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.942 0.378 6.545 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -2.754 0.785 4.113 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -1.215 0.226 4.809 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -2.232 -0.900 3.878 1.00 0.00 H new ATOM 791 N GLY A 58 -4.639 -1.811 4.729 1.00 0.00 N ATOM 792 CA GLY A 58 -5.991 -2.208 4.378 1.00 0.00 C ATOM 793 C GLY A 58 -6.920 -2.222 5.575 1.00 0.00 C ATOM 794 O GLY A 58 -8.057 -1.757 5.492 1.00 0.00 O ATOM 0 H GLY A 58 -3.903 -2.371 4.299 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -6.383 -1.524 3.625 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -5.970 -3.200 3.927 1.00 0.00 H new ATOM 798 N ARG A 59 -6.437 -2.759 6.691 1.00 0.00 N ATOM 799 CA ARG A 59 -7.234 -2.835 7.909 1.00 0.00 C ATOM 800 C ARG A 59 -7.239 -1.495 8.639 1.00 0.00 C ATOM 801 O ARG A 59 -8.134 -1.216 9.438 1.00 0.00 O ATOM 802 CB ARG A 59 -6.692 -3.928 8.831 1.00 0.00 C ATOM 803 CG ARG A 59 -5.234 -3.733 9.216 1.00 0.00 C ATOM 804 CD ARG A 59 -4.576 -5.051 9.594 1.00 0.00 C ATOM 805 NE ARG A 59 -4.550 -5.254 11.040 1.00 0.00 N ATOM 806 CZ ARG A 59 -3.772 -6.146 11.643 1.00 0.00 C ATOM 807 NH1 ARG A 59 -2.959 -6.912 10.928 1.00 0.00 N ATOM 808 NH2 ARG A 59 -3.805 -6.272 12.963 1.00 0.00 N ATOM 0 H ARG A 59 -5.498 -3.148 6.776 1.00 0.00 H new ATOM 0 HA ARG A 59 -8.258 -3.081 7.629 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -7.297 -3.960 9.737 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -6.803 -4.894 8.339 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.694 -3.281 8.384 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.168 -3.039 10.054 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -5.114 -5.873 9.122 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -3.557 -5.072 9.206 1.00 0.00 H new ATOM 0 HE ARG A 59 -5.163 -4.679 11.619 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -2.930 -6.817 9.913 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -2.363 -7.596 11.393 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -4.428 -5.684 13.516 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -3.207 -6.957 13.425 1.00 0.00 H new ATOM 822 N ASP A 60 -6.235 -0.671 8.361 1.00 0.00 N ATOM 823 CA ASP A 60 -6.124 0.640 8.990 1.00 0.00 C ATOM 824 C ASP A 60 -7.395 1.455 8.775 1.00 0.00 C ATOM 825 O ASP A 60 -8.054 1.861 9.731 1.00 0.00 O ATOM 826 CB ASP A 60 -4.917 1.396 8.434 1.00 0.00 C ATOM 827 CG ASP A 60 -4.653 2.691 9.176 1.00 0.00 C ATOM 828 OD1 ASP A 60 -5.379 3.676 8.929 1.00 0.00 O ATOM 829 OD2 ASP A 60 -3.718 2.720 10.005 1.00 0.00 O ATOM 0 H ASP A 60 -5.486 -0.888 7.704 1.00 0.00 H new ATOM 0 HA ASP A 60 -5.987 0.491 10.061 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -4.034 0.760 8.494 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -5.082 1.613 7.379 1.00 0.00 H new ATOM 834 N GLY A 61 -7.733 1.692 7.511 1.00 0.00 N ATOM 835 CA GLY A 61 -8.923 2.460 7.193 1.00 0.00 C ATOM 836 C GLY A 61 -8.607 3.728 6.424 1.00 0.00 C ATOM 837 O GLY A 61 -9.512 4.453 6.012 1.00 0.00 O ATOM 0 H GLY A 61 -7.204 1.366 6.702 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -9.604 1.843 6.606 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -9.442 2.718 8.116 1.00 0.00 H new ATOM 841 N ARG A 62 -7.320 3.996 6.232 1.00 0.00 N ATOM 842 CA ARG A 62 -6.887 5.186 5.510 1.00 0.00 C ATOM 843 C ARG A 62 -6.103 4.808 4.257 1.00 0.00 C ATOM 844 O ARG A 62 -6.582 4.982 3.136 1.00 0.00 O ATOM 845 CB ARG A 62 -6.028 6.072 6.414 1.00 0.00 C ATOM 846 CG ARG A 62 -6.562 6.196 7.832 1.00 0.00 C ATOM 847 CD ARG A 62 -7.659 7.245 7.924 1.00 0.00 C ATOM 848 NE ARG A 62 -8.906 6.788 7.316 1.00 0.00 N ATOM 849 CZ ARG A 62 -9.895 7.603 6.966 1.00 0.00 C ATOM 850 NH1 ARG A 62 -9.783 8.909 7.160 1.00 0.00 N ATOM 851 NH2 ARG A 62 -10.999 7.111 6.418 1.00 0.00 N ATOM 0 H ARG A 62 -6.559 3.405 6.566 1.00 0.00 H new ATOM 0 HA ARG A 62 -7.776 5.740 5.207 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -5.017 5.667 6.450 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -5.958 7.066 5.973 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -6.950 5.232 8.161 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -5.748 6.459 8.507 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -7.836 7.494 8.970 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -7.329 8.159 7.430 1.00 0.00 H new ATOM 0 HE ARG A 62 -9.024 5.788 7.151 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -8.935 9.291 7.579 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -10.544 9.532 6.890 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -11.089 6.106 6.265 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -11.758 7.737 6.150 1.00 0.00 H new ATOM 865 N LEU A 63 -4.896 4.290 4.455 1.00 0.00 N ATOM 866 CA LEU A 63 -4.045 3.887 3.341 1.00 0.00 C ATOM 867 C LEU A 63 -4.873 3.273 2.217 1.00 0.00 C ATOM 868 O LEU A 63 -5.817 2.523 2.466 1.00 0.00 O ATOM 869 CB LEU A 63 -2.989 2.887 3.816 1.00 0.00 C ATOM 870 CG LEU A 63 -1.693 2.842 3.005 1.00 0.00 C ATOM 871 CD1 LEU A 63 -1.908 2.099 1.696 1.00 0.00 C ATOM 872 CD2 LEU A 63 -1.180 4.251 2.743 1.00 0.00 C ATOM 0 H LEU A 63 -4.485 4.139 5.376 1.00 0.00 H new ATOM 0 HA LEU A 63 -3.547 4.777 2.956 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -2.738 3.118 4.851 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -3.432 1.891 3.810 1.00 0.00 H new ATOM 0 HG LEU A 63 -0.942 2.305 3.584 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.975 2.077 1.133 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -2.229 1.079 1.905 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -2.674 2.608 1.110 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -0.257 4.201 2.165 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -1.928 4.813 2.184 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -0.986 4.750 3.692 1.00 0.00 H new ATOM 884 N ARG A 64 -4.512 3.595 0.979 1.00 0.00 N ATOM 885 CA ARG A 64 -5.221 3.075 -0.184 1.00 0.00 C ATOM 886 C ARG A 64 -4.429 3.330 -1.462 1.00 0.00 C ATOM 887 O ARG A 64 -3.538 4.179 -1.494 1.00 0.00 O ATOM 888 CB ARG A 64 -6.606 3.716 -0.292 1.00 0.00 C ATOM 889 CG ARG A 64 -6.583 5.233 -0.205 1.00 0.00 C ATOM 890 CD ARG A 64 -7.806 5.847 -0.868 1.00 0.00 C ATOM 891 NE ARG A 64 -7.761 5.720 -2.323 1.00 0.00 N ATOM 892 CZ ARG A 64 -8.834 5.808 -3.101 1.00 0.00 C ATOM 893 NH1 ARG A 64 -10.028 6.022 -2.568 1.00 0.00 N ATOM 894 NH2 ARG A 64 -8.712 5.682 -4.417 1.00 0.00 N ATOM 0 H ARG A 64 -3.732 4.214 0.756 1.00 0.00 H new ATOM 0 HA ARG A 64 -5.336 1.998 -0.057 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -7.061 3.422 -1.238 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -7.241 3.324 0.502 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -6.543 5.538 0.841 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -5.680 5.612 -0.683 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -8.706 5.362 -0.489 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -7.874 6.901 -0.598 1.00 0.00 H new ATOM 0 HE ARG A 64 -6.857 5.555 -2.765 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -10.125 6.120 -1.557 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -10.850 6.089 -3.168 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -7.794 5.518 -4.831 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -9.536 5.750 -5.014 1.00 0.00 H new ATOM 908 N VAL A 65 -4.760 2.590 -2.516 1.00 0.00 N ATOM 909 CA VAL A 65 -4.081 2.736 -3.797 1.00 0.00 C ATOM 910 C VAL A 65 -4.441 4.060 -4.462 1.00 0.00 C ATOM 911 O VAL A 65 -5.517 4.203 -5.041 1.00 0.00 O ATOM 912 CB VAL A 65 -4.433 1.581 -4.754 1.00 0.00 C ATOM 913 CG1 VAL A 65 -3.549 1.625 -5.991 1.00 0.00 C ATOM 914 CG2 VAL A 65 -4.303 0.243 -4.043 1.00 0.00 C ATOM 0 H VAL A 65 -5.495 1.883 -2.507 1.00 0.00 H new ATOM 0 HA VAL A 65 -3.011 2.715 -3.592 1.00 0.00 H new ATOM 0 HB VAL A 65 -5.469 1.698 -5.073 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -3.812 0.802 -6.655 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -3.697 2.572 -6.510 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -2.504 1.533 -5.695 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -4.555 -0.562 -4.733 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -3.278 0.114 -3.694 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -4.982 0.216 -3.191 1.00 0.00 H new ATOM 924 N GLY A 66 -3.532 5.026 -4.376 1.00 0.00 N ATOM 925 CA GLY A 66 -3.773 6.326 -4.974 1.00 0.00 C ATOM 926 C GLY A 66 -3.142 7.455 -4.181 1.00 0.00 C ATOM 927 O GLY A 66 -3.111 8.600 -4.634 1.00 0.00 O ATOM 0 H GLY A 66 -2.633 4.932 -3.903 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -3.378 6.334 -5.990 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.847 6.495 -5.049 1.00 0.00 H new ATOM 931 N LEU A 67 -2.640 7.133 -2.994 1.00 0.00 N ATOM 932 CA LEU A 67 -2.009 8.129 -2.135 1.00 0.00 C ATOM 933 C LEU A 67 -0.517 8.239 -2.435 1.00 0.00 C ATOM 934 O LEU A 67 0.198 7.237 -2.452 1.00 0.00 O ATOM 935 CB LEU A 67 -2.220 7.769 -0.663 1.00 0.00 C ATOM 936 CG LEU A 67 -3.672 7.713 -0.188 1.00 0.00 C ATOM 937 CD1 LEU A 67 -3.793 6.848 1.057 1.00 0.00 C ATOM 938 CD2 LEU A 67 -4.201 9.114 0.080 1.00 0.00 C ATOM 0 H LEU A 67 -2.658 6.190 -2.605 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.474 9.094 -2.337 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.760 6.798 -0.477 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -1.686 8.497 -0.052 1.00 0.00 H new ATOM 0 HG LEU A 67 -4.275 7.264 -0.977 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.833 6.820 1.381 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.456 5.836 0.831 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -3.177 7.267 1.852 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.236 9.054 0.417 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.595 9.590 0.851 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.151 9.703 -0.836 1.00 0.00 H new ATOM 950 N ARG A 68 -0.055 9.463 -2.668 1.00 0.00 N ATOM 951 CA ARG A 68 1.352 9.704 -2.965 1.00 0.00 C ATOM 952 C ARG A 68 2.189 9.679 -1.690 1.00 0.00 C ATOM 953 O ARG A 68 1.950 10.454 -0.762 1.00 0.00 O ATOM 954 CB ARG A 68 1.522 11.049 -3.673 1.00 0.00 C ATOM 955 CG ARG A 68 2.955 11.345 -4.084 1.00 0.00 C ATOM 956 CD ARG A 68 3.116 12.783 -4.552 1.00 0.00 C ATOM 957 NE ARG A 68 4.406 13.007 -5.199 1.00 0.00 N ATOM 958 CZ ARG A 68 4.703 14.105 -5.885 1.00 0.00 C ATOM 959 NH1 ARG A 68 3.806 15.074 -6.012 1.00 0.00 N ATOM 960 NH2 ARG A 68 5.898 14.236 -6.445 1.00 0.00 N ATOM 0 H ARG A 68 -0.634 10.303 -2.657 1.00 0.00 H new ATOM 0 HA ARG A 68 1.700 8.908 -3.623 1.00 0.00 H new ATOM 0 HB2 ARG A 68 0.888 11.066 -4.560 1.00 0.00 H new ATOM 0 HB3 ARG A 68 1.170 11.843 -3.015 1.00 0.00 H new ATOM 0 HG2 ARG A 68 3.622 11.159 -3.242 1.00 0.00 H new ATOM 0 HG3 ARG A 68 3.253 10.666 -4.883 1.00 0.00 H new ATOM 0 HD2 ARG A 68 2.314 13.030 -5.248 1.00 0.00 H new ATOM 0 HD3 ARG A 68 3.017 13.455 -3.700 1.00 0.00 H new ATOM 0 HE ARG A 68 5.118 12.281 -5.120 1.00 0.00 H new ATOM 0 HH11 ARG A 68 2.886 14.977 -5.582 1.00 0.00 H new ATOM 0 HH12 ARG A 68 4.036 15.916 -6.539 1.00 0.00 H new ATOM 0 HH21 ARG A 68 6.590 13.493 -6.349 1.00 0.00 H new ATOM 0 HH22 ARG A 68 6.125 15.080 -6.972 1.00 0.00 H new ATOM 974 N LEU A 69 3.171 8.785 -1.650 1.00 0.00 N ATOM 975 CA LEU A 69 4.044 8.659 -0.488 1.00 0.00 C ATOM 976 C LEU A 69 4.969 9.865 -0.368 1.00 0.00 C ATOM 977 O LEU A 69 5.862 10.061 -1.194 1.00 0.00 O ATOM 978 CB LEU A 69 4.871 7.375 -0.584 1.00 0.00 C ATOM 979 CG LEU A 69 4.323 6.165 0.174 1.00 0.00 C ATOM 980 CD1 LEU A 69 4.604 6.297 1.663 1.00 0.00 C ATOM 981 CD2 LEU A 69 2.830 6.010 -0.077 1.00 0.00 C ATOM 0 H LEU A 69 3.383 8.137 -2.409 1.00 0.00 H new ATOM 0 HA LEU A 69 3.418 8.615 0.403 1.00 0.00 H new ATOM 0 HB2 LEU A 69 4.967 7.106 -1.636 1.00 0.00 H new ATOM 0 HB3 LEU A 69 5.875 7.585 -0.216 1.00 0.00 H new ATOM 0 HG LEU A 69 4.827 5.271 -0.193 1.00 0.00 H new ATOM 0 HD11 LEU A 69 4.207 5.427 2.187 1.00 0.00 H new ATOM 0 HD12 LEU A 69 5.680 6.359 1.826 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.127 7.199 2.045 1.00 0.00 H new ATOM 0 HD21 LEU A 69 2.457 5.144 0.470 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.309 6.905 0.262 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.653 5.869 -1.143 1.00 0.00 H new ATOM 993 N LEU A 70 4.751 10.671 0.665 1.00 0.00 N ATOM 994 CA LEU A 70 5.567 11.858 0.895 1.00 0.00 C ATOM 995 C LEU A 70 6.781 11.526 1.757 1.00 0.00 C ATOM 996 O LEU A 70 7.910 11.879 1.417 1.00 0.00 O ATOM 997 CB LEU A 70 4.734 12.951 1.568 1.00 0.00 C ATOM 998 CG LEU A 70 3.696 13.643 0.684 1.00 0.00 C ATOM 999 CD1 LEU A 70 2.926 14.685 1.480 1.00 0.00 C ATOM 1000 CD2 LEU A 70 4.365 14.280 -0.526 1.00 0.00 C ATOM 0 H LEU A 70 4.016 10.524 1.357 1.00 0.00 H new ATOM 0 HA LEU A 70 5.918 12.220 -0.071 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.220 12.513 2.423 1.00 0.00 H new ATOM 0 HB3 LEU A 70 5.413 13.709 1.958 1.00 0.00 H new ATOM 0 HG LEU A 70 2.990 12.892 0.330 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.192 15.167 0.834 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.415 14.202 2.313 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.618 15.434 1.864 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.611 14.768 -1.144 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.094 15.019 -0.192 1.00 0.00 H new ATOM 0 HD23 LEU A 70 4.870 13.510 -1.110 1.00 0.00 H new ATOM 1012 N GLU A 71 6.541 10.843 2.872 1.00 0.00 N ATOM 1013 CA GLU A 71 7.615 10.462 3.781 1.00 0.00 C ATOM 1014 C GLU A 71 7.227 9.234 4.599 1.00 0.00 C ATOM 1015 O GLU A 71 6.077 9.089 5.013 1.00 0.00 O ATOM 1016 CB GLU A 71 7.958 11.624 4.716 1.00 0.00 C ATOM 1017 CG GLU A 71 8.266 12.922 3.987 1.00 0.00 C ATOM 1018 CD GLU A 71 8.812 13.993 4.910 1.00 0.00 C ATOM 1019 OE1 GLU A 71 8.003 14.660 5.589 1.00 0.00 O ATOM 1020 OE2 GLU A 71 10.048 14.166 4.953 1.00 0.00 O ATOM 0 H GLU A 71 5.612 10.542 3.167 1.00 0.00 H new ATOM 0 HA GLU A 71 8.492 10.215 3.182 1.00 0.00 H new ATOM 0 HB2 GLU A 71 7.124 11.789 5.398 1.00 0.00 H new ATOM 0 HB3 GLU A 71 8.818 11.347 5.326 1.00 0.00 H new ATOM 0 HG2 GLU A 71 8.989 12.727 3.195 1.00 0.00 H new ATOM 0 HG3 GLU A 71 7.359 13.289 3.507 1.00 0.00 H new ATOM 1027 N VAL A 72 8.195 8.352 4.827 1.00 0.00 N ATOM 1028 CA VAL A 72 7.955 7.136 5.595 1.00 0.00 C ATOM 1029 C VAL A 72 8.820 7.100 6.851 1.00 0.00 C ATOM 1030 O VAL A 72 10.036 6.931 6.774 1.00 0.00 O ATOM 1031 CB VAL A 72 8.237 5.876 4.755 1.00 0.00 C ATOM 1032 CG1 VAL A 72 8.128 4.626 5.614 1.00 0.00 C ATOM 1033 CG2 VAL A 72 7.286 5.803 3.570 1.00 0.00 C ATOM 0 H VAL A 72 9.152 8.457 4.491 1.00 0.00 H new ATOM 0 HA VAL A 72 6.903 7.145 5.881 1.00 0.00 H new ATOM 0 HB VAL A 72 9.256 5.936 4.372 1.00 0.00 H new ATOM 0 HG11 VAL A 72 8.330 3.746 5.003 1.00 0.00 H new ATOM 0 HG12 VAL A 72 8.853 4.678 6.426 1.00 0.00 H new ATOM 0 HG13 VAL A 72 7.122 4.556 6.029 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.499 4.907 2.987 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.258 5.766 3.930 1.00 0.00 H new ATOM 0 HG23 VAL A 72 7.419 6.684 2.942 1.00 0.00 H new ATOM 1043 N ASN A 73 8.183 7.261 8.006 1.00 0.00 N ATOM 1044 CA ASN A 73 8.894 7.247 9.279 1.00 0.00 C ATOM 1045 C ASN A 73 9.844 8.436 9.384 1.00 0.00 C ATOM 1046 O ASN A 73 10.966 8.304 9.872 1.00 0.00 O ATOM 1047 CB ASN A 73 9.674 5.940 9.437 1.00 0.00 C ATOM 1048 CG ASN A 73 8.887 4.885 10.190 1.00 0.00 C ATOM 1049 OD1 ASN A 73 7.885 5.186 10.838 1.00 0.00 O ATOM 1050 ND2 ASN A 73 9.340 3.639 10.109 1.00 0.00 N ATOM 0 H ASN A 73 7.176 7.403 8.087 1.00 0.00 H new ATOM 0 HA ASN A 73 8.158 7.321 10.079 1.00 0.00 H new ATOM 0 HB2 ASN A 73 9.940 5.557 8.452 1.00 0.00 H new ATOM 0 HB3 ASN A 73 10.607 6.138 9.964 1.00 0.00 H new ATOM 0 HD21 ASN A 73 8.853 2.887 10.596 1.00 0.00 H new ATOM 0 HD22 ASN A 73 10.175 3.435 9.560 1.00 0.00 H new ATOM 1057 N GLN A 74 9.386 9.595 8.924 1.00 0.00 N ATOM 1058 CA GLN A 74 10.196 10.807 8.967 1.00 0.00 C ATOM 1059 C GLN A 74 11.438 10.662 8.094 1.00 0.00 C ATOM 1060 O GLN A 74 12.502 11.189 8.421 1.00 0.00 O ATOM 1061 CB GLN A 74 10.604 11.123 10.407 1.00 0.00 C ATOM 1062 CG GLN A 74 9.439 11.537 11.292 1.00 0.00 C ATOM 1063 CD GLN A 74 9.673 11.211 12.754 1.00 0.00 C ATOM 1064 OE1 GLN A 74 10.578 11.756 13.386 1.00 0.00 O ATOM 1065 NE2 GLN A 74 8.856 10.319 13.300 1.00 0.00 N ATOM 0 H GLN A 74 8.459 9.721 8.517 1.00 0.00 H new ATOM 0 HA GLN A 74 9.595 11.629 8.579 1.00 0.00 H new ATOM 0 HB2 GLN A 74 11.085 10.246 10.840 1.00 0.00 H new ATOM 0 HB3 GLN A 74 11.345 11.922 10.399 1.00 0.00 H new ATOM 0 HG2 GLN A 74 9.269 12.608 11.185 1.00 0.00 H new ATOM 0 HG3 GLN A 74 8.533 11.035 10.952 1.00 0.00 H new ATOM 0 HE21 GLN A 74 8.119 9.892 12.739 1.00 0.00 H new ATOM 0 HE22 GLN A 74 8.965 10.061 14.281 1.00 0.00 H new ATOM 1074 N GLN A 75 11.295 9.946 6.984 1.00 0.00 N ATOM 1075 CA GLN A 75 12.407 9.731 6.065 1.00 0.00 C ATOM 1076 C GLN A 75 12.006 10.076 4.635 1.00 0.00 C ATOM 1077 O GLN A 75 11.516 9.223 3.894 1.00 0.00 O ATOM 1078 CB GLN A 75 12.884 8.280 6.138 1.00 0.00 C ATOM 1079 CG GLN A 75 13.274 7.837 7.539 1.00 0.00 C ATOM 1080 CD GLN A 75 14.019 6.517 7.547 1.00 0.00 C ATOM 1081 OE1 GLN A 75 14.845 6.251 6.673 1.00 0.00 O ATOM 1082 NE2 GLN A 75 13.731 5.680 8.537 1.00 0.00 N ATOM 0 H GLN A 75 10.421 9.505 6.699 1.00 0.00 H new ATOM 0 HA GLN A 75 13.223 10.389 6.363 1.00 0.00 H new ATOM 0 HB2 GLN A 75 12.094 7.628 5.766 1.00 0.00 H new ATOM 0 HB3 GLN A 75 13.740 8.154 5.475 1.00 0.00 H new ATOM 0 HG2 GLN A 75 13.897 8.604 7.998 1.00 0.00 H new ATOM 0 HG3 GLN A 75 12.376 7.747 8.151 1.00 0.00 H new ATOM 0 HE21 GLN A 75 13.040 5.941 9.240 1.00 0.00 H new ATOM 0 HE22 GLN A 75 14.201 4.777 8.594 1.00 0.00 H new ATOM 1091 N SER A 76 12.216 11.332 4.253 1.00 0.00 N ATOM 1092 CA SER A 76 11.872 11.791 2.912 1.00 0.00 C ATOM 1093 C SER A 76 12.285 10.763 1.863 1.00 0.00 C ATOM 1094 O SER A 76 13.414 10.270 1.871 1.00 0.00 O ATOM 1095 CB SER A 76 12.546 13.133 2.621 1.00 0.00 C ATOM 1096 OG SER A 76 12.279 13.561 1.296 1.00 0.00 O ATOM 0 H SER A 76 12.623 12.050 4.853 1.00 0.00 H new ATOM 0 HA SER A 76 10.790 11.918 2.864 1.00 0.00 H new ATOM 0 HB2 SER A 76 12.190 13.883 3.327 1.00 0.00 H new ATOM 0 HB3 SER A 76 13.622 13.042 2.767 1.00 0.00 H new ATOM 0 HG SER A 76 12.719 14.422 1.135 1.00 0.00 H new ATOM 1102 N LEU A 77 11.364 10.444 0.961 1.00 0.00 N ATOM 1103 CA LEU A 77 11.631 9.475 -0.096 1.00 0.00 C ATOM 1104 C LEU A 77 12.199 10.161 -1.334 1.00 0.00 C ATOM 1105 O LEU A 77 12.338 9.544 -2.391 1.00 0.00 O ATOM 1106 CB LEU A 77 10.351 8.721 -0.459 1.00 0.00 C ATOM 1107 CG LEU A 77 9.536 8.177 0.715 1.00 0.00 C ATOM 1108 CD1 LEU A 77 8.217 7.598 0.227 1.00 0.00 C ATOM 1109 CD2 LEU A 77 10.332 7.126 1.475 1.00 0.00 C ATOM 0 H LEU A 77 10.425 10.842 0.940 1.00 0.00 H new ATOM 0 HA LEU A 77 12.371 8.765 0.275 1.00 0.00 H new ATOM 0 HB2 LEU A 77 9.713 9.387 -1.040 1.00 0.00 H new ATOM 0 HB3 LEU A 77 10.616 7.887 -1.108 1.00 0.00 H new ATOM 0 HG LEU A 77 9.318 9.002 1.394 1.00 0.00 H new ATOM 0 HD11 LEU A 77 7.651 7.216 1.076 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.640 8.377 -0.273 1.00 0.00 H new ATOM 0 HD13 LEU A 77 8.413 6.786 -0.473 1.00 0.00 H new ATOM 0 HD21 LEU A 77 9.737 6.750 2.307 1.00 0.00 H new ATOM 0 HD22 LEU A 77 10.580 6.303 0.805 1.00 0.00 H new ATOM 0 HD23 LEU A 77 11.250 7.572 1.858 1.00 0.00 H new ATOM 1121 N LEU A 78 12.528 11.441 -1.196 1.00 0.00 N ATOM 1122 CA LEU A 78 13.084 12.212 -2.302 1.00 0.00 C ATOM 1123 C LEU A 78 14.557 11.877 -2.514 1.00 0.00 C ATOM 1124 O LEU A 78 15.342 11.860 -1.567 1.00 0.00 O ATOM 1125 CB LEU A 78 12.923 13.710 -2.038 1.00 0.00 C ATOM 1126 CG LEU A 78 12.779 14.598 -3.274 1.00 0.00 C ATOM 1127 CD1 LEU A 78 14.032 14.524 -4.133 1.00 0.00 C ATOM 1128 CD2 LEU A 78 11.553 14.196 -4.080 1.00 0.00 C ATOM 0 H LEU A 78 12.419 11.967 -0.329 1.00 0.00 H new ATOM 0 HA LEU A 78 12.537 11.948 -3.207 1.00 0.00 H new ATOM 0 HB2 LEU A 78 12.046 13.855 -1.407 1.00 0.00 H new ATOM 0 HB3 LEU A 78 13.786 14.053 -1.468 1.00 0.00 H new ATOM 0 HG LEU A 78 12.650 15.629 -2.944 1.00 0.00 H new ATOM 0 HD11 LEU A 78 13.911 15.162 -5.008 1.00 0.00 H new ATOM 0 HD12 LEU A 78 14.891 14.862 -3.553 1.00 0.00 H new ATOM 0 HD13 LEU A 78 14.193 13.495 -4.454 1.00 0.00 H new ATOM 0 HD21 LEU A 78 11.467 14.839 -4.956 1.00 0.00 H new ATOM 0 HD22 LEU A 78 11.652 13.159 -4.400 1.00 0.00 H new ATOM 0 HD23 LEU A 78 10.661 14.302 -3.463 1.00 0.00 H new ATOM 1140 N GLY A 79 14.925 11.612 -3.764 1.00 0.00 N ATOM 1141 CA GLY A 79 16.303 11.283 -4.077 1.00 0.00 C ATOM 1142 C GLY A 79 16.507 9.799 -4.306 1.00 0.00 C ATOM 1143 O GLY A 79 17.194 9.396 -5.246 1.00 0.00 O ATOM 0 H GLY A 79 14.293 11.619 -4.565 1.00 0.00 H new ATOM 0 HA2 GLY A 79 16.611 11.831 -4.968 1.00 0.00 H new ATOM 0 HA3 GLY A 79 16.946 11.613 -3.262 1.00 0.00 H new ATOM 1147 N LEU A 80 15.912 8.982 -3.444 1.00 0.00 N ATOM 1148 CA LEU A 80 16.033 7.532 -3.556 1.00 0.00 C ATOM 1149 C LEU A 80 15.096 6.988 -4.629 1.00 0.00 C ATOM 1150 O LEU A 80 14.084 7.608 -4.958 1.00 0.00 O ATOM 1151 CB LEU A 80 15.725 6.870 -2.211 1.00 0.00 C ATOM 1152 CG LEU A 80 14.537 7.442 -1.438 1.00 0.00 C ATOM 1153 CD1 LEU A 80 13.868 6.357 -0.608 1.00 0.00 C ATOM 1154 CD2 LEU A 80 14.982 8.596 -0.552 1.00 0.00 C ATOM 0 H LEU A 80 15.341 9.298 -2.660 1.00 0.00 H new ATOM 0 HA LEU A 80 17.058 7.299 -3.843 1.00 0.00 H new ATOM 0 HB2 LEU A 80 15.543 5.809 -2.384 1.00 0.00 H new ATOM 0 HB3 LEU A 80 16.612 6.943 -1.581 1.00 0.00 H new ATOM 0 HG LEU A 80 13.810 7.822 -2.156 1.00 0.00 H new ATOM 0 HD11 LEU A 80 13.024 6.783 -0.065 1.00 0.00 H new ATOM 0 HD12 LEU A 80 13.513 5.563 -1.265 1.00 0.00 H new ATOM 0 HD13 LEU A 80 14.587 5.946 0.101 1.00 0.00 H new ATOM 0 HD21 LEU A 80 14.123 8.990 -0.009 1.00 0.00 H new ATOM 0 HD22 LEU A 80 15.729 8.242 0.159 1.00 0.00 H new ATOM 0 HD23 LEU A 80 15.414 9.383 -1.170 1.00 0.00 H new ATOM 1166 N THR A 81 15.439 5.824 -5.172 1.00 0.00 N ATOM 1167 CA THR A 81 14.628 5.195 -6.208 1.00 0.00 C ATOM 1168 C THR A 81 13.639 4.204 -5.606 1.00 0.00 C ATOM 1169 O THR A 81 13.525 4.089 -4.385 1.00 0.00 O ATOM 1170 CB THR A 81 15.506 4.464 -7.241 1.00 0.00 C ATOM 1171 OG1 THR A 81 16.320 3.485 -6.587 1.00 0.00 O ATOM 1172 CG2 THR A 81 16.391 5.447 -7.992 1.00 0.00 C ATOM 0 H THR A 81 16.273 5.298 -4.912 1.00 0.00 H new ATOM 0 HA THR A 81 14.079 5.993 -6.708 1.00 0.00 H new ATOM 0 HB THR A 81 14.850 3.970 -7.958 1.00 0.00 H new ATOM 0 HG1 THR A 81 16.874 3.024 -7.251 1.00 0.00 H new ATOM 0 HG21 THR A 81 17.002 4.907 -8.716 1.00 0.00 H new ATOM 0 HG22 THR A 81 15.767 6.173 -8.513 1.00 0.00 H new ATOM 0 HG23 THR A 81 17.039 5.966 -7.286 1.00 0.00 H new ATOM 1180 N HIS A 82 12.925 3.489 -6.470 1.00 0.00 N ATOM 1181 CA HIS A 82 11.945 2.505 -6.022 1.00 0.00 C ATOM 1182 C HIS A 82 12.549 1.574 -4.976 1.00 0.00 C ATOM 1183 O HIS A 82 12.092 1.527 -3.835 1.00 0.00 O ATOM 1184 CB HIS A 82 11.430 1.692 -7.209 1.00 0.00 C ATOM 1185 CG HIS A 82 10.030 1.189 -7.029 1.00 0.00 C ATOM 1186 ND1 HIS A 82 9.661 -0.116 -7.275 1.00 0.00 N ATOM 1187 CD2 HIS A 82 8.907 1.826 -6.622 1.00 0.00 C ATOM 1188 CE1 HIS A 82 8.372 -0.261 -7.029 1.00 0.00 C ATOM 1189 NE2 HIS A 82 7.890 0.903 -6.631 1.00 0.00 N ATOM 0 H HIS A 82 13.006 3.572 -7.483 1.00 0.00 H new ATOM 0 HA HIS A 82 11.111 3.040 -5.568 1.00 0.00 H new ATOM 0 HB2 HIS A 82 11.473 2.308 -8.107 1.00 0.00 H new ATOM 0 HB3 HIS A 82 12.094 0.843 -7.373 1.00 0.00 H new ATOM 0 HD1 HIS A 82 10.286 -0.855 -7.597 1.00 0.00 H new ATOM 0 HD2 HIS A 82 8.826 2.866 -6.342 1.00 0.00 H new ATOM 0 HE1 HIS A 82 7.808 -1.176 -7.135 1.00 0.00 H new ATOM 1198 N GLY A 83 13.580 0.834 -5.373 1.00 0.00 N ATOM 1199 CA GLY A 83 14.229 -0.087 -4.458 1.00 0.00 C ATOM 1200 C GLY A 83 14.510 0.541 -3.107 1.00 0.00 C ATOM 1201 O GLY A 83 14.061 0.039 -2.077 1.00 0.00 O ATOM 0 H GLY A 83 13.977 0.856 -6.312 1.00 0.00 H new ATOM 0 HA2 GLY A 83 13.598 -0.965 -4.323 1.00 0.00 H new ATOM 0 HA3 GLY A 83 15.165 -0.432 -4.897 1.00 0.00 H new ATOM 1205 N GLU A 84 15.257 1.641 -3.111 1.00 0.00 N ATOM 1206 CA GLU A 84 15.599 2.335 -1.875 1.00 0.00 C ATOM 1207 C GLU A 84 14.342 2.716 -1.099 1.00 0.00 C ATOM 1208 O GLU A 84 14.288 2.580 0.123 1.00 0.00 O ATOM 1209 CB GLU A 84 16.424 3.588 -2.179 1.00 0.00 C ATOM 1210 CG GLU A 84 17.909 3.313 -2.345 1.00 0.00 C ATOM 1211 CD GLU A 84 18.701 4.565 -2.669 1.00 0.00 C ATOM 1212 OE1 GLU A 84 18.855 4.877 -3.868 1.00 0.00 O ATOM 1213 OE2 GLU A 84 19.166 5.234 -1.722 1.00 0.00 O ATOM 0 H GLU A 84 15.636 2.070 -3.955 1.00 0.00 H new ATOM 0 HA GLU A 84 16.193 1.658 -1.261 1.00 0.00 H new ATOM 0 HB2 GLU A 84 16.045 4.050 -3.090 1.00 0.00 H new ATOM 0 HB3 GLU A 84 16.284 4.309 -1.374 1.00 0.00 H new ATOM 0 HG2 GLU A 84 18.297 2.869 -1.428 1.00 0.00 H new ATOM 0 HG3 GLU A 84 18.053 2.581 -3.140 1.00 0.00 H new ATOM 1220 N ALA A 85 13.332 3.195 -1.819 1.00 0.00 N ATOM 1221 CA ALA A 85 12.075 3.595 -1.199 1.00 0.00 C ATOM 1222 C ALA A 85 11.411 2.417 -0.494 1.00 0.00 C ATOM 1223 O ALA A 85 10.994 2.526 0.659 1.00 0.00 O ATOM 1224 CB ALA A 85 11.137 4.185 -2.242 1.00 0.00 C ATOM 0 H ALA A 85 13.360 3.315 -2.831 1.00 0.00 H new ATOM 0 HA ALA A 85 12.294 4.356 -0.450 1.00 0.00 H new ATOM 0 HB1 ALA A 85 10.202 4.480 -1.765 1.00 0.00 H new ATOM 0 HB2 ALA A 85 11.603 5.059 -2.698 1.00 0.00 H new ATOM 0 HB3 ALA A 85 10.933 3.440 -3.011 1.00 0.00 H new ATOM 1230 N VAL A 86 11.316 1.291 -1.194 1.00 0.00 N ATOM 1231 CA VAL A 86 10.703 0.093 -0.635 1.00 0.00 C ATOM 1232 C VAL A 86 11.325 -0.266 0.710 1.00 0.00 C ATOM 1233 O VAL A 86 10.631 -0.354 1.722 1.00 0.00 O ATOM 1234 CB VAL A 86 10.844 -1.108 -1.590 1.00 0.00 C ATOM 1235 CG1 VAL A 86 10.387 -2.389 -0.909 1.00 0.00 C ATOM 1236 CG2 VAL A 86 10.058 -0.865 -2.869 1.00 0.00 C ATOM 0 H VAL A 86 11.656 1.184 -2.150 1.00 0.00 H new ATOM 0 HA VAL A 86 9.645 0.315 -0.496 1.00 0.00 H new ATOM 0 HB VAL A 86 11.896 -1.220 -1.852 1.00 0.00 H new ATOM 0 HG11 VAL A 86 10.494 -3.226 -1.599 1.00 0.00 H new ATOM 0 HG12 VAL A 86 10.997 -2.568 -0.024 1.00 0.00 H new ATOM 0 HG13 VAL A 86 9.342 -2.292 -0.615 1.00 0.00 H new ATOM 0 HG21 VAL A 86 10.168 -1.723 -3.532 1.00 0.00 H new ATOM 0 HG22 VAL A 86 9.004 -0.726 -2.628 1.00 0.00 H new ATOM 0 HG23 VAL A 86 10.437 0.028 -3.365 1.00 0.00 H new ATOM 1246 N GLN A 87 12.638 -0.472 0.712 1.00 0.00 N ATOM 1247 CA GLN A 87 13.354 -0.822 1.934 1.00 0.00 C ATOM 1248 C GLN A 87 13.052 0.176 3.046 1.00 0.00 C ATOM 1249 O GLN A 87 13.240 -0.119 4.227 1.00 0.00 O ATOM 1250 CB GLN A 87 14.860 -0.871 1.671 1.00 0.00 C ATOM 1251 CG GLN A 87 15.251 -1.822 0.551 1.00 0.00 C ATOM 1252 CD GLN A 87 14.787 -3.243 0.802 1.00 0.00 C ATOM 1253 OE1 GLN A 87 15.390 -3.976 1.586 1.00 0.00 O ATOM 1254 NE2 GLN A 87 13.709 -3.640 0.137 1.00 0.00 N ATOM 0 H GLN A 87 13.227 -0.403 -0.118 1.00 0.00 H new ATOM 0 HA GLN A 87 13.016 -1.808 2.254 1.00 0.00 H new ATOM 0 HB2 GLN A 87 15.210 0.131 1.424 1.00 0.00 H new ATOM 0 HB3 GLN A 87 15.371 -1.171 2.586 1.00 0.00 H new ATOM 0 HG2 GLN A 87 14.826 -1.466 -0.388 1.00 0.00 H new ATOM 0 HG3 GLN A 87 16.335 -1.813 0.434 1.00 0.00 H new ATOM 0 HE21 GLN A 87 13.240 -2.999 -0.503 1.00 0.00 H new ATOM 0 HE22 GLN A 87 13.350 -4.586 0.266 1.00 0.00 H new ATOM 1263 N LEU A 88 12.585 1.359 2.662 1.00 0.00 N ATOM 1264 CA LEU A 88 12.257 2.402 3.627 1.00 0.00 C ATOM 1265 C LEU A 88 10.894 2.148 4.262 1.00 0.00 C ATOM 1266 O LEU A 88 10.634 2.570 5.390 1.00 0.00 O ATOM 1267 CB LEU A 88 12.269 3.774 2.950 1.00 0.00 C ATOM 1268 CG LEU A 88 12.691 4.953 3.827 1.00 0.00 C ATOM 1269 CD1 LEU A 88 13.129 6.128 2.968 1.00 0.00 C ATOM 1270 CD2 LEU A 88 11.555 5.361 4.754 1.00 0.00 C ATOM 0 H LEU A 88 12.425 1.620 1.689 1.00 0.00 H new ATOM 0 HA LEU A 88 13.012 2.385 4.413 1.00 0.00 H new ATOM 0 HB2 LEU A 88 12.940 3.727 2.092 1.00 0.00 H new ATOM 0 HB3 LEU A 88 11.270 3.974 2.563 1.00 0.00 H new ATOM 0 HG LEU A 88 13.538 4.642 4.438 1.00 0.00 H new ATOM 0 HD11 LEU A 88 13.426 6.957 3.610 1.00 0.00 H new ATOM 0 HD12 LEU A 88 13.974 5.830 2.347 1.00 0.00 H new ATOM 0 HD13 LEU A 88 12.302 6.441 2.330 1.00 0.00 H new ATOM 0 HD21 LEU A 88 11.873 6.201 5.371 1.00 0.00 H new ATOM 0 HD22 LEU A 88 10.689 5.653 4.161 1.00 0.00 H new ATOM 0 HD23 LEU A 88 11.289 4.521 5.395 1.00 0.00 H new ATOM 1282 N LEU A 89 10.027 1.455 3.532 1.00 0.00 N ATOM 1283 CA LEU A 89 8.690 1.141 4.025 1.00 0.00 C ATOM 1284 C LEU A 89 8.717 -0.084 4.932 1.00 0.00 C ATOM 1285 O LEU A 89 7.826 -0.276 5.759 1.00 0.00 O ATOM 1286 CB LEU A 89 7.737 0.901 2.853 1.00 0.00 C ATOM 1287 CG LEU A 89 7.637 -0.540 2.353 1.00 0.00 C ATOM 1288 CD1 LEU A 89 6.744 -1.362 3.268 1.00 0.00 C ATOM 1289 CD2 LEU A 89 7.115 -0.574 0.924 1.00 0.00 C ATOM 0 H LEU A 89 10.226 1.100 2.597 1.00 0.00 H new ATOM 0 HA LEU A 89 8.335 1.992 4.606 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.741 1.232 3.147 1.00 0.00 H new ATOM 0 HB3 LEU A 89 8.050 1.532 2.021 1.00 0.00 H new ATOM 0 HG LEU A 89 8.635 -0.978 2.365 1.00 0.00 H new ATOM 0 HD11 LEU A 89 6.685 -2.385 2.896 1.00 0.00 H new ATOM 0 HD12 LEU A 89 7.160 -1.366 4.275 1.00 0.00 H new ATOM 0 HD13 LEU A 89 5.745 -0.926 3.290 1.00 0.00 H new ATOM 0 HD21 LEU A 89 7.050 -1.608 0.585 1.00 0.00 H new ATOM 0 HD22 LEU A 89 6.126 -0.117 0.887 1.00 0.00 H new ATOM 0 HD23 LEU A 89 7.794 -0.021 0.275 1.00 0.00 H new ATOM 1301 N ARG A 90 9.747 -0.910 4.773 1.00 0.00 N ATOM 1302 CA ARG A 90 9.891 -2.116 5.578 1.00 0.00 C ATOM 1303 C ARG A 90 10.822 -1.872 6.762 1.00 0.00 C ATOM 1304 O ARG A 90 11.069 -2.770 7.566 1.00 0.00 O ATOM 1305 CB ARG A 90 10.428 -3.265 4.723 1.00 0.00 C ATOM 1306 CG ARG A 90 11.607 -2.873 3.848 1.00 0.00 C ATOM 1307 CD ARG A 90 12.305 -4.096 3.273 1.00 0.00 C ATOM 1308 NE ARG A 90 13.073 -4.814 4.286 1.00 0.00 N ATOM 1309 CZ ARG A 90 13.432 -6.088 4.171 1.00 0.00 C ATOM 1310 NH1 ARG A 90 13.094 -6.780 3.092 1.00 0.00 N ATOM 1311 NH2 ARG A 90 14.131 -6.672 5.136 1.00 0.00 N ATOM 0 H ARG A 90 10.494 -0.765 4.094 1.00 0.00 H new ATOM 0 HA ARG A 90 8.907 -2.386 5.961 1.00 0.00 H new ATOM 0 HB2 ARG A 90 10.728 -4.084 5.377 1.00 0.00 H new ATOM 0 HB3 ARG A 90 9.625 -3.641 4.089 1.00 0.00 H new ATOM 0 HG2 ARG A 90 11.262 -2.234 3.035 1.00 0.00 H new ATOM 0 HG3 ARG A 90 12.317 -2.289 4.433 1.00 0.00 H new ATOM 0 HD2 ARG A 90 11.563 -4.766 2.838 1.00 0.00 H new ATOM 0 HD3 ARG A 90 12.969 -3.788 2.465 1.00 0.00 H new ATOM 0 HE ARG A 90 13.349 -4.310 5.129 1.00 0.00 H new ATOM 0 HH11 ARG A 90 12.557 -6.334 2.348 1.00 0.00 H new ATOM 0 HH12 ARG A 90 13.371 -7.758 3.006 1.00 0.00 H new ATOM 0 HH21 ARG A 90 14.393 -6.143 5.968 1.00 0.00 H new ATOM 0 HH22 ARG A 90 14.406 -7.650 5.046 1.00 0.00 H new ATOM 1325 N SER A 91 11.334 -0.649 6.863 1.00 0.00 N ATOM 1326 CA SER A 91 12.241 -0.288 7.946 1.00 0.00 C ATOM 1327 C SER A 91 11.463 0.087 9.204 1.00 0.00 C ATOM 1328 O SER A 91 12.004 0.705 10.121 1.00 0.00 O ATOM 1329 CB SER A 91 13.138 0.877 7.521 1.00 0.00 C ATOM 1330 OG SER A 91 12.549 2.122 7.857 1.00 0.00 O ATOM 0 H SER A 91 11.136 0.108 6.208 1.00 0.00 H new ATOM 0 HA SER A 91 12.864 -1.154 8.170 1.00 0.00 H new ATOM 0 HB2 SER A 91 14.110 0.788 8.006 1.00 0.00 H new ATOM 0 HB3 SER A 91 13.313 0.832 6.446 1.00 0.00 H new ATOM 0 HG SER A 91 11.942 2.401 7.140 1.00 0.00 H new ATOM 1336 N VAL A 92 10.190 -0.292 9.239 1.00 0.00 N ATOM 1337 CA VAL A 92 9.336 0.002 10.383 1.00 0.00 C ATOM 1338 C VAL A 92 9.066 -1.254 11.205 1.00 0.00 C ATOM 1339 O VAL A 92 8.875 -2.338 10.656 1.00 0.00 O ATOM 1340 CB VAL A 92 7.992 0.611 9.940 1.00 0.00 C ATOM 1341 CG1 VAL A 92 7.316 -0.281 8.910 1.00 0.00 C ATOM 1342 CG2 VAL A 92 7.086 0.834 11.141 1.00 0.00 C ATOM 0 H VAL A 92 9.727 -0.804 8.488 1.00 0.00 H new ATOM 0 HA VAL A 92 9.870 0.727 10.997 1.00 0.00 H new ATOM 0 HB VAL A 92 8.186 1.578 9.477 1.00 0.00 H new ATOM 0 HG11 VAL A 92 6.368 0.165 8.609 1.00 0.00 H new ATOM 0 HG12 VAL A 92 7.962 -0.384 8.038 1.00 0.00 H new ATOM 0 HG13 VAL A 92 7.133 -1.264 9.344 1.00 0.00 H new ATOM 0 HG21 VAL A 92 6.141 1.265 10.809 1.00 0.00 H new ATOM 0 HG22 VAL A 92 6.897 -0.119 11.636 1.00 0.00 H new ATOM 0 HG23 VAL A 92 7.570 1.516 11.840 1.00 0.00 H new ATOM 1352 N GLY A 93 9.050 -1.099 12.525 1.00 0.00 N ATOM 1353 CA GLY A 93 8.802 -2.228 13.402 1.00 0.00 C ATOM 1354 C GLY A 93 7.363 -2.702 13.344 1.00 0.00 C ATOM 1355 O GLY A 93 7.031 -3.609 12.581 1.00 0.00 O ATOM 0 H GLY A 93 9.204 -0.211 13.003 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.463 -3.050 13.127 1.00 0.00 H new ATOM 0 HA3 GLY A 93 9.049 -1.949 14.427 1.00 0.00 H new ATOM 1359 N ASP A 94 6.508 -2.088 14.154 1.00 0.00 N ATOM 1360 CA ASP A 94 5.096 -2.452 14.193 1.00 0.00 C ATOM 1361 C ASP A 94 4.218 -1.261 13.822 1.00 0.00 C ATOM 1362 O ASP A 94 3.021 -1.412 13.574 1.00 0.00 O ATOM 1363 CB ASP A 94 4.719 -2.967 15.583 1.00 0.00 C ATOM 1364 CG ASP A 94 5.164 -2.029 16.689 1.00 0.00 C ATOM 1365 OD1 ASP A 94 4.431 -1.060 16.975 1.00 0.00 O ATOM 1366 OD2 ASP A 94 6.246 -2.265 17.266 1.00 0.00 O ATOM 0 H ASP A 94 6.768 -1.336 14.792 1.00 0.00 H new ATOM 0 HA ASP A 94 4.929 -3.244 13.463 1.00 0.00 H new ATOM 0 HB2 ASP A 94 3.639 -3.101 15.637 1.00 0.00 H new ATOM 0 HB3 ASP A 94 5.170 -3.947 15.739 1.00 0.00 H new ATOM 1371 N THR A 95 4.819 -0.076 13.787 1.00 0.00 N ATOM 1372 CA THR A 95 4.092 1.140 13.449 1.00 0.00 C ATOM 1373 C THR A 95 5.000 2.150 12.757 1.00 0.00 C ATOM 1374 O THR A 95 6.113 2.415 13.214 1.00 0.00 O ATOM 1375 CB THR A 95 3.477 1.794 14.701 1.00 0.00 C ATOM 1376 OG1 THR A 95 2.908 0.789 15.548 1.00 0.00 O ATOM 1377 CG2 THR A 95 2.406 2.803 14.314 1.00 0.00 C ATOM 0 H THR A 95 5.809 0.067 13.989 1.00 0.00 H new ATOM 0 HA THR A 95 3.291 0.850 12.769 1.00 0.00 H new ATOM 0 HB THR A 95 4.269 2.316 15.238 1.00 0.00 H new ATOM 0 HG1 THR A 95 3.626 0.283 15.983 1.00 0.00 H new ATOM 0 HG21 THR A 95 1.986 3.252 15.214 1.00 0.00 H new ATOM 0 HG22 THR A 95 2.848 3.582 13.692 1.00 0.00 H new ATOM 0 HG23 THR A 95 1.616 2.299 13.757 1.00 0.00 H new ATOM 1385 N LEU A 96 4.520 2.712 11.653 1.00 0.00 N ATOM 1386 CA LEU A 96 5.290 3.694 10.898 1.00 0.00 C ATOM 1387 C LEU A 96 4.513 4.999 10.751 1.00 0.00 C ATOM 1388 O LEU A 96 3.330 5.071 11.088 1.00 0.00 O ATOM 1389 CB LEU A 96 5.645 3.141 9.516 1.00 0.00 C ATOM 1390 CG LEU A 96 4.667 3.473 8.389 1.00 0.00 C ATOM 1391 CD1 LEU A 96 5.342 3.319 7.034 1.00 0.00 C ATOM 1392 CD2 LEU A 96 3.432 2.589 8.475 1.00 0.00 C ATOM 0 H LEU A 96 3.601 2.504 11.261 1.00 0.00 H new ATOM 0 HA LEU A 96 6.209 3.899 11.448 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.630 3.517 9.238 1.00 0.00 H new ATOM 0 HB3 LEU A 96 5.727 2.057 9.591 1.00 0.00 H new ATOM 0 HG LEU A 96 4.354 4.511 8.501 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.631 3.559 6.244 1.00 0.00 H new ATOM 0 HD12 LEU A 96 6.194 3.996 6.973 1.00 0.00 H new ATOM 0 HD13 LEU A 96 5.685 2.291 6.913 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.748 2.840 7.665 1.00 0.00 H new ATOM 0 HD22 LEU A 96 3.727 1.543 8.390 1.00 0.00 H new ATOM 0 HD23 LEU A 96 2.936 2.750 9.432 1.00 0.00 H new ATOM 1404 N THR A 97 5.185 6.028 10.244 1.00 0.00 N ATOM 1405 CA THR A 97 4.558 7.329 10.052 1.00 0.00 C ATOM 1406 C THR A 97 4.619 7.759 8.591 1.00 0.00 C ATOM 1407 O THR A 97 5.642 8.258 8.122 1.00 0.00 O ATOM 1408 CB THR A 97 5.228 8.410 10.921 1.00 0.00 C ATOM 1409 OG1 THR A 97 5.525 7.881 12.218 1.00 0.00 O ATOM 1410 CG2 THR A 97 4.329 9.629 11.059 1.00 0.00 C ATOM 0 H THR A 97 6.163 5.985 9.959 1.00 0.00 H new ATOM 0 HA THR A 97 3.516 7.224 10.354 1.00 0.00 H new ATOM 0 HB THR A 97 6.153 8.715 10.432 1.00 0.00 H new ATOM 0 HG1 THR A 97 5.952 8.574 12.764 1.00 0.00 H new ATOM 0 HG21 THR A 97 4.824 10.378 11.677 1.00 0.00 H new ATOM 0 HG22 THR A 97 4.129 10.047 10.072 1.00 0.00 H new ATOM 0 HG23 THR A 97 3.389 9.337 11.527 1.00 0.00 H new ATOM 1418 N VAL A 98 3.517 7.561 7.874 1.00 0.00 N ATOM 1419 CA VAL A 98 3.445 7.930 6.465 1.00 0.00 C ATOM 1420 C VAL A 98 2.803 9.301 6.288 1.00 0.00 C ATOM 1421 O VAL A 98 1.745 9.581 6.854 1.00 0.00 O ATOM 1422 CB VAL A 98 2.647 6.892 5.653 1.00 0.00 C ATOM 1423 CG1 VAL A 98 3.066 5.480 6.033 1.00 0.00 C ATOM 1424 CG2 VAL A 98 1.153 7.088 5.862 1.00 0.00 C ATOM 0 H VAL A 98 2.662 7.147 8.246 1.00 0.00 H new ATOM 0 HA VAL A 98 4.469 7.961 6.093 1.00 0.00 H new ATOM 0 HB VAL A 98 2.865 7.037 4.595 1.00 0.00 H new ATOM 0 HG11 VAL A 98 2.492 4.761 5.449 1.00 0.00 H new ATOM 0 HG12 VAL A 98 4.128 5.348 5.828 1.00 0.00 H new ATOM 0 HG13 VAL A 98 2.879 5.318 7.094 1.00 0.00 H new ATOM 0 HG21 VAL A 98 0.604 6.347 5.281 1.00 0.00 H new ATOM 0 HG22 VAL A 98 0.915 6.970 6.919 1.00 0.00 H new ATOM 0 HG23 VAL A 98 0.868 8.088 5.536 1.00 0.00 H new ATOM 1434 N LEU A 99 3.447 10.153 5.498 1.00 0.00 N ATOM 1435 CA LEU A 99 2.938 11.496 5.244 1.00 0.00 C ATOM 1436 C LEU A 99 2.188 11.553 3.918 1.00 0.00 C ATOM 1437 O LEU A 99 2.175 12.583 3.243 1.00 0.00 O ATOM 1438 CB LEU A 99 4.088 12.505 5.237 1.00 0.00 C ATOM 1439 CG LEU A 99 3.686 13.981 5.227 1.00 0.00 C ATOM 1440 CD1 LEU A 99 2.691 14.270 6.340 1.00 0.00 C ATOM 1441 CD2 LEU A 99 4.914 14.869 5.363 1.00 0.00 C ATOM 0 H LEU A 99 4.323 9.937 5.022 1.00 0.00 H new ATOM 0 HA LEU A 99 2.243 11.752 6.044 1.00 0.00 H new ATOM 0 HB2 LEU A 99 4.709 12.324 6.114 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.709 12.312 4.362 1.00 0.00 H new ATOM 0 HG LEU A 99 3.207 14.201 4.273 1.00 0.00 H new ATOM 0 HD11 LEU A 99 2.416 15.325 6.318 1.00 0.00 H new ATOM 0 HD12 LEU A 99 1.799 13.660 6.198 1.00 0.00 H new ATOM 0 HD13 LEU A 99 3.143 14.033 7.303 1.00 0.00 H new ATOM 0 HD21 LEU A 99 4.609 15.915 5.354 1.00 0.00 H new ATOM 0 HD22 LEU A 99 5.421 14.647 6.302 1.00 0.00 H new ATOM 0 HD23 LEU A 99 5.592 14.682 4.531 1.00 0.00 H new ATOM 1453 N VAL A 100 1.561 10.440 3.550 1.00 0.00 N ATOM 1454 CA VAL A 100 0.805 10.364 2.305 1.00 0.00 C ATOM 1455 C VAL A 100 -0.364 11.342 2.312 1.00 0.00 C ATOM 1456 O VAL A 100 -0.607 12.028 3.306 1.00 0.00 O ATOM 1457 CB VAL A 100 0.268 8.941 2.061 1.00 0.00 C ATOM 1458 CG1 VAL A 100 1.380 7.916 2.221 1.00 0.00 C ATOM 1459 CG2 VAL A 100 -0.886 8.639 3.004 1.00 0.00 C ATOM 0 H VAL A 100 1.562 9.579 4.096 1.00 0.00 H new ATOM 0 HA VAL A 100 1.491 10.628 1.501 1.00 0.00 H new ATOM 0 HB VAL A 100 -0.103 8.882 1.038 1.00 0.00 H new ATOM 0 HG11 VAL A 100 0.982 6.917 2.045 1.00 0.00 H new ATOM 0 HG12 VAL A 100 2.172 8.123 1.501 1.00 0.00 H new ATOM 0 HG13 VAL A 100 1.784 7.973 3.232 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -1.253 7.630 2.818 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -0.543 8.716 4.036 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -1.691 9.355 2.835 1.00 0.00 H new ATOM 1469 N CYS A 101 -1.084 11.402 1.197 1.00 0.00 N ATOM 1470 CA CYS A 101 -2.228 12.298 1.074 1.00 0.00 C ATOM 1471 C CYS A 101 -2.995 12.025 -0.216 1.00 0.00 C ATOM 1472 O CYS A 101 -2.405 11.682 -1.241 1.00 0.00 O ATOM 1473 CB CYS A 101 -1.768 13.756 1.109 1.00 0.00 C ATOM 1474 SG CYS A 101 -1.073 14.348 -0.452 1.00 0.00 S ATOM 0 H CYS A 101 -0.896 10.841 0.366 1.00 0.00 H new ATOM 0 HA CYS A 101 -2.893 12.115 1.918 1.00 0.00 H new ATOM 0 HB2 CYS A 101 -2.615 14.387 1.380 1.00 0.00 H new ATOM 0 HB3 CYS A 101 -1.021 13.871 1.894 1.00 0.00 H new ATOM 0 HG CYS A 101 -1.169 13.414 -1.351 1.00 0.00 H new ATOM 1480 N ASP A 102 -4.314 12.179 -0.158 1.00 0.00 N ATOM 1481 CA ASP A 102 -5.162 11.949 -1.322 1.00 0.00 C ATOM 1482 C ASP A 102 -4.531 12.537 -2.580 1.00 0.00 C ATOM 1483 O ASP A 102 -4.606 13.741 -2.819 1.00 0.00 O ATOM 1484 CB ASP A 102 -6.547 12.558 -1.098 1.00 0.00 C ATOM 1485 CG ASP A 102 -6.478 13.941 -0.481 1.00 0.00 C ATOM 1486 OD1 ASP A 102 -6.080 14.045 0.698 1.00 0.00 O ATOM 1487 OD2 ASP A 102 -6.823 14.920 -1.177 1.00 0.00 O ATOM 0 H ASP A 102 -4.818 12.462 0.682 1.00 0.00 H new ATOM 0 HA ASP A 102 -5.264 10.873 -1.459 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -7.074 12.614 -2.050 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -7.128 11.903 -0.450 1.00 0.00 H new ATOM 1492 N GLY A 103 -3.907 11.678 -3.380 1.00 0.00 N ATOM 1493 CA GLY A 103 -3.271 12.131 -4.603 1.00 0.00 C ATOM 1494 C GLY A 103 -4.233 12.183 -5.773 1.00 0.00 C ATOM 1495 O GLY A 103 -4.242 13.149 -6.537 1.00 0.00 O ATOM 0 H GLY A 103 -3.831 10.676 -3.203 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -2.846 13.122 -4.442 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -2.443 11.465 -4.847 1.00 0.00 H new ATOM 1499 N PHE A 104 -5.046 11.142 -5.915 1.00 0.00 N ATOM 1500 CA PHE A 104 -6.015 11.071 -7.002 1.00 0.00 C ATOM 1501 C PHE A 104 -7.034 9.963 -6.752 1.00 0.00 C ATOM 1502 O PHE A 104 -6.707 8.778 -6.822 1.00 0.00 O ATOM 1503 CB PHE A 104 -5.303 10.832 -8.335 1.00 0.00 C ATOM 1504 CG PHE A 104 -4.090 9.954 -8.217 1.00 0.00 C ATOM 1505 CD1 PHE A 104 -4.208 8.575 -8.278 1.00 0.00 C ATOM 1506 CD2 PHE A 104 -2.831 10.508 -8.045 1.00 0.00 C ATOM 1507 CE1 PHE A 104 -3.094 7.764 -8.170 1.00 0.00 C ATOM 1508 CE2 PHE A 104 -1.714 9.703 -7.938 1.00 0.00 C ATOM 1509 CZ PHE A 104 -1.845 8.329 -7.999 1.00 0.00 C ATOM 0 H PHE A 104 -5.053 10.335 -5.291 1.00 0.00 H new ATOM 0 HA PHE A 104 -6.543 12.024 -7.046 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -6.004 10.378 -9.036 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -5.007 11.792 -8.757 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -5.182 8.128 -8.412 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -2.722 11.581 -7.994 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -3.200 6.690 -8.219 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -0.738 10.147 -7.807 1.00 0.00 H new ATOM 0 HZ PHE A 104 -0.973 7.698 -7.913 1.00 0.00 H new ATOM 1519 N GLU A 105 -8.269 10.357 -6.459 1.00 0.00 N ATOM 1520 CA GLU A 105 -9.335 9.397 -6.196 1.00 0.00 C ATOM 1521 C GLU A 105 -9.662 8.591 -7.450 1.00 0.00 C ATOM 1522 O GLU A 105 -9.886 9.154 -8.522 1.00 0.00 O ATOM 1523 CB GLU A 105 -10.589 10.118 -5.698 1.00 0.00 C ATOM 1524 CG GLU A 105 -10.452 10.676 -4.292 1.00 0.00 C ATOM 1525 CD GLU A 105 -11.788 11.051 -3.680 1.00 0.00 C ATOM 1526 OE1 GLU A 105 -12.781 10.340 -3.943 1.00 0.00 O ATOM 1527 OE2 GLU A 105 -11.842 12.055 -2.940 1.00 0.00 O ATOM 0 H GLU A 105 -8.556 11.334 -6.398 1.00 0.00 H new ATOM 0 HA GLU A 105 -8.989 8.710 -5.424 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -10.825 10.933 -6.382 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -11.431 9.426 -5.725 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -9.961 9.937 -3.658 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -9.808 11.555 -4.315 1.00 0.00 H new ATOM 1534 N SER A 106 -9.688 7.270 -7.307 1.00 0.00 N ATOM 1535 CA SER A 106 -9.983 6.386 -8.428 1.00 0.00 C ATOM 1536 C SER A 106 -11.432 5.910 -8.379 1.00 0.00 C ATOM 1537 O SER A 106 -12.126 5.892 -9.394 1.00 0.00 O ATOM 1538 CB SER A 106 -9.039 5.182 -8.418 1.00 0.00 C ATOM 1539 OG SER A 106 -7.696 5.585 -8.621 1.00 0.00 O ATOM 0 H SER A 106 -9.508 6.788 -6.426 1.00 0.00 H new ATOM 0 HA SER A 106 -9.834 6.948 -9.350 1.00 0.00 H new ATOM 0 HB2 SER A 106 -9.124 4.657 -7.467 1.00 0.00 H new ATOM 0 HB3 SER A 106 -9.333 4.479 -9.198 1.00 0.00 H new ATOM 0 HG SER A 106 -7.113 4.798 -8.609 1.00 0.00 H new ATOM 1545 N GLY A 107 -11.882 5.526 -7.188 1.00 0.00 N ATOM 1546 CA GLY A 107 -13.245 5.056 -7.026 1.00 0.00 C ATOM 1547 C GLY A 107 -13.370 4.002 -5.944 1.00 0.00 C ATOM 1548 O GLY A 107 -12.750 2.940 -6.008 1.00 0.00 O ATOM 0 H GLY A 107 -11.326 5.532 -6.333 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -13.891 5.900 -6.783 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -13.599 4.645 -7.972 1.00 0.00 H new ATOM 1552 N PRO A 108 -14.188 4.292 -4.921 1.00 0.00 N ATOM 1553 CA PRO A 108 -14.410 3.373 -3.801 1.00 0.00 C ATOM 1554 C PRO A 108 -15.204 2.138 -4.212 1.00 0.00 C ATOM 1555 O PRO A 108 -16.388 2.228 -4.534 1.00 0.00 O ATOM 1556 CB PRO A 108 -15.211 4.216 -2.805 1.00 0.00 C ATOM 1557 CG PRO A 108 -15.894 5.243 -3.641 1.00 0.00 C ATOM 1558 CD PRO A 108 -14.958 5.539 -4.780 1.00 0.00 C ATOM 0 HA PRO A 108 -13.473 2.987 -3.399 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -15.932 3.606 -2.260 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -14.559 4.678 -2.064 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -16.851 4.873 -4.009 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -16.101 6.143 -3.062 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -15.501 5.782 -5.694 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -14.311 6.388 -4.558 1.00 0.00 H new ATOM 1566 N SER A 109 -14.543 0.985 -4.200 1.00 0.00 N ATOM 1567 CA SER A 109 -15.186 -0.269 -4.575 1.00 0.00 C ATOM 1568 C SER A 109 -14.936 -1.345 -3.523 1.00 0.00 C ATOM 1569 O SER A 109 -13.802 -1.782 -3.324 1.00 0.00 O ATOM 1570 CB SER A 109 -14.673 -0.742 -5.937 1.00 0.00 C ATOM 1571 OG SER A 109 -15.443 -0.192 -6.991 1.00 0.00 O ATOM 0 H SER A 109 -13.562 0.893 -3.935 1.00 0.00 H new ATOM 0 HA SER A 109 -16.260 -0.092 -4.640 1.00 0.00 H new ATOM 0 HB2 SER A 109 -13.629 -0.453 -6.056 1.00 0.00 H new ATOM 0 HB3 SER A 109 -14.710 -1.830 -5.985 1.00 0.00 H new ATOM 0 HG SER A 109 -15.094 -0.508 -7.850 1.00 0.00 H new ATOM 1577 N SER A 110 -16.002 -1.766 -2.851 1.00 0.00 N ATOM 1578 CA SER A 110 -15.899 -2.787 -1.815 1.00 0.00 C ATOM 1579 C SER A 110 -14.901 -3.869 -2.217 1.00 0.00 C ATOM 1580 O SER A 110 -14.087 -4.310 -1.407 1.00 0.00 O ATOM 1581 CB SER A 110 -17.269 -3.414 -1.549 1.00 0.00 C ATOM 1582 OG SER A 110 -17.349 -3.924 -0.229 1.00 0.00 O ATOM 0 H SER A 110 -16.948 -1.416 -3.005 1.00 0.00 H new ATOM 0 HA SER A 110 -15.543 -2.309 -0.902 1.00 0.00 H new ATOM 0 HB2 SER A 110 -18.049 -2.669 -1.702 1.00 0.00 H new ATOM 0 HB3 SER A 110 -17.450 -4.217 -2.264 1.00 0.00 H new ATOM 0 HG SER A 110 -18.235 -4.318 -0.084 1.00 0.00 H new ATOM 1588 N GLY A 111 -14.972 -4.293 -3.475 1.00 0.00 N ATOM 1589 CA GLY A 111 -14.070 -5.320 -3.964 1.00 0.00 C ATOM 1590 C GLY A 111 -14.766 -6.650 -4.175 1.00 0.00 C ATOM 1591 O GLY A 111 -15.138 -7.323 -3.214 1.00 0.00 O ATOM 0 H GLY A 111 -15.638 -3.944 -4.164 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -13.627 -4.992 -4.904 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -13.253 -5.450 -3.254 1.00 0.00 H new TER 1595 GLY A 111