USER MOD reduce.3.24.130724 H: found=0, std=0, add=1138, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1140 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 Single : A 6 MET CE :methyl -130:sc=-0.00187 (180deg=-0.368) USER MOD Single : A 17 ASN :FLIP amide:sc= -0.0565 F(o=-2.9,f=-0.056) USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 ASN : amide:sc= -0.505 X(o=-0.51,f=-0.57) USER MOD Single : A 26 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00187) USER MOD Single : A 28 GLN : amide:sc= -1.23 K(o=-1.2,f=-6.3!) USER MOD Single : A 31 ASN : amide:sc= -1.47! X(o=-1.5!,f=-1.3) USER MOD Single : A 37 THR OG1 : rot 1:sc= -0.27 USER MOD Single : A 38 LYS NZ :NH3+ -154:sc= -0.131 (180deg=-0.658) USER MOD Single : A 39 LYS NZ :NH3+ -169:sc= -0.0396 (180deg=-0.177) USER MOD Single : A 40 HIS : +bothHN:sc= 0.767 K(o=0.77,f=-2.7!) USER MOD Single : A 43 HIS : no HD1:sc= -0.0456 X(o=-0.046,f=-0.0096) USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 47 GLN : amide:sc= -0.348 X(o=-0.35,f=-0.13) USER MOD Single : A 49 LYS NZ :NH3+ 138:sc= 0.928 (180deg=0.00647) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 154:sc= -0.188 (180deg=-0.39) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 67 SER OG : rot -103:sc= 0.311 USER MOD Single : A 69 GLN : amide:sc= -0.158 X(o=-0.16,f=-0.35) USER MOD Single : A 71 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 73 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 77 LYS NZ :NH3+ -112:sc= 0.584 (180deg=-0.172) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 ASN :FLIP amide:sc= -0.0745 F(o=-1.9!,f=-0.075) USER MOD Single : A 87 CYS SG : rot -30:sc= -4.46! USER MOD Single : A 90 CYS SG : rot -135:sc= 0.988 USER MOD Single : A 95 THR OG1 : rot 78:sc= 0.497 USER MOD Single : A 98 LYS NZ :NH3+ -115:sc= 0.756 (180deg=-0.145) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 20:sc= 0.367 USER MOD Single : A 115 ASN : amide:sc= -3.26! C(o=-3.3!,f=-4.2!) USER MOD Single : A 118 LYS NZ :NH3+ 155:sc= -0.081 (180deg=-0.177) USER MOD Single : A 127 LYS NZ :NH3+ -103:sc= -0.805 (180deg=-3.04!) USER MOD Single : A 133 ASN : amide:sc= -0.652 X(o=-0.65,f=-0.2) USER MOD Single : A 141 LYS NZ :NH3+ -142:sc= 0.403 (180deg=-0.103) USER MOD ----------------------------------------------------------------- ATOM 63 N MET A 6 -3.420 10.462 4.935 1.00 0.00 N ATOM 64 CA MET A 6 -2.935 9.498 5.939 1.00 0.00 C ATOM 65 C MET A 6 -1.416 9.656 6.063 1.00 0.00 C ATOM 66 O MET A 6 -0.800 10.401 5.284 1.00 0.00 O ATOM 67 CB MET A 6 -3.310 8.038 5.544 1.00 0.00 C ATOM 68 CG MET A 6 -4.744 7.865 5.019 1.00 0.00 C ATOM 69 SD MET A 6 -4.882 8.267 3.263 1.00 0.00 S ATOM 70 CE MET A 6 -6.644 8.093 2.964 1.00 0.00 C ATOM 0 HA MET A 6 -3.409 9.700 6.899 1.00 0.00 H new ATOM 0 HB2 MET A 6 -2.613 7.692 4.780 1.00 0.00 H new ATOM 0 HB3 MET A 6 -3.175 7.394 6.413 1.00 0.00 H new ATOM 0 HG2 MET A 6 -5.067 6.836 5.181 1.00 0.00 H new ATOM 0 HG3 MET A 6 -5.418 8.504 5.590 1.00 0.00 H new ATOM 0 HE1 MET A 6 -6.804 7.464 2.088 1.00 0.00 H new ATOM 0 HE2 MET A 6 -7.117 7.634 3.832 1.00 0.00 H new ATOM 0 HE3 MET A 6 -7.082 9.076 2.790 1.00 0.00 H new ATOM 80 N ILE A 7 -0.796 8.948 7.015 1.00 0.00 N ATOM 81 CA ILE A 7 0.641 9.060 7.273 1.00 0.00 C ATOM 82 C ILE A 7 1.314 7.798 6.729 1.00 0.00 C ATOM 83 O ILE A 7 1.189 6.719 7.318 1.00 0.00 O ATOM 84 CB ILE A 7 0.921 9.208 8.816 1.00 0.00 C ATOM 85 CG1 ILE A 7 0.119 10.421 9.386 1.00 0.00 C ATOM 86 CG2 ILE A 7 2.439 9.341 9.116 1.00 0.00 C ATOM 87 CD1 ILE A 7 0.191 10.578 10.888 1.00 0.00 C ATOM 0 H ILE A 7 -1.275 8.285 7.624 1.00 0.00 H new ATOM 0 HA ILE A 7 1.041 9.947 6.781 1.00 0.00 H new ATOM 0 HB ILE A 7 0.583 8.300 9.314 1.00 0.00 H new ATOM 0 HG12 ILE A 7 0.490 11.335 8.921 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -0.926 10.317 9.095 1.00 0.00 H new ATOM 0 HG21 ILE A 7 2.590 9.441 10.191 1.00 0.00 H new ATOM 0 HG22 ILE A 7 2.960 8.453 8.757 1.00 0.00 H new ATOM 0 HG23 ILE A 7 2.834 10.222 8.611 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -0.395 11.445 11.192 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -0.209 9.684 11.367 1.00 0.00 H new ATOM 0 HD13 ILE A 7 1.229 10.718 11.190 1.00 0.00 H new ATOM 99 N ILE A 8 1.966 7.936 5.567 1.00 0.00 N ATOM 100 CA ILE A 8 2.749 6.855 4.949 1.00 0.00 C ATOM 101 C ILE A 8 4.222 7.227 5.111 1.00 0.00 C ATOM 102 O ILE A 8 4.630 8.308 4.657 1.00 0.00 O ATOM 103 CB ILE A 8 2.406 6.679 3.413 1.00 0.00 C ATOM 104 CG1 ILE A 8 0.856 6.687 3.166 1.00 0.00 C ATOM 105 CG2 ILE A 8 3.053 5.390 2.833 1.00 0.00 C ATOM 106 CD1 ILE A 8 0.072 5.656 3.956 1.00 0.00 C ATOM 0 H ILE A 8 1.966 8.801 5.027 1.00 0.00 H new ATOM 0 HA ILE A 8 2.514 5.907 5.434 1.00 0.00 H new ATOM 0 HB ILE A 8 2.831 7.533 2.886 1.00 0.00 H new ATOM 0 HG12 ILE A 8 0.470 7.677 3.408 1.00 0.00 H new ATOM 0 HG13 ILE A 8 0.672 6.524 2.104 1.00 0.00 H new ATOM 0 HG21 ILE A 8 2.798 5.299 1.777 1.00 0.00 H new ATOM 0 HG22 ILE A 8 4.136 5.446 2.942 1.00 0.00 H new ATOM 0 HG23 ILE A 8 2.679 4.520 3.373 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -0.988 5.742 3.716 1.00 0.00 H new ATOM 0 HD12 ILE A 8 0.422 4.657 3.698 1.00 0.00 H new ATOM 0 HD13 ILE A 8 0.217 5.827 5.023 1.00 0.00 H new ATOM 118 N ARG A 9 5.039 6.369 5.742 1.00 0.00 N ATOM 119 CA ARG A 9 6.428 6.728 6.063 1.00 0.00 C ATOM 120 C ARG A 9 7.389 5.651 5.570 1.00 0.00 C ATOM 121 O ARG A 9 7.074 4.461 5.602 1.00 0.00 O ATOM 122 CB ARG A 9 6.605 6.953 7.590 1.00 0.00 C ATOM 123 CG ARG A 9 7.836 7.824 7.970 1.00 0.00 C ATOM 124 CD ARG A 9 7.571 9.350 7.846 1.00 0.00 C ATOM 125 NE ARG A 9 6.948 9.739 6.558 1.00 0.00 N ATOM 126 CZ ARG A 9 7.529 10.437 5.570 1.00 0.00 C ATOM 127 NH1 ARG A 9 8.760 10.927 5.698 1.00 0.00 N ATOM 128 NH2 ARG A 9 6.848 10.660 4.459 1.00 0.00 N ATOM 0 H ARG A 9 4.765 5.432 6.037 1.00 0.00 H new ATOM 0 HA ARG A 9 6.661 7.662 5.551 1.00 0.00 H new ATOM 0 HB2 ARG A 9 5.705 7.426 7.982 1.00 0.00 H new ATOM 0 HB3 ARG A 9 6.695 5.984 8.080 1.00 0.00 H new ATOM 0 HG2 ARG A 9 8.132 7.596 8.994 1.00 0.00 H new ATOM 0 HG3 ARG A 9 8.675 7.555 7.328 1.00 0.00 H new ATOM 0 HD2 ARG A 9 6.923 9.666 8.664 1.00 0.00 H new ATOM 0 HD3 ARG A 9 8.514 9.885 7.961 1.00 0.00 H new ATOM 0 HE ARG A 9 5.982 9.447 6.408 1.00 0.00 H new ATOM 0 HH11 ARG A 9 9.282 10.775 6.561 1.00 0.00 H new ATOM 0 HH12 ARG A 9 9.181 11.455 4.933 1.00 0.00 H new ATOM 0 HH21 ARG A 9 5.897 10.303 4.363 1.00 0.00 H new ATOM 0 HH22 ARG A 9 7.273 11.189 3.697 1.00 0.00 H new ATOM 142 N GLY A 10 8.567 6.104 5.127 1.00 0.00 N ATOM 143 CA GLY A 10 9.614 5.232 4.633 1.00 0.00 C ATOM 144 C GLY A 10 10.709 5.109 5.653 1.00 0.00 C ATOM 145 O GLY A 10 11.190 6.120 6.174 1.00 0.00 O ATOM 0 H GLY A 10 8.813 7.094 5.105 1.00 0.00 H new ATOM 0 HA2 GLY A 10 9.203 4.248 4.410 1.00 0.00 H new ATOM 0 HA3 GLY A 10 10.018 5.628 3.701 1.00 0.00 H new ATOM 149 N ILE A 11 11.051 3.869 5.981 1.00 0.00 N ATOM 150 CA ILE A 11 12.061 3.561 6.992 1.00 0.00 C ATOM 151 C ILE A 11 12.909 2.351 6.562 1.00 0.00 C ATOM 152 O ILE A 11 12.412 1.434 5.905 1.00 0.00 O ATOM 153 CB ILE A 11 11.361 3.327 8.383 1.00 0.00 C ATOM 154 CG1 ILE A 11 12.403 3.083 9.521 1.00 0.00 C ATOM 155 CG2 ILE A 11 10.324 2.180 8.297 1.00 0.00 C ATOM 156 CD1 ILE A 11 11.802 2.937 10.907 1.00 0.00 C ATOM 0 H ILE A 11 10.634 3.043 5.552 1.00 0.00 H new ATOM 0 HA ILE A 11 12.742 4.406 7.094 1.00 0.00 H new ATOM 0 HB ILE A 11 10.822 4.239 8.640 1.00 0.00 H new ATOM 0 HG12 ILE A 11 12.971 2.182 9.289 1.00 0.00 H new ATOM 0 HG13 ILE A 11 13.111 3.912 9.532 1.00 0.00 H new ATOM 0 HG21 ILE A 11 9.855 2.039 9.271 1.00 0.00 H new ATOM 0 HG22 ILE A 11 9.561 2.433 7.561 1.00 0.00 H new ATOM 0 HG23 ILE A 11 10.824 1.259 7.999 1.00 0.00 H new ATOM 0 HD11 ILE A 11 12.598 2.771 11.633 1.00 0.00 H new ATOM 0 HD12 ILE A 11 11.259 3.846 11.166 1.00 0.00 H new ATOM 0 HD13 ILE A 11 11.117 2.089 10.919 1.00 0.00 H new ATOM 168 N ARG A 12 14.200 2.380 6.931 1.00 0.00 N ATOM 169 CA ARG A 12 15.187 1.354 6.585 1.00 0.00 C ATOM 170 C ARG A 12 15.817 0.790 7.869 1.00 0.00 C ATOM 171 O ARG A 12 16.219 1.543 8.762 1.00 0.00 O ATOM 172 CB ARG A 12 16.261 1.939 5.622 1.00 0.00 C ATOM 173 CG ARG A 12 17.129 3.107 6.167 1.00 0.00 C ATOM 174 CD ARG A 12 18.113 3.639 5.104 1.00 0.00 C ATOM 175 NE ARG A 12 18.909 4.798 5.572 1.00 0.00 N ATOM 176 CZ ARG A 12 19.441 5.740 4.769 1.00 0.00 C ATOM 177 NH1 ARG A 12 19.179 5.755 3.470 1.00 0.00 N ATOM 178 NH2 ARG A 12 20.227 6.672 5.275 1.00 0.00 N ATOM 0 H ARG A 12 14.592 3.137 7.491 1.00 0.00 H new ATOM 0 HA ARG A 12 14.695 0.534 6.062 1.00 0.00 H new ATOM 0 HB2 ARG A 12 16.928 1.130 5.325 1.00 0.00 H new ATOM 0 HB3 ARG A 12 15.756 2.283 4.719 1.00 0.00 H new ATOM 0 HG2 ARG A 12 16.480 3.917 6.498 1.00 0.00 H new ATOM 0 HG3 ARG A 12 17.687 2.768 7.040 1.00 0.00 H new ATOM 0 HD2 ARG A 12 18.790 2.836 4.811 1.00 0.00 H new ATOM 0 HD3 ARG A 12 17.555 3.926 4.213 1.00 0.00 H new ATOM 0 HE ARG A 12 19.066 4.889 6.576 1.00 0.00 H new ATOM 0 HH11 ARG A 12 18.567 5.047 3.065 1.00 0.00 H new ATOM 0 HH12 ARG A 12 19.589 6.475 2.875 1.00 0.00 H new ATOM 0 HH21 ARG A 12 20.432 6.679 6.274 1.00 0.00 H new ATOM 0 HH22 ARG A 12 20.630 7.385 4.667 1.00 0.00 H new ATOM 192 N GLY A 13 15.854 -0.543 7.964 1.00 0.00 N ATOM 193 CA GLY A 13 16.366 -1.236 9.147 1.00 0.00 C ATOM 194 C GLY A 13 15.287 -1.494 10.196 1.00 0.00 C ATOM 195 O GLY A 13 15.595 -1.947 11.303 1.00 0.00 O ATOM 0 H GLY A 13 15.531 -1.168 7.226 1.00 0.00 H new ATOM 0 HA2 GLY A 13 16.806 -2.186 8.844 1.00 0.00 H new ATOM 0 HA3 GLY A 13 17.165 -0.643 9.592 1.00 0.00 H new ATOM 199 N ALA A 14 14.019 -1.209 9.836 1.00 0.00 N ATOM 200 CA ALA A 14 12.865 -1.360 10.722 1.00 0.00 C ATOM 201 C ALA A 14 12.544 -2.839 10.964 1.00 0.00 C ATOM 202 O ALA A 14 11.861 -3.473 10.153 1.00 0.00 O ATOM 203 CB ALA A 14 11.659 -0.645 10.114 1.00 0.00 C ATOM 0 H ALA A 14 13.773 -0.864 8.908 1.00 0.00 H new ATOM 0 HA ALA A 14 13.104 -0.911 11.686 1.00 0.00 H new ATOM 0 HB1 ALA A 14 10.799 -0.757 10.774 1.00 0.00 H new ATOM 0 HB2 ALA A 14 11.887 0.414 9.992 1.00 0.00 H new ATOM 0 HB3 ALA A 14 11.430 -1.081 9.142 1.00 0.00 H new ATOM 209 N ARG A 15 13.074 -3.385 12.066 1.00 0.00 N ATOM 210 CA ARG A 15 12.854 -4.780 12.453 1.00 0.00 C ATOM 211 C ARG A 15 11.417 -4.956 12.974 1.00 0.00 C ATOM 212 O ARG A 15 11.095 -4.528 14.091 1.00 0.00 O ATOM 213 CB ARG A 15 13.894 -5.224 13.510 1.00 0.00 C ATOM 214 CG ARG A 15 15.359 -5.125 13.033 1.00 0.00 C ATOM 215 CD ARG A 15 16.364 -5.590 14.103 1.00 0.00 C ATOM 216 NE ARG A 15 17.763 -5.404 13.661 1.00 0.00 N ATOM 217 CZ ARG A 15 18.734 -6.332 13.716 1.00 0.00 C ATOM 218 NH1 ARG A 15 18.484 -7.556 14.174 1.00 0.00 N ATOM 219 NH2 ARG A 15 19.957 -6.028 13.295 1.00 0.00 N ATOM 0 H ARG A 15 13.669 -2.869 12.714 1.00 0.00 H new ATOM 0 HA ARG A 15 12.983 -5.417 11.578 1.00 0.00 H new ATOM 0 HB2 ARG A 15 13.772 -4.612 14.404 1.00 0.00 H new ATOM 0 HB3 ARG A 15 13.686 -6.254 13.798 1.00 0.00 H new ATOM 0 HG2 ARG A 15 15.486 -5.729 12.134 1.00 0.00 H new ATOM 0 HG3 ARG A 15 15.579 -4.093 12.758 1.00 0.00 H new ATOM 0 HD2 ARG A 15 16.197 -5.033 15.025 1.00 0.00 H new ATOM 0 HD3 ARG A 15 16.192 -6.642 14.331 1.00 0.00 H new ATOM 0 HE ARG A 15 18.013 -4.491 13.281 1.00 0.00 H new ATOM 0 HH11 ARG A 15 17.545 -7.801 14.489 1.00 0.00 H new ATOM 0 HH12 ARG A 15 19.231 -8.250 14.210 1.00 0.00 H new ATOM 0 HH21 ARG A 15 20.155 -5.095 12.933 1.00 0.00 H new ATOM 0 HH22 ARG A 15 20.698 -6.727 13.334 1.00 0.00 H new ATOM 233 N ILE A 16 10.558 -5.543 12.119 1.00 0.00 N ATOM 234 CA ILE A 16 9.149 -5.812 12.440 1.00 0.00 C ATOM 235 C ILE A 16 9.064 -6.842 13.586 1.00 0.00 C ATOM 236 O ILE A 16 9.403 -8.018 13.407 1.00 0.00 O ATOM 237 CB ILE A 16 8.355 -6.319 11.167 1.00 0.00 C ATOM 238 CG1 ILE A 16 8.407 -5.259 10.014 1.00 0.00 C ATOM 239 CG2 ILE A 16 6.885 -6.690 11.512 1.00 0.00 C ATOM 240 CD1 ILE A 16 7.761 -3.917 10.333 1.00 0.00 C ATOM 0 H ILE A 16 10.826 -5.844 11.182 1.00 0.00 H new ATOM 0 HA ILE A 16 8.684 -4.881 12.764 1.00 0.00 H new ATOM 0 HB ILE A 16 8.847 -7.227 10.820 1.00 0.00 H new ATOM 0 HG12 ILE A 16 9.450 -5.087 9.748 1.00 0.00 H new ATOM 0 HG13 ILE A 16 7.918 -5.679 9.135 1.00 0.00 H new ATOM 0 HG21 ILE A 16 6.375 -7.033 10.612 1.00 0.00 H new ATOM 0 HG22 ILE A 16 6.876 -7.484 12.259 1.00 0.00 H new ATOM 0 HG23 ILE A 16 6.372 -5.814 11.908 1.00 0.00 H new ATOM 0 HD11 ILE A 16 7.851 -3.256 9.471 1.00 0.00 H new ATOM 0 HD12 ILE A 16 6.707 -4.067 10.567 1.00 0.00 H new ATOM 0 HD13 ILE A 16 8.262 -3.466 11.190 1.00 0.00 H new ATOM 252 N ASN A 17 8.652 -6.363 14.771 1.00 0.00 N ATOM 253 CA ASN A 17 8.505 -7.198 15.987 1.00 0.00 C ATOM 254 C ASN A 17 7.037 -7.290 16.402 1.00 0.00 C ATOM 255 O ASN A 17 6.219 -6.497 15.942 1.00 0.00 O ATOM 256 CB ASN A 17 9.390 -6.672 17.155 1.00 0.00 C ATOM 257 CG ASN A 17 9.246 -5.178 17.527 1.00 0.00 C ATOM 258 OD1 ASN A 17 8.100 -4.537 17.284 1.00 0.00 O flip ATOM 259 ND2 ASN A 17 10.189 -4.595 18.052 1.00 0.00 N flip ATOM 0 H ASN A 17 8.409 -5.383 14.919 1.00 0.00 H new ATOM 0 HA ASN A 17 8.855 -8.202 15.747 1.00 0.00 H new ATOM 0 HB2 ASN A 17 9.168 -7.265 18.042 1.00 0.00 H new ATOM 0 HB3 ASN A 17 10.433 -6.859 16.900 1.00 0.00 H new ATOM 0 HD21 ASN A 17 11.060 -5.094 18.233 1.00 0.00 H new ATOM 0 HD22 ASN A 17 10.102 -3.611 18.307 1.00 0.00 H new ATOM 266 N ASN A 18 6.712 -8.235 17.290 1.00 0.00 N ATOM 267 CA ASN A 18 5.324 -8.476 17.736 1.00 0.00 C ATOM 268 C ASN A 18 4.770 -7.361 18.655 1.00 0.00 C ATOM 269 O ASN A 18 3.550 -7.270 18.830 1.00 0.00 O ATOM 270 CB ASN A 18 5.233 -9.847 18.458 1.00 0.00 C ATOM 271 CG ASN A 18 5.542 -11.038 17.541 1.00 0.00 C ATOM 272 OD1 ASN A 18 4.652 -11.576 16.882 1.00 0.00 O ATOM 273 ND2 ASN A 18 6.798 -11.465 17.491 1.00 0.00 N ATOM 0 H ASN A 18 7.396 -8.856 17.722 1.00 0.00 H new ATOM 0 HA ASN A 18 4.705 -8.476 16.839 1.00 0.00 H new ATOM 0 HB2 ASN A 18 5.928 -9.854 19.298 1.00 0.00 H new ATOM 0 HB3 ASN A 18 4.232 -9.966 18.872 1.00 0.00 H new ATOM 0 HD21 ASN A 18 7.044 -12.256 16.897 1.00 0.00 H new ATOM 0 HD22 ASN A 18 7.517 -11.002 18.047 1.00 0.00 H new ATOM 280 N GLU A 19 5.650 -6.503 19.224 1.00 0.00 N ATOM 281 CA GLU A 19 5.247 -5.483 20.220 1.00 0.00 C ATOM 282 C GLU A 19 4.322 -4.412 19.598 1.00 0.00 C ATOM 283 O GLU A 19 3.393 -3.935 20.257 1.00 0.00 O ATOM 284 CB GLU A 19 6.511 -4.826 20.847 1.00 0.00 C ATOM 285 CG GLU A 19 6.243 -3.890 22.047 1.00 0.00 C ATOM 286 CD GLU A 19 5.585 -4.599 23.246 1.00 0.00 C ATOM 287 OE1 GLU A 19 6.288 -5.327 23.975 1.00 0.00 O ATOM 288 OE2 GLU A 19 4.365 -4.440 23.462 1.00 0.00 O ATOM 0 H GLU A 19 6.647 -6.498 19.009 1.00 0.00 H new ATOM 0 HA GLU A 19 4.679 -5.982 21.005 1.00 0.00 H new ATOM 0 HB2 GLU A 19 7.189 -5.616 21.168 1.00 0.00 H new ATOM 0 HB3 GLU A 19 7.027 -4.258 20.073 1.00 0.00 H new ATOM 0 HG2 GLU A 19 7.185 -3.447 22.370 1.00 0.00 H new ATOM 0 HG3 GLU A 19 5.601 -3.071 21.722 1.00 0.00 H new ATOM 295 N ILE A 20 4.595 -4.047 18.321 1.00 0.00 N ATOM 296 CA ILE A 20 3.755 -3.112 17.520 1.00 0.00 C ATOM 297 C ILE A 20 2.253 -3.466 17.510 1.00 0.00 C ATOM 298 O ILE A 20 1.442 -2.605 17.212 1.00 0.00 O ATOM 299 CB ILE A 20 4.248 -2.994 16.021 1.00 0.00 C ATOM 300 CG1 ILE A 20 4.053 -4.347 15.257 1.00 0.00 C ATOM 301 CG2 ILE A 20 5.713 -2.505 15.951 1.00 0.00 C ATOM 302 CD1 ILE A 20 4.570 -4.375 13.827 1.00 0.00 C ATOM 0 H ILE A 20 5.408 -4.393 17.812 1.00 0.00 H new ATOM 0 HA ILE A 20 3.875 -2.156 18.029 1.00 0.00 H new ATOM 0 HB ILE A 20 3.632 -2.245 15.523 1.00 0.00 H new ATOM 0 HG12 ILE A 20 4.551 -5.136 15.820 1.00 0.00 H new ATOM 0 HG13 ILE A 20 2.990 -4.587 15.245 1.00 0.00 H new ATOM 0 HG21 ILE A 20 6.023 -2.434 14.909 1.00 0.00 H new ATOM 0 HG22 ILE A 20 5.792 -1.525 16.421 1.00 0.00 H new ATOM 0 HG23 ILE A 20 6.358 -3.211 16.474 1.00 0.00 H new ATOM 0 HD11 ILE A 20 4.384 -5.357 13.392 1.00 0.00 H new ATOM 0 HD12 ILE A 20 4.056 -3.615 13.239 1.00 0.00 H new ATOM 0 HD13 ILE A 20 5.641 -4.173 13.823 1.00 0.00 H new ATOM 314 N PHE A 21 1.890 -4.727 17.813 1.00 0.00 N ATOM 315 CA PHE A 21 0.497 -5.201 17.775 1.00 0.00 C ATOM 316 C PHE A 21 -0.176 -5.074 19.162 1.00 0.00 C ATOM 317 O PHE A 21 -1.397 -4.898 19.250 1.00 0.00 O ATOM 318 CB PHE A 21 0.501 -6.678 17.288 1.00 0.00 C ATOM 319 CG PHE A 21 -0.881 -7.328 17.151 1.00 0.00 C ATOM 320 CD1 PHE A 21 -1.740 -6.967 16.112 1.00 0.00 C ATOM 321 CD2 PHE A 21 -1.317 -8.305 18.055 1.00 0.00 C ATOM 322 CE1 PHE A 21 -2.988 -7.552 15.987 1.00 0.00 C ATOM 323 CE2 PHE A 21 -2.568 -8.886 17.927 1.00 0.00 C ATOM 324 CZ PHE A 21 -3.400 -8.513 16.889 1.00 0.00 C ATOM 0 H PHE A 21 2.558 -5.446 18.091 1.00 0.00 H new ATOM 0 HA PHE A 21 -0.083 -4.585 17.087 1.00 0.00 H new ATOM 0 HB2 PHE A 21 1.003 -6.723 16.321 1.00 0.00 H new ATOM 0 HB3 PHE A 21 1.095 -7.271 17.983 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -1.427 -6.221 15.396 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -0.669 -8.610 18.863 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -3.642 -7.256 15.181 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -2.893 -9.631 18.639 1.00 0.00 H new ATOM 0 HZ PHE A 21 -4.372 -8.973 16.783 1.00 0.00 H new ATOM 334 N ASN A 22 0.644 -5.115 20.234 1.00 0.00 N ATOM 335 CA ASN A 22 0.163 -5.233 21.633 1.00 0.00 C ATOM 336 C ASN A 22 -0.482 -3.929 22.137 1.00 0.00 C ATOM 337 O ASN A 22 -1.206 -3.939 23.137 1.00 0.00 O ATOM 338 CB ASN A 22 1.331 -5.647 22.571 1.00 0.00 C ATOM 339 CG ASN A 22 1.939 -7.014 22.238 1.00 0.00 C ATOM 340 OD1 ASN A 22 1.260 -7.904 21.725 1.00 0.00 O ATOM 341 ND2 ASN A 22 3.215 -7.196 22.550 1.00 0.00 N ATOM 0 H ASN A 22 1.660 -5.067 20.157 1.00 0.00 H new ATOM 0 HA ASN A 22 -0.606 -6.006 21.647 1.00 0.00 H new ATOM 0 HB2 ASN A 22 2.113 -4.890 22.518 1.00 0.00 H new ATOM 0 HB3 ASN A 22 0.971 -5.661 23.600 1.00 0.00 H new ATOM 0 HD21 ASN A 22 3.662 -8.094 22.366 1.00 0.00 H new ATOM 0 HD22 ASN A 22 3.749 -6.438 22.974 1.00 0.00 H new ATOM 348 N LEU A 23 -0.217 -2.812 21.433 1.00 0.00 N ATOM 349 CA LEU A 23 -0.778 -1.490 21.784 1.00 0.00 C ATOM 350 C LEU A 23 -2.228 -1.325 21.268 1.00 0.00 C ATOM 351 O LEU A 23 -2.913 -0.370 21.647 1.00 0.00 O ATOM 352 CB LEU A 23 0.169 -0.334 21.305 1.00 0.00 C ATOM 353 CG LEU A 23 0.876 -0.502 19.912 1.00 0.00 C ATOM 354 CD1 LEU A 23 -0.115 -0.484 18.734 1.00 0.00 C ATOM 355 CD2 LEU A 23 1.975 0.564 19.716 1.00 0.00 C ATOM 0 H LEU A 23 0.387 -2.798 20.611 1.00 0.00 H new ATOM 0 HA LEU A 23 -0.835 -1.427 22.871 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -0.413 0.587 21.277 1.00 0.00 H new ATOM 0 HB3 LEU A 23 0.943 -0.199 22.060 1.00 0.00 H new ATOM 0 HG LEU A 23 1.341 -1.488 19.919 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.430 -0.604 17.798 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -0.828 -1.301 18.846 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -0.650 0.466 18.723 1.00 0.00 H new ATOM 0 HD21 LEU A 23 2.448 0.424 18.744 1.00 0.00 H new ATOM 0 HD22 LEU A 23 1.530 1.558 19.764 1.00 0.00 H new ATOM 0 HD23 LEU A 23 2.724 0.463 20.502 1.00 0.00 H new ATOM 367 N GLY A 24 -2.678 -2.277 20.419 1.00 0.00 N ATOM 368 CA GLY A 24 -4.048 -2.299 19.875 1.00 0.00 C ATOM 369 C GLY A 24 -4.508 -1.038 19.141 1.00 0.00 C ATOM 370 O GLY A 24 -5.717 -0.811 19.007 1.00 0.00 O ATOM 0 H GLY A 24 -2.098 -3.051 20.094 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -4.130 -3.143 19.190 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -4.739 -2.487 20.697 1.00 0.00 H new ATOM 374 N LEU A 25 -3.557 -0.223 18.668 1.00 0.00 N ATOM 375 CA LEU A 25 -3.849 1.070 18.018 1.00 0.00 C ATOM 376 C LEU A 25 -4.097 0.898 16.504 1.00 0.00 C ATOM 377 O LEU A 25 -3.984 -0.209 15.959 1.00 0.00 O ATOM 378 CB LEU A 25 -2.688 2.062 18.276 1.00 0.00 C ATOM 379 CG LEU A 25 -2.407 2.420 19.771 1.00 0.00 C ATOM 380 CD1 LEU A 25 -1.158 3.319 19.906 1.00 0.00 C ATOM 381 CD2 LEU A 25 -3.646 3.066 20.434 1.00 0.00 C ATOM 0 H LEU A 25 -2.561 -0.438 18.723 1.00 0.00 H new ATOM 0 HA LEU A 25 -4.764 1.473 18.453 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.778 1.643 17.847 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -2.900 2.985 17.736 1.00 0.00 H new ATOM 0 HG LEU A 25 -2.199 1.491 20.302 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -0.989 3.551 20.957 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.289 2.797 19.505 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -1.314 4.244 19.351 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -3.420 3.304 21.473 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -3.909 3.980 19.901 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -4.484 2.370 20.395 1.00 0.00 H new ATOM 393 N LYS A 26 -4.443 2.017 15.842 1.00 0.00 N ATOM 394 CA LYS A 26 -4.800 2.048 14.415 1.00 0.00 C ATOM 395 C LYS A 26 -3.523 2.178 13.561 1.00 0.00 C ATOM 396 O LYS A 26 -2.970 3.278 13.424 1.00 0.00 O ATOM 397 CB LYS A 26 -5.772 3.232 14.110 1.00 0.00 C ATOM 398 CG LYS A 26 -7.168 3.172 14.783 1.00 0.00 C ATOM 399 CD LYS A 26 -7.138 3.456 16.307 1.00 0.00 C ATOM 400 CE LYS A 26 -8.542 3.572 16.921 1.00 0.00 C ATOM 401 NZ LYS A 26 -9.357 2.344 16.724 1.00 0.00 N ATOM 0 H LYS A 26 -4.482 2.933 16.289 1.00 0.00 H new ATOM 0 HA LYS A 26 -5.309 1.117 14.165 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -5.286 4.159 14.414 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -5.916 3.286 13.031 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -7.826 3.895 14.301 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -7.601 2.186 14.615 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.592 2.658 16.810 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -6.590 4.381 16.489 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -8.452 3.776 17.988 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -9.060 4.422 16.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -10.287 2.469 17.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -9.483 2.170 15.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -8.872 1.532 17.156 1.00 0.00 H new ATOM 415 N PHE A 27 -3.033 1.042 13.035 1.00 0.00 N ATOM 416 CA PHE A 27 -1.883 1.012 12.110 1.00 0.00 C ATOM 417 C PHE A 27 -2.045 -0.135 11.090 1.00 0.00 C ATOM 418 O PHE A 27 -2.826 -1.071 11.302 1.00 0.00 O ATOM 419 CB PHE A 27 -0.545 0.833 12.904 1.00 0.00 C ATOM 420 CG PHE A 27 -0.340 -0.569 13.498 1.00 0.00 C ATOM 421 CD1 PHE A 27 -1.046 -0.982 14.631 1.00 0.00 C ATOM 422 CD2 PHE A 27 0.542 -1.482 12.905 1.00 0.00 C ATOM 423 CE1 PHE A 27 -0.883 -2.254 15.143 1.00 0.00 C ATOM 424 CE2 PHE A 27 0.707 -2.751 13.423 1.00 0.00 C ATOM 425 CZ PHE A 27 -0.007 -3.139 14.537 1.00 0.00 C ATOM 0 H PHE A 27 -3.421 0.120 13.237 1.00 0.00 H new ATOM 0 HA PHE A 27 -1.849 1.961 11.574 1.00 0.00 H new ATOM 0 HB2 PHE A 27 0.290 1.058 12.240 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -0.516 1.564 13.712 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -1.728 -0.297 15.113 1.00 0.00 H new ATOM 0 HD2 PHE A 27 1.101 -1.188 12.029 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -1.439 -2.559 16.017 1.00 0.00 H new ATOM 0 HE2 PHE A 27 1.395 -3.440 12.956 1.00 0.00 H new ATOM 0 HZ PHE A 27 0.117 -4.134 14.937 1.00 0.00 H new ATOM 435 N GLN A 28 -1.311 -0.026 9.982 1.00 0.00 N ATOM 436 CA GLN A 28 -1.013 -1.152 9.075 1.00 0.00 C ATOM 437 C GLN A 28 0.408 -0.922 8.561 1.00 0.00 C ATOM 438 O GLN A 28 0.860 0.217 8.489 1.00 0.00 O ATOM 439 CB GLN A 28 -2.059 -1.240 7.907 1.00 0.00 C ATOM 440 CG GLN A 28 -2.193 -2.622 7.190 1.00 0.00 C ATOM 441 CD GLN A 28 -1.080 -2.953 6.187 1.00 0.00 C ATOM 442 OE1 GLN A 28 -0.530 -2.074 5.536 1.00 0.00 O ATOM 443 NE2 GLN A 28 -0.731 -4.224 6.066 1.00 0.00 N ATOM 0 H GLN A 28 -0.898 0.856 9.679 1.00 0.00 H new ATOM 0 HA GLN A 28 -1.082 -2.108 9.594 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -3.037 -0.966 8.304 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -1.798 -0.492 7.159 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -2.220 -3.405 7.948 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -3.150 -2.650 6.668 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -1.205 -4.938 6.620 1.00 0.00 H new ATOM 0 HE22 GLN A 28 0.012 -4.490 5.419 1.00 0.00 H new ATOM 452 N ILE A 29 1.141 -1.993 8.258 1.00 0.00 N ATOM 453 CA ILE A 29 2.502 -1.885 7.706 1.00 0.00 C ATOM 454 C ILE A 29 2.598 -2.804 6.480 1.00 0.00 C ATOM 455 O ILE A 29 2.245 -3.991 6.568 1.00 0.00 O ATOM 456 CB ILE A 29 3.624 -2.262 8.764 1.00 0.00 C ATOM 457 CG1 ILE A 29 3.385 -1.563 10.142 1.00 0.00 C ATOM 458 CG2 ILE A 29 5.029 -1.904 8.225 1.00 0.00 C ATOM 459 CD1 ILE A 29 4.439 -1.856 11.203 1.00 0.00 C ATOM 0 H ILE A 29 0.818 -2.952 8.384 1.00 0.00 H new ATOM 0 HA ILE A 29 2.679 -0.846 7.429 1.00 0.00 H new ATOM 0 HB ILE A 29 3.567 -3.339 8.921 1.00 0.00 H new ATOM 0 HG12 ILE A 29 3.340 -0.486 9.983 1.00 0.00 H new ATOM 0 HG13 ILE A 29 2.411 -1.869 10.524 1.00 0.00 H new ATOM 0 HG21 ILE A 29 5.782 -2.171 8.966 1.00 0.00 H new ATOM 0 HG22 ILE A 29 5.216 -2.455 7.303 1.00 0.00 H new ATOM 0 HG23 ILE A 29 5.080 -0.834 8.025 1.00 0.00 H new ATOM 0 HD11 ILE A 29 4.187 -1.327 12.122 1.00 0.00 H new ATOM 0 HD12 ILE A 29 4.471 -2.928 11.398 1.00 0.00 H new ATOM 0 HD13 ILE A 29 5.414 -1.523 10.849 1.00 0.00 H new ATOM 471 N LEU A 30 3.042 -2.254 5.336 1.00 0.00 N ATOM 472 CA LEU A 30 3.269 -3.030 4.101 1.00 0.00 C ATOM 473 C LEU A 30 4.706 -2.809 3.598 1.00 0.00 C ATOM 474 O LEU A 30 5.425 -1.956 4.117 1.00 0.00 O ATOM 475 CB LEU A 30 2.167 -2.724 3.019 1.00 0.00 C ATOM 476 CG LEU A 30 1.929 -1.236 2.558 1.00 0.00 C ATOM 477 CD1 LEU A 30 3.039 -0.706 1.617 1.00 0.00 C ATOM 478 CD2 LEU A 30 0.541 -1.085 1.887 1.00 0.00 C ATOM 0 H LEU A 30 3.254 -1.261 5.240 1.00 0.00 H new ATOM 0 HA LEU A 30 3.170 -4.093 4.320 1.00 0.00 H new ATOM 0 HB2 LEU A 30 2.410 -3.307 2.131 1.00 0.00 H new ATOM 0 HB3 LEU A 30 1.219 -3.104 3.400 1.00 0.00 H new ATOM 0 HG LEU A 30 1.963 -0.627 3.461 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.817 0.323 1.336 1.00 0.00 H new ATOM 0 HD12 LEU A 30 4.000 -0.742 2.131 1.00 0.00 H new ATOM 0 HD13 LEU A 30 3.083 -1.326 0.721 1.00 0.00 H new ATOM 0 HD21 LEU A 30 0.398 -0.050 1.577 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.486 -1.736 1.015 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -0.238 -1.362 2.597 1.00 0.00 H new ATOM 490 N ASN A 31 5.093 -3.562 2.564 1.00 0.00 N ATOM 491 CA ASN A 31 6.484 -3.612 2.072 1.00 0.00 C ATOM 492 C ASN A 31 6.816 -2.352 1.240 1.00 0.00 C ATOM 493 O ASN A 31 5.997 -1.896 0.442 1.00 0.00 O ATOM 494 CB ASN A 31 6.700 -4.907 1.240 1.00 0.00 C ATOM 495 CG ASN A 31 8.163 -5.151 0.849 1.00 0.00 C ATOM 496 OD1 ASN A 31 9.086 -4.700 1.529 1.00 0.00 O ATOM 497 ND2 ASN A 31 8.386 -5.891 -0.230 1.00 0.00 N ATOM 0 H ASN A 31 4.453 -4.158 2.039 1.00 0.00 H new ATOM 0 HA ASN A 31 7.162 -3.630 2.925 1.00 0.00 H new ATOM 0 HB2 ASN A 31 6.339 -5.761 1.813 1.00 0.00 H new ATOM 0 HB3 ASN A 31 6.095 -4.852 0.335 1.00 0.00 H new ATOM 0 HD21 ASN A 31 9.342 -6.100 -0.516 1.00 0.00 H new ATOM 0 HD22 ASN A 31 7.601 -6.250 -0.773 1.00 0.00 H new ATOM 504 N ALA A 32 8.028 -1.798 1.429 1.00 0.00 N ATOM 505 CA ALA A 32 8.466 -0.554 0.739 1.00 0.00 C ATOM 506 C ALA A 32 8.949 -0.800 -0.707 1.00 0.00 C ATOM 507 O ALA A 32 9.349 0.137 -1.407 1.00 0.00 O ATOM 508 CB ALA A 32 9.558 0.136 1.558 1.00 0.00 C ATOM 0 H ALA A 32 8.731 -2.190 2.056 1.00 0.00 H new ATOM 0 HA ALA A 32 7.593 0.094 0.664 1.00 0.00 H new ATOM 0 HB1 ALA A 32 9.875 1.046 1.048 1.00 0.00 H new ATOM 0 HB2 ALA A 32 9.168 0.389 2.544 1.00 0.00 H new ATOM 0 HB3 ALA A 32 10.410 -0.535 1.666 1.00 0.00 H new ATOM 514 N ASP A 33 8.912 -2.060 -1.144 1.00 0.00 N ATOM 515 CA ASP A 33 9.277 -2.450 -2.517 1.00 0.00 C ATOM 516 C ASP A 33 8.102 -2.242 -3.482 1.00 0.00 C ATOM 517 O ASP A 33 8.298 -2.082 -4.691 1.00 0.00 O ATOM 518 CB ASP A 33 9.727 -3.928 -2.529 1.00 0.00 C ATOM 519 CG ASP A 33 11.110 -4.133 -1.889 1.00 0.00 C ATOM 520 OD1 ASP A 33 12.123 -3.732 -2.505 1.00 0.00 O ATOM 521 OD2 ASP A 33 11.194 -4.686 -0.777 1.00 0.00 O ATOM 0 H ASP A 33 8.628 -2.845 -0.558 1.00 0.00 H new ATOM 0 HA ASP A 33 10.098 -1.817 -2.853 1.00 0.00 H new ATOM 0 HB2 ASP A 33 8.992 -4.532 -1.997 1.00 0.00 H new ATOM 0 HB3 ASP A 33 9.750 -4.288 -3.558 1.00 0.00 H new ATOM 526 N VAL A 34 6.884 -2.231 -2.924 1.00 0.00 N ATOM 527 CA VAL A 34 5.629 -2.219 -3.699 1.00 0.00 C ATOM 528 C VAL A 34 4.850 -0.903 -3.503 1.00 0.00 C ATOM 529 O VAL A 34 3.796 -0.705 -4.126 1.00 0.00 O ATOM 530 CB VAL A 34 4.723 -3.420 -3.257 1.00 0.00 C ATOM 531 CG1 VAL A 34 5.427 -4.786 -3.478 1.00 0.00 C ATOM 532 CG2 VAL A 34 4.293 -3.241 -1.783 1.00 0.00 C ATOM 0 H VAL A 34 6.737 -2.230 -1.915 1.00 0.00 H new ATOM 0 HA VAL A 34 5.891 -2.309 -4.753 1.00 0.00 H new ATOM 0 HB VAL A 34 3.831 -3.422 -3.884 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.766 -5.592 -3.159 1.00 0.00 H new ATOM 0 HG12 VAL A 34 5.663 -4.907 -4.535 1.00 0.00 H new ATOM 0 HG13 VAL A 34 6.347 -4.820 -2.895 1.00 0.00 H new ATOM 0 HG21 VAL A 34 3.664 -4.079 -1.483 1.00 0.00 H new ATOM 0 HG22 VAL A 34 5.178 -3.206 -1.148 1.00 0.00 H new ATOM 0 HG23 VAL A 34 3.734 -2.311 -1.678 1.00 0.00 H new ATOM 542 N VAL A 35 5.370 -0.023 -2.623 1.00 0.00 N ATOM 543 CA VAL A 35 4.687 1.216 -2.202 1.00 0.00 C ATOM 544 C VAL A 35 4.388 2.155 -3.390 1.00 0.00 C ATOM 545 O VAL A 35 3.349 2.817 -3.396 1.00 0.00 O ATOM 546 CB VAL A 35 5.522 1.982 -1.102 1.00 0.00 C ATOM 547 CG1 VAL A 35 6.929 2.378 -1.615 1.00 0.00 C ATOM 548 CG2 VAL A 35 4.760 3.220 -0.555 1.00 0.00 C ATOM 0 H VAL A 35 6.281 -0.153 -2.182 1.00 0.00 H new ATOM 0 HA VAL A 35 3.732 0.912 -1.773 1.00 0.00 H new ATOM 0 HB VAL A 35 5.658 1.286 -0.274 1.00 0.00 H new ATOM 0 HG11 VAL A 35 7.469 2.903 -0.827 1.00 0.00 H new ATOM 0 HG12 VAL A 35 7.479 1.480 -1.897 1.00 0.00 H new ATOM 0 HG13 VAL A 35 6.830 3.030 -2.483 1.00 0.00 H new ATOM 0 HG21 VAL A 35 5.369 3.718 0.199 1.00 0.00 H new ATOM 0 HG22 VAL A 35 4.556 3.912 -1.372 1.00 0.00 H new ATOM 0 HG23 VAL A 35 3.819 2.900 -0.108 1.00 0.00 H new ATOM 558 N ALA A 36 5.283 2.141 -4.407 1.00 0.00 N ATOM 559 CA ALA A 36 5.289 3.102 -5.527 1.00 0.00 C ATOM 560 C ALA A 36 5.464 4.531 -4.974 1.00 0.00 C ATOM 561 O ALA A 36 6.590 5.023 -4.871 1.00 0.00 O ATOM 562 CB ALA A 36 4.047 2.949 -6.442 1.00 0.00 C ATOM 0 H ALA A 36 6.031 1.450 -4.469 1.00 0.00 H new ATOM 0 HA ALA A 36 6.139 2.885 -6.175 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.099 3.678 -7.250 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.026 1.943 -6.861 1.00 0.00 H new ATOM 0 HB3 ALA A 36 3.142 3.118 -5.858 1.00 0.00 H new ATOM 568 N THR A 37 4.350 5.155 -4.566 1.00 0.00 N ATOM 569 CA THR A 37 4.344 6.441 -3.856 1.00 0.00 C ATOM 570 C THR A 37 3.301 6.399 -2.742 1.00 0.00 C ATOM 571 O THR A 37 2.558 5.412 -2.605 1.00 0.00 O ATOM 572 CB THR A 37 4.033 7.651 -4.800 1.00 0.00 C ATOM 573 OG1 THR A 37 2.809 7.409 -5.501 1.00 0.00 O ATOM 574 CG2 THR A 37 5.170 7.938 -5.797 1.00 0.00 C ATOM 0 H THR A 37 3.416 4.776 -4.722 1.00 0.00 H new ATOM 0 HA THR A 37 5.344 6.589 -3.450 1.00 0.00 H new ATOM 0 HB THR A 37 3.937 8.537 -4.173 1.00 0.00 H new ATOM 0 HG1 THR A 37 2.436 6.547 -5.220 1.00 0.00 H new ATOM 0 HG21 THR A 37 4.898 8.787 -6.425 1.00 0.00 H new ATOM 0 HG22 THR A 37 6.084 8.170 -5.250 1.00 0.00 H new ATOM 0 HG23 THR A 37 5.334 7.061 -6.424 1.00 0.00 H new ATOM 582 N LYS A 38 3.268 7.475 -1.931 1.00 0.00 N ATOM 583 CA LYS A 38 2.141 7.736 -1.016 1.00 0.00 C ATOM 584 C LYS A 38 0.811 7.636 -1.777 1.00 0.00 C ATOM 585 O LYS A 38 -0.102 6.985 -1.305 1.00 0.00 O ATOM 586 CB LYS A 38 2.212 9.127 -0.329 1.00 0.00 C ATOM 587 CG LYS A 38 3.395 9.356 0.645 1.00 0.00 C ATOM 588 CD LYS A 38 4.735 9.666 -0.064 1.00 0.00 C ATOM 589 CE LYS A 38 5.712 10.427 0.839 1.00 0.00 C ATOM 590 NZ LYS A 38 5.163 11.746 1.250 1.00 0.00 N ATOM 0 H LYS A 38 4.008 8.176 -1.892 1.00 0.00 H new ATOM 0 HA LYS A 38 2.206 6.978 -0.235 1.00 0.00 H new ATOM 0 HB2 LYS A 38 2.257 9.890 -1.106 1.00 0.00 H new ATOM 0 HB3 LYS A 38 1.283 9.285 0.219 1.00 0.00 H new ATOM 0 HG2 LYS A 38 3.149 10.181 1.314 1.00 0.00 H new ATOM 0 HG3 LYS A 38 3.520 8.469 1.266 1.00 0.00 H new ATOM 0 HD2 LYS A 38 5.196 8.733 -0.388 1.00 0.00 H new ATOM 0 HD3 LYS A 38 4.541 10.254 -0.961 1.00 0.00 H new ATOM 0 HE2 LYS A 38 5.929 9.831 1.725 1.00 0.00 H new ATOM 0 HE3 LYS A 38 6.656 10.573 0.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 5.946 12.397 1.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 4.586 12.138 0.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 4.573 11.627 2.098 1.00 0.00 H new ATOM 604 N LYS A 39 0.756 8.256 -2.983 1.00 0.00 N ATOM 605 CA LYS A 39 -0.453 8.305 -3.846 1.00 0.00 C ATOM 606 C LYS A 39 -1.067 6.907 -4.088 1.00 0.00 C ATOM 607 O LYS A 39 -2.291 6.772 -4.179 1.00 0.00 O ATOM 608 CB LYS A 39 -0.114 8.981 -5.203 1.00 0.00 C ATOM 609 CG LYS A 39 -1.322 9.235 -6.135 1.00 0.00 C ATOM 610 CD LYS A 39 -2.314 10.265 -5.557 1.00 0.00 C ATOM 611 CE LYS A 39 -3.474 10.560 -6.519 1.00 0.00 C ATOM 612 NZ LYS A 39 -3.008 11.076 -7.840 1.00 0.00 N ATOM 0 H LYS A 39 1.557 8.741 -3.388 1.00 0.00 H new ATOM 0 HA LYS A 39 -1.200 8.896 -3.317 1.00 0.00 H new ATOM 0 HB2 LYS A 39 0.376 9.934 -5.003 1.00 0.00 H new ATOM 0 HB3 LYS A 39 0.606 8.357 -5.731 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -0.962 9.587 -7.102 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -1.843 8.294 -6.312 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -2.713 9.892 -4.614 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -1.784 11.191 -5.335 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -4.054 9.650 -6.673 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -4.142 11.291 -6.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -3.822 11.433 -8.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -2.327 11.847 -7.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -2.550 10.308 -8.371 1.00 0.00 H new ATOM 626 N HIS A 40 -0.197 5.888 -4.172 1.00 0.00 N ATOM 627 CA HIS A 40 -0.620 4.489 -4.330 1.00 0.00 C ATOM 628 C HIS A 40 -1.361 3.991 -3.076 1.00 0.00 C ATOM 629 O HIS A 40 -2.492 3.482 -3.173 1.00 0.00 O ATOM 630 CB HIS A 40 0.598 3.589 -4.660 1.00 0.00 C ATOM 631 CG HIS A 40 0.311 2.101 -4.723 1.00 0.00 C ATOM 632 ND1 HIS A 40 1.104 1.160 -4.101 1.00 0.00 N ATOM 633 CD2 HIS A 40 -0.668 1.397 -5.347 1.00 0.00 C ATOM 634 CE1 HIS A 40 0.633 -0.045 -4.336 1.00 0.00 C ATOM 635 NE2 HIS A 40 -0.441 0.069 -5.088 1.00 0.00 N ATOM 0 H HIS A 40 0.815 6.011 -4.132 1.00 0.00 H new ATOM 0 HA HIS A 40 -1.318 4.433 -5.166 1.00 0.00 H new ATOM 0 HB2 HIS A 40 1.011 3.903 -5.619 1.00 0.00 H new ATOM 0 HB3 HIS A 40 1.369 3.761 -3.909 1.00 0.00 H new ATOM 0 HD1 HIS A 40 1.932 1.367 -3.542 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -1.475 1.806 -5.937 1.00 0.00 H new ATOM 0 HE1 HIS A 40 1.056 -0.971 -3.974 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -1.013 -0.706 -5.424 1.00 0.00 H new ATOM 644 N VAL A 41 -0.714 4.122 -1.910 1.00 0.00 N ATOM 645 CA VAL A 41 -1.250 3.606 -0.642 1.00 0.00 C ATOM 646 C VAL A 41 -2.472 4.420 -0.153 1.00 0.00 C ATOM 647 O VAL A 41 -3.482 3.835 0.216 1.00 0.00 O ATOM 648 CB VAL A 41 -0.137 3.568 0.460 1.00 0.00 C ATOM 649 CG1 VAL A 41 -0.654 2.899 1.752 1.00 0.00 C ATOM 650 CG2 VAL A 41 1.140 2.856 -0.058 1.00 0.00 C ATOM 0 H VAL A 41 0.190 4.585 -1.818 1.00 0.00 H new ATOM 0 HA VAL A 41 -1.591 2.588 -0.829 1.00 0.00 H new ATOM 0 HB VAL A 41 0.127 4.599 0.698 1.00 0.00 H new ATOM 0 HG11 VAL A 41 0.140 2.887 2.498 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -1.505 3.460 2.137 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -0.962 1.877 1.534 1.00 0.00 H new ATOM 0 HG21 VAL A 41 1.895 2.845 0.728 1.00 0.00 H new ATOM 0 HG22 VAL A 41 0.896 1.832 -0.341 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.528 3.390 -0.926 1.00 0.00 H new ATOM 660 N LEU A 42 -2.368 5.766 -0.152 1.00 0.00 N ATOM 661 CA LEU A 42 -3.470 6.666 0.272 1.00 0.00 C ATOM 662 C LEU A 42 -4.722 6.481 -0.607 1.00 0.00 C ATOM 663 O LEU A 42 -5.832 6.688 -0.134 1.00 0.00 O ATOM 664 CB LEU A 42 -3.000 8.160 0.347 1.00 0.00 C ATOM 665 CG LEU A 42 -2.672 8.935 -0.988 1.00 0.00 C ATOM 666 CD1 LEU A 42 -3.922 9.515 -1.701 1.00 0.00 C ATOM 667 CD2 LEU A 42 -1.638 10.060 -0.740 1.00 0.00 C ATOM 0 H LEU A 42 -1.524 6.260 -0.443 1.00 0.00 H new ATOM 0 HA LEU A 42 -3.757 6.382 1.284 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -3.775 8.721 0.870 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -2.107 8.192 0.972 1.00 0.00 H new ATOM 0 HG LEU A 42 -2.248 8.187 -1.658 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -3.615 10.033 -2.610 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -4.603 8.704 -1.958 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -4.427 10.216 -1.037 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -1.431 10.577 -1.677 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -2.038 10.769 -0.015 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -0.715 9.627 -0.353 1.00 0.00 H new ATOM 679 N HIS A 43 -4.515 6.109 -1.895 1.00 0.00 N ATOM 680 CA HIS A 43 -5.614 5.681 -2.785 1.00 0.00 C ATOM 681 C HIS A 43 -6.282 4.424 -2.210 1.00 0.00 C ATOM 682 O HIS A 43 -7.495 4.368 -2.106 1.00 0.00 O ATOM 683 CB HIS A 43 -5.120 5.426 -4.241 1.00 0.00 C ATOM 684 CG HIS A 43 -6.160 4.829 -5.169 1.00 0.00 C ATOM 685 ND1 HIS A 43 -7.073 5.577 -5.872 1.00 0.00 N ATOM 686 CD2 HIS A 43 -6.425 3.540 -5.490 1.00 0.00 C ATOM 687 CE1 HIS A 43 -7.854 4.779 -6.573 1.00 0.00 C ATOM 688 NE2 HIS A 43 -7.481 3.536 -6.361 1.00 0.00 N ATOM 0 H HIS A 43 -3.596 6.098 -2.337 1.00 0.00 H new ATOM 0 HA HIS A 43 -6.344 6.489 -2.835 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -4.775 6.370 -4.663 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -4.259 4.759 -4.206 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -5.898 2.671 -5.124 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -8.664 5.093 -7.214 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -7.907 2.707 -6.776 1.00 0.00 H new ATOM 697 N ALA A 44 -5.460 3.447 -1.799 1.00 0.00 N ATOM 698 CA ALA A 44 -5.947 2.147 -1.290 1.00 0.00 C ATOM 699 C ALA A 44 -6.802 2.325 -0.014 1.00 0.00 C ATOM 700 O ALA A 44 -7.878 1.730 0.116 1.00 0.00 O ATOM 701 CB ALA A 44 -4.763 1.199 -1.029 1.00 0.00 C ATOM 0 H ALA A 44 -4.443 3.530 -1.808 1.00 0.00 H new ATOM 0 HA ALA A 44 -6.587 1.703 -2.053 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -5.136 0.246 -0.655 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -4.216 1.035 -1.958 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -4.097 1.644 -0.290 1.00 0.00 H new ATOM 707 N ILE A 45 -6.295 3.164 0.899 1.00 0.00 N ATOM 708 CA ILE A 45 -6.956 3.506 2.171 1.00 0.00 C ATOM 709 C ILE A 45 -8.265 4.292 1.924 1.00 0.00 C ATOM 710 O ILE A 45 -9.306 3.960 2.492 1.00 0.00 O ATOM 711 CB ILE A 45 -5.989 4.361 3.068 1.00 0.00 C ATOM 712 CG1 ILE A 45 -4.585 3.689 3.186 1.00 0.00 C ATOM 713 CG2 ILE A 45 -6.591 4.609 4.472 1.00 0.00 C ATOM 714 CD1 ILE A 45 -3.511 4.583 3.768 1.00 0.00 C ATOM 0 H ILE A 45 -5.398 3.634 0.775 1.00 0.00 H new ATOM 0 HA ILE A 45 -7.202 2.576 2.684 1.00 0.00 H new ATOM 0 HB ILE A 45 -5.865 5.327 2.579 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -4.674 2.797 3.806 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -4.269 3.359 2.196 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -5.896 5.203 5.066 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -7.535 5.145 4.374 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -6.766 3.654 4.967 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -2.569 4.037 3.814 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -3.390 5.464 3.137 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -3.800 4.893 4.772 1.00 0.00 H new ATOM 726 N ASN A 46 -8.167 5.348 1.086 1.00 0.00 N ATOM 727 CA ASN A 46 -9.316 6.206 0.678 1.00 0.00 C ATOM 728 C ASN A 46 -10.478 5.355 0.155 1.00 0.00 C ATOM 729 O ASN A 46 -11.638 5.538 0.544 1.00 0.00 O ATOM 730 CB ASN A 46 -8.871 7.203 -0.429 1.00 0.00 C ATOM 731 CG ASN A 46 -9.975 8.141 -0.927 1.00 0.00 C ATOM 732 OD1 ASN A 46 -10.910 8.474 -0.203 1.00 0.00 O ATOM 733 ND2 ASN A 46 -9.859 8.597 -2.165 1.00 0.00 N ATOM 0 H ASN A 46 -7.283 5.636 0.667 1.00 0.00 H new ATOM 0 HA ASN A 46 -9.652 6.757 1.556 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -8.047 7.805 -0.047 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -8.485 6.636 -1.276 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -10.556 9.241 -2.539 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -9.072 8.304 -2.745 1.00 0.00 H new ATOM 740 N GLN A 47 -10.121 4.423 -0.726 1.00 0.00 N ATOM 741 CA GLN A 47 -11.068 3.502 -1.341 1.00 0.00 C ATOM 742 C GLN A 47 -11.659 2.534 -0.305 1.00 0.00 C ATOM 743 O GLN A 47 -12.836 2.213 -0.376 1.00 0.00 O ATOM 744 CB GLN A 47 -10.412 2.762 -2.525 1.00 0.00 C ATOM 745 CG GLN A 47 -9.995 3.697 -3.686 1.00 0.00 C ATOM 746 CD GLN A 47 -11.135 4.550 -4.271 1.00 0.00 C ATOM 747 OE1 GLN A 47 -10.923 5.684 -4.694 1.00 0.00 O ATOM 748 NE2 GLN A 47 -12.335 4.001 -4.343 1.00 0.00 N ATOM 0 H GLN A 47 -9.158 4.287 -1.034 1.00 0.00 H new ATOM 0 HA GLN A 47 -11.903 4.080 -1.739 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -9.532 2.228 -2.166 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -11.107 2.013 -2.905 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -9.207 4.362 -3.333 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -9.567 3.092 -4.485 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -12.487 3.058 -3.985 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -13.109 4.520 -4.757 1.00 0.00 H new ATOM 757 N ALA A 48 -10.857 2.115 0.685 1.00 0.00 N ATOM 758 CA ALA A 48 -11.339 1.268 1.800 1.00 0.00 C ATOM 759 C ALA A 48 -12.281 2.058 2.751 1.00 0.00 C ATOM 760 O ALA A 48 -13.067 1.459 3.495 1.00 0.00 O ATOM 761 CB ALA A 48 -10.137 0.683 2.564 1.00 0.00 C ATOM 0 H ALA A 48 -9.865 2.347 0.741 1.00 0.00 H new ATOM 0 HA ALA A 48 -11.925 0.448 1.384 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -10.495 0.060 3.384 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -9.534 0.079 1.886 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -9.530 1.495 2.964 1.00 0.00 H new ATOM 767 N LYS A 49 -12.179 3.409 2.719 1.00 0.00 N ATOM 768 CA LYS A 49 -13.022 4.312 3.540 1.00 0.00 C ATOM 769 C LYS A 49 -14.362 4.640 2.850 1.00 0.00 C ATOM 770 O LYS A 49 -15.387 4.766 3.527 1.00 0.00 O ATOM 771 CB LYS A 49 -12.265 5.634 3.887 1.00 0.00 C ATOM 772 CG LYS A 49 -11.050 5.434 4.818 1.00 0.00 C ATOM 773 CD LYS A 49 -10.375 6.746 5.285 1.00 0.00 C ATOM 774 CE LYS A 49 -9.219 6.467 6.271 1.00 0.00 C ATOM 775 NZ LYS A 49 -8.590 7.693 6.817 1.00 0.00 N ATOM 0 H LYS A 49 -11.512 3.902 2.125 1.00 0.00 H new ATOM 0 HA LYS A 49 -13.241 3.778 4.465 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -11.928 6.102 2.962 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -12.962 6.327 4.359 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -11.370 4.873 5.696 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -10.309 4.823 4.302 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -9.994 7.289 4.420 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -11.115 7.388 5.763 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -9.596 5.864 7.097 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -8.457 5.873 5.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -8.409 7.567 7.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -7.691 7.871 6.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -9.228 8.502 6.676 1.00 0.00 H new ATOM 789 N THR A 50 -14.353 4.797 1.510 1.00 0.00 N ATOM 790 CA THR A 50 -15.560 5.211 0.750 1.00 0.00 C ATOM 791 C THR A 50 -16.406 3.979 0.342 1.00 0.00 C ATOM 792 O THR A 50 -17.648 4.024 0.358 1.00 0.00 O ATOM 793 CB THR A 50 -15.180 6.090 -0.502 1.00 0.00 C ATOM 794 OG1 THR A 50 -16.365 6.558 -1.165 1.00 0.00 O ATOM 795 CG2 THR A 50 -14.297 5.345 -1.520 1.00 0.00 C ATOM 0 H THR A 50 -13.528 4.645 0.930 1.00 0.00 H new ATOM 0 HA THR A 50 -16.170 5.832 1.406 1.00 0.00 H new ATOM 0 HB THR A 50 -14.602 6.930 -0.117 1.00 0.00 H new ATOM 0 HG1 THR A 50 -16.113 7.103 -1.939 1.00 0.00 H new ATOM 0 HG21 THR A 50 -14.071 6.005 -2.358 1.00 0.00 H new ATOM 0 HG22 THR A 50 -13.368 5.037 -1.040 1.00 0.00 H new ATOM 0 HG23 THR A 50 -14.826 4.464 -1.885 1.00 0.00 H new ATOM 803 N LYS A 51 -15.713 2.883 -0.008 1.00 0.00 N ATOM 804 CA LYS A 51 -16.353 1.592 -0.333 1.00 0.00 C ATOM 805 C LYS A 51 -16.595 0.797 0.955 1.00 0.00 C ATOM 806 O LYS A 51 -15.930 1.032 1.970 1.00 0.00 O ATOM 807 CB LYS A 51 -15.470 0.738 -1.277 1.00 0.00 C ATOM 808 CG LYS A 51 -15.002 1.434 -2.573 1.00 0.00 C ATOM 809 CD LYS A 51 -14.131 0.498 -3.452 1.00 0.00 C ATOM 810 CE LYS A 51 -12.946 -0.135 -2.682 1.00 0.00 C ATOM 811 NZ LYS A 51 -12.156 -1.072 -3.524 1.00 0.00 N ATOM 0 H LYS A 51 -14.695 2.864 -0.074 1.00 0.00 H new ATOM 0 HA LYS A 51 -17.295 1.810 -0.836 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -14.589 0.412 -0.724 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -16.025 -0.160 -1.549 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -15.871 1.762 -3.143 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -14.432 2.328 -2.319 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -14.758 -0.296 -3.857 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -13.744 1.063 -4.300 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -12.293 0.656 -2.313 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -13.326 -0.667 -1.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -11.182 -1.126 -3.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -12.590 -2.017 -3.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -12.143 -0.729 -4.506 1.00 0.00 H new ATOM 825 N LYS A 52 -17.551 -0.144 0.909 1.00 0.00 N ATOM 826 CA LYS A 52 -17.781 -1.117 1.978 1.00 0.00 C ATOM 827 C LYS A 52 -17.173 -2.468 1.524 1.00 0.00 C ATOM 828 O LYS A 52 -17.751 -3.132 0.653 1.00 0.00 O ATOM 829 CB LYS A 52 -19.303 -1.246 2.299 1.00 0.00 C ATOM 830 CG LYS A 52 -19.946 -0.005 2.980 1.00 0.00 C ATOM 831 CD LYS A 52 -20.056 1.237 2.057 1.00 0.00 C ATOM 832 CE LYS A 52 -20.647 2.466 2.766 1.00 0.00 C ATOM 833 NZ LYS A 52 -20.725 3.647 1.863 1.00 0.00 N ATOM 0 H LYS A 52 -18.189 -0.248 0.120 1.00 0.00 H new ATOM 0 HA LYS A 52 -17.301 -0.790 2.900 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -19.837 -1.448 1.371 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -19.449 -2.111 2.946 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -20.942 -0.272 3.332 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -19.358 0.259 3.859 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -19.066 1.487 1.675 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -20.677 0.988 1.196 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -21.644 2.226 3.136 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -20.035 2.713 3.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -21.129 4.454 2.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -19.771 3.892 1.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -21.330 3.421 1.047 1.00 0.00 H new ATOM 847 N PRO A 53 -15.964 -2.855 2.069 1.00 0.00 N ATOM 848 CA PRO A 53 -15.216 -4.087 1.665 1.00 0.00 C ATOM 849 C PRO A 53 -15.995 -5.415 1.809 1.00 0.00 C ATOM 850 O PRO A 53 -17.131 -5.455 2.296 1.00 0.00 O ATOM 851 CB PRO A 53 -14.000 -4.096 2.638 1.00 0.00 C ATOM 852 CG PRO A 53 -13.824 -2.672 3.051 1.00 0.00 C ATOM 853 CD PRO A 53 -15.214 -2.092 3.108 1.00 0.00 C ATOM 0 HA PRO A 53 -14.976 -4.042 0.603 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -14.189 -4.736 3.500 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -13.105 -4.478 2.147 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -13.330 -2.603 4.020 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -13.202 -2.131 2.338 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -15.659 -2.218 4.095 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -15.210 -1.023 2.894 1.00 0.00 H new ATOM 861 N ILE A 54 -15.329 -6.509 1.391 1.00 0.00 N ATOM 862 CA ILE A 54 -15.733 -7.897 1.707 1.00 0.00 C ATOM 863 C ILE A 54 -14.579 -8.607 2.455 1.00 0.00 C ATOM 864 O ILE A 54 -14.660 -9.803 2.761 1.00 0.00 O ATOM 865 CB ILE A 54 -16.213 -8.700 0.417 1.00 0.00 C ATOM 866 CG1 ILE A 54 -15.197 -8.617 -0.791 1.00 0.00 C ATOM 867 CG2 ILE A 54 -17.624 -8.220 -0.022 1.00 0.00 C ATOM 868 CD1 ILE A 54 -13.946 -9.491 -0.698 1.00 0.00 C ATOM 0 H ILE A 54 -14.487 -6.456 0.818 1.00 0.00 H new ATOM 0 HA ILE A 54 -16.604 -7.867 2.362 1.00 0.00 H new ATOM 0 HB ILE A 54 -16.257 -9.750 0.705 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -15.731 -8.883 -1.703 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -14.880 -7.580 -0.898 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -17.940 -8.777 -0.904 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -18.334 -8.390 0.787 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -17.590 -7.156 -0.257 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -13.332 -9.343 -1.586 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -13.374 -9.215 0.188 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -14.238 -10.539 -0.629 1.00 0.00 H new ATOM 880 N ALA A 55 -13.513 -7.829 2.762 1.00 0.00 N ATOM 881 CA ALA A 55 -12.334 -8.288 3.518 1.00 0.00 C ATOM 882 C ALA A 55 -12.674 -8.559 4.998 1.00 0.00 C ATOM 883 O ALA A 55 -13.819 -8.365 5.433 1.00 0.00 O ATOM 884 CB ALA A 55 -11.226 -7.227 3.407 1.00 0.00 C ATOM 0 H ALA A 55 -13.452 -6.849 2.484 1.00 0.00 H new ATOM 0 HA ALA A 55 -11.992 -9.230 3.091 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -10.349 -7.557 3.963 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -10.960 -7.087 2.359 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -11.583 -6.283 3.820 1.00 0.00 H new ATOM 890 N LYS A 56 -11.657 -8.999 5.769 1.00 0.00 N ATOM 891 CA LYS A 56 -11.805 -9.285 7.212 1.00 0.00 C ATOM 892 C LYS A 56 -12.188 -8.003 7.975 1.00 0.00 C ATOM 893 O LYS A 56 -13.140 -8.002 8.766 1.00 0.00 O ATOM 894 CB LYS A 56 -10.495 -9.890 7.791 1.00 0.00 C ATOM 895 CG LYS A 56 -9.979 -11.149 7.056 1.00 0.00 C ATOM 896 CD LYS A 56 -11.008 -12.306 7.010 1.00 0.00 C ATOM 897 CE LYS A 56 -10.481 -13.524 6.231 1.00 0.00 C ATOM 898 NZ LYS A 56 -11.478 -14.625 6.156 1.00 0.00 N ATOM 0 H LYS A 56 -10.716 -9.165 5.412 1.00 0.00 H new ATOM 0 HA LYS A 56 -12.603 -10.017 7.336 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -9.717 -9.127 7.764 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -10.660 -10.141 8.839 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -9.704 -10.877 6.037 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -9.072 -11.500 7.548 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -11.258 -12.608 8.027 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -11.929 -11.952 6.547 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -10.208 -13.216 5.222 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -9.573 -13.892 6.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -11.076 -15.422 5.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -11.721 -14.940 7.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -12.336 -14.285 5.676 1.00 0.00 H new ATOM 912 N SER A 57 -11.451 -6.911 7.688 1.00 0.00 N ATOM 913 CA SER A 57 -11.668 -5.578 8.292 1.00 0.00 C ATOM 914 C SER A 57 -11.066 -4.472 7.381 1.00 0.00 C ATOM 915 O SER A 57 -10.624 -4.757 6.261 1.00 0.00 O ATOM 916 CB SER A 57 -11.053 -5.524 9.718 1.00 0.00 C ATOM 917 OG SER A 57 -11.653 -6.459 10.601 1.00 0.00 O ATOM 0 H SER A 57 -10.678 -6.929 7.022 1.00 0.00 H new ATOM 0 HA SER A 57 -12.740 -5.400 8.380 1.00 0.00 H new ATOM 0 HB2 SER A 57 -9.983 -5.721 9.657 1.00 0.00 H new ATOM 0 HB3 SER A 57 -11.170 -4.519 10.123 1.00 0.00 H new ATOM 0 HG SER A 57 -11.234 -6.390 11.484 1.00 0.00 H new ATOM 923 N PHE A 58 -11.060 -3.217 7.884 1.00 0.00 N ATOM 924 CA PHE A 58 -10.600 -2.015 7.146 1.00 0.00 C ATOM 925 C PHE A 58 -9.104 -2.087 6.748 1.00 0.00 C ATOM 926 O PHE A 58 -8.781 -2.004 5.562 1.00 0.00 O ATOM 927 CB PHE A 58 -10.894 -0.751 8.004 1.00 0.00 C ATOM 928 CG PHE A 58 -10.252 0.542 7.504 1.00 0.00 C ATOM 929 CD1 PHE A 58 -10.664 1.127 6.313 1.00 0.00 C ATOM 930 CD2 PHE A 58 -9.220 1.157 8.221 1.00 0.00 C ATOM 931 CE1 PHE A 58 -10.076 2.286 5.862 1.00 0.00 C ATOM 932 CE2 PHE A 58 -8.637 2.319 7.765 1.00 0.00 C ATOM 933 CZ PHE A 58 -9.060 2.877 6.583 1.00 0.00 C ATOM 0 H PHE A 58 -11.380 -3.006 8.829 1.00 0.00 H new ATOM 0 HA PHE A 58 -11.152 -1.963 6.208 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -11.973 -0.607 8.051 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -10.553 -0.936 9.023 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -11.453 0.668 5.736 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -8.876 0.715 9.144 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -10.412 2.735 4.939 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -7.850 2.790 8.335 1.00 0.00 H new ATOM 0 HZ PHE A 58 -8.596 3.781 6.218 1.00 0.00 H new ATOM 943 N TRP A 59 -8.201 -2.218 7.745 1.00 0.00 N ATOM 944 CA TRP A 59 -6.735 -2.308 7.489 1.00 0.00 C ATOM 945 C TRP A 59 -6.396 -3.576 6.676 1.00 0.00 C ATOM 946 O TRP A 59 -5.431 -3.592 5.902 1.00 0.00 O ATOM 947 CB TRP A 59 -5.922 -2.285 8.813 1.00 0.00 C ATOM 948 CG TRP A 59 -6.144 -1.052 9.669 1.00 0.00 C ATOM 949 CD1 TRP A 59 -6.886 -0.959 10.813 1.00 0.00 C ATOM 950 CD2 TRP A 59 -5.608 0.261 9.442 1.00 0.00 C ATOM 951 NE1 TRP A 59 -6.844 0.321 11.301 1.00 0.00 N ATOM 952 CE2 TRP A 59 -6.069 1.087 10.475 1.00 0.00 C ATOM 953 CE3 TRP A 59 -4.788 0.815 8.461 1.00 0.00 C ATOM 954 CZ2 TRP A 59 -5.733 2.432 10.551 1.00 0.00 C ATOM 955 CZ3 TRP A 59 -4.455 2.147 8.540 1.00 0.00 C ATOM 956 CH2 TRP A 59 -4.926 2.943 9.577 1.00 0.00 C ATOM 0 H TRP A 59 -8.454 -2.264 8.732 1.00 0.00 H new ATOM 0 HA TRP A 59 -6.453 -1.432 6.905 1.00 0.00 H new ATOM 0 HB2 TRP A 59 -6.180 -3.168 9.398 1.00 0.00 H new ATOM 0 HB3 TRP A 59 -4.861 -2.359 8.574 1.00 0.00 H new ATOM 0 HD1 TRP A 59 -7.427 -1.776 11.267 1.00 0.00 H new ATOM 0 HE1 TRP A 59 -7.315 0.649 12.144 1.00 0.00 H new ATOM 0 HE3 TRP A 59 -4.419 0.206 7.649 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 -6.099 3.053 11.355 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 -3.817 2.581 7.784 1.00 0.00 H new ATOM 0 HH2 TRP A 59 -4.648 3.986 9.613 1.00 0.00 H new ATOM 967 N MET A 60 -7.231 -4.620 6.846 1.00 0.00 N ATOM 968 CA MET A 60 -7.106 -5.890 6.103 1.00 0.00 C ATOM 969 C MET A 60 -7.583 -5.746 4.645 1.00 0.00 C ATOM 970 O MET A 60 -7.234 -6.565 3.797 1.00 0.00 O ATOM 971 CB MET A 60 -7.878 -7.016 6.830 1.00 0.00 C ATOM 972 CG MET A 60 -7.295 -7.371 8.204 1.00 0.00 C ATOM 973 SD MET A 60 -5.568 -7.908 8.104 1.00 0.00 S ATOM 974 CE MET A 60 -5.101 -7.997 9.836 1.00 0.00 C ATOM 0 H MET A 60 -8.011 -4.607 7.503 1.00 0.00 H new ATOM 0 HA MET A 60 -6.050 -6.157 6.071 1.00 0.00 H new ATOM 0 HB2 MET A 60 -8.917 -6.712 6.953 1.00 0.00 H new ATOM 0 HB3 MET A 60 -7.879 -7.908 6.203 1.00 0.00 H new ATOM 0 HG2 MET A 60 -7.365 -6.504 8.861 1.00 0.00 H new ATOM 0 HG3 MET A 60 -7.893 -8.162 8.656 1.00 0.00 H new ATOM 0 HE1 MET A 60 -4.062 -8.316 9.917 1.00 0.00 H new ATOM 0 HE2 MET A 60 -5.216 -7.015 10.295 1.00 0.00 H new ATOM 0 HE3 MET A 60 -5.741 -8.714 10.349 1.00 0.00 H new ATOM 984 N GLU A 61 -8.411 -4.727 4.371 1.00 0.00 N ATOM 985 CA GLU A 61 -8.772 -4.352 2.993 1.00 0.00 C ATOM 986 C GLU A 61 -7.613 -3.605 2.322 1.00 0.00 C ATOM 987 O GLU A 61 -7.302 -3.879 1.186 1.00 0.00 O ATOM 988 CB GLU A 61 -10.066 -3.491 2.961 1.00 0.00 C ATOM 989 CG GLU A 61 -10.476 -2.955 1.558 1.00 0.00 C ATOM 990 CD GLU A 61 -10.697 -4.037 0.478 1.00 0.00 C ATOM 991 OE1 GLU A 61 -11.280 -5.102 0.782 1.00 0.00 O ATOM 992 OE2 GLU A 61 -10.321 -3.808 -0.697 1.00 0.00 O ATOM 0 H GLU A 61 -8.845 -4.145 5.087 1.00 0.00 H new ATOM 0 HA GLU A 61 -8.968 -5.269 2.437 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -10.888 -4.086 3.358 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -9.934 -2.642 3.631 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -11.394 -2.376 1.662 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -9.704 -2.269 1.209 1.00 0.00 H new ATOM 999 N ILE A 62 -6.976 -2.676 3.057 1.00 0.00 N ATOM 1000 CA ILE A 62 -5.899 -1.796 2.523 1.00 0.00 C ATOM 1001 C ILE A 62 -4.729 -2.606 1.921 1.00 0.00 C ATOM 1002 O ILE A 62 -4.187 -2.253 0.859 1.00 0.00 O ATOM 1003 CB ILE A 62 -5.374 -0.831 3.648 1.00 0.00 C ATOM 1004 CG1 ILE A 62 -6.539 0.081 4.146 1.00 0.00 C ATOM 1005 CG2 ILE A 62 -4.152 0.016 3.180 1.00 0.00 C ATOM 1006 CD1 ILE A 62 -6.191 0.960 5.321 1.00 0.00 C ATOM 0 H ILE A 62 -7.187 -2.507 4.040 1.00 0.00 H new ATOM 0 HA ILE A 62 -6.333 -1.205 1.716 1.00 0.00 H new ATOM 0 HB ILE A 62 -5.021 -1.443 4.478 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -6.866 0.713 3.321 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -7.385 -0.550 4.419 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -3.827 0.666 3.993 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -3.335 -0.649 2.898 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -4.438 0.624 2.322 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -7.059 1.558 5.598 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -5.894 0.338 6.166 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -5.367 1.620 5.050 1.00 0.00 H new ATOM 1018 N LEU A 63 -4.386 -3.715 2.591 1.00 0.00 N ATOM 1019 CA LEU A 63 -3.301 -4.605 2.155 1.00 0.00 C ATOM 1020 C LEU A 63 -3.695 -5.391 0.879 1.00 0.00 C ATOM 1021 O LEU A 63 -2.835 -5.720 0.066 1.00 0.00 O ATOM 1022 CB LEU A 63 -2.772 -5.488 3.332 1.00 0.00 C ATOM 1023 CG LEU A 63 -3.815 -6.291 4.187 1.00 0.00 C ATOM 1024 CD1 LEU A 63 -4.210 -7.627 3.537 1.00 0.00 C ATOM 1025 CD2 LEU A 63 -3.308 -6.514 5.633 1.00 0.00 C ATOM 0 H LEU A 63 -4.850 -4.019 3.447 1.00 0.00 H new ATOM 0 HA LEU A 63 -2.447 -3.996 1.860 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -2.061 -6.203 2.918 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -2.215 -4.840 4.009 1.00 0.00 H new ATOM 0 HG LEU A 63 -4.715 -5.677 4.228 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -4.933 -8.140 4.171 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.654 -7.439 2.559 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -3.324 -8.250 3.419 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -4.054 -7.073 6.198 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -2.375 -7.077 5.609 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -3.138 -5.550 6.112 1.00 0.00 H new ATOM 1037 N VAL A 64 -4.993 -5.704 0.692 1.00 0.00 N ATOM 1038 CA VAL A 64 -5.464 -6.339 -0.568 1.00 0.00 C ATOM 1039 C VAL A 64 -5.710 -5.273 -1.667 1.00 0.00 C ATOM 1040 O VAL A 64 -5.594 -5.565 -2.855 1.00 0.00 O ATOM 1041 CB VAL A 64 -6.737 -7.262 -0.381 1.00 0.00 C ATOM 1042 CG1 VAL A 64 -6.641 -8.093 0.916 1.00 0.00 C ATOM 1043 CG2 VAL A 64 -8.079 -6.506 -0.455 1.00 0.00 C ATOM 0 H VAL A 64 -5.727 -5.534 1.380 1.00 0.00 H new ATOM 0 HA VAL A 64 -4.659 -7.001 -0.887 1.00 0.00 H new ATOM 0 HB VAL A 64 -6.732 -7.939 -1.235 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -7.530 -8.716 1.016 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -5.756 -8.727 0.877 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -6.570 -7.423 1.773 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -8.901 -7.209 -0.318 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -8.114 -5.749 0.329 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -8.172 -6.025 -1.429 1.00 0.00 H new ATOM 1053 N ARG A 65 -6.066 -4.048 -1.235 1.00 0.00 N ATOM 1054 CA ARG A 65 -6.502 -2.945 -2.113 1.00 0.00 C ATOM 1055 C ARG A 65 -5.298 -2.406 -2.920 1.00 0.00 C ATOM 1056 O ARG A 65 -5.402 -2.173 -4.132 1.00 0.00 O ATOM 1057 CB ARG A 65 -7.189 -1.813 -1.256 1.00 0.00 C ATOM 1058 CG ARG A 65 -8.397 -1.107 -1.925 1.00 0.00 C ATOM 1059 CD ARG A 65 -8.030 -0.278 -3.184 1.00 0.00 C ATOM 1060 NE ARG A 65 -9.055 -0.391 -4.230 1.00 0.00 N ATOM 1061 CZ ARG A 65 -9.128 -1.399 -5.111 1.00 0.00 C ATOM 1062 NH1 ARG A 65 -8.138 -2.275 -5.214 1.00 0.00 N ATOM 1063 NH2 ARG A 65 -10.166 -1.495 -5.926 1.00 0.00 N ATOM 0 H ARG A 65 -6.058 -3.793 -0.248 1.00 0.00 H new ATOM 0 HA ARG A 65 -7.240 -3.313 -2.826 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -7.521 -2.247 -0.313 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -6.439 -1.060 -1.014 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -9.136 -1.859 -2.201 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -8.869 -0.449 -1.195 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -7.908 0.769 -2.907 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -7.072 -0.618 -3.576 1.00 0.00 H new ATOM 0 HE ARG A 65 -9.758 0.346 -4.290 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -7.313 -2.185 -4.621 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -8.201 -3.039 -5.887 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -10.913 -0.801 -5.885 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -10.219 -2.263 -6.595 1.00 0.00 H new ATOM 1077 N ALA A 66 -4.169 -2.197 -2.219 1.00 0.00 N ATOM 1078 CA ALA A 66 -2.888 -1.793 -2.837 1.00 0.00 C ATOM 1079 C ALA A 66 -2.322 -2.890 -3.769 1.00 0.00 C ATOM 1080 O ALA A 66 -1.564 -2.587 -4.699 1.00 0.00 O ATOM 1081 CB ALA A 66 -1.870 -1.412 -1.745 1.00 0.00 C ATOM 0 H ALA A 66 -4.117 -2.303 -1.206 1.00 0.00 H new ATOM 0 HA ALA A 66 -3.078 -0.919 -3.460 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -0.930 -1.116 -2.211 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -2.261 -0.581 -1.157 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -1.698 -2.269 -1.093 1.00 0.00 H new ATOM 1087 N SER A 67 -2.709 -4.155 -3.523 1.00 0.00 N ATOM 1088 CA SER A 67 -2.333 -5.299 -4.381 1.00 0.00 C ATOM 1089 C SER A 67 -3.499 -5.673 -5.332 1.00 0.00 C ATOM 1090 O SER A 67 -3.560 -6.803 -5.834 1.00 0.00 O ATOM 1091 CB SER A 67 -1.909 -6.500 -3.494 1.00 0.00 C ATOM 1092 OG SER A 67 -2.963 -6.934 -2.654 1.00 0.00 O ATOM 0 H SER A 67 -3.290 -4.415 -2.726 1.00 0.00 H new ATOM 0 HA SER A 67 -1.484 -5.019 -5.005 1.00 0.00 H new ATOM 0 HB2 SER A 67 -1.588 -7.325 -4.130 1.00 0.00 H new ATOM 0 HB3 SER A 67 -1.052 -6.216 -2.884 1.00 0.00 H new ATOM 0 HG SER A 67 -2.807 -6.613 -1.741 1.00 0.00 H new ATOM 1098 N GLY A 68 -4.409 -4.703 -5.618 1.00 0.00 N ATOM 1099 CA GLY A 68 -5.568 -4.942 -6.485 1.00 0.00 C ATOM 1100 C GLY A 68 -6.757 -5.556 -5.753 1.00 0.00 C ATOM 1101 O GLY A 68 -7.619 -4.847 -5.230 1.00 0.00 O ATOM 0 H GLY A 68 -4.351 -3.752 -5.255 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -5.876 -3.998 -6.935 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -5.272 -5.603 -7.300 1.00 0.00 H new ATOM 1105 N GLN A 69 -6.761 -6.880 -5.710 1.00 0.00 N ATOM 1106 CA GLN A 69 -7.849 -7.674 -5.115 1.00 0.00 C ATOM 1107 C GLN A 69 -7.375 -9.108 -4.958 1.00 0.00 C ATOM 1108 O GLN A 69 -6.996 -9.754 -5.942 1.00 0.00 O ATOM 1109 CB GLN A 69 -9.151 -7.602 -5.983 1.00 0.00 C ATOM 1110 CG GLN A 69 -10.479 -8.078 -5.317 1.00 0.00 C ATOM 1111 CD GLN A 69 -10.617 -9.598 -5.165 1.00 0.00 C ATOM 1112 OE1 GLN A 69 -10.285 -10.172 -4.128 1.00 0.00 O ATOM 1113 NE2 GLN A 69 -11.076 -10.263 -6.214 1.00 0.00 N ATOM 0 H GLN A 69 -6.004 -7.449 -6.089 1.00 0.00 H new ATOM 0 HA GLN A 69 -8.101 -7.263 -4.137 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -9.286 -6.569 -6.305 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -8.991 -8.198 -6.882 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -10.558 -7.620 -4.331 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -11.317 -7.709 -5.908 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -11.343 -9.760 -7.060 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -11.162 -11.279 -6.176 1.00 0.00 H new ATOM 1122 N ARG A 70 -7.402 -9.573 -3.711 1.00 0.00 N ATOM 1123 CA ARG A 70 -7.083 -10.947 -3.334 1.00 0.00 C ATOM 1124 C ARG A 70 -7.387 -11.140 -1.852 1.00 0.00 C ATOM 1125 O ARG A 70 -7.646 -10.175 -1.138 1.00 0.00 O ATOM 1126 CB ARG A 70 -5.602 -11.281 -3.668 1.00 0.00 C ATOM 1127 CG ARG A 70 -4.560 -10.351 -2.999 1.00 0.00 C ATOM 1128 CD ARG A 70 -3.220 -10.336 -3.753 1.00 0.00 C ATOM 1129 NE ARG A 70 -3.325 -9.620 -5.047 1.00 0.00 N ATOM 1130 CZ ARG A 70 -2.871 -10.049 -6.242 1.00 0.00 C ATOM 1131 NH1 ARG A 70 -2.332 -11.256 -6.388 1.00 0.00 N ATOM 1132 NH2 ARG A 70 -2.984 -9.258 -7.299 1.00 0.00 N ATOM 0 H ARG A 70 -7.653 -8.988 -2.914 1.00 0.00 H new ATOM 0 HA ARG A 70 -7.700 -11.638 -3.909 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -5.399 -12.308 -3.365 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -5.469 -11.235 -4.749 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -4.959 -9.338 -2.951 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -4.393 -10.676 -1.972 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -2.460 -9.859 -3.134 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -2.891 -11.360 -3.930 1.00 0.00 H new ATOM 0 HE ARG A 70 -3.787 -8.711 -5.032 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -2.255 -11.881 -5.585 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -1.996 -11.557 -7.303 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -3.410 -8.336 -7.203 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -2.644 -9.571 -8.209 1.00 0.00 H new ATOM 1146 N GLN A 71 -7.474 -12.397 -1.435 1.00 0.00 N ATOM 1147 CA GLN A 71 -7.575 -12.753 -0.011 1.00 0.00 C ATOM 1148 C GLN A 71 -6.386 -12.206 0.812 1.00 0.00 C ATOM 1149 O GLN A 71 -5.277 -12.032 0.290 1.00 0.00 O ATOM 1150 CB GLN A 71 -7.734 -14.281 0.169 1.00 0.00 C ATOM 1151 CG GLN A 71 -9.042 -14.842 -0.431 1.00 0.00 C ATOM 1152 CD GLN A 71 -9.346 -16.286 -0.038 1.00 0.00 C ATOM 1153 OE1 GLN A 71 -8.995 -16.737 1.055 1.00 0.00 O ATOM 1154 NE2 GLN A 71 -10.024 -17.010 -0.911 1.00 0.00 N ATOM 0 H GLN A 71 -7.477 -13.200 -2.064 1.00 0.00 H new ATOM 0 HA GLN A 71 -8.473 -12.274 0.379 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -6.886 -14.783 -0.296 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -7.701 -14.518 1.232 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -9.872 -14.210 -0.117 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -8.986 -14.778 -1.518 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -10.298 -16.605 -1.806 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -10.273 -17.974 -0.690 1.00 0.00 H new ATOM 1163 N ILE A 72 -6.676 -11.914 2.095 1.00 0.00 N ATOM 1164 CA ILE A 72 -5.734 -11.288 3.051 1.00 0.00 C ATOM 1165 C ILE A 72 -4.384 -12.051 3.115 1.00 0.00 C ATOM 1166 O ILE A 72 -3.328 -11.418 3.112 1.00 0.00 O ATOM 1167 CB ILE A 72 -6.397 -11.124 4.489 1.00 0.00 C ATOM 1168 CG1 ILE A 72 -7.443 -9.948 4.513 1.00 0.00 C ATOM 1169 CG2 ILE A 72 -5.344 -10.908 5.610 1.00 0.00 C ATOM 1170 CD1 ILE A 72 -8.661 -10.094 3.614 1.00 0.00 C ATOM 0 H ILE A 72 -7.589 -12.109 2.506 1.00 0.00 H new ATOM 0 HA ILE A 72 -5.509 -10.287 2.682 1.00 0.00 H new ATOM 0 HB ILE A 72 -6.913 -12.063 4.688 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -7.791 -9.824 5.539 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -6.926 -9.028 4.238 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -5.850 -10.802 6.569 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -4.671 -11.765 5.647 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -4.770 -10.005 5.401 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -9.301 -9.219 3.724 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -8.339 -10.180 2.576 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -9.217 -10.988 3.897 1.00 0.00 H new ATOM 1182 N HIS A 73 -4.444 -13.401 3.103 1.00 0.00 N ATOM 1183 CA HIS A 73 -3.241 -14.273 3.088 1.00 0.00 C ATOM 1184 C HIS A 73 -2.342 -13.957 1.877 1.00 0.00 C ATOM 1185 O HIS A 73 -1.129 -13.762 2.027 1.00 0.00 O ATOM 1186 CB HIS A 73 -3.625 -15.778 3.053 1.00 0.00 C ATOM 1187 CG HIS A 73 -4.144 -16.336 4.351 1.00 0.00 C ATOM 1188 ND1 HIS A 73 -5.367 -16.961 4.471 1.00 0.00 N ATOM 1189 CD2 HIS A 73 -3.565 -16.418 5.574 1.00 0.00 C ATOM 1190 CE1 HIS A 73 -5.519 -17.394 5.707 1.00 0.00 C ATOM 1191 NE2 HIS A 73 -4.443 -17.079 6.396 1.00 0.00 N ATOM 0 H HIS A 73 -5.323 -13.919 3.103 1.00 0.00 H new ATOM 0 HA HIS A 73 -2.695 -14.069 4.009 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -4.383 -15.926 2.283 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -2.749 -16.353 2.753 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -2.594 -16.035 5.850 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -6.382 -17.919 6.090 1.00 0.00 H new ATOM 0 HE2 HIS A 73 -4.287 -17.292 7.381 1.00 0.00 H new ATOM 1200 N GLU A 74 -2.966 -13.909 0.688 1.00 0.00 N ATOM 1201 CA GLU A 74 -2.277 -13.613 -0.581 1.00 0.00 C ATOM 1202 C GLU A 74 -1.547 -12.256 -0.528 1.00 0.00 C ATOM 1203 O GLU A 74 -0.371 -12.159 -0.890 1.00 0.00 O ATOM 1204 CB GLU A 74 -3.287 -13.631 -1.754 1.00 0.00 C ATOM 1205 CG GLU A 74 -4.062 -14.951 -1.932 1.00 0.00 C ATOM 1206 CD GLU A 74 -3.153 -16.171 -2.177 1.00 0.00 C ATOM 1207 OE1 GLU A 74 -2.488 -16.229 -3.235 1.00 0.00 O ATOM 1208 OE2 GLU A 74 -3.084 -17.067 -1.311 1.00 0.00 O ATOM 0 H GLU A 74 -3.966 -14.075 0.579 1.00 0.00 H new ATOM 0 HA GLU A 74 -1.527 -14.388 -0.741 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -4.005 -12.824 -1.607 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -2.750 -13.416 -2.678 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -4.666 -15.131 -1.043 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -4.751 -14.848 -2.770 1.00 0.00 H new ATOM 1215 N ALA A 75 -2.272 -11.227 -0.068 1.00 0.00 N ATOM 1216 CA ALA A 75 -1.746 -9.859 0.080 1.00 0.00 C ATOM 1217 C ALA A 75 -0.578 -9.771 1.092 1.00 0.00 C ATOM 1218 O ALA A 75 0.355 -8.998 0.889 1.00 0.00 O ATOM 1219 CB ALA A 75 -2.885 -8.929 0.484 1.00 0.00 C ATOM 0 H ALA A 75 -3.248 -11.319 0.215 1.00 0.00 H new ATOM 0 HA ALA A 75 -1.335 -9.551 -0.882 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -2.504 -7.914 0.596 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -3.657 -8.944 -0.285 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -3.309 -9.263 1.431 1.00 0.00 H new ATOM 1225 N ILE A 76 -0.657 -10.561 2.182 1.00 0.00 N ATOM 1226 CA ILE A 76 0.420 -10.648 3.197 1.00 0.00 C ATOM 1227 C ILE A 76 1.709 -11.246 2.584 1.00 0.00 C ATOM 1228 O ILE A 76 2.820 -10.802 2.907 1.00 0.00 O ATOM 1229 CB ILE A 76 -0.044 -11.479 4.461 1.00 0.00 C ATOM 1230 CG1 ILE A 76 -1.150 -10.701 5.251 1.00 0.00 C ATOM 1231 CG2 ILE A 76 1.142 -11.851 5.399 1.00 0.00 C ATOM 1232 CD1 ILE A 76 -1.760 -11.464 6.421 1.00 0.00 C ATOM 0 H ILE A 76 -1.462 -11.154 2.385 1.00 0.00 H new ATOM 0 HA ILE A 76 0.642 -9.635 3.532 1.00 0.00 H new ATOM 0 HB ILE A 76 -0.461 -12.416 4.092 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -0.722 -9.771 5.626 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -1.947 -10.429 4.559 1.00 0.00 H new ATOM 0 HG21 ILE A 76 0.768 -12.420 6.250 1.00 0.00 H new ATOM 0 HG22 ILE A 76 1.866 -12.453 4.849 1.00 0.00 H new ATOM 0 HG23 ILE A 76 1.624 -10.940 5.755 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -2.515 -10.844 6.906 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -2.223 -12.381 6.056 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -0.979 -11.713 7.140 1.00 0.00 H new ATOM 1244 N LYS A 77 1.549 -12.232 1.685 1.00 0.00 N ATOM 1245 CA LYS A 77 2.695 -12.875 1.015 1.00 0.00 C ATOM 1246 C LYS A 77 3.386 -11.877 0.069 1.00 0.00 C ATOM 1247 O LYS A 77 4.610 -11.702 0.117 1.00 0.00 O ATOM 1248 CB LYS A 77 2.251 -14.148 0.244 1.00 0.00 C ATOM 1249 CG LYS A 77 1.687 -15.274 1.145 1.00 0.00 C ATOM 1250 CD LYS A 77 1.299 -16.550 0.360 1.00 0.00 C ATOM 1251 CE LYS A 77 0.222 -16.292 -0.706 1.00 0.00 C ATOM 1252 NZ LYS A 77 -0.167 -17.521 -1.440 1.00 0.00 N ATOM 0 H LYS A 77 0.640 -12.601 1.405 1.00 0.00 H new ATOM 0 HA LYS A 77 3.409 -13.183 1.779 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.492 -13.870 -0.487 1.00 0.00 H new ATOM 0 HB3 LYS A 77 3.103 -14.537 -0.313 1.00 0.00 H new ATOM 0 HG2 LYS A 77 2.430 -15.532 1.900 1.00 0.00 H new ATOM 0 HG3 LYS A 77 0.810 -14.901 1.675 1.00 0.00 H new ATOM 0 HD2 LYS A 77 2.188 -16.959 -0.120 1.00 0.00 H new ATOM 0 HD3 LYS A 77 0.938 -17.305 1.059 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -0.660 -15.865 -0.229 1.00 0.00 H new ATOM 0 HE3 LYS A 77 0.590 -15.552 -1.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 0.152 -17.451 -2.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 0.275 -18.348 -0.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -1.201 -17.626 -1.417 1.00 0.00 H new ATOM 1266 N ILE A 78 2.573 -11.205 -0.757 1.00 0.00 N ATOM 1267 CA ILE A 78 3.062 -10.280 -1.790 1.00 0.00 C ATOM 1268 C ILE A 78 3.560 -8.956 -1.178 1.00 0.00 C ATOM 1269 O ILE A 78 4.752 -8.637 -1.267 1.00 0.00 O ATOM 1270 CB ILE A 78 1.927 -9.996 -2.846 1.00 0.00 C ATOM 1271 CG1 ILE A 78 1.452 -11.327 -3.501 1.00 0.00 C ATOM 1272 CG2 ILE A 78 2.374 -8.978 -3.929 1.00 0.00 C ATOM 1273 CD1 ILE A 78 0.261 -11.176 -4.416 1.00 0.00 C ATOM 0 H ILE A 78 1.557 -11.287 -0.728 1.00 0.00 H new ATOM 0 HA ILE A 78 3.907 -10.755 -2.288 1.00 0.00 H new ATOM 0 HB ILE A 78 1.090 -9.545 -2.313 1.00 0.00 H new ATOM 0 HG12 ILE A 78 2.279 -11.756 -4.067 1.00 0.00 H new ATOM 0 HG13 ILE A 78 1.203 -12.038 -2.713 1.00 0.00 H new ATOM 0 HG21 ILE A 78 1.559 -8.815 -4.634 1.00 0.00 H new ATOM 0 HG22 ILE A 78 2.637 -8.033 -3.454 1.00 0.00 H new ATOM 0 HG23 ILE A 78 3.240 -9.370 -4.461 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -0.005 -12.148 -4.830 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -0.583 -10.778 -3.852 1.00 0.00 H new ATOM 0 HD13 ILE A 78 0.510 -10.492 -5.227 1.00 0.00 H new ATOM 1285 N ILE A 79 2.643 -8.172 -0.568 1.00 0.00 N ATOM 1286 CA ILE A 79 2.977 -6.817 -0.085 1.00 0.00 C ATOM 1287 C ILE A 79 3.029 -6.700 1.445 1.00 0.00 C ATOM 1288 O ILE A 79 3.082 -5.580 1.953 1.00 0.00 O ATOM 1289 CB ILE A 79 1.992 -5.721 -0.664 1.00 0.00 C ATOM 1290 CG1 ILE A 79 0.599 -5.684 0.034 1.00 0.00 C ATOM 1291 CG2 ILE A 79 1.816 -5.881 -2.188 1.00 0.00 C ATOM 1292 CD1 ILE A 79 -0.169 -4.405 -0.273 1.00 0.00 C ATOM 0 H ILE A 79 1.677 -8.452 -0.401 1.00 0.00 H new ATOM 0 HA ILE A 79 3.984 -6.633 -0.460 1.00 0.00 H new ATOM 0 HB ILE A 79 2.469 -4.765 -0.448 1.00 0.00 H new ATOM 0 HG12 ILE A 79 0.011 -6.544 -0.288 1.00 0.00 H new ATOM 0 HG13 ILE A 79 0.733 -5.775 1.112 1.00 0.00 H new ATOM 0 HG21 ILE A 79 1.134 -5.115 -2.558 1.00 0.00 H new ATOM 0 HG22 ILE A 79 2.783 -5.774 -2.679 1.00 0.00 H new ATOM 0 HG23 ILE A 79 1.406 -6.867 -2.405 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.132 -4.428 0.236 1.00 0.00 H new ATOM 0 HD12 ILE A 79 0.404 -3.545 0.073 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -0.329 -4.326 -1.348 1.00 0.00 H new ATOM 1304 N GLY A 80 3.069 -7.820 2.194 1.00 0.00 N ATOM 1305 CA GLY A 80 3.059 -7.737 3.665 1.00 0.00 C ATOM 1306 C GLY A 80 4.361 -7.161 4.226 1.00 0.00 C ATOM 1307 O GLY A 80 5.356 -7.036 3.498 1.00 0.00 O ATOM 0 H GLY A 80 3.107 -8.767 1.817 1.00 0.00 H new ATOM 0 HA2 GLY A 80 2.222 -7.116 3.985 1.00 0.00 H new ATOM 0 HA3 GLY A 80 2.896 -8.731 4.081 1.00 0.00 H new ATOM 1311 N ALA A 81 4.362 -6.827 5.519 1.00 0.00 N ATOM 1312 CA ALA A 81 5.506 -6.176 6.173 1.00 0.00 C ATOM 1313 C ALA A 81 6.584 -7.195 6.553 1.00 0.00 C ATOM 1314 O ALA A 81 6.306 -8.151 7.280 1.00 0.00 O ATOM 1315 CB ALA A 81 5.039 -5.434 7.426 1.00 0.00 C ATOM 0 H ALA A 81 3.573 -6.999 6.143 1.00 0.00 H new ATOM 0 HA ALA A 81 5.938 -5.468 5.466 1.00 0.00 H new ATOM 0 HB1 ALA A 81 5.893 -4.955 7.904 1.00 0.00 H new ATOM 0 HB2 ALA A 81 4.306 -4.676 7.148 1.00 0.00 H new ATOM 0 HB3 ALA A 81 4.585 -6.141 8.120 1.00 0.00 H new ATOM 1321 N LYS A 82 7.795 -6.995 6.034 1.00 0.00 N ATOM 1322 CA LYS A 82 9.007 -7.673 6.522 1.00 0.00 C ATOM 1323 C LYS A 82 9.965 -6.613 7.072 1.00 0.00 C ATOM 1324 O LYS A 82 9.810 -5.417 6.772 1.00 0.00 O ATOM 1325 CB LYS A 82 9.691 -8.487 5.398 1.00 0.00 C ATOM 1326 CG LYS A 82 10.191 -7.656 4.187 1.00 0.00 C ATOM 1327 CD LYS A 82 11.025 -8.499 3.192 1.00 0.00 C ATOM 1328 CE LYS A 82 12.296 -9.090 3.839 1.00 0.00 C ATOM 1329 NZ LYS A 82 13.082 -9.910 2.886 1.00 0.00 N ATOM 0 H LYS A 82 7.969 -6.356 5.259 1.00 0.00 H new ATOM 0 HA LYS A 82 8.732 -8.377 7.307 1.00 0.00 H new ATOM 0 HB2 LYS A 82 10.539 -9.023 5.825 1.00 0.00 H new ATOM 0 HB3 LYS A 82 8.988 -9.238 5.037 1.00 0.00 H new ATOM 0 HG2 LYS A 82 9.335 -7.228 3.666 1.00 0.00 H new ATOM 0 HG3 LYS A 82 10.795 -6.823 4.547 1.00 0.00 H new ATOM 0 HD2 LYS A 82 10.409 -9.309 2.802 1.00 0.00 H new ATOM 0 HD3 LYS A 82 11.309 -7.877 2.343 1.00 0.00 H new ATOM 0 HE2 LYS A 82 12.919 -8.280 4.218 1.00 0.00 H new ATOM 0 HE3 LYS A 82 12.014 -9.702 4.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 13.925 -10.286 3.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 12.498 -10.699 2.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 13.375 -9.321 2.080 1.00 0.00 H new ATOM 1343 N ASP A 83 10.944 -7.038 7.878 1.00 0.00 N ATOM 1344 CA ASP A 83 11.958 -6.146 8.454 1.00 0.00 C ATOM 1345 C ASP A 83 12.866 -5.532 7.380 1.00 0.00 C ATOM 1346 O ASP A 83 13.043 -6.102 6.292 1.00 0.00 O ATOM 1347 CB ASP A 83 12.811 -6.901 9.504 1.00 0.00 C ATOM 1348 CG ASP A 83 13.636 -8.061 8.918 1.00 0.00 C ATOM 1349 OD1 ASP A 83 13.052 -9.132 8.655 1.00 0.00 O ATOM 1350 OD2 ASP A 83 14.864 -7.911 8.727 1.00 0.00 O ATOM 0 H ASP A 83 11.056 -8.014 8.151 1.00 0.00 H new ATOM 0 HA ASP A 83 11.427 -5.329 8.942 1.00 0.00 H new ATOM 0 HB2 ASP A 83 13.487 -6.194 9.985 1.00 0.00 H new ATOM 0 HB3 ASP A 83 12.153 -7.292 10.280 1.00 0.00 H new ATOM 1355 N GLY A 84 13.418 -4.358 7.701 1.00 0.00 N ATOM 1356 CA GLY A 84 14.327 -3.650 6.818 1.00 0.00 C ATOM 1357 C GLY A 84 13.668 -2.427 6.213 1.00 0.00 C ATOM 1358 O GLY A 84 13.262 -1.518 6.947 1.00 0.00 O ATOM 0 H GLY A 84 13.242 -3.878 8.583 1.00 0.00 H new ATOM 0 HA2 GLY A 84 15.216 -3.349 7.373 1.00 0.00 H new ATOM 0 HA3 GLY A 84 14.658 -4.318 6.023 1.00 0.00 H new ATOM 1362 N ASN A 85 13.569 -2.391 4.878 1.00 0.00 N ATOM 1363 CA ASN A 85 12.946 -1.273 4.162 1.00 0.00 C ATOM 1364 C ASN A 85 11.442 -1.545 4.061 1.00 0.00 C ATOM 1365 O ASN A 85 10.999 -2.392 3.273 1.00 0.00 O ATOM 1366 CB ASN A 85 13.595 -1.082 2.764 1.00 0.00 C ATOM 1367 CG ASN A 85 15.066 -0.609 2.804 1.00 0.00 C ATOM 1368 OD1 ASN A 85 15.859 -1.063 3.776 1.00 0.00 O flip ATOM 1369 ND2 ASN A 85 15.500 0.146 1.939 1.00 0.00 N flip ATOM 0 H ASN A 85 13.916 -3.131 4.268 1.00 0.00 H new ATOM 0 HA ASN A 85 13.105 -0.342 4.706 1.00 0.00 H new ATOM 0 HB2 ASN A 85 13.544 -2.026 2.221 1.00 0.00 H new ATOM 0 HB3 ASN A 85 13.008 -0.357 2.200 1.00 0.00 H new ATOM 0 HD21 ASN A 85 14.882 0.485 1.202 1.00 0.00 H new ATOM 0 HD22 ASN A 85 16.478 0.434 1.958 1.00 0.00 H new ATOM 1376 N VAL A 86 10.668 -0.829 4.888 1.00 0.00 N ATOM 1377 CA VAL A 86 9.222 -1.054 5.016 1.00 0.00 C ATOM 1378 C VAL A 86 8.460 0.301 5.058 1.00 0.00 C ATOM 1379 O VAL A 86 9.076 1.375 5.169 1.00 0.00 O ATOM 1380 CB VAL A 86 8.948 -1.974 6.280 1.00 0.00 C ATOM 1381 CG1 VAL A 86 8.894 -1.175 7.605 1.00 0.00 C ATOM 1382 CG2 VAL A 86 7.700 -2.861 6.088 1.00 0.00 C ATOM 0 H VAL A 86 11.024 -0.082 5.484 1.00 0.00 H new ATOM 0 HA VAL A 86 8.840 -1.582 4.142 1.00 0.00 H new ATOM 0 HB VAL A 86 9.807 -2.640 6.363 1.00 0.00 H new ATOM 0 HG11 VAL A 86 8.704 -1.857 8.434 1.00 0.00 H new ATOM 0 HG12 VAL A 86 9.846 -0.668 7.763 1.00 0.00 H new ATOM 0 HG13 VAL A 86 8.094 -0.436 7.552 1.00 0.00 H new ATOM 0 HG21 VAL A 86 7.549 -3.474 6.976 1.00 0.00 H new ATOM 0 HG22 VAL A 86 6.826 -2.230 5.930 1.00 0.00 H new ATOM 0 HG23 VAL A 86 7.842 -3.507 5.221 1.00 0.00 H new ATOM 1392 N CYS A 87 7.123 0.227 4.937 1.00 0.00 N ATOM 1393 CA CYS A 87 6.225 1.401 4.849 1.00 0.00 C ATOM 1394 C CYS A 87 5.189 1.358 5.968 1.00 0.00 C ATOM 1395 O CYS A 87 4.428 0.392 6.078 1.00 0.00 O ATOM 1396 CB CYS A 87 5.525 1.457 3.475 1.00 0.00 C ATOM 1397 SG CYS A 87 6.653 1.777 2.116 1.00 0.00 S ATOM 0 H CYS A 87 6.624 -0.662 4.897 1.00 0.00 H new ATOM 0 HA CYS A 87 6.829 2.302 4.961 1.00 0.00 H new ATOM 0 HB2 CYS A 87 5.012 0.512 3.297 1.00 0.00 H new ATOM 0 HB3 CYS A 87 4.762 2.235 3.495 1.00 0.00 H new ATOM 0 HG CYS A 87 7.648 2.498 2.539 1.00 0.00 H new ATOM 1403 N LEU A 88 5.145 2.430 6.770 1.00 0.00 N ATOM 1404 CA LEU A 88 4.273 2.521 7.942 1.00 0.00 C ATOM 1405 C LEU A 88 3.058 3.409 7.615 1.00 0.00 C ATOM 1406 O LEU A 88 3.206 4.548 7.176 1.00 0.00 O ATOM 1407 CB LEU A 88 5.078 3.041 9.165 1.00 0.00 C ATOM 1408 CG LEU A 88 4.281 3.289 10.493 1.00 0.00 C ATOM 1409 CD1 LEU A 88 3.306 2.134 10.830 1.00 0.00 C ATOM 1410 CD2 LEU A 88 5.254 3.533 11.668 1.00 0.00 C ATOM 0 H LEU A 88 5.717 3.261 6.621 1.00 0.00 H new ATOM 0 HA LEU A 88 3.895 1.533 8.205 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.872 2.325 9.376 1.00 0.00 H new ATOM 0 HB3 LEU A 88 5.559 3.976 8.880 1.00 0.00 H new ATOM 0 HG LEU A 88 3.674 4.180 10.336 1.00 0.00 H new ATOM 0 HD11 LEU A 88 2.782 2.360 11.759 1.00 0.00 H new ATOM 0 HD12 LEU A 88 2.582 2.022 10.023 1.00 0.00 H new ATOM 0 HD13 LEU A 88 3.867 1.207 10.946 1.00 0.00 H new ATOM 0 HD21 LEU A 88 4.685 3.703 12.582 1.00 0.00 H new ATOM 0 HD22 LEU A 88 5.895 2.661 11.797 1.00 0.00 H new ATOM 0 HD23 LEU A 88 5.869 4.407 11.455 1.00 0.00 H new ATOM 1422 N ILE A 89 1.874 2.832 7.842 1.00 0.00 N ATOM 1423 CA ILE A 89 0.570 3.475 7.612 1.00 0.00 C ATOM 1424 C ILE A 89 -0.064 3.796 8.970 1.00 0.00 C ATOM 1425 O ILE A 89 -0.100 2.923 9.853 1.00 0.00 O ATOM 1426 CB ILE A 89 -0.405 2.546 6.805 1.00 0.00 C ATOM 1427 CG1 ILE A 89 0.269 2.011 5.505 1.00 0.00 C ATOM 1428 CG2 ILE A 89 -1.732 3.273 6.487 1.00 0.00 C ATOM 1429 CD1 ILE A 89 -0.574 1.001 4.747 1.00 0.00 C ATOM 0 H ILE A 89 1.790 1.881 8.200 1.00 0.00 H new ATOM 0 HA ILE A 89 0.734 4.381 7.028 1.00 0.00 H new ATOM 0 HB ILE A 89 -0.638 1.686 7.433 1.00 0.00 H new ATOM 0 HG12 ILE A 89 0.488 2.853 4.848 1.00 0.00 H new ATOM 0 HG13 ILE A 89 1.223 1.552 5.764 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.388 2.606 5.928 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -2.219 3.564 7.417 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -1.526 4.162 5.891 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -0.038 0.676 3.855 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -0.772 0.140 5.386 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -1.518 1.461 4.455 1.00 0.00 H new ATOM 1441 N CYS A 90 -0.573 5.028 9.130 1.00 0.00 N ATOM 1442 CA CYS A 90 -1.219 5.454 10.378 1.00 0.00 C ATOM 1443 C CYS A 90 -2.214 6.602 10.127 1.00 0.00 C ATOM 1444 O CYS A 90 -2.094 7.350 9.151 1.00 0.00 O ATOM 1445 CB CYS A 90 -0.146 5.873 11.405 1.00 0.00 C ATOM 1446 SG CYS A 90 -0.773 6.052 13.084 1.00 0.00 S ATOM 0 H CYS A 90 -0.549 5.747 8.407 1.00 0.00 H new ATOM 0 HA CYS A 90 -1.785 4.613 10.780 1.00 0.00 H new ATOM 0 HB2 CYS A 90 0.653 5.132 11.403 1.00 0.00 H new ATOM 0 HB3 CYS A 90 0.295 6.819 11.090 1.00 0.00 H new ATOM 0 HG CYS A 90 -0.308 7.148 13.606 1.00 0.00 H new ATOM 1452 N GLU A 91 -3.201 6.705 11.024 1.00 0.00 N ATOM 1453 CA GLU A 91 -4.222 7.767 11.001 1.00 0.00 C ATOM 1454 C GLU A 91 -3.735 9.015 11.762 1.00 0.00 C ATOM 1455 O GLU A 91 -3.963 10.148 11.326 1.00 0.00 O ATOM 1456 CB GLU A 91 -5.541 7.244 11.627 1.00 0.00 C ATOM 1457 CG GLU A 91 -6.195 6.067 10.877 1.00 0.00 C ATOM 1458 CD GLU A 91 -6.812 6.458 9.516 1.00 0.00 C ATOM 1459 OE1 GLU A 91 -6.096 6.470 8.483 1.00 0.00 O ATOM 1460 OE2 GLU A 91 -8.023 6.771 9.476 1.00 0.00 O ATOM 0 H GLU A 91 -3.318 6.048 11.796 1.00 0.00 H new ATOM 0 HA GLU A 91 -4.402 8.049 9.964 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -5.341 6.936 12.653 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -6.255 8.067 11.674 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -5.447 5.291 10.716 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -6.973 5.635 11.507 1.00 0.00 H new ATOM 1467 N ASP A 92 -3.066 8.786 12.902 1.00 0.00 N ATOM 1468 CA ASP A 92 -2.671 9.844 13.860 1.00 0.00 C ATOM 1469 C ASP A 92 -1.165 9.739 14.191 1.00 0.00 C ATOM 1470 O ASP A 92 -0.645 8.643 14.394 1.00 0.00 O ATOM 1471 CB ASP A 92 -3.568 9.701 15.123 1.00 0.00 C ATOM 1472 CG ASP A 92 -3.001 10.352 16.392 1.00 0.00 C ATOM 1473 OD1 ASP A 92 -3.184 11.571 16.591 1.00 0.00 O ATOM 1474 OD2 ASP A 92 -2.365 9.637 17.190 1.00 0.00 O ATOM 0 H ASP A 92 -2.778 7.852 13.193 1.00 0.00 H new ATOM 0 HA ASP A 92 -2.820 10.835 13.430 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -4.543 10.140 14.911 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -3.731 8.641 15.317 1.00 0.00 H new ATOM 1479 N GLU A 93 -0.482 10.900 14.250 1.00 0.00 N ATOM 1480 CA GLU A 93 0.998 10.983 14.342 1.00 0.00 C ATOM 1481 C GLU A 93 1.595 10.445 15.661 1.00 0.00 C ATOM 1482 O GLU A 93 2.683 9.848 15.636 1.00 0.00 O ATOM 1483 CB GLU A 93 1.464 12.444 14.101 1.00 0.00 C ATOM 1484 CG GLU A 93 2.997 12.616 13.979 1.00 0.00 C ATOM 1485 CD GLU A 93 3.438 14.077 13.802 1.00 0.00 C ATOM 1486 OE1 GLU A 93 3.585 14.789 14.821 1.00 0.00 O ATOM 1487 OE2 GLU A 93 3.633 14.520 12.649 1.00 0.00 O ATOM 0 H GLU A 93 -0.939 11.812 14.235 1.00 0.00 H new ATOM 0 HA GLU A 93 1.378 10.324 13.561 1.00 0.00 H new ATOM 0 HB2 GLU A 93 0.996 12.816 13.190 1.00 0.00 H new ATOM 0 HB3 GLU A 93 1.105 13.066 14.921 1.00 0.00 H new ATOM 0 HG2 GLU A 93 3.473 12.207 14.870 1.00 0.00 H new ATOM 0 HG3 GLU A 93 3.354 12.032 13.131 1.00 0.00 H new ATOM 1494 N GLU A 94 0.913 10.638 16.809 1.00 0.00 N ATOM 1495 CA GLU A 94 1.458 10.167 18.108 1.00 0.00 C ATOM 1496 C GLU A 94 1.298 8.639 18.234 1.00 0.00 C ATOM 1497 O GLU A 94 2.069 7.991 18.945 1.00 0.00 O ATOM 1498 CB GLU A 94 0.872 10.945 19.330 1.00 0.00 C ATOM 1499 CG GLU A 94 -0.658 11.041 19.389 1.00 0.00 C ATOM 1500 CD GLU A 94 -1.202 11.822 20.601 1.00 0.00 C ATOM 1501 OE1 GLU A 94 -0.901 13.028 20.728 1.00 0.00 O ATOM 1502 OE2 GLU A 94 -1.942 11.236 21.427 1.00 0.00 O ATOM 0 H GLU A 94 0.007 11.104 16.869 1.00 0.00 H new ATOM 0 HA GLU A 94 2.525 10.389 18.122 1.00 0.00 H new ATOM 0 HB2 GLU A 94 1.223 10.466 20.244 1.00 0.00 H new ATOM 0 HB3 GLU A 94 1.281 11.955 19.323 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -1.015 11.517 18.476 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.072 10.033 19.406 1.00 0.00 H new ATOM 1509 N THR A 95 0.291 8.075 17.543 1.00 0.00 N ATOM 1510 CA THR A 95 0.183 6.623 17.313 1.00 0.00 C ATOM 1511 C THR A 95 1.306 6.121 16.375 1.00 0.00 C ATOM 1512 O THR A 95 1.912 5.068 16.629 1.00 0.00 O ATOM 1513 CB THR A 95 -1.214 6.284 16.706 1.00 0.00 C ATOM 1514 OG1 THR A 95 -2.241 6.687 17.626 1.00 0.00 O ATOM 1515 CG2 THR A 95 -1.373 4.792 16.362 1.00 0.00 C ATOM 0 H THR A 95 -0.470 8.613 17.129 1.00 0.00 H new ATOM 0 HA THR A 95 0.293 6.117 18.272 1.00 0.00 H new ATOM 0 HB THR A 95 -1.304 6.832 15.768 1.00 0.00 H new ATOM 0 HG1 THR A 95 -2.369 7.657 17.569 1.00 0.00 H new ATOM 0 HG21 THR A 95 -2.365 4.619 15.944 1.00 0.00 H new ATOM 0 HG22 THR A 95 -0.616 4.504 15.632 1.00 0.00 H new ATOM 0 HG23 THR A 95 -1.251 4.195 17.266 1.00 0.00 H new ATOM 1523 N PHE A 96 1.574 6.903 15.304 1.00 0.00 N ATOM 1524 CA PHE A 96 2.590 6.582 14.280 1.00 0.00 C ATOM 1525 C PHE A 96 3.973 6.394 14.923 1.00 0.00 C ATOM 1526 O PHE A 96 4.657 5.396 14.654 1.00 0.00 O ATOM 1527 CB PHE A 96 2.622 7.702 13.167 1.00 0.00 C ATOM 1528 CG PHE A 96 3.990 7.931 12.501 1.00 0.00 C ATOM 1529 CD1 PHE A 96 4.543 6.975 11.652 1.00 0.00 C ATOM 1530 CD2 PHE A 96 4.747 9.076 12.781 1.00 0.00 C ATOM 1531 CE1 PHE A 96 5.797 7.155 11.106 1.00 0.00 C ATOM 1532 CE2 PHE A 96 6.006 9.248 12.238 1.00 0.00 C ATOM 1533 CZ PHE A 96 6.530 8.287 11.402 1.00 0.00 C ATOM 0 H PHE A 96 1.086 7.781 15.127 1.00 0.00 H new ATOM 0 HA PHE A 96 2.317 5.640 13.804 1.00 0.00 H new ATOM 0 HB2 PHE A 96 1.899 7.443 12.394 1.00 0.00 H new ATOM 0 HB3 PHE A 96 2.291 8.641 13.611 1.00 0.00 H new ATOM 0 HD1 PHE A 96 3.983 6.082 11.418 1.00 0.00 H new ATOM 0 HD2 PHE A 96 4.340 9.836 13.431 1.00 0.00 H new ATOM 0 HE1 PHE A 96 6.207 6.407 10.444 1.00 0.00 H new ATOM 0 HE2 PHE A 96 6.578 10.134 12.469 1.00 0.00 H new ATOM 0 HZ PHE A 96 7.514 8.419 10.978 1.00 0.00 H new ATOM 1543 N ARG A 97 4.373 7.367 15.768 1.00 0.00 N ATOM 1544 CA ARG A 97 5.716 7.382 16.354 1.00 0.00 C ATOM 1545 C ARG A 97 5.907 6.179 17.287 1.00 0.00 C ATOM 1546 O ARG A 97 6.980 5.611 17.311 1.00 0.00 O ATOM 1547 CB ARG A 97 6.028 8.701 17.106 1.00 0.00 C ATOM 1548 CG ARG A 97 7.494 8.766 17.607 1.00 0.00 C ATOM 1549 CD ARG A 97 7.832 10.006 18.437 1.00 0.00 C ATOM 1550 NE ARG A 97 9.214 9.920 18.961 1.00 0.00 N ATOM 1551 CZ ARG A 97 9.750 10.712 19.898 1.00 0.00 C ATOM 1552 NH1 ARG A 97 9.045 11.687 20.458 1.00 0.00 N ATOM 1553 NH2 ARG A 97 11.008 10.521 20.274 1.00 0.00 N ATOM 0 H ARG A 97 3.782 8.147 16.055 1.00 0.00 H new ATOM 0 HA ARG A 97 6.422 7.314 15.526 1.00 0.00 H new ATOM 0 HB2 ARG A 97 5.835 9.546 16.446 1.00 0.00 H new ATOM 0 HB3 ARG A 97 5.352 8.800 17.956 1.00 0.00 H new ATOM 0 HG2 ARG A 97 7.699 7.878 18.205 1.00 0.00 H new ATOM 0 HG3 ARG A 97 8.160 8.730 16.745 1.00 0.00 H new ATOM 0 HD2 ARG A 97 7.724 10.901 17.824 1.00 0.00 H new ATOM 0 HD3 ARG A 97 7.129 10.100 19.264 1.00 0.00 H new ATOM 0 HE ARG A 97 9.812 9.191 18.573 1.00 0.00 H new ATOM 0 HH11 ARG A 97 8.077 11.843 20.176 1.00 0.00 H new ATOM 0 HH12 ARG A 97 9.471 12.280 21.170 1.00 0.00 H new ATOM 0 HH21 ARG A 97 11.559 9.775 19.850 1.00 0.00 H new ATOM 0 HH22 ARG A 97 11.424 11.120 20.987 1.00 0.00 H new ATOM 1567 N LYS A 98 4.844 5.791 18.028 1.00 0.00 N ATOM 1568 CA LYS A 98 4.871 4.593 18.909 1.00 0.00 C ATOM 1569 C LYS A 98 5.251 3.321 18.128 1.00 0.00 C ATOM 1570 O LYS A 98 6.021 2.497 18.624 1.00 0.00 O ATOM 1571 CB LYS A 98 3.516 4.380 19.634 1.00 0.00 C ATOM 1572 CG LYS A 98 3.176 5.472 20.661 1.00 0.00 C ATOM 1573 CD LYS A 98 1.847 5.202 21.400 1.00 0.00 C ATOM 1574 CE LYS A 98 1.475 6.330 22.374 1.00 0.00 C ATOM 1575 NZ LYS A 98 1.284 7.627 21.673 1.00 0.00 N ATOM 0 H LYS A 98 3.954 6.289 18.036 1.00 0.00 H new ATOM 0 HA LYS A 98 5.638 4.780 19.661 1.00 0.00 H new ATOM 0 HB2 LYS A 98 2.721 4.336 18.890 1.00 0.00 H new ATOM 0 HB3 LYS A 98 3.534 3.414 20.139 1.00 0.00 H new ATOM 0 HG2 LYS A 98 3.984 5.544 21.389 1.00 0.00 H new ATOM 0 HG3 LYS A 98 3.116 6.435 20.155 1.00 0.00 H new ATOM 0 HD2 LYS A 98 1.047 5.079 20.669 1.00 0.00 H new ATOM 0 HD3 LYS A 98 1.925 4.263 21.949 1.00 0.00 H new ATOM 0 HE2 LYS A 98 0.560 6.065 22.904 1.00 0.00 H new ATOM 0 HE3 LYS A 98 2.259 6.435 23.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 2.014 8.300 21.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 1.361 7.481 20.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 0.343 8.009 21.899 1.00 0.00 H new ATOM 1589 N ILE A 99 4.721 3.185 16.899 1.00 0.00 N ATOM 1590 CA ILE A 99 5.045 2.047 16.024 1.00 0.00 C ATOM 1591 C ILE A 99 6.512 2.157 15.546 1.00 0.00 C ATOM 1592 O ILE A 99 7.256 1.168 15.591 1.00 0.00 O ATOM 1593 CB ILE A 99 4.081 1.954 14.787 1.00 0.00 C ATOM 1594 CG1 ILE A 99 2.577 1.986 15.221 1.00 0.00 C ATOM 1595 CG2 ILE A 99 4.385 0.686 13.947 1.00 0.00 C ATOM 1596 CD1 ILE A 99 2.120 0.791 16.040 1.00 0.00 C ATOM 0 H ILE A 99 4.066 3.851 16.490 1.00 0.00 H new ATOM 0 HA ILE A 99 4.912 1.135 16.607 1.00 0.00 H new ATOM 0 HB ILE A 99 4.260 2.831 14.165 1.00 0.00 H new ATOM 0 HG12 ILE A 99 2.401 2.893 15.799 1.00 0.00 H new ATOM 0 HG13 ILE A 99 1.958 2.053 14.327 1.00 0.00 H new ATOM 0 HG21 ILE A 99 3.706 0.642 13.096 1.00 0.00 H new ATOM 0 HG22 ILE A 99 5.414 0.725 13.589 1.00 0.00 H new ATOM 0 HG23 ILE A 99 4.250 -0.201 14.565 1.00 0.00 H new ATOM 0 HD11 ILE A 99 1.066 0.905 16.292 1.00 0.00 H new ATOM 0 HD12 ILE A 99 2.258 -0.122 15.460 1.00 0.00 H new ATOM 0 HD13 ILE A 99 2.708 0.731 16.956 1.00 0.00 H new ATOM 1608 N TYR A 100 6.916 3.377 15.106 1.00 0.00 N ATOM 1609 CA TYR A 100 8.304 3.710 14.709 1.00 0.00 C ATOM 1610 C TYR A 100 9.334 3.365 15.808 1.00 0.00 C ATOM 1611 O TYR A 100 10.429 2.870 15.502 1.00 0.00 O ATOM 1612 CB TYR A 100 8.354 5.227 14.330 1.00 0.00 C ATOM 1613 CG TYR A 100 9.760 5.845 14.164 1.00 0.00 C ATOM 1614 CD1 TYR A 100 10.635 5.389 13.182 1.00 0.00 C ATOM 1615 CD2 TYR A 100 10.212 6.873 15.006 1.00 0.00 C ATOM 1616 CE1 TYR A 100 11.900 5.932 13.036 1.00 0.00 C ATOM 1617 CE2 TYR A 100 11.476 7.417 14.860 1.00 0.00 C ATOM 1618 CZ TYR A 100 12.317 6.940 13.878 1.00 0.00 C ATOM 1619 OH TYR A 100 13.580 7.478 13.733 1.00 0.00 O ATOM 0 H TYR A 100 6.276 4.166 15.017 1.00 0.00 H new ATOM 0 HA TYR A 100 8.582 3.101 13.849 1.00 0.00 H new ATOM 0 HB2 TYR A 100 7.807 5.365 13.397 1.00 0.00 H new ATOM 0 HB3 TYR A 100 7.822 5.789 15.097 1.00 0.00 H new ATOM 0 HD1 TYR A 100 10.320 4.595 12.520 1.00 0.00 H new ATOM 0 HD2 TYR A 100 9.561 7.247 15.783 1.00 0.00 H new ATOM 0 HE1 TYR A 100 12.559 5.566 12.263 1.00 0.00 H new ATOM 0 HE2 TYR A 100 11.802 8.213 15.513 1.00 0.00 H new ATOM 0 HH TYR A 100 13.716 8.179 14.404 1.00 0.00 H new ATOM 1629 N GLU A 101 8.969 3.636 17.073 1.00 0.00 N ATOM 1630 CA GLU A 101 9.821 3.356 18.234 1.00 0.00 C ATOM 1631 C GLU A 101 10.152 1.857 18.321 1.00 0.00 C ATOM 1632 O GLU A 101 11.318 1.485 18.506 1.00 0.00 O ATOM 1633 CB GLU A 101 9.158 3.830 19.563 1.00 0.00 C ATOM 1634 CG GLU A 101 8.982 5.361 19.706 1.00 0.00 C ATOM 1635 CD GLU A 101 10.292 6.159 19.559 1.00 0.00 C ATOM 1636 OE1 GLU A 101 11.247 5.895 20.326 1.00 0.00 O ATOM 1637 OE2 GLU A 101 10.378 7.059 18.687 1.00 0.00 O ATOM 0 H GLU A 101 8.072 4.056 17.316 1.00 0.00 H new ATOM 0 HA GLU A 101 10.745 3.917 18.096 1.00 0.00 H new ATOM 0 HB2 GLU A 101 8.179 3.359 19.649 1.00 0.00 H new ATOM 0 HB3 GLU A 101 9.759 3.471 20.398 1.00 0.00 H new ATOM 0 HG2 GLU A 101 8.272 5.706 18.955 1.00 0.00 H new ATOM 0 HG3 GLU A 101 8.545 5.577 20.681 1.00 0.00 H new ATOM 1644 N LEU A 102 9.116 1.012 18.176 1.00 0.00 N ATOM 1645 CA LEU A 102 9.244 -0.443 18.338 1.00 0.00 C ATOM 1646 C LEU A 102 9.992 -1.105 17.163 1.00 0.00 C ATOM 1647 O LEU A 102 10.786 -2.014 17.390 1.00 0.00 O ATOM 1648 CB LEU A 102 7.839 -1.073 18.522 1.00 0.00 C ATOM 1649 CG LEU A 102 6.962 -0.429 19.644 1.00 0.00 C ATOM 1650 CD1 LEU A 102 5.570 -1.057 19.725 1.00 0.00 C ATOM 1651 CD2 LEU A 102 7.675 -0.442 21.019 1.00 0.00 C ATOM 0 H LEU A 102 8.171 1.319 17.944 1.00 0.00 H new ATOM 0 HA LEU A 102 9.845 -0.626 19.229 1.00 0.00 H new ATOM 0 HB2 LEU A 102 7.300 -1.003 17.577 1.00 0.00 H new ATOM 0 HB3 LEU A 102 7.960 -2.134 18.742 1.00 0.00 H new ATOM 0 HG LEU A 102 6.822 0.615 19.364 1.00 0.00 H new ATOM 0 HD11 LEU A 102 4.999 -0.576 20.519 1.00 0.00 H new ATOM 0 HD12 LEU A 102 5.054 -0.922 18.774 1.00 0.00 H new ATOM 0 HD13 LEU A 102 5.663 -2.122 19.939 1.00 0.00 H new ATOM 0 HD21 LEU A 102 7.029 0.015 21.768 1.00 0.00 H new ATOM 0 HD22 LEU A 102 7.892 -1.471 21.306 1.00 0.00 H new ATOM 0 HD23 LEU A 102 8.606 0.120 20.951 1.00 0.00 H new ATOM 1663 N ILE A 103 9.762 -0.643 15.913 1.00 0.00 N ATOM 1664 CA ILE A 103 10.402 -1.262 14.724 1.00 0.00 C ATOM 1665 C ILE A 103 11.897 -0.867 14.637 1.00 0.00 C ATOM 1666 O ILE A 103 12.732 -1.697 14.265 1.00 0.00 O ATOM 1667 CB ILE A 103 9.645 -0.943 13.370 1.00 0.00 C ATOM 1668 CG1 ILE A 103 9.475 0.596 13.143 1.00 0.00 C ATOM 1669 CG2 ILE A 103 8.275 -1.666 13.331 1.00 0.00 C ATOM 1670 CD1 ILE A 103 8.672 0.990 11.902 1.00 0.00 C ATOM 0 H ILE A 103 9.148 0.144 15.700 1.00 0.00 H new ATOM 0 HA ILE A 103 10.332 -2.341 14.861 1.00 0.00 H new ATOM 0 HB ILE A 103 10.260 -1.320 12.552 1.00 0.00 H new ATOM 0 HG12 ILE A 103 8.990 1.024 14.020 1.00 0.00 H new ATOM 0 HG13 ILE A 103 10.465 1.048 13.073 1.00 0.00 H new ATOM 0 HG21 ILE A 103 7.769 -1.436 12.394 1.00 0.00 H new ATOM 0 HG22 ILE A 103 8.429 -2.742 13.405 1.00 0.00 H new ATOM 0 HG23 ILE A 103 7.662 -1.329 14.167 1.00 0.00 H new ATOM 0 HD11 ILE A 103 8.613 2.076 11.837 1.00 0.00 H new ATOM 0 HD12 ILE A 103 9.164 0.599 11.011 1.00 0.00 H new ATOM 0 HD13 ILE A 103 7.666 0.576 11.973 1.00 0.00 H new ATOM 1682 N GLY A 104 12.208 0.398 14.996 1.00 0.00 N ATOM 1683 CA GLY A 104 13.591 0.866 15.165 1.00 0.00 C ATOM 1684 C GLY A 104 14.419 0.867 13.875 1.00 0.00 C ATOM 1685 O GLY A 104 15.014 -0.153 13.514 1.00 0.00 O ATOM 0 H GLY A 104 11.507 1.117 15.175 1.00 0.00 H new ATOM 0 HA2 GLY A 104 13.573 1.877 15.572 1.00 0.00 H new ATOM 0 HA3 GLY A 104 14.088 0.235 15.902 1.00 0.00 H new ATOM 1689 N GLY A 105 14.445 2.015 13.184 1.00 0.00 N ATOM 1690 CA GLY A 105 15.261 2.196 11.979 1.00 0.00 C ATOM 1691 C GLY A 105 15.469 3.669 11.663 1.00 0.00 C ATOM 1692 O GLY A 105 15.148 4.536 12.492 1.00 0.00 O ATOM 0 H GLY A 105 13.903 2.839 13.444 1.00 0.00 H new ATOM 0 HA2 GLY A 105 16.228 1.712 12.117 1.00 0.00 H new ATOM 0 HA3 GLY A 105 14.777 1.706 11.134 1.00 0.00 H new ATOM 1696 N GLU A 106 15.977 3.961 10.454 1.00 0.00 N ATOM 1697 CA GLU A 106 16.278 5.332 10.014 1.00 0.00 C ATOM 1698 C GLU A 106 15.333 5.705 8.873 1.00 0.00 C ATOM 1699 O GLU A 106 15.047 4.871 8.020 1.00 0.00 O ATOM 1700 CB GLU A 106 17.765 5.433 9.579 1.00 0.00 C ATOM 1701 CG GLU A 106 18.216 6.825 9.088 1.00 0.00 C ATOM 1702 CD GLU A 106 19.747 6.959 8.994 1.00 0.00 C ATOM 1703 OE1 GLU A 106 20.362 6.286 8.143 1.00 0.00 O ATOM 1704 OE2 GLU A 106 20.342 7.723 9.782 1.00 0.00 O ATOM 0 H GLU A 106 16.191 3.251 9.754 1.00 0.00 H new ATOM 0 HA GLU A 106 16.126 6.034 10.834 1.00 0.00 H new ATOM 0 HB2 GLU A 106 18.393 5.142 10.421 1.00 0.00 H new ATOM 0 HB3 GLU A 106 17.943 4.710 8.783 1.00 0.00 H new ATOM 0 HG2 GLU A 106 17.778 7.019 8.109 1.00 0.00 H new ATOM 0 HG3 GLU A 106 17.830 7.587 9.766 1.00 0.00 H new ATOM 1711 N ILE A 107 14.854 6.956 8.865 1.00 0.00 N ATOM 1712 CA ILE A 107 13.870 7.417 7.874 1.00 0.00 C ATOM 1713 C ILE A 107 14.530 7.483 6.478 1.00 0.00 C ATOM 1714 O ILE A 107 15.560 8.143 6.295 1.00 0.00 O ATOM 1715 CB ILE A 107 13.240 8.810 8.256 1.00 0.00 C ATOM 1716 CG1 ILE A 107 12.545 8.742 9.661 1.00 0.00 C ATOM 1717 CG2 ILE A 107 12.245 9.304 7.161 1.00 0.00 C ATOM 1718 CD1 ILE A 107 11.380 7.763 9.756 1.00 0.00 C ATOM 0 H ILE A 107 15.133 7.671 9.537 1.00 0.00 H new ATOM 0 HA ILE A 107 13.052 6.697 7.859 1.00 0.00 H new ATOM 0 HB ILE A 107 14.050 9.537 8.314 1.00 0.00 H new ATOM 0 HG12 ILE A 107 13.292 8.468 10.406 1.00 0.00 H new ATOM 0 HG13 ILE A 107 12.186 9.738 9.921 1.00 0.00 H new ATOM 0 HG21 ILE A 107 11.829 10.267 7.456 1.00 0.00 H new ATOM 0 HG22 ILE A 107 12.772 9.411 6.213 1.00 0.00 H new ATOM 0 HG23 ILE A 107 11.439 8.579 7.048 1.00 0.00 H new ATOM 0 HD11 ILE A 107 10.965 7.787 10.764 1.00 0.00 H new ATOM 0 HD12 ILE A 107 10.609 8.045 9.039 1.00 0.00 H new ATOM 0 HD13 ILE A 107 11.732 6.756 9.533 1.00 0.00 H new ATOM 1730 N ASP A 108 13.933 6.761 5.521 1.00 0.00 N ATOM 1731 CA ASP A 108 14.376 6.707 4.128 1.00 0.00 C ATOM 1732 C ASP A 108 13.206 7.188 3.255 1.00 0.00 C ATOM 1733 O ASP A 108 12.282 6.420 2.966 1.00 0.00 O ATOM 1734 CB ASP A 108 14.792 5.258 3.753 1.00 0.00 C ATOM 1735 CG ASP A 108 15.455 5.165 2.367 1.00 0.00 C ATOM 1736 OD1 ASP A 108 14.748 5.168 1.341 1.00 0.00 O ATOM 1737 OD2 ASP A 108 16.693 5.104 2.291 1.00 0.00 O ATOM 0 H ASP A 108 13.110 6.186 5.701 1.00 0.00 H new ATOM 0 HA ASP A 108 15.246 7.344 3.972 1.00 0.00 H new ATOM 0 HB2 ASP A 108 15.481 4.877 4.506 1.00 0.00 H new ATOM 0 HB3 ASP A 108 13.911 4.616 3.773 1.00 0.00 H new ATOM 1742 N ASP A 109 13.212 8.479 2.908 1.00 0.00 N ATOM 1743 CA ASP A 109 12.142 9.097 2.104 1.00 0.00 C ATOM 1744 C ASP A 109 12.126 8.542 0.662 1.00 0.00 C ATOM 1745 O ASP A 109 11.056 8.281 0.105 1.00 0.00 O ATOM 1746 CB ASP A 109 12.284 10.645 2.107 1.00 0.00 C ATOM 1747 CG ASP A 109 13.595 11.147 1.476 1.00 0.00 C ATOM 1748 OD1 ASP A 109 14.656 11.032 2.129 1.00 0.00 O ATOM 1749 OD2 ASP A 109 13.572 11.648 0.332 1.00 0.00 O ATOM 0 H ASP A 109 13.954 9.127 3.173 1.00 0.00 H new ATOM 0 HA ASP A 109 11.187 8.840 2.561 1.00 0.00 H new ATOM 0 HB2 ASP A 109 11.442 11.079 1.568 1.00 0.00 H new ATOM 0 HB3 ASP A 109 12.224 11.005 3.134 1.00 0.00 H new ATOM 1754 N SER A 110 13.328 8.380 0.070 1.00 0.00 N ATOM 1755 CA SER A 110 13.512 7.915 -1.319 1.00 0.00 C ATOM 1756 C SER A 110 12.821 6.576 -1.676 1.00 0.00 C ATOM 1757 O SER A 110 12.430 6.385 -2.834 1.00 0.00 O ATOM 1758 CB SER A 110 15.026 7.853 -1.635 1.00 0.00 C ATOM 1759 OG SER A 110 15.738 7.142 -0.632 1.00 0.00 O ATOM 0 H SER A 110 14.208 8.571 0.550 1.00 0.00 H new ATOM 0 HA SER A 110 13.006 8.648 -1.948 1.00 0.00 H new ATOM 0 HB2 SER A 110 15.178 7.372 -2.601 1.00 0.00 H new ATOM 0 HB3 SER A 110 15.423 8.865 -1.717 1.00 0.00 H new ATOM 0 HG SER A 110 15.117 6.575 -0.130 1.00 0.00 H new ATOM 1765 N VAL A 111 12.657 5.659 -0.707 1.00 0.00 N ATOM 1766 CA VAL A 111 12.018 4.351 -0.975 1.00 0.00 C ATOM 1767 C VAL A 111 10.514 4.528 -1.318 1.00 0.00 C ATOM 1768 O VAL A 111 9.924 3.696 -2.017 1.00 0.00 O ATOM 1769 CB VAL A 111 12.220 3.341 0.227 1.00 0.00 C ATOM 1770 CG1 VAL A 111 11.310 3.664 1.441 1.00 0.00 C ATOM 1771 CG2 VAL A 111 12.058 1.874 -0.236 1.00 0.00 C ATOM 0 H VAL A 111 12.953 5.793 0.260 1.00 0.00 H new ATOM 0 HA VAL A 111 12.512 3.917 -1.844 1.00 0.00 H new ATOM 0 HB VAL A 111 13.246 3.469 0.573 1.00 0.00 H new ATOM 0 HG11 VAL A 111 11.491 2.939 2.235 1.00 0.00 H new ATOM 0 HG12 VAL A 111 11.533 4.666 1.807 1.00 0.00 H new ATOM 0 HG13 VAL A 111 10.265 3.614 1.136 1.00 0.00 H new ATOM 0 HG21 VAL A 111 12.203 1.206 0.613 1.00 0.00 H new ATOM 0 HG22 VAL A 111 11.058 1.730 -0.645 1.00 0.00 H new ATOM 0 HG23 VAL A 111 12.799 1.651 -1.004 1.00 0.00 H new ATOM 1781 N LEU A 112 9.927 5.652 -0.848 1.00 0.00 N ATOM 1782 CA LEU A 112 8.523 6.013 -1.110 1.00 0.00 C ATOM 1783 C LEU A 112 8.362 6.775 -2.434 1.00 0.00 C ATOM 1784 O LEU A 112 7.250 6.892 -2.920 1.00 0.00 O ATOM 1785 CB LEU A 112 7.956 6.931 0.009 1.00 0.00 C ATOM 1786 CG LEU A 112 7.986 6.399 1.463 1.00 0.00 C ATOM 1787 CD1 LEU A 112 7.375 7.447 2.419 1.00 0.00 C ATOM 1788 CD2 LEU A 112 7.269 5.035 1.589 1.00 0.00 C ATOM 0 H LEU A 112 10.420 6.335 -0.273 1.00 0.00 H new ATOM 0 HA LEU A 112 7.980 5.069 -1.150 1.00 0.00 H new ATOM 0 HB2 LEU A 112 8.509 7.870 -0.016 1.00 0.00 H new ATOM 0 HB3 LEU A 112 6.921 7.164 -0.241 1.00 0.00 H new ATOM 0 HG LEU A 112 9.026 6.234 1.745 1.00 0.00 H new ATOM 0 HD11 LEU A 112 7.399 7.066 3.440 1.00 0.00 H new ATOM 0 HD12 LEU A 112 7.951 8.371 2.362 1.00 0.00 H new ATOM 0 HD13 LEU A 112 6.343 7.645 2.130 1.00 0.00 H new ATOM 0 HD21 LEU A 112 7.312 4.696 2.624 1.00 0.00 H new ATOM 0 HD22 LEU A 112 6.228 5.142 1.285 1.00 0.00 H new ATOM 0 HD23 LEU A 112 7.761 4.305 0.947 1.00 0.00 H new ATOM 1800 N GLU A 113 9.444 7.366 -2.979 1.00 0.00 N ATOM 1801 CA GLU A 113 9.302 8.366 -4.065 1.00 0.00 C ATOM 1802 C GLU A 113 9.407 7.748 -5.470 1.00 0.00 C ATOM 1803 O GLU A 113 9.261 8.488 -6.453 1.00 0.00 O ATOM 1804 CB GLU A 113 10.312 9.545 -3.903 1.00 0.00 C ATOM 1805 CG GLU A 113 11.761 9.248 -4.332 1.00 0.00 C ATOM 1806 CD GLU A 113 12.669 10.491 -4.301 1.00 0.00 C ATOM 1807 OE1 GLU A 113 12.562 11.339 -5.215 1.00 0.00 O ATOM 1808 OE2 GLU A 113 13.486 10.631 -3.367 1.00 0.00 O ATOM 0 H GLU A 113 10.406 7.177 -2.696 1.00 0.00 H new ATOM 0 HA GLU A 113 8.292 8.765 -3.969 1.00 0.00 H new ATOM 0 HB2 GLU A 113 9.948 10.393 -4.483 1.00 0.00 H new ATOM 0 HB3 GLU A 113 10.318 9.853 -2.857 1.00 0.00 H new ATOM 0 HG2 GLU A 113 12.178 8.485 -3.675 1.00 0.00 H new ATOM 0 HG3 GLU A 113 11.757 8.834 -5.340 1.00 0.00 H new ATOM 1815 N ILE A 114 9.648 6.414 -5.579 1.00 0.00 N ATOM 1816 CA ILE A 114 9.806 5.692 -6.860 1.00 0.00 C ATOM 1817 C ILE A 114 11.205 5.880 -7.487 1.00 0.00 C ATOM 1818 O ILE A 114 11.756 6.987 -7.542 1.00 0.00 O ATOM 1819 CB ILE A 114 8.623 5.916 -7.933 1.00 0.00 C ATOM 1820 CG1 ILE A 114 7.622 4.712 -7.924 1.00 0.00 C ATOM 1821 CG2 ILE A 114 9.126 6.182 -9.379 1.00 0.00 C ATOM 1822 CD1 ILE A 114 8.248 3.339 -8.189 1.00 0.00 C ATOM 0 H ILE A 114 9.738 5.806 -4.765 1.00 0.00 H new ATOM 0 HA ILE A 114 9.715 4.644 -6.573 1.00 0.00 H new ATOM 0 HB ILE A 114 8.109 6.822 -7.614 1.00 0.00 H new ATOM 0 HG12 ILE A 114 7.121 4.684 -6.956 1.00 0.00 H new ATOM 0 HG13 ILE A 114 6.854 4.894 -8.675 1.00 0.00 H new ATOM 0 HG21 ILE A 114 8.272 6.322 -10.041 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.745 7.079 -9.390 1.00 0.00 H new ATOM 0 HG23 ILE A 114 9.715 5.331 -9.722 1.00 0.00 H new ATOM 0 HD11 ILE A 114 7.472 2.574 -8.161 1.00 0.00 H new ATOM 0 HD12 ILE A 114 8.723 3.339 -9.170 1.00 0.00 H new ATOM 0 HD13 ILE A 114 8.995 3.126 -7.424 1.00 0.00 H new ATOM 1834 N ASN A 115 11.759 4.738 -7.916 1.00 0.00 N ATOM 1835 CA ASN A 115 12.948 4.633 -8.766 1.00 0.00 C ATOM 1836 C ASN A 115 12.768 3.393 -9.664 1.00 0.00 C ATOM 1837 O ASN A 115 11.872 2.567 -9.402 1.00 0.00 O ATOM 1838 CB ASN A 115 14.239 4.553 -7.908 1.00 0.00 C ATOM 1839 CG ASN A 115 14.263 3.385 -6.915 1.00 0.00 C ATOM 1840 OD1 ASN A 115 13.762 3.498 -5.795 1.00 0.00 O ATOM 1841 ND2 ASN A 115 14.876 2.273 -7.299 1.00 0.00 N ATOM 0 H ASN A 115 11.374 3.826 -7.669 1.00 0.00 H new ATOM 0 HA ASN A 115 13.057 5.521 -9.389 1.00 0.00 H new ATOM 0 HB2 ASN A 115 15.099 4.468 -8.573 1.00 0.00 H new ATOM 0 HB3 ASN A 115 14.354 5.486 -7.357 1.00 0.00 H new ATOM 0 HD21 ASN A 115 14.942 1.481 -6.660 1.00 0.00 H new ATOM 0 HD22 ASN A 115 15.281 2.210 -8.233 1.00 0.00 H new ATOM 1848 N GLU A 116 13.629 3.239 -10.693 1.00 0.00 N ATOM 1849 CA GLU A 116 13.436 2.233 -11.757 1.00 0.00 C ATOM 1850 C GLU A 116 13.464 0.793 -11.198 1.00 0.00 C ATOM 1851 O GLU A 116 12.723 -0.065 -11.681 1.00 0.00 O ATOM 1852 CB GLU A 116 14.495 2.417 -12.878 1.00 0.00 C ATOM 1853 CG GLU A 116 14.372 3.744 -13.662 1.00 0.00 C ATOM 1854 CD GLU A 116 15.418 3.875 -14.785 1.00 0.00 C ATOM 1855 OE1 GLU A 116 15.159 3.414 -15.922 1.00 0.00 O ATOM 1856 OE2 GLU A 116 16.519 4.410 -14.529 1.00 0.00 O ATOM 0 H GLU A 116 14.470 3.804 -10.808 1.00 0.00 H new ATOM 0 HA GLU A 116 12.447 2.391 -12.186 1.00 0.00 H new ATOM 0 HB2 GLU A 116 15.489 2.362 -12.434 1.00 0.00 H new ATOM 0 HB3 GLU A 116 14.412 1.586 -13.579 1.00 0.00 H new ATOM 0 HG2 GLU A 116 13.373 3.815 -14.093 1.00 0.00 H new ATOM 0 HG3 GLU A 116 14.481 4.580 -12.971 1.00 0.00 H new ATOM 1863 N ASP A 117 14.290 0.554 -10.156 1.00 0.00 N ATOM 1864 CA ASP A 117 14.394 -0.774 -9.495 1.00 0.00 C ATOM 1865 C ASP A 117 13.040 -1.222 -8.914 1.00 0.00 C ATOM 1866 O ASP A 117 12.596 -2.346 -9.177 1.00 0.00 O ATOM 1867 CB ASP A 117 15.473 -0.784 -8.377 1.00 0.00 C ATOM 1868 CG ASP A 117 16.905 -0.719 -8.925 1.00 0.00 C ATOM 1869 OD1 ASP A 117 17.431 -1.776 -9.340 1.00 0.00 O ATOM 1870 OD2 ASP A 117 17.499 0.381 -8.963 1.00 0.00 O ATOM 0 H ASP A 117 14.899 1.265 -9.750 1.00 0.00 H new ATOM 0 HA ASP A 117 14.696 -1.480 -10.268 1.00 0.00 H new ATOM 0 HB2 ASP A 117 15.306 0.063 -7.711 1.00 0.00 H new ATOM 0 HB3 ASP A 117 15.360 -1.688 -7.778 1.00 0.00 H new ATOM 1875 N LYS A 118 12.377 -0.316 -8.157 1.00 0.00 N ATOM 1876 CA LYS A 118 11.039 -0.594 -7.565 1.00 0.00 C ATOM 1877 C LYS A 118 9.975 -0.718 -8.662 1.00 0.00 C ATOM 1878 O LYS A 118 9.016 -1.435 -8.489 1.00 0.00 O ATOM 1879 CB LYS A 118 10.604 0.494 -6.523 1.00 0.00 C ATOM 1880 CG LYS A 118 11.179 0.316 -5.097 1.00 0.00 C ATOM 1881 CD LYS A 118 12.710 0.476 -5.041 1.00 0.00 C ATOM 1882 CE LYS A 118 13.276 0.282 -3.626 1.00 0.00 C ATOM 1883 NZ LYS A 118 13.116 -1.119 -3.138 1.00 0.00 N ATOM 0 H LYS A 118 12.742 0.611 -7.940 1.00 0.00 H new ATOM 0 HA LYS A 118 11.125 -1.542 -7.034 1.00 0.00 H new ATOM 0 HB2 LYS A 118 10.905 1.472 -6.898 1.00 0.00 H new ATOM 0 HB3 LYS A 118 9.516 0.497 -6.460 1.00 0.00 H new ATOM 0 HG2 LYS A 118 10.718 1.046 -4.432 1.00 0.00 H new ATOM 0 HG3 LYS A 118 10.908 -0.671 -4.723 1.00 0.00 H new ATOM 0 HD2 LYS A 118 13.171 -0.246 -5.714 1.00 0.00 H new ATOM 0 HD3 LYS A 118 12.981 1.468 -5.403 1.00 0.00 H new ATOM 0 HE2 LYS A 118 14.333 0.547 -3.621 1.00 0.00 H new ATOM 0 HE3 LYS A 118 12.773 0.963 -2.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 13.841 -1.321 -2.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 12.171 -1.235 -2.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 13.224 -1.779 -3.935 1.00 0.00 H new ATOM 1897 N GLU A 119 10.201 -0.050 -9.799 1.00 0.00 N ATOM 1898 CA GLU A 119 9.221 0.016 -10.902 1.00 0.00 C ATOM 1899 C GLU A 119 9.131 -1.334 -11.643 1.00 0.00 C ATOM 1900 O GLU A 119 8.027 -1.830 -11.924 1.00 0.00 O ATOM 1901 CB GLU A 119 9.569 1.174 -11.872 1.00 0.00 C ATOM 1902 CG GLU A 119 8.775 1.182 -13.202 1.00 0.00 C ATOM 1903 CD GLU A 119 8.961 2.462 -14.032 1.00 0.00 C ATOM 1904 OE1 GLU A 119 10.111 2.768 -14.405 1.00 0.00 O ATOM 1905 OE2 GLU A 119 7.958 3.170 -14.319 1.00 0.00 O ATOM 0 H GLU A 119 11.064 0.460 -9.985 1.00 0.00 H new ATOM 0 HA GLU A 119 8.239 0.221 -10.477 1.00 0.00 H new ATOM 0 HB2 GLU A 119 9.397 2.120 -11.359 1.00 0.00 H new ATOM 0 HB3 GLU A 119 10.633 1.126 -12.103 1.00 0.00 H new ATOM 0 HG2 GLU A 119 9.081 0.325 -13.801 1.00 0.00 H new ATOM 0 HG3 GLU A 119 7.715 1.055 -12.982 1.00 0.00 H new ATOM 1912 N ARG A 120 10.300 -1.936 -11.939 1.00 0.00 N ATOM 1913 CA ARG A 120 10.401 -3.206 -12.693 1.00 0.00 C ATOM 1914 C ARG A 120 9.968 -4.380 -11.804 1.00 0.00 C ATOM 1915 O ARG A 120 9.311 -5.327 -12.252 1.00 0.00 O ATOM 1916 CB ARG A 120 11.876 -3.378 -13.167 1.00 0.00 C ATOM 1917 CG ARG A 120 12.397 -2.192 -14.025 1.00 0.00 C ATOM 1918 CD ARG A 120 13.931 -2.012 -13.983 1.00 0.00 C ATOM 1919 NE ARG A 120 14.672 -3.065 -14.693 1.00 0.00 N ATOM 1920 CZ ARG A 120 16.006 -3.069 -14.871 1.00 0.00 C ATOM 1921 NH1 ARG A 120 16.772 -2.130 -14.322 1.00 0.00 N ATOM 1922 NH2 ARG A 120 16.566 -4.022 -15.595 1.00 0.00 N ATOM 0 H ARG A 120 11.205 -1.556 -11.662 1.00 0.00 H new ATOM 0 HA ARG A 120 9.742 -3.187 -13.561 1.00 0.00 H new ATOM 0 HB2 ARG A 120 12.518 -3.493 -12.294 1.00 0.00 H new ATOM 0 HB3 ARG A 120 11.958 -4.298 -13.746 1.00 0.00 H new ATOM 0 HG2 ARG A 120 12.087 -2.342 -15.059 1.00 0.00 H new ATOM 0 HG3 ARG A 120 11.924 -1.272 -13.680 1.00 0.00 H new ATOM 0 HD2 ARG A 120 14.186 -1.045 -14.417 1.00 0.00 H new ATOM 0 HD3 ARG A 120 14.256 -1.990 -12.943 1.00 0.00 H new ATOM 0 HE ARG A 120 14.139 -3.845 -15.077 1.00 0.00 H new ATOM 0 HH11 ARG A 120 16.350 -1.393 -13.757 1.00 0.00 H new ATOM 0 HH12 ARG A 120 17.782 -2.147 -14.466 1.00 0.00 H new ATOM 0 HH21 ARG A 120 15.988 -4.749 -16.016 1.00 0.00 H new ATOM 0 HH22 ARG A 120 17.577 -4.030 -15.733 1.00 0.00 H new ATOM 1936 N LEU A 121 10.397 -4.297 -10.549 1.00 0.00 N ATOM 1937 CA LEU A 121 9.979 -5.171 -9.455 1.00 0.00 C ATOM 1938 C LEU A 121 8.441 -5.221 -9.298 1.00 0.00 C ATOM 1939 O LEU A 121 7.855 -6.306 -9.304 1.00 0.00 O ATOM 1940 CB LEU A 121 10.650 -4.618 -8.188 1.00 0.00 C ATOM 1941 CG LEU A 121 10.373 -5.340 -6.852 1.00 0.00 C ATOM 1942 CD1 LEU A 121 10.847 -6.805 -6.888 1.00 0.00 C ATOM 1943 CD2 LEU A 121 11.034 -4.556 -5.713 1.00 0.00 C ATOM 0 H LEU A 121 11.072 -3.592 -10.253 1.00 0.00 H new ATOM 0 HA LEU A 121 10.281 -6.200 -9.652 1.00 0.00 H new ATOM 0 HB2 LEU A 121 11.728 -4.619 -8.352 1.00 0.00 H new ATOM 0 HB3 LEU A 121 10.346 -3.577 -8.075 1.00 0.00 H new ATOM 0 HG LEU A 121 9.297 -5.373 -6.681 1.00 0.00 H new ATOM 0 HD11 LEU A 121 10.635 -7.280 -5.930 1.00 0.00 H new ATOM 0 HD12 LEU A 121 10.322 -7.338 -7.681 1.00 0.00 H new ATOM 0 HD13 LEU A 121 11.920 -6.836 -7.078 1.00 0.00 H new ATOM 0 HD21 LEU A 121 10.843 -5.060 -4.766 1.00 0.00 H new ATOM 0 HD22 LEU A 121 12.109 -4.502 -5.885 1.00 0.00 H new ATOM 0 HD23 LEU A 121 10.621 -3.548 -5.678 1.00 0.00 H new ATOM 1955 N ILE A 122 7.823 -4.024 -9.169 1.00 0.00 N ATOM 1956 CA ILE A 122 6.350 -3.839 -9.077 1.00 0.00 C ATOM 1957 C ILE A 122 5.613 -4.524 -10.248 1.00 0.00 C ATOM 1958 O ILE A 122 4.503 -5.037 -10.085 1.00 0.00 O ATOM 1959 CB ILE A 122 5.992 -2.295 -8.963 1.00 0.00 C ATOM 1960 CG1 ILE A 122 6.176 -1.799 -7.485 1.00 0.00 C ATOM 1961 CG2 ILE A 122 4.583 -1.939 -9.500 1.00 0.00 C ATOM 1962 CD1 ILE A 122 6.026 -0.293 -7.289 1.00 0.00 C ATOM 0 H ILE A 122 8.338 -3.145 -9.125 1.00 0.00 H new ATOM 0 HA ILE A 122 6.001 -4.329 -8.168 1.00 0.00 H new ATOM 0 HB ILE A 122 6.693 -1.768 -9.610 1.00 0.00 H new ATOM 0 HG12 ILE A 122 5.447 -2.307 -6.853 1.00 0.00 H new ATOM 0 HG13 ILE A 122 7.164 -2.099 -7.137 1.00 0.00 H new ATOM 0 HG21 ILE A 122 4.411 -0.868 -9.389 1.00 0.00 H new ATOM 0 HG22 ILE A 122 4.516 -2.210 -10.554 1.00 0.00 H new ATOM 0 HG23 ILE A 122 3.829 -2.488 -8.936 1.00 0.00 H new ATOM 0 HD11 ILE A 122 6.170 -0.047 -6.237 1.00 0.00 H new ATOM 0 HD12 ILE A 122 6.772 0.228 -7.889 1.00 0.00 H new ATOM 0 HD13 ILE A 122 5.029 0.017 -7.601 1.00 0.00 H new ATOM 1974 N ARG A 123 6.284 -4.589 -11.399 1.00 0.00 N ATOM 1975 CA ARG A 123 5.740 -5.233 -12.598 1.00 0.00 C ATOM 1976 C ARG A 123 5.720 -6.766 -12.442 1.00 0.00 C ATOM 1977 O ARG A 123 4.850 -7.404 -12.997 1.00 0.00 O ATOM 1978 CB ARG A 123 6.533 -4.782 -13.849 1.00 0.00 C ATOM 1979 CG ARG A 123 6.342 -5.648 -15.111 1.00 0.00 C ATOM 1980 CD ARG A 123 7.002 -5.042 -16.358 1.00 0.00 C ATOM 1981 NE ARG A 123 8.342 -4.470 -16.086 1.00 0.00 N ATOM 1982 CZ ARG A 123 9.514 -4.935 -16.553 1.00 0.00 C ATOM 1983 NH1 ARG A 123 9.568 -6.042 -17.278 1.00 0.00 N ATOM 1984 NH2 ARG A 123 10.624 -4.275 -16.288 1.00 0.00 N ATOM 0 H ARG A 123 7.217 -4.198 -11.527 1.00 0.00 H new ATOM 0 HA ARG A 123 4.705 -4.919 -12.730 1.00 0.00 H new ATOM 0 HB2 ARG A 123 6.248 -3.757 -14.087 1.00 0.00 H new ATOM 0 HB3 ARG A 123 7.594 -4.767 -13.598 1.00 0.00 H new ATOM 0 HG2 ARG A 123 6.758 -6.639 -14.931 1.00 0.00 H new ATOM 0 HG3 ARG A 123 5.276 -5.779 -15.298 1.00 0.00 H new ATOM 0 HD2 ARG A 123 7.091 -5.811 -17.125 1.00 0.00 H new ATOM 0 HD3 ARG A 123 6.356 -4.262 -16.761 1.00 0.00 H new ATOM 0 HE ARG A 123 8.379 -3.645 -15.487 1.00 0.00 H new ATOM 0 HH11 ARG A 123 8.712 -6.555 -17.490 1.00 0.00 H new ATOM 0 HH12 ARG A 123 10.465 -6.381 -17.625 1.00 0.00 H new ATOM 0 HH21 ARG A 123 10.589 -3.420 -15.733 1.00 0.00 H new ATOM 0 HH22 ARG A 123 11.518 -4.620 -16.638 1.00 0.00 H new ATOM 1998 N GLU A 124 6.688 -7.376 -11.736 1.00 0.00 N ATOM 1999 CA GLU A 124 6.625 -8.827 -11.432 1.00 0.00 C ATOM 2000 C GLU A 124 5.458 -9.241 -10.493 1.00 0.00 C ATOM 2001 O GLU A 124 4.687 -10.134 -10.849 1.00 0.00 O ATOM 2002 CB GLU A 124 7.969 -9.278 -10.818 1.00 0.00 C ATOM 2003 CG GLU A 124 9.204 -8.967 -11.681 1.00 0.00 C ATOM 2004 CD GLU A 124 10.511 -9.416 -11.015 1.00 0.00 C ATOM 2005 OE1 GLU A 124 10.999 -8.705 -10.109 1.00 0.00 O ATOM 2006 OE2 GLU A 124 11.038 -10.499 -11.367 1.00 0.00 O ATOM 0 H GLU A 124 7.513 -6.902 -11.368 1.00 0.00 H new ATOM 0 HA GLU A 124 6.433 -9.327 -12.381 1.00 0.00 H new ATOM 0 HB2 GLU A 124 8.090 -8.797 -9.848 1.00 0.00 H new ATOM 0 HB3 GLU A 124 7.929 -10.352 -10.638 1.00 0.00 H new ATOM 0 HG2 GLU A 124 9.103 -9.462 -12.647 1.00 0.00 H new ATOM 0 HG3 GLU A 124 9.248 -7.895 -11.875 1.00 0.00 H new ATOM 2013 N ILE A 125 5.350 -8.645 -9.279 1.00 0.00 N ATOM 2014 CA ILE A 125 4.293 -9.074 -8.311 1.00 0.00 C ATOM 2015 C ILE A 125 2.883 -8.591 -8.697 1.00 0.00 C ATOM 2016 O ILE A 125 1.902 -9.306 -8.456 1.00 0.00 O ATOM 2017 CB ILE A 125 4.581 -8.713 -6.798 1.00 0.00 C ATOM 2018 CG1 ILE A 125 4.656 -7.169 -6.515 1.00 0.00 C ATOM 2019 CG2 ILE A 125 5.846 -9.441 -6.287 1.00 0.00 C ATOM 2020 CD1 ILE A 125 5.997 -6.517 -6.775 1.00 0.00 C ATOM 0 H ILE A 125 5.955 -7.893 -8.949 1.00 0.00 H new ATOM 0 HA ILE A 125 4.329 -10.161 -8.388 1.00 0.00 H new ATOM 0 HB ILE A 125 3.719 -9.071 -6.236 1.00 0.00 H new ATOM 0 HG12 ILE A 125 3.905 -6.669 -7.127 1.00 0.00 H new ATOM 0 HG13 ILE A 125 4.385 -6.996 -5.474 1.00 0.00 H new ATOM 0 HG21 ILE A 125 6.022 -9.176 -5.244 1.00 0.00 H new ATOM 0 HG22 ILE A 125 5.704 -10.519 -6.368 1.00 0.00 H new ATOM 0 HG23 ILE A 125 6.705 -9.142 -6.887 1.00 0.00 H new ATOM 0 HD11 ILE A 125 5.935 -5.453 -6.547 1.00 0.00 H new ATOM 0 HD12 ILE A 125 6.755 -6.980 -6.143 1.00 0.00 H new ATOM 0 HD13 ILE A 125 6.268 -6.648 -7.822 1.00 0.00 H new ATOM 2032 N PHE A 126 2.771 -7.377 -9.262 1.00 0.00 N ATOM 2033 CA PHE A 126 1.454 -6.826 -9.662 1.00 0.00 C ATOM 2034 C PHE A 126 1.099 -7.196 -11.115 1.00 0.00 C ATOM 2035 O PHE A 126 -0.080 -7.408 -11.417 1.00 0.00 O ATOM 2036 CB PHE A 126 1.419 -5.286 -9.455 1.00 0.00 C ATOM 2037 CG PHE A 126 1.508 -4.818 -7.995 1.00 0.00 C ATOM 2038 CD1 PHE A 126 1.212 -5.674 -6.930 1.00 0.00 C ATOM 2039 CD2 PHE A 126 1.884 -3.512 -7.689 1.00 0.00 C ATOM 2040 CE1 PHE A 126 1.281 -5.234 -5.625 1.00 0.00 C ATOM 2041 CE2 PHE A 126 1.948 -3.073 -6.377 1.00 0.00 C ATOM 2042 CZ PHE A 126 1.652 -3.936 -5.348 1.00 0.00 C ATOM 0 H PHE A 126 3.562 -6.761 -9.452 1.00 0.00 H new ATOM 0 HA PHE A 126 0.698 -7.277 -9.019 1.00 0.00 H new ATOM 0 HB2 PHE A 126 2.244 -4.842 -10.012 1.00 0.00 H new ATOM 0 HB3 PHE A 126 0.497 -4.899 -9.888 1.00 0.00 H new ATOM 0 HD1 PHE A 126 0.925 -6.695 -7.132 1.00 0.00 H new ATOM 0 HD2 PHE A 126 2.130 -2.830 -8.489 1.00 0.00 H new ATOM 0 HE1 PHE A 126 1.043 -5.909 -4.817 1.00 0.00 H new ATOM 0 HE2 PHE A 126 2.230 -2.053 -6.162 1.00 0.00 H new ATOM 0 HZ PHE A 126 1.710 -3.597 -4.324 1.00 0.00 H new ATOM 2052 N LYS A 127 2.125 -7.288 -11.991 1.00 0.00 N ATOM 2053 CA LYS A 127 1.971 -7.691 -13.414 1.00 0.00 C ATOM 2054 C LYS A 127 1.127 -6.692 -14.196 1.00 0.00 C ATOM 2055 O LYS A 127 -0.022 -6.971 -14.535 1.00 0.00 O ATOM 2056 CB LYS A 127 1.451 -9.151 -13.551 1.00 0.00 C ATOM 2057 CG LYS A 127 2.450 -10.219 -13.067 1.00 0.00 C ATOM 2058 CD LYS A 127 3.683 -10.411 -13.996 1.00 0.00 C ATOM 2059 CE LYS A 127 3.349 -11.020 -15.379 1.00 0.00 C ATOM 2060 NZ LYS A 127 2.757 -10.038 -16.320 1.00 0.00 N ATOM 0 H LYS A 127 3.090 -7.084 -11.732 1.00 0.00 H new ATOM 0 HA LYS A 127 2.964 -7.676 -13.864 1.00 0.00 H new ATOM 0 HB2 LYS A 127 0.525 -9.251 -12.985 1.00 0.00 H new ATOM 0 HB3 LYS A 127 1.208 -9.343 -14.596 1.00 0.00 H new ATOM 0 HG2 LYS A 127 2.799 -9.948 -12.071 1.00 0.00 H new ATOM 0 HG3 LYS A 127 1.928 -11.172 -12.974 1.00 0.00 H new ATOM 0 HD2 LYS A 127 4.166 -9.445 -14.144 1.00 0.00 H new ATOM 0 HD3 LYS A 127 4.405 -11.054 -13.493 1.00 0.00 H new ATOM 0 HE2 LYS A 127 4.258 -11.431 -15.817 1.00 0.00 H new ATOM 0 HE3 LYS A 127 2.655 -11.850 -15.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 1.731 -10.193 -16.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 2.941 -9.074 -15.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 3.184 -10.158 -17.261 1.00 0.00 H new ATOM 2074 N ILE A 128 1.709 -5.511 -14.468 1.00 0.00 N ATOM 2075 CA ILE A 128 0.995 -4.392 -15.101 1.00 0.00 C ATOM 2076 C ILE A 128 1.347 -4.342 -16.591 1.00 0.00 C ATOM 2077 O ILE A 128 2.533 -4.398 -16.940 1.00 0.00 O ATOM 2078 CB ILE A 128 1.375 -3.006 -14.447 1.00 0.00 C ATOM 2079 CG1 ILE A 128 1.471 -3.113 -12.887 1.00 0.00 C ATOM 2080 CG2 ILE A 128 0.347 -1.922 -14.858 1.00 0.00 C ATOM 2081 CD1 ILE A 128 1.922 -1.841 -12.181 1.00 0.00 C ATOM 0 H ILE A 128 2.685 -5.307 -14.255 1.00 0.00 H new ATOM 0 HA ILE A 128 -0.073 -4.559 -14.958 1.00 0.00 H new ATOM 0 HB ILE A 128 2.359 -2.718 -14.816 1.00 0.00 H new ATOM 0 HG12 ILE A 128 0.495 -3.400 -12.497 1.00 0.00 H new ATOM 0 HG13 ILE A 128 2.164 -3.916 -12.635 1.00 0.00 H new ATOM 0 HG21 ILE A 128 0.619 -0.971 -14.401 1.00 0.00 H new ATOM 0 HG22 ILE A 128 0.344 -1.816 -15.943 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -0.647 -2.216 -14.520 1.00 0.00 H new ATOM 0 HD11 ILE A 128 1.957 -2.015 -11.106 1.00 0.00 H new ATOM 0 HD12 ILE A 128 2.914 -1.560 -12.536 1.00 0.00 H new ATOM 0 HD13 ILE A 128 1.218 -1.037 -12.396 1.00 0.00 H new ATOM 2151 N ASN A 133 3.466 5.957 -16.525 1.00 0.00 N ATOM 2152 CA ASN A 133 4.188 5.997 -15.235 1.00 0.00 C ATOM 2153 C ASN A 133 3.669 4.889 -14.314 1.00 0.00 C ATOM 2154 O ASN A 133 2.465 4.713 -14.213 1.00 0.00 O ATOM 2155 CB ASN A 133 3.968 7.376 -14.562 1.00 0.00 C ATOM 2156 CG ASN A 133 4.549 7.483 -13.145 1.00 0.00 C ATOM 2157 OD1 ASN A 133 5.604 6.919 -12.843 1.00 0.00 O ATOM 2158 ND2 ASN A 133 3.836 8.164 -12.260 1.00 0.00 N ATOM 0 HA ASN A 133 5.252 5.844 -15.414 1.00 0.00 H new ATOM 0 HB2 ASN A 133 4.417 8.148 -15.186 1.00 0.00 H new ATOM 0 HB3 ASN A 133 2.898 7.581 -14.521 1.00 0.00 H new ATOM 0 HD21 ASN A 133 4.155 8.234 -11.294 1.00 0.00 H new ATOM 0 HD22 ASN A 133 2.968 8.618 -12.545 1.00 0.00 H new ATOM 2165 N VAL A 134 4.587 4.197 -13.606 1.00 0.00 N ATOM 2166 CA VAL A 134 4.271 3.043 -12.724 1.00 0.00 C ATOM 2167 C VAL A 134 3.201 3.355 -11.655 1.00 0.00 C ATOM 2168 O VAL A 134 2.384 2.491 -11.339 1.00 0.00 O ATOM 2169 CB VAL A 134 5.578 2.515 -12.027 1.00 0.00 C ATOM 2170 CG1 VAL A 134 6.266 3.628 -11.205 1.00 0.00 C ATOM 2171 CG2 VAL A 134 5.321 1.245 -11.168 1.00 0.00 C ATOM 0 H VAL A 134 5.581 4.423 -13.628 1.00 0.00 H new ATOM 0 HA VAL A 134 3.851 2.274 -13.373 1.00 0.00 H new ATOM 0 HB VAL A 134 6.262 2.218 -12.822 1.00 0.00 H new ATOM 0 HG11 VAL A 134 7.166 3.230 -10.736 1.00 0.00 H new ATOM 0 HG12 VAL A 134 6.535 4.454 -11.864 1.00 0.00 H new ATOM 0 HG13 VAL A 134 5.583 3.986 -10.434 1.00 0.00 H new ATOM 0 HG21 VAL A 134 6.255 0.921 -10.709 1.00 0.00 H new ATOM 0 HG22 VAL A 134 4.594 1.474 -10.389 1.00 0.00 H new ATOM 0 HG23 VAL A 134 4.934 0.448 -11.803 1.00 0.00 H new ATOM 2181 N VAL A 135 3.187 4.600 -11.144 1.00 0.00 N ATOM 2182 CA VAL A 135 2.261 5.012 -10.073 1.00 0.00 C ATOM 2183 C VAL A 135 0.836 5.109 -10.629 1.00 0.00 C ATOM 2184 O VAL A 135 -0.124 4.609 -10.030 1.00 0.00 O ATOM 2185 CB VAL A 135 2.683 6.390 -9.455 1.00 0.00 C ATOM 2186 CG1 VAL A 135 1.684 6.858 -8.368 1.00 0.00 C ATOM 2187 CG2 VAL A 135 4.123 6.316 -8.900 1.00 0.00 C ATOM 0 H VAL A 135 3.811 5.343 -11.458 1.00 0.00 H new ATOM 0 HA VAL A 135 2.298 4.260 -9.285 1.00 0.00 H new ATOM 0 HB VAL A 135 2.662 7.135 -10.251 1.00 0.00 H new ATOM 0 HG11 VAL A 135 2.010 7.816 -7.963 1.00 0.00 H new ATOM 0 HG12 VAL A 135 0.693 6.968 -8.808 1.00 0.00 H new ATOM 0 HG13 VAL A 135 1.646 6.120 -7.567 1.00 0.00 H new ATOM 0 HG21 VAL A 135 4.399 7.281 -8.475 1.00 0.00 H new ATOM 0 HG22 VAL A 135 4.176 5.550 -8.126 1.00 0.00 H new ATOM 0 HG23 VAL A 135 4.811 6.064 -9.707 1.00 0.00 H new ATOM 2197 N GLU A 136 0.731 5.745 -11.798 1.00 0.00 N ATOM 2198 CA GLU A 136 -0.537 5.896 -12.510 1.00 0.00 C ATOM 2199 C GLU A 136 -1.018 4.532 -13.032 1.00 0.00 C ATOM 2200 O GLU A 136 -2.211 4.260 -13.024 1.00 0.00 O ATOM 2201 CB GLU A 136 -0.381 6.914 -13.666 1.00 0.00 C ATOM 2202 CG GLU A 136 0.088 8.310 -13.207 1.00 0.00 C ATOM 2203 CD GLU A 136 0.197 9.320 -14.361 1.00 0.00 C ATOM 2204 OE1 GLU A 136 -0.820 9.962 -14.705 1.00 0.00 O ATOM 2205 OE2 GLU A 136 1.291 9.462 -14.947 1.00 0.00 O ATOM 0 H GLU A 136 1.525 6.170 -12.277 1.00 0.00 H new ATOM 0 HA GLU A 136 -1.290 6.279 -11.821 1.00 0.00 H new ATOM 0 HB2 GLU A 136 0.333 6.521 -14.390 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -1.336 7.013 -14.182 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -0.608 8.693 -12.461 1.00 0.00 H new ATOM 0 HG3 GLU A 136 1.059 8.218 -12.720 1.00 0.00 H new ATOM 2212 N ARG A 137 -0.055 3.672 -13.423 1.00 0.00 N ATOM 2213 CA ARG A 137 -0.327 2.341 -14.012 1.00 0.00 C ATOM 2214 C ARG A 137 -0.850 1.341 -12.965 1.00 0.00 C ATOM 2215 O ARG A 137 -1.741 0.531 -13.264 1.00 0.00 O ATOM 2216 CB ARG A 137 0.943 1.765 -14.702 1.00 0.00 C ATOM 2217 CG ARG A 137 1.317 2.431 -16.044 1.00 0.00 C ATOM 2218 CD ARG A 137 2.505 1.734 -16.740 1.00 0.00 C ATOM 2219 NE ARG A 137 3.787 1.869 -15.998 1.00 0.00 N ATOM 2220 CZ ARG A 137 4.670 0.874 -15.781 1.00 0.00 C ATOM 2221 NH1 ARG A 137 4.354 -0.383 -16.062 1.00 0.00 N ATOM 2222 NH2 ARG A 137 5.861 1.143 -15.255 1.00 0.00 N ATOM 0 H ARG A 137 0.940 3.881 -13.339 1.00 0.00 H new ATOM 0 HA ARG A 137 -1.106 2.484 -14.761 1.00 0.00 H new ATOM 0 HB2 ARG A 137 1.786 1.863 -14.018 1.00 0.00 H new ATOM 0 HB3 ARG A 137 0.793 0.699 -14.872 1.00 0.00 H new ATOM 0 HG2 ARG A 137 0.452 2.415 -16.707 1.00 0.00 H new ATOM 0 HG3 ARG A 137 1.566 3.478 -15.869 1.00 0.00 H new ATOM 0 HD2 ARG A 137 2.275 0.676 -16.863 1.00 0.00 H new ATOM 0 HD3 ARG A 137 2.627 2.152 -17.739 1.00 0.00 H new ATOM 0 HE ARG A 137 4.017 2.789 -15.623 1.00 0.00 H new ATOM 0 HH11 ARG A 137 3.435 -0.604 -16.446 1.00 0.00 H new ATOM 0 HH12 ARG A 137 5.030 -1.128 -15.894 1.00 0.00 H new ATOM 0 HH21 ARG A 137 6.107 2.103 -15.015 1.00 0.00 H new ATOM 0 HH22 ARG A 137 6.528 0.389 -15.091 1.00 0.00 H new ATOM 2236 N VAL A 138 -0.290 1.391 -11.738 1.00 0.00 N ATOM 2237 CA VAL A 138 -0.741 0.514 -10.645 1.00 0.00 C ATOM 2238 C VAL A 138 -2.122 0.986 -10.165 1.00 0.00 C ATOM 2239 O VAL A 138 -2.960 0.170 -9.799 1.00 0.00 O ATOM 2240 CB VAL A 138 0.289 0.419 -9.446 1.00 0.00 C ATOM 2241 CG1 VAL A 138 0.514 1.776 -8.744 1.00 0.00 C ATOM 2242 CG2 VAL A 138 -0.147 -0.671 -8.434 1.00 0.00 C ATOM 0 H VAL A 138 0.468 2.024 -11.484 1.00 0.00 H new ATOM 0 HA VAL A 138 -0.811 -0.500 -11.039 1.00 0.00 H new ATOM 0 HB VAL A 138 1.249 0.131 -9.874 1.00 0.00 H new ATOM 0 HG11 VAL A 138 1.229 1.651 -7.931 1.00 0.00 H new ATOM 0 HG12 VAL A 138 0.904 2.497 -9.462 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -0.432 2.139 -8.343 1.00 0.00 H new ATOM 0 HG21 VAL A 138 0.574 -0.720 -7.618 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -1.131 -0.424 -8.034 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -0.192 -1.637 -8.937 1.00 0.00 H new ATOM 2252 N LEU A 139 -2.346 2.319 -10.210 1.00 0.00 N ATOM 2253 CA LEU A 139 -3.658 2.928 -9.922 1.00 0.00 C ATOM 2254 C LEU A 139 -4.717 2.471 -10.939 1.00 0.00 C ATOM 2255 O LEU A 139 -5.851 2.218 -10.550 1.00 0.00 O ATOM 2256 CB LEU A 139 -3.552 4.489 -9.841 1.00 0.00 C ATOM 2257 CG LEU A 139 -3.457 5.098 -8.398 1.00 0.00 C ATOM 2258 CD1 LEU A 139 -2.395 4.386 -7.540 1.00 0.00 C ATOM 2259 CD2 LEU A 139 -3.190 6.621 -8.446 1.00 0.00 C ATOM 0 H LEU A 139 -1.623 2.998 -10.447 1.00 0.00 H new ATOM 0 HA LEU A 139 -3.985 2.580 -8.942 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -2.674 4.803 -10.405 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -4.421 4.919 -10.339 1.00 0.00 H new ATOM 0 HG LEU A 139 -4.425 4.936 -7.923 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -2.363 4.840 -6.550 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -2.650 3.330 -7.447 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -1.419 4.483 -8.015 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -3.130 7.012 -7.430 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -2.249 6.809 -8.964 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -4.002 7.116 -8.978 1.00 0.00 H new ATOM 2271 N GLU A 140 -4.341 2.360 -12.234 1.00 0.00 N ATOM 2272 CA GLU A 140 -5.235 1.804 -13.272 1.00 0.00 C ATOM 2273 C GLU A 140 -5.641 0.360 -12.934 1.00 0.00 C ATOM 2274 O GLU A 140 -6.825 0.021 -12.986 1.00 0.00 O ATOM 2275 CB GLU A 140 -4.590 1.848 -14.689 1.00 0.00 C ATOM 2276 CG GLU A 140 -4.228 3.255 -15.209 1.00 0.00 C ATOM 2277 CD GLU A 140 -5.364 4.287 -15.053 1.00 0.00 C ATOM 2278 OE1 GLU A 140 -6.383 4.179 -15.769 1.00 0.00 O ATOM 2279 OE2 GLU A 140 -5.245 5.209 -14.213 1.00 0.00 O ATOM 0 H GLU A 140 -3.427 2.648 -12.583 1.00 0.00 H new ATOM 0 HA GLU A 140 -6.124 2.434 -13.286 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -3.685 1.240 -14.677 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -5.277 1.383 -15.397 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -3.348 3.614 -14.676 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -3.956 3.184 -16.262 1.00 0.00 H new ATOM 2286 N LYS A 141 -4.645 -0.468 -12.563 1.00 0.00 N ATOM 2287 CA LYS A 141 -4.858 -1.888 -12.241 1.00 0.00 C ATOM 2288 C LYS A 141 -5.753 -2.069 -11.009 1.00 0.00 C ATOM 2289 O LYS A 141 -6.703 -2.857 -11.037 1.00 0.00 O ATOM 2290 CB LYS A 141 -3.510 -2.614 -11.999 1.00 0.00 C ATOM 2291 CG LYS A 141 -3.660 -4.054 -11.422 1.00 0.00 C ATOM 2292 CD LYS A 141 -2.325 -4.807 -11.331 1.00 0.00 C ATOM 2293 CE LYS A 141 -1.712 -5.036 -12.712 1.00 0.00 C ATOM 2294 NZ LYS A 141 -2.577 -5.862 -13.602 1.00 0.00 N ATOM 0 H LYS A 141 -3.673 -0.170 -12.479 1.00 0.00 H new ATOM 0 HA LYS A 141 -5.359 -2.329 -13.103 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -2.963 -2.666 -12.940 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -2.907 -2.020 -11.313 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -4.107 -3.997 -10.429 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -4.348 -4.621 -12.049 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -1.629 -4.240 -10.713 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -2.481 -5.767 -10.838 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -1.527 -4.072 -13.186 1.00 0.00 H new ATOM 0 HE3 LYS A 141 -0.745 -5.526 -12.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -1.983 -6.500 -14.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -3.234 -6.424 -13.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -3.119 -5.239 -14.235 1.00 0.00 H new ATOM 2308 N ILE A 142 -5.445 -1.341 -9.929 1.00 0.00 N ATOM 2309 CA ILE A 142 -6.130 -1.536 -8.647 1.00 0.00 C ATOM 2310 C ILE A 142 -7.523 -0.891 -8.694 1.00 0.00 C ATOM 2311 O ILE A 142 -8.438 -1.361 -8.027 1.00 0.00 O ATOM 2312 CB ILE A 142 -5.285 -1.046 -7.408 1.00 0.00 C ATOM 2313 CG1 ILE A 142 -5.102 0.501 -7.391 1.00 0.00 C ATOM 2314 CG2 ILE A 142 -3.907 -1.767 -7.367 1.00 0.00 C ATOM 2315 CD1 ILE A 142 -4.200 1.017 -6.278 1.00 0.00 C ATOM 0 H ILE A 142 -4.729 -0.615 -9.918 1.00 0.00 H new ATOM 0 HA ILE A 142 -6.249 -2.609 -8.499 1.00 0.00 H new ATOM 0 HB ILE A 142 -5.846 -1.309 -6.511 1.00 0.00 H new ATOM 0 HG12 ILE A 142 -4.691 0.816 -8.350 1.00 0.00 H new ATOM 0 HG13 ILE A 142 -6.082 0.969 -7.294 1.00 0.00 H new ATOM 0 HG21 ILE A 142 -3.338 -1.416 -6.506 1.00 0.00 H new ATOM 0 HG22 ILE A 142 -4.062 -2.843 -7.286 1.00 0.00 H new ATOM 0 HG23 ILE A 142 -3.354 -1.548 -8.281 1.00 0.00 H new ATOM 0 HD11 ILE A 142 -4.129 2.103 -6.341 1.00 0.00 H new ATOM 0 HD12 ILE A 142 -4.618 0.737 -5.311 1.00 0.00 H new ATOM 0 HD13 ILE A 142 -3.206 0.581 -6.384 1.00 0.00 H new ATOM 2327 N ALA A 143 -7.709 0.131 -9.561 1.00 0.00 N ATOM 2328 CA ALA A 143 -9.031 0.728 -9.797 1.00 0.00 C ATOM 2329 C ALA A 143 -9.851 -0.142 -10.764 1.00 0.00 C ATOM 2330 O ALA A 143 -11.061 -0.038 -10.794 1.00 0.00 O ATOM 2331 CB ALA A 143 -8.908 2.163 -10.327 1.00 0.00 C ATOM 0 H ALA A 143 -6.957 0.554 -10.105 1.00 0.00 H new ATOM 0 HA ALA A 143 -9.555 0.771 -8.842 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -9.903 2.577 -10.491 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.376 2.775 -9.599 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -8.357 2.157 -11.268 1.00 0.00 H new