USER MOD reduce.3.24.130724 H: found=0, std=0, add=958, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 964 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 50 THR OG1 : rot 13:sc= 0.76 USER MOD Single : A 53 HIS : no HD1:sc= -0.0197 X(o=-0.02,f=-0.069) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot -16:sc= 0.132 USER MOD Single : A 66 GLN : amide:sc= -0.341 K(o=-0.34,f=-3!) USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 MET CE :methyl -160:sc= -0.0375 (180deg=-0.402) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot -30:sc= 0.141 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 101 ASN : amide:sc= -0.206 K(o=-0.21,f=-1.3!) USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 THR OG1 : rot -24:sc= 0.491 USER MOD Single : B 53 HIS : no HD1:sc= -0.0231 X(o=-0.023,f=-0.065) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD Single : B 59 SER OG : rot -18:sc= 0.184 USER MOD Single : B 66 GLN : amide:sc= -0.368 K(o=-0.37,f=-3.1!) USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 MET CE :methyl -161:sc= -0.0389 (180deg=-0.388) USER MOD Single : B 85 SER OG : rot 180:sc= 0 USER MOD Single : B 94 THR OG1 : rot -27:sc= 0.137 USER MOD Single : B 99 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : B 101 ASN : amide:sc= -0.174 K(o=-0.17,f=-1.5!) USER MOD Single : B 103 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 50 2.229 -35.750 7.013 1.00 0.00 N ATOM 2 CA THR A 50 2.741 -36.554 5.873 1.00 0.00 C ATOM 3 C THR A 50 1.868 -37.781 5.630 1.00 0.00 C ATOM 4 O THR A 50 2.271 -38.911 5.909 1.00 0.00 O ATOM 5 CB THR A 50 4.178 -36.978 6.181 1.00 0.00 C ATOM 6 OG1 THR A 50 4.799 -36.051 7.054 1.00 0.00 O ATOM 7 CG2 THR A 50 5.044 -37.096 4.945 1.00 0.00 C ATOM 0 HA THR A 50 2.716 -35.949 4.967 1.00 0.00 H new ATOM 0 HB THR A 50 4.096 -37.961 6.644 1.00 0.00 H new ATOM 0 HG1 THR A 50 4.120 -35.460 7.440 1.00 0.00 H new ATOM 0 HG21 THR A 50 6.050 -37.400 5.233 1.00 0.00 H new ATOM 0 HG22 THR A 50 4.619 -37.841 4.273 1.00 0.00 H new ATOM 0 HG23 THR A 50 5.087 -36.132 4.438 1.00 0.00 H new ATOM 17 N ARG A 51 0.667 -37.550 5.108 1.00 0.00 N ATOM 18 CA ARG A 51 -0.267 -38.634 4.829 1.00 0.00 C ATOM 19 C ARG A 51 -0.506 -38.782 3.329 1.00 0.00 C ATOM 20 O ARG A 51 -0.756 -39.884 2.839 1.00 0.00 O ATOM 21 CB ARG A 51 -1.597 -38.383 5.542 1.00 0.00 C ATOM 22 CG ARG A 51 -2.340 -39.658 5.908 1.00 0.00 C ATOM 23 CD ARG A 51 -2.386 -39.867 7.413 1.00 0.00 C ATOM 24 NE ARG A 51 -3.168 -38.832 8.086 1.00 0.00 N ATOM 25 CZ ARG A 51 -3.596 -38.925 9.343 1.00 0.00 C ATOM 26 NH1 ARG A 51 -3.322 -40.004 10.065 1.00 0.00 N ATOM 27 NH2 ARG A 51 -4.301 -37.939 9.878 1.00 0.00 N ATOM 0 H ARG A 51 0.318 -36.621 4.870 1.00 0.00 H new ATOM 0 HA ARG A 51 0.173 -39.559 5.201 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -1.411 -37.808 6.449 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -2.234 -37.772 4.902 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -3.356 -39.613 5.515 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -1.853 -40.512 5.436 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -2.816 -40.845 7.630 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -1.371 -39.870 7.810 1.00 0.00 H new ATOM 0 HE ARG A 51 -3.400 -37.988 7.561 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -2.781 -40.767 9.657 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -3.652 -40.071 11.028 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -4.516 -37.108 9.327 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -4.629 -38.011 10.841 1.00 0.00 H new ATOM 41 N ALA A 52 -0.429 -37.670 2.605 1.00 0.00 N ATOM 42 CA ALA A 52 -0.641 -37.684 1.163 1.00 0.00 C ATOM 43 C ALA A 52 0.244 -36.659 0.461 1.00 0.00 C ATOM 44 O ALA A 52 -0.117 -36.138 -0.595 1.00 0.00 O ATOM 45 CB ALA A 52 -2.106 -37.423 0.847 1.00 0.00 C ATOM 0 H ALA A 52 -0.222 -36.750 2.993 1.00 0.00 H new ATOM 0 HA ALA A 52 -0.366 -38.671 0.791 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -2.253 -37.436 -0.233 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -2.721 -38.197 1.306 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -2.395 -36.449 1.241 1.00 0.00 H new ATOM 51 N HIS A 53 1.401 -36.375 1.049 1.00 0.00 N ATOM 52 CA HIS A 53 2.334 -35.409 0.475 1.00 0.00 C ATOM 53 C HIS A 53 1.685 -34.034 0.350 1.00 0.00 C ATOM 54 O HIS A 53 0.765 -33.840 -0.443 1.00 0.00 O ATOM 55 CB HIS A 53 2.813 -35.890 -0.895 1.00 0.00 C ATOM 56 CG HIS A 53 3.540 -37.199 -0.848 1.00 0.00 C ATOM 57 ND1 HIS A 53 4.431 -37.530 0.151 1.00 0.00 N ATOM 58 CD2 HIS A 53 3.500 -38.266 -1.682 1.00 0.00 C ATOM 59 CE1 HIS A 53 4.910 -38.741 -0.070 1.00 0.00 C ATOM 60 NE2 HIS A 53 4.360 -39.210 -1.175 1.00 0.00 N ATOM 0 H HIS A 53 1.716 -36.799 1.922 1.00 0.00 H new ATOM 0 HA HIS A 53 3.191 -35.324 1.143 1.00 0.00 H new ATOM 0 HB2 HIS A 53 1.954 -35.984 -1.559 1.00 0.00 H new ATOM 0 HB3 HIS A 53 3.469 -35.134 -1.328 1.00 0.00 H new ATOM 0 HD2 HIS A 53 2.904 -38.357 -2.578 1.00 0.00 H new ATOM 0 HE1 HIS A 53 5.629 -39.259 0.548 1.00 0.00 H new ATOM 0 HE2 HIS A 53 4.544 -40.125 -1.586 1.00 0.00 H new ATOM 69 N LEU A 54 2.163 -33.085 1.150 1.00 0.00 N ATOM 70 CA LEU A 54 1.621 -31.729 1.136 1.00 0.00 C ATOM 71 C LEU A 54 2.682 -30.697 0.752 1.00 0.00 C ATOM 72 O LEU A 54 2.353 -29.567 0.402 1.00 0.00 O ATOM 73 CB LEU A 54 1.044 -31.383 2.510 1.00 0.00 C ATOM 74 CG LEU A 54 -0.275 -32.080 2.856 1.00 0.00 C ATOM 75 CD1 LEU A 54 -0.202 -32.710 4.238 1.00 0.00 C ATOM 76 CD2 LEU A 54 -1.433 -31.097 2.778 1.00 0.00 C ATOM 0 H LEU A 54 2.923 -33.229 1.815 1.00 0.00 H new ATOM 0 HA LEU A 54 0.833 -31.698 0.384 1.00 0.00 H new ATOM 0 HB2 LEU A 54 1.782 -31.637 3.271 1.00 0.00 H new ATOM 0 HB3 LEU A 54 0.892 -30.305 2.562 1.00 0.00 H new ATOM 0 HG LEU A 54 -0.446 -32.873 2.127 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -1.149 -33.200 4.465 1.00 0.00 H new ATOM 0 HD12 LEU A 54 0.602 -33.446 4.260 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.007 -31.936 4.981 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.362 -31.609 3.027 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.267 -30.283 3.483 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.500 -30.694 1.768 1.00 0.00 H new ATOM 88 N THR A 55 3.950 -31.081 0.836 1.00 0.00 N ATOM 89 CA THR A 55 5.050 -30.177 0.517 1.00 0.00 C ATOM 90 C THR A 55 4.905 -29.551 -0.874 1.00 0.00 C ATOM 91 O THR A 55 4.410 -28.432 -1.012 1.00 0.00 O ATOM 92 CB THR A 55 6.381 -30.918 0.626 1.00 0.00 C ATOM 93 OG1 THR A 55 6.569 -31.423 1.935 1.00 0.00 O ATOM 94 CG2 THR A 55 7.581 -30.057 0.290 1.00 0.00 C ATOM 0 H THR A 55 4.243 -32.015 1.123 1.00 0.00 H new ATOM 0 HA THR A 55 5.023 -29.362 1.240 1.00 0.00 H new ATOM 0 HB THR A 55 6.319 -31.724 -0.105 1.00 0.00 H new ATOM 0 HG1 THR A 55 7.426 -31.896 1.983 1.00 0.00 H new ATOM 0 HG21 THR A 55 8.492 -30.648 0.388 1.00 0.00 H new ATOM 0 HG22 THR A 55 7.493 -29.694 -0.734 1.00 0.00 H new ATOM 0 HG23 THR A 55 7.623 -29.209 0.973 1.00 0.00 H new ATOM 102 N GLU A 56 5.362 -30.274 -1.899 1.00 0.00 N ATOM 103 CA GLU A 56 5.317 -29.800 -3.287 1.00 0.00 C ATOM 104 C GLU A 56 4.137 -28.864 -3.562 1.00 0.00 C ATOM 105 O GLU A 56 4.329 -27.713 -3.944 1.00 0.00 O ATOM 106 CB GLU A 56 5.269 -30.989 -4.251 1.00 0.00 C ATOM 107 CG GLU A 56 4.345 -32.104 -3.797 1.00 0.00 C ATOM 108 CD GLU A 56 4.747 -33.457 -4.351 1.00 0.00 C ATOM 109 OE1 GLU A 56 5.614 -34.115 -3.736 1.00 0.00 O ATOM 110 OE2 GLU A 56 4.197 -33.858 -5.398 1.00 0.00 O ATOM 0 H GLU A 56 5.773 -31.202 -1.792 1.00 0.00 H new ATOM 0 HA GLU A 56 6.228 -29.224 -3.449 1.00 0.00 H new ATOM 0 HB2 GLU A 56 4.947 -30.638 -5.231 1.00 0.00 H new ATOM 0 HB3 GLU A 56 6.276 -31.389 -4.371 1.00 0.00 H new ATOM 0 HG2 GLU A 56 4.342 -32.148 -2.708 1.00 0.00 H new ATOM 0 HG3 GLU A 56 3.326 -31.876 -4.109 1.00 0.00 H new ATOM 117 N VAL A 57 2.925 -29.364 -3.381 1.00 0.00 N ATOM 118 CA VAL A 57 1.725 -28.564 -3.634 1.00 0.00 C ATOM 119 C VAL A 57 1.718 -27.273 -2.813 1.00 0.00 C ATOM 120 O VAL A 57 1.323 -26.198 -3.311 1.00 0.00 O ATOM 121 CB VAL A 57 0.441 -29.356 -3.336 1.00 0.00 C ATOM 122 CG1 VAL A 57 -0.753 -28.685 -3.994 1.00 0.00 C ATOM 123 CG2 VAL A 57 0.574 -30.800 -3.799 1.00 0.00 C ATOM 0 H VAL A 57 2.741 -30.315 -3.061 1.00 0.00 H new ATOM 0 HA VAL A 57 1.748 -28.309 -4.693 1.00 0.00 H new ATOM 0 HB VAL A 57 0.283 -29.365 -2.258 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -1.656 -29.255 -3.776 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -0.860 -27.672 -3.606 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -0.600 -28.646 -5.072 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -0.347 -31.339 -3.577 1.00 0.00 H new ATOM 0 HG22 VAL A 57 0.758 -30.822 -4.873 1.00 0.00 H new ATOM 0 HG23 VAL A 57 1.406 -31.274 -3.279 1.00 0.00 H new ATOM 133 N GLU A 58 2.173 -27.368 -1.560 1.00 0.00 N ATOM 134 CA GLU A 58 2.224 -26.202 -0.694 1.00 0.00 C ATOM 135 C GLU A 58 3.092 -25.133 -1.336 1.00 0.00 C ATOM 136 O GLU A 58 2.644 -24.012 -1.572 1.00 0.00 O ATOM 137 CB GLU A 58 2.722 -26.579 0.715 1.00 0.00 C ATOM 138 CG GLU A 58 4.194 -26.301 0.970 1.00 0.00 C ATOM 139 CD GLU A 58 4.588 -26.523 2.417 1.00 0.00 C ATOM 140 OE1 GLU A 58 4.217 -25.688 3.269 1.00 0.00 O ATOM 141 OE2 GLU A 58 5.268 -27.532 2.699 1.00 0.00 O ATOM 0 H GLU A 58 2.506 -28.232 -1.133 1.00 0.00 H new ATOM 0 HA GLU A 58 1.218 -25.800 -0.572 1.00 0.00 H new ATOM 0 HB2 GLU A 58 2.132 -26.033 1.451 1.00 0.00 H new ATOM 0 HB3 GLU A 58 2.534 -27.640 0.879 1.00 0.00 H new ATOM 0 HG2 GLU A 58 4.798 -26.945 0.330 1.00 0.00 H new ATOM 0 HG3 GLU A 58 4.419 -25.272 0.690 1.00 0.00 H new ATOM 148 N SER A 59 4.322 -25.505 -1.665 1.00 0.00 N ATOM 149 CA SER A 59 5.233 -24.588 -2.327 1.00 0.00 C ATOM 150 C SER A 59 4.675 -24.211 -3.698 1.00 0.00 C ATOM 151 O SER A 59 5.134 -23.260 -4.329 1.00 0.00 O ATOM 152 CB SER A 59 6.618 -25.222 -2.477 1.00 0.00 C ATOM 153 OG SER A 59 7.476 -24.401 -3.250 1.00 0.00 O ATOM 0 H SER A 59 4.708 -26.432 -1.484 1.00 0.00 H new ATOM 0 HA SER A 59 5.332 -23.689 -1.719 1.00 0.00 H new ATOM 0 HB2 SER A 59 7.055 -25.384 -1.492 1.00 0.00 H new ATOM 0 HB3 SER A 59 6.524 -26.200 -2.949 1.00 0.00 H new ATOM 0 HG SER A 59 6.943 -23.742 -3.742 1.00 0.00 H new ATOM 159 N ARG A 60 3.688 -24.983 -4.155 1.00 0.00 N ATOM 160 CA ARG A 60 3.060 -24.763 -5.443 1.00 0.00 C ATOM 161 C ARG A 60 2.207 -23.517 -5.437 1.00 0.00 C ATOM 162 O ARG A 60 2.595 -22.492 -6.016 1.00 0.00 O ATOM 163 CB ARG A 60 2.201 -25.968 -5.824 1.00 0.00 C ATOM 164 CG ARG A 60 2.110 -26.208 -7.322 1.00 0.00 C ATOM 165 CD ARG A 60 0.699 -26.587 -7.743 1.00 0.00 C ATOM 166 NE ARG A 60 0.582 -26.740 -9.191 1.00 0.00 N ATOM 167 CZ ARG A 60 -0.422 -27.373 -9.792 1.00 0.00 C ATOM 168 NH1 ARG A 60 -1.401 -27.912 -9.074 1.00 0.00 N ATOM 169 NH2 ARG A 60 -0.451 -27.467 -11.115 1.00 0.00 N ATOM 0 H ARG A 60 3.307 -25.775 -3.638 1.00 0.00 H new ATOM 0 HA ARG A 60 3.854 -24.631 -6.179 1.00 0.00 H new ATOM 0 HB2 ARG A 60 2.610 -26.859 -5.347 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.196 -25.826 -5.427 1.00 0.00 H new ATOM 0 HG2 ARG A 60 2.420 -25.309 -7.855 1.00 0.00 H new ATOM 0 HG3 ARG A 60 2.801 -27.002 -7.607 1.00 0.00 H new ATOM 0 HD2 ARG A 60 0.414 -27.519 -7.256 1.00 0.00 H new ATOM 0 HD3 ARG A 60 0.001 -25.822 -7.402 1.00 0.00 H new ATOM 0 HE ARG A 60 1.314 -26.337 -9.776 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -1.385 -27.842 -8.057 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -2.168 -28.396 -9.540 1.00 0.00 H new ATOM 0 HH21 ARG A 60 0.297 -27.054 -11.672 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -1.221 -27.953 -11.575 1.00 0.00 H new ATOM 183 N LEU A 61 1.039 -23.566 -4.792 1.00 0.00 N ATOM 184 CA LEU A 61 0.217 -22.369 -4.789 1.00 0.00 C ATOM 185 C LEU A 61 0.914 -21.272 -4.007 1.00 0.00 C ATOM 186 O LEU A 61 0.666 -20.084 -4.216 1.00 0.00 O ATOM 187 CB LEU A 61 -1.197 -22.629 -4.297 1.00 0.00 C ATOM 188 CG LEU A 61 -2.226 -22.612 -5.432 1.00 0.00 C ATOM 189 CD1 LEU A 61 -3.072 -23.865 -5.408 1.00 0.00 C ATOM 190 CD2 LEU A 61 -3.090 -21.361 -5.371 1.00 0.00 C ATOM 0 H LEU A 61 0.663 -24.373 -4.295 1.00 0.00 H new ATOM 0 HA LEU A 61 0.100 -22.034 -5.820 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -1.231 -23.596 -3.794 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -1.465 -21.875 -3.557 1.00 0.00 H new ATOM 0 HG LEU A 61 -1.685 -22.591 -6.378 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -3.796 -23.831 -6.223 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -2.431 -24.739 -5.528 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.600 -23.930 -4.456 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.811 -21.376 -6.189 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -3.621 -21.332 -4.420 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -2.458 -20.478 -5.461 1.00 0.00 H new ATOM 202 N GLU A 62 1.855 -21.681 -3.163 1.00 0.00 N ATOM 203 CA GLU A 62 2.658 -20.733 -2.420 1.00 0.00 C ATOM 204 C GLU A 62 3.481 -19.942 -3.422 1.00 0.00 C ATOM 205 O GLU A 62 3.652 -18.727 -3.295 1.00 0.00 O ATOM 206 CB GLU A 62 3.576 -21.456 -1.439 1.00 0.00 C ATOM 207 CG GLU A 62 4.403 -20.520 -0.573 1.00 0.00 C ATOM 208 CD GLU A 62 5.698 -20.099 -1.241 1.00 0.00 C ATOM 209 OE1 GLU A 62 6.353 -20.961 -1.863 1.00 0.00 O ATOM 210 OE2 GLU A 62 6.058 -18.907 -1.139 1.00 0.00 O ATOM 0 H GLU A 62 2.075 -22.660 -2.981 1.00 0.00 H new ATOM 0 HA GLU A 62 2.015 -20.069 -1.842 1.00 0.00 H new ATOM 0 HB2 GLU A 62 2.973 -22.095 -0.794 1.00 0.00 H new ATOM 0 HB3 GLU A 62 4.247 -22.109 -1.997 1.00 0.00 H new ATOM 0 HG2 GLU A 62 3.814 -19.633 -0.338 1.00 0.00 H new ATOM 0 HG3 GLU A 62 4.630 -21.012 0.373 1.00 0.00 H new ATOM 217 N ARG A 63 3.954 -20.649 -4.454 1.00 0.00 N ATOM 218 CA ARG A 63 4.718 -20.023 -5.516 1.00 0.00 C ATOM 219 C ARG A 63 3.784 -19.158 -6.350 1.00 0.00 C ATOM 220 O ARG A 63 4.193 -18.137 -6.905 1.00 0.00 O ATOM 221 CB ARG A 63 5.389 -21.081 -6.397 1.00 0.00 C ATOM 222 CG ARG A 63 6.792 -21.452 -5.942 1.00 0.00 C ATOM 223 CD ARG A 63 7.199 -22.824 -6.456 1.00 0.00 C ATOM 224 NE ARG A 63 8.559 -23.180 -6.056 1.00 0.00 N ATOM 225 CZ ARG A 63 9.032 -24.423 -6.062 1.00 0.00 C ATOM 226 NH1 ARG A 63 8.259 -25.433 -6.442 1.00 0.00 N ATOM 227 NH2 ARG A 63 10.281 -24.659 -5.688 1.00 0.00 N ATOM 0 H ARG A 63 3.817 -21.653 -4.568 1.00 0.00 H new ATOM 0 HA ARG A 63 5.502 -19.404 -5.079 1.00 0.00 H new ATOM 0 HB2 ARG A 63 4.770 -21.978 -6.408 1.00 0.00 H new ATOM 0 HB3 ARG A 63 5.434 -20.713 -7.422 1.00 0.00 H new ATOM 0 HG2 ARG A 63 7.501 -20.704 -6.297 1.00 0.00 H new ATOM 0 HG3 ARG A 63 6.837 -21.442 -4.853 1.00 0.00 H new ATOM 0 HD2 ARG A 63 6.503 -23.573 -6.079 1.00 0.00 H new ATOM 0 HD3 ARG A 63 7.126 -22.840 -7.543 1.00 0.00 H new ATOM 0 HE ARG A 63 9.182 -22.431 -5.754 1.00 0.00 H new ATOM 0 HH11 ARG A 63 7.297 -25.258 -6.731 1.00 0.00 H new ATOM 0 HH12 ARG A 63 8.627 -26.384 -6.445 1.00 0.00 H new ATOM 0 HH21 ARG A 63 10.880 -23.887 -5.395 1.00 0.00 H new ATOM 0 HH22 ARG A 63 10.643 -25.612 -5.693 1.00 0.00 H new ATOM 241 N LEU A 64 2.513 -19.562 -6.405 1.00 0.00 N ATOM 242 CA LEU A 64 1.509 -18.803 -7.142 1.00 0.00 C ATOM 243 C LEU A 64 1.266 -17.466 -6.455 1.00 0.00 C ATOM 244 O LEU A 64 0.913 -16.473 -7.090 1.00 0.00 O ATOM 245 CB LEU A 64 0.201 -19.601 -7.249 1.00 0.00 C ATOM 246 CG LEU A 64 -1.083 -18.765 -7.324 1.00 0.00 C ATOM 247 CD1 LEU A 64 -2.123 -19.457 -8.191 1.00 0.00 C ATOM 248 CD2 LEU A 64 -1.635 -18.510 -5.927 1.00 0.00 C ATOM 0 H LEU A 64 2.160 -20.404 -5.951 1.00 0.00 H new ATOM 0 HA LEU A 64 1.876 -18.619 -8.152 1.00 0.00 H new ATOM 0 HB2 LEU A 64 0.254 -20.233 -8.136 1.00 0.00 H new ATOM 0 HB3 LEU A 64 0.131 -20.265 -6.388 1.00 0.00 H new ATOM 0 HG LEU A 64 -0.842 -17.805 -7.780 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -3.026 -18.848 -8.232 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -1.728 -19.588 -9.198 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.361 -20.432 -7.765 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.546 -17.916 -5.999 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.860 -19.462 -5.445 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -0.895 -17.970 -5.336 1.00 0.00 H new ATOM 260 N GLU A 65 1.477 -17.464 -5.151 1.00 0.00 N ATOM 261 CA GLU A 65 1.308 -16.268 -4.338 1.00 0.00 C ATOM 262 C GLU A 65 2.566 -15.412 -4.392 1.00 0.00 C ATOM 263 O GLU A 65 2.499 -14.185 -4.316 1.00 0.00 O ATOM 264 CB GLU A 65 1.000 -16.650 -2.889 1.00 0.00 C ATOM 265 CG GLU A 65 0.748 -15.455 -1.983 1.00 0.00 C ATOM 266 CD GLU A 65 1.949 -15.111 -1.123 1.00 0.00 C ATOM 267 OE1 GLU A 65 2.150 -15.782 -0.090 1.00 0.00 O ATOM 268 OE2 GLU A 65 2.687 -14.171 -1.484 1.00 0.00 O ATOM 0 H GLU A 65 1.769 -18.287 -4.625 1.00 0.00 H new ATOM 0 HA GLU A 65 0.472 -15.694 -4.737 1.00 0.00 H new ATOM 0 HB2 GLU A 65 0.124 -17.299 -2.872 1.00 0.00 H new ATOM 0 HB3 GLU A 65 1.833 -17.228 -2.490 1.00 0.00 H new ATOM 0 HG2 GLU A 65 0.483 -14.591 -2.593 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -0.106 -15.665 -1.340 1.00 0.00 H new ATOM 275 N GLN A 66 3.713 -16.070 -4.542 1.00 0.00 N ATOM 276 CA GLN A 66 4.987 -15.369 -4.622 1.00 0.00 C ATOM 277 C GLN A 66 4.990 -14.412 -5.809 1.00 0.00 C ATOM 278 O GLN A 66 5.662 -13.380 -5.790 1.00 0.00 O ATOM 279 CB GLN A 66 6.138 -16.369 -4.753 1.00 0.00 C ATOM 280 CG GLN A 66 7.387 -15.961 -3.987 1.00 0.00 C ATOM 281 CD GLN A 66 8.615 -15.866 -4.874 1.00 0.00 C ATOM 282 OE1 GLN A 66 8.571 -16.206 -6.057 1.00 0.00 O ATOM 283 NE2 GLN A 66 9.720 -15.398 -4.305 1.00 0.00 N ATOM 0 H GLN A 66 3.784 -17.085 -4.610 1.00 0.00 H new ATOM 0 HA GLN A 66 5.124 -14.795 -3.706 1.00 0.00 H new ATOM 0 HB2 GLN A 66 5.805 -17.343 -4.396 1.00 0.00 H new ATOM 0 HB3 GLN A 66 6.390 -16.485 -5.807 1.00 0.00 H new ATOM 0 HG2 GLN A 66 7.215 -14.997 -3.507 1.00 0.00 H new ATOM 0 HG3 GLN A 66 7.573 -16.684 -3.193 1.00 0.00 H new ATOM 0 HE21 GLN A 66 9.712 -15.128 -3.321 1.00 0.00 H new ATOM 0 HE22 GLN A 66 10.577 -15.309 -4.852 1.00 0.00 H new ATOM 292 N LEU A 67 4.228 -14.762 -6.842 1.00 0.00 N ATOM 293 CA LEU A 67 4.131 -13.938 -8.040 1.00 0.00 C ATOM 294 C LEU A 67 3.094 -12.831 -7.861 1.00 0.00 C ATOM 295 O LEU A 67 3.023 -11.906 -8.671 1.00 0.00 O ATOM 296 CB LEU A 67 3.764 -14.799 -9.249 1.00 0.00 C ATOM 297 CG LEU A 67 4.819 -15.826 -9.660 1.00 0.00 C ATOM 298 CD1 LEU A 67 4.158 -17.063 -10.245 1.00 0.00 C ATOM 299 CD2 LEU A 67 5.792 -15.216 -10.658 1.00 0.00 C ATOM 0 H LEU A 67 3.668 -15.614 -6.872 1.00 0.00 H new ATOM 0 HA LEU A 67 5.104 -13.477 -8.210 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.834 -15.324 -9.032 1.00 0.00 H new ATOM 0 HB3 LEU A 67 3.569 -14.142 -10.097 1.00 0.00 H new ATOM 0 HG LEU A 67 5.377 -16.124 -8.772 1.00 0.00 H new ATOM 0 HD11 LEU A 67 4.924 -17.783 -10.532 1.00 0.00 H new ATOM 0 HD12 LEU A 67 3.500 -17.510 -9.500 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.575 -16.784 -11.123 1.00 0.00 H new ATOM 0 HD21 LEU A 67 6.537 -15.960 -10.941 1.00 0.00 H new ATOM 0 HD22 LEU A 67 5.248 -14.892 -11.545 1.00 0.00 H new ATOM 0 HD23 LEU A 67 6.289 -14.359 -10.204 1.00 0.00 H new ATOM 311 N PHE A 68 2.288 -12.930 -6.803 1.00 0.00 N ATOM 312 CA PHE A 68 1.257 -11.934 -6.530 1.00 0.00 C ATOM 313 C PHE A 68 0.190 -11.947 -7.620 1.00 0.00 C ATOM 314 O PHE A 68 0.343 -11.309 -8.661 1.00 0.00 O ATOM 315 CB PHE A 68 1.881 -10.537 -6.415 1.00 0.00 C ATOM 316 CG PHE A 68 0.873 -9.429 -6.289 1.00 0.00 C ATOM 317 CD1 PHE A 68 0.255 -9.168 -5.076 1.00 0.00 C ATOM 318 CD2 PHE A 68 0.546 -8.646 -7.385 1.00 0.00 C ATOM 319 CE1 PHE A 68 -0.671 -8.149 -4.960 1.00 0.00 C ATOM 320 CE2 PHE A 68 -0.379 -7.625 -7.274 1.00 0.00 C ATOM 321 CZ PHE A 68 -0.987 -7.376 -6.060 1.00 0.00 C ATOM 0 H PHE A 68 2.331 -13.689 -6.123 1.00 0.00 H new ATOM 0 HA PHE A 68 0.782 -12.186 -5.582 1.00 0.00 H new ATOM 0 HB2 PHE A 68 2.541 -10.515 -5.548 1.00 0.00 H new ATOM 0 HB3 PHE A 68 2.501 -10.353 -7.293 1.00 0.00 H new ATOM 0 HD1 PHE A 68 0.500 -9.768 -4.212 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.020 -8.836 -8.337 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -1.147 -7.957 -4.010 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.626 -7.023 -8.136 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.709 -6.578 -5.970 1.00 0.00 H new ATOM 331 N LEU A 69 -0.891 -12.680 -7.374 1.00 0.00 N ATOM 332 CA LEU A 69 -1.984 -12.778 -8.335 1.00 0.00 C ATOM 333 C LEU A 69 -3.295 -13.126 -7.637 1.00 0.00 C ATOM 334 O LEU A 69 -3.299 -13.688 -6.541 1.00 0.00 O ATOM 335 CB LEU A 69 -1.659 -13.828 -9.400 1.00 0.00 C ATOM 336 CG LEU A 69 -1.707 -13.325 -10.845 1.00 0.00 C ATOM 337 CD1 LEU A 69 -3.131 -12.961 -11.235 1.00 0.00 C ATOM 338 CD2 LEU A 69 -0.780 -12.131 -11.024 1.00 0.00 C ATOM 0 H LEU A 69 -1.034 -13.215 -6.517 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.101 -11.807 -8.817 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.664 -14.226 -9.203 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -2.360 -14.656 -9.297 1.00 0.00 H new ATOM 0 HG LEU A 69 -1.366 -14.126 -11.501 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -3.146 -12.605 -12.265 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -3.769 -13.840 -11.145 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -3.500 -12.176 -10.575 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.826 -11.786 -12.057 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -1.091 -11.326 -10.358 1.00 0.00 H new ATOM 0 HD23 LEU A 69 0.242 -12.425 -10.785 1.00 0.00 H new ATOM 350 N LEU A 70 -4.407 -12.796 -8.285 1.00 0.00 N ATOM 351 CA LEU A 70 -5.730 -13.074 -7.740 1.00 0.00 C ATOM 352 C LEU A 70 -5.893 -12.500 -6.332 1.00 0.00 C ATOM 353 O LEU A 70 -6.750 -12.947 -5.569 1.00 0.00 O ATOM 354 CB LEU A 70 -5.982 -14.580 -7.729 1.00 0.00 C ATOM 355 CG LEU A 70 -7.121 -15.050 -8.635 1.00 0.00 C ATOM 356 CD1 LEU A 70 -7.124 -16.567 -8.748 1.00 0.00 C ATOM 357 CD2 LEU A 70 -8.459 -14.550 -8.111 1.00 0.00 C ATOM 0 H LEU A 70 -4.417 -12.333 -9.194 1.00 0.00 H new ATOM 0 HA LEU A 70 -6.466 -12.588 -8.381 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.066 -15.089 -8.028 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -6.199 -14.890 -6.707 1.00 0.00 H new ATOM 0 HG LEU A 70 -6.963 -14.633 -9.630 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.941 -16.882 -9.397 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -6.176 -16.902 -9.170 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -7.256 -17.005 -7.759 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -9.258 -14.894 -8.768 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -8.624 -14.937 -7.106 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -8.455 -13.460 -8.084 1.00 0.00 H new ATOM 369 N ILE A 71 -5.073 -11.508 -5.992 1.00 0.00 N ATOM 370 CA ILE A 71 -5.143 -10.882 -4.679 1.00 0.00 C ATOM 371 C ILE A 71 -5.424 -9.385 -4.805 1.00 0.00 C ATOM 372 O ILE A 71 -6.314 -8.855 -4.140 1.00 0.00 O ATOM 373 CB ILE A 71 -3.842 -11.119 -3.874 1.00 0.00 C ATOM 374 CG1 ILE A 71 -4.072 -10.836 -2.384 1.00 0.00 C ATOM 375 CG2 ILE A 71 -2.695 -10.274 -4.414 1.00 0.00 C ATOM 376 CD1 ILE A 71 -4.256 -9.369 -2.059 1.00 0.00 C ATOM 0 H ILE A 71 -4.356 -11.123 -6.607 1.00 0.00 H new ATOM 0 HA ILE A 71 -5.967 -11.346 -4.136 1.00 0.00 H new ATOM 0 HB ILE A 71 -3.563 -12.167 -3.988 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -4.953 -11.385 -2.052 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -3.225 -11.220 -1.816 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -1.796 -10.463 -3.827 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -2.510 -10.535 -5.456 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -2.957 -9.218 -4.345 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -4.413 -9.251 -0.987 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -3.366 -8.816 -2.358 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -5.121 -8.983 -2.597 1.00 0.00 H new ATOM 388 N PHE A 72 -4.668 -8.711 -5.670 1.00 0.00 N ATOM 389 CA PHE A 72 -4.844 -7.279 -5.892 1.00 0.00 C ATOM 390 C PHE A 72 -4.728 -6.497 -4.584 1.00 0.00 C ATOM 391 O PHE A 72 -4.776 -7.073 -3.498 1.00 0.00 O ATOM 392 CB PHE A 72 -6.200 -7.008 -6.544 1.00 0.00 C ATOM 393 CG PHE A 72 -6.139 -6.911 -8.041 1.00 0.00 C ATOM 394 CD1 PHE A 72 -5.850 -8.027 -8.810 1.00 0.00 C ATOM 395 CD2 PHE A 72 -6.371 -5.703 -8.680 1.00 0.00 C ATOM 396 CE1 PHE A 72 -5.794 -7.940 -10.188 1.00 0.00 C ATOM 397 CE2 PHE A 72 -6.315 -5.610 -10.058 1.00 0.00 C ATOM 398 CZ PHE A 72 -6.026 -6.730 -10.813 1.00 0.00 C ATOM 0 H PHE A 72 -3.927 -9.135 -6.229 1.00 0.00 H new ATOM 0 HA PHE A 72 -4.051 -6.943 -6.560 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -6.892 -7.804 -6.268 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -6.607 -6.079 -6.144 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -5.666 -8.975 -8.327 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -6.598 -4.824 -8.094 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -5.569 -8.817 -10.776 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -6.497 -4.663 -10.544 1.00 0.00 H new ATOM 0 HZ PHE A 72 -5.981 -6.660 -11.890 1.00 0.00 H new ATOM 408 N PRO A 73 -4.572 -5.165 -4.671 1.00 0.00 N ATOM 409 CA PRO A 73 -4.452 -4.306 -3.493 1.00 0.00 C ATOM 410 C PRO A 73 -5.801 -4.036 -2.835 1.00 0.00 C ATOM 411 O PRO A 73 -6.742 -3.586 -3.489 1.00 0.00 O ATOM 412 CB PRO A 73 -3.866 -3.017 -4.065 1.00 0.00 C ATOM 413 CG PRO A 73 -4.379 -2.961 -5.463 1.00 0.00 C ATOM 414 CD PRO A 73 -4.503 -4.391 -5.927 1.00 0.00 C ATOM 0 HA PRO A 73 -3.843 -4.759 -2.711 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -4.184 -2.147 -3.490 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -2.776 -3.032 -4.043 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -5.343 -2.454 -5.503 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -3.698 -2.402 -6.105 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -5.395 -4.538 -6.537 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -3.649 -4.690 -6.534 1.00 0.00 H new ATOM 422 N ARG A 74 -5.889 -4.316 -1.539 1.00 0.00 N ATOM 423 CA ARG A 74 -7.126 -4.105 -0.796 1.00 0.00 C ATOM 424 C ARG A 74 -7.052 -2.829 0.038 1.00 0.00 C ATOM 425 O ARG A 74 -8.065 -2.173 0.276 1.00 0.00 O ATOM 426 CB ARG A 74 -7.411 -5.305 0.110 1.00 0.00 C ATOM 427 CG ARG A 74 -7.807 -6.561 -0.651 1.00 0.00 C ATOM 428 CD ARG A 74 -9.180 -6.417 -1.286 1.00 0.00 C ATOM 429 NE ARG A 74 -9.506 -7.549 -2.150 1.00 0.00 N ATOM 430 CZ ARG A 74 -10.454 -7.521 -3.085 1.00 0.00 C ATOM 431 NH1 ARG A 74 -11.171 -6.422 -3.278 1.00 0.00 N ATOM 432 NH2 ARG A 74 -10.684 -8.596 -3.828 1.00 0.00 N ATOM 0 H ARG A 74 -5.120 -4.689 -0.982 1.00 0.00 H new ATOM 0 HA ARG A 74 -7.938 -3.999 -1.515 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -6.525 -5.517 0.708 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -8.209 -5.044 0.805 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -7.067 -6.768 -1.424 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -7.806 -7.414 0.027 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -9.934 -6.330 -0.503 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -9.216 -5.496 -1.867 1.00 0.00 H new ATOM 0 HE ARG A 74 -8.976 -8.412 -2.030 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -10.997 -5.593 -2.709 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -11.896 -6.405 -3.995 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -10.135 -9.443 -3.683 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -11.410 -8.575 -4.544 1.00 0.00 H new ATOM 446 N GLU A 75 -5.846 -2.484 0.480 1.00 0.00 N ATOM 447 CA GLU A 75 -5.643 -1.288 1.287 1.00 0.00 C ATOM 448 C GLU A 75 -5.303 -0.088 0.408 1.00 0.00 C ATOM 449 O GLU A 75 -4.994 -0.239 -0.773 1.00 0.00 O ATOM 450 CB GLU A 75 -4.527 -1.520 2.307 1.00 0.00 C ATOM 451 CG GLU A 75 -4.935 -2.428 3.456 1.00 0.00 C ATOM 452 CD GLU A 75 -3.753 -3.143 4.083 1.00 0.00 C ATOM 453 OE1 GLU A 75 -2.677 -2.521 4.201 1.00 0.00 O ATOM 454 OE2 GLU A 75 -3.904 -4.327 4.454 1.00 0.00 O ATOM 0 H GLU A 75 -4.996 -3.016 0.292 1.00 0.00 H new ATOM 0 HA GLU A 75 -6.572 -1.075 1.816 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -3.666 -1.954 1.799 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -4.208 -0.559 2.710 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -5.443 -1.837 4.218 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -5.651 -3.166 3.094 1.00 0.00 H new ATOM 461 N ASP A 76 -5.365 1.105 0.994 1.00 0.00 N ATOM 462 CA ASP A 76 -5.064 2.331 0.264 1.00 0.00 C ATOM 463 C ASP A 76 -3.726 2.914 0.709 1.00 0.00 C ATOM 464 O ASP A 76 -2.924 3.352 -0.117 1.00 0.00 O ATOM 465 CB ASP A 76 -6.178 3.359 0.476 1.00 0.00 C ATOM 466 CG ASP A 76 -6.158 4.455 -0.572 1.00 0.00 C ATOM 467 OD1 ASP A 76 -6.020 4.131 -1.770 1.00 0.00 O ATOM 468 OD2 ASP A 76 -6.282 5.639 -0.194 1.00 0.00 O ATOM 0 H ASP A 76 -5.621 1.248 1.971 1.00 0.00 H new ATOM 0 HA ASP A 76 -4.999 2.088 -0.797 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -7.144 2.855 0.452 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -6.075 3.804 1.466 1.00 0.00 H new ATOM 473 N LEU A 77 -3.492 2.918 2.017 1.00 0.00 N ATOM 474 CA LEU A 77 -2.252 3.446 2.573 1.00 0.00 C ATOM 475 C LEU A 77 -2.115 4.939 2.288 1.00 0.00 C ATOM 476 O LEU A 77 -2.457 5.409 1.203 1.00 0.00 O ATOM 477 CB LEU A 77 -1.048 2.694 1.999 1.00 0.00 C ATOM 478 CG LEU A 77 -1.071 1.178 2.211 1.00 0.00 C ATOM 479 CD1 LEU A 77 -1.360 0.458 0.902 1.00 0.00 C ATOM 480 CD2 LEU A 77 0.248 0.700 2.802 1.00 0.00 C ATOM 0 H LEU A 77 -4.146 2.561 2.713 1.00 0.00 H new ATOM 0 HA LEU A 77 -2.281 3.303 3.653 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.989 2.895 0.929 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.140 3.095 2.449 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.869 0.944 2.916 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.372 -0.618 1.074 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -2.330 0.775 0.519 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -0.585 0.701 0.175 1.00 0.00 H new ATOM 0 HD21 LEU A 77 0.212 -0.380 2.945 1.00 0.00 H new ATOM 0 HD22 LEU A 77 1.063 0.949 2.122 1.00 0.00 H new ATOM 0 HD23 LEU A 77 0.415 1.188 3.762 1.00 0.00 H new ATOM 492 N ASP A 78 -1.615 5.679 3.272 1.00 0.00 N ATOM 493 CA ASP A 78 -1.432 7.120 3.132 1.00 0.00 C ATOM 494 C ASP A 78 0.050 7.477 3.054 1.00 0.00 C ATOM 495 O ASP A 78 0.423 8.500 2.477 1.00 0.00 O ATOM 496 CB ASP A 78 -2.084 7.853 4.305 1.00 0.00 C ATOM 497 CG ASP A 78 -2.769 9.136 3.876 1.00 0.00 C ATOM 498 OD1 ASP A 78 -3.444 9.127 2.823 1.00 0.00 O ATOM 499 OD2 ASP A 78 -2.633 10.150 4.592 1.00 0.00 O ATOM 0 H ASP A 78 -1.329 5.304 4.177 1.00 0.00 H new ATOM 0 HA ASP A 78 -1.911 7.433 2.204 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -2.813 7.197 4.780 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -1.326 8.082 5.054 1.00 0.00 H new ATOM 504 N MET A 79 0.890 6.628 3.639 1.00 0.00 N ATOM 505 CA MET A 79 2.332 6.853 3.638 1.00 0.00 C ATOM 506 C MET A 79 2.864 6.996 2.215 1.00 0.00 C ATOM 507 O MET A 79 3.858 7.684 1.981 1.00 0.00 O ATOM 508 CB MET A 79 3.048 5.701 4.347 1.00 0.00 C ATOM 509 CG MET A 79 2.806 4.346 3.702 1.00 0.00 C ATOM 510 SD MET A 79 4.282 3.311 3.685 1.00 0.00 S ATOM 511 CE MET A 79 3.787 1.997 4.797 1.00 0.00 C ATOM 0 H MET A 79 0.597 5.778 4.120 1.00 0.00 H new ATOM 0 HA MET A 79 2.528 7.782 4.173 1.00 0.00 H new ATOM 0 HB2 MET A 79 4.119 5.902 4.359 1.00 0.00 H new ATOM 0 HB3 MET A 79 2.719 5.664 5.385 1.00 0.00 H new ATOM 0 HG2 MET A 79 2.011 3.829 4.239 1.00 0.00 H new ATOM 0 HG3 MET A 79 2.457 4.492 2.680 1.00 0.00 H new ATOM 0 HE1 MET A 79 4.598 1.274 4.890 1.00 0.00 H new ATOM 0 HE2 MET A 79 3.560 2.416 5.777 1.00 0.00 H new ATOM 0 HE3 MET A 79 2.902 1.500 4.401 1.00 0.00 H new ATOM 521 N ILE A 80 2.195 6.344 1.269 1.00 0.00 N ATOM 522 CA ILE A 80 2.601 6.399 -0.129 1.00 0.00 C ATOM 523 C ILE A 80 2.454 7.811 -0.682 1.00 0.00 C ATOM 524 O ILE A 80 3.443 8.466 -1.014 1.00 0.00 O ATOM 525 CB ILE A 80 1.769 5.432 -0.995 1.00 0.00 C ATOM 526 CG1 ILE A 80 1.762 4.033 -0.375 1.00 0.00 C ATOM 527 CG2 ILE A 80 2.315 5.386 -2.413 1.00 0.00 C ATOM 528 CD1 ILE A 80 3.147 3.459 -0.163 1.00 0.00 C ATOM 0 H ILE A 80 1.369 5.772 1.446 1.00 0.00 H new ATOM 0 HA ILE A 80 3.648 6.099 -0.169 1.00 0.00 H new ATOM 0 HB ILE A 80 0.742 5.796 -1.034 1.00 0.00 H new ATOM 0 HG12 ILE A 80 1.243 4.071 0.583 1.00 0.00 H new ATOM 0 HG13 ILE A 80 1.194 3.362 -1.019 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.717 4.699 -3.011 1.00 0.00 H new ATOM 0 HG22 ILE A 80 2.271 6.383 -2.852 1.00 0.00 H new ATOM 0 HG23 ILE A 80 3.350 5.044 -2.394 1.00 0.00 H new ATOM 0 HD11 ILE A 80 3.066 2.466 0.279 1.00 0.00 H new ATOM 0 HD12 ILE A 80 3.662 3.388 -1.121 1.00 0.00 H new ATOM 0 HD13 ILE A 80 3.712 4.109 0.505 1.00 0.00 H new ATOM 540 N LEU A 81 1.214 8.276 -0.778 1.00 0.00 N ATOM 541 CA LEU A 81 0.935 9.613 -1.290 1.00 0.00 C ATOM 542 C LEU A 81 1.605 10.683 -0.430 1.00 0.00 C ATOM 543 O LEU A 81 1.794 11.817 -0.872 1.00 0.00 O ATOM 544 CB LEU A 81 -0.574 9.858 -1.343 1.00 0.00 C ATOM 545 CG LEU A 81 -1.305 9.686 -0.008 1.00 0.00 C ATOM 546 CD1 LEU A 81 -2.142 10.918 0.310 1.00 0.00 C ATOM 547 CD2 LEU A 81 -2.181 8.441 -0.035 1.00 0.00 C ATOM 0 H LEU A 81 0.385 7.747 -0.508 1.00 0.00 H new ATOM 0 HA LEU A 81 1.344 9.677 -2.298 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -0.750 10.870 -1.709 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.012 9.175 -2.071 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.558 9.567 0.777 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -2.653 10.775 1.262 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -1.494 11.792 0.374 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -2.879 11.070 -0.478 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.692 8.335 0.922 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -2.918 8.532 -0.833 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -1.560 7.563 -0.214 1.00 0.00 H new ATOM 559 N LYS A 82 1.964 10.318 0.799 1.00 0.00 N ATOM 560 CA LYS A 82 2.610 11.252 1.714 1.00 0.00 C ATOM 561 C LYS A 82 4.104 11.362 1.420 1.00 0.00 C ATOM 562 O LYS A 82 4.710 12.414 1.621 1.00 0.00 O ATOM 563 CB LYS A 82 2.399 10.808 3.163 1.00 0.00 C ATOM 564 CG LYS A 82 1.093 11.297 3.765 1.00 0.00 C ATOM 565 CD LYS A 82 0.986 10.933 5.239 1.00 0.00 C ATOM 566 CE LYS A 82 0.554 12.123 6.079 1.00 0.00 C ATOM 567 NZ LYS A 82 1.192 12.116 7.424 1.00 0.00 N ATOM 0 H LYS A 82 1.818 9.384 1.182 1.00 0.00 H new ATOM 0 HA LYS A 82 2.156 12.232 1.569 1.00 0.00 H new ATOM 0 HB2 LYS A 82 2.425 9.719 3.208 1.00 0.00 H new ATOM 0 HB3 LYS A 82 3.228 11.172 3.770 1.00 0.00 H new ATOM 0 HG2 LYS A 82 1.021 12.379 3.650 1.00 0.00 H new ATOM 0 HG3 LYS A 82 0.255 10.862 3.220 1.00 0.00 H new ATOM 0 HD2 LYS A 82 0.270 10.121 5.363 1.00 0.00 H new ATOM 0 HD3 LYS A 82 1.949 10.566 5.595 1.00 0.00 H new ATOM 0 HE2 LYS A 82 0.812 13.046 5.560 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -0.530 12.113 6.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 0.871 12.944 7.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 0.926 11.247 7.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 2.226 12.152 7.318 1.00 0.00 H new ATOM 581 N MET A 83 4.691 10.268 0.946 1.00 0.00 N ATOM 582 CA MET A 83 6.116 10.242 0.628 1.00 0.00 C ATOM 583 C MET A 83 6.371 10.590 -0.838 1.00 0.00 C ATOM 584 O MET A 83 7.509 10.852 -1.231 1.00 0.00 O ATOM 585 CB MET A 83 6.703 8.865 0.949 1.00 0.00 C ATOM 586 CG MET A 83 6.235 7.764 0.010 1.00 0.00 C ATOM 587 SD MET A 83 7.162 6.232 0.219 1.00 0.00 S ATOM 588 CE MET A 83 8.745 6.696 -0.477 1.00 0.00 C ATOM 0 H MET A 83 4.204 9.389 0.773 1.00 0.00 H new ATOM 0 HA MET A 83 6.607 10.997 1.242 1.00 0.00 H new ATOM 0 HB2 MET A 83 7.791 8.926 0.909 1.00 0.00 H new ATOM 0 HB3 MET A 83 6.436 8.596 1.971 1.00 0.00 H new ATOM 0 HG2 MET A 83 5.176 7.570 0.183 1.00 0.00 H new ATOM 0 HG3 MET A 83 6.332 8.105 -1.021 1.00 0.00 H new ATOM 0 HE1 MET A 83 9.300 5.798 -0.749 1.00 0.00 H new ATOM 0 HE2 MET A 83 8.587 7.308 -1.365 1.00 0.00 H new ATOM 0 HE3 MET A 83 9.313 7.265 0.259 1.00 0.00 H new ATOM 598 N ASP A 84 5.314 10.585 -1.646 1.00 0.00 N ATOM 599 CA ASP A 84 5.439 10.894 -3.067 1.00 0.00 C ATOM 600 C ASP A 84 5.360 12.399 -3.320 1.00 0.00 C ATOM 601 O ASP A 84 4.582 12.859 -4.157 1.00 0.00 O ATOM 602 CB ASP A 84 4.348 10.173 -3.861 1.00 0.00 C ATOM 603 CG ASP A 84 4.861 9.615 -5.174 1.00 0.00 C ATOM 604 OD1 ASP A 84 5.892 10.116 -5.670 1.00 0.00 O ATOM 605 OD2 ASP A 84 4.234 8.675 -5.706 1.00 0.00 O ATOM 0 H ASP A 84 4.364 10.371 -1.342 1.00 0.00 H new ATOM 0 HA ASP A 84 6.417 10.547 -3.399 1.00 0.00 H new ATOM 0 HB2 ASP A 84 3.941 9.361 -3.259 1.00 0.00 H new ATOM 0 HB3 ASP A 84 3.529 10.865 -4.059 1.00 0.00 H new ATOM 610 N SER A 85 6.177 13.162 -2.596 1.00 0.00 N ATOM 611 CA SER A 85 6.210 14.618 -2.742 1.00 0.00 C ATOM 612 C SER A 85 4.802 15.209 -2.799 1.00 0.00 C ATOM 613 O SER A 85 4.199 15.297 -3.868 1.00 0.00 O ATOM 614 CB SER A 85 6.984 15.005 -4.004 1.00 0.00 C ATOM 615 OG SER A 85 8.202 14.284 -4.097 1.00 0.00 O ATOM 0 H SER A 85 6.827 12.796 -1.900 1.00 0.00 H new ATOM 0 HA SER A 85 6.714 15.026 -1.866 1.00 0.00 H new ATOM 0 HB2 SER A 85 6.373 14.807 -4.884 1.00 0.00 H new ATOM 0 HB3 SER A 85 7.191 16.075 -3.994 1.00 0.00 H new ATOM 0 HG SER A 85 8.677 14.548 -4.913 1.00 0.00 H new ATOM 621 N LEU A 86 4.287 15.614 -1.643 1.00 0.00 N ATOM 622 CA LEU A 86 2.952 16.198 -1.564 1.00 0.00 C ATOM 623 C LEU A 86 3.013 17.652 -1.106 1.00 0.00 C ATOM 624 O LEU A 86 2.149 18.457 -1.451 1.00 0.00 O ATOM 625 CB LEU A 86 2.074 15.386 -0.610 1.00 0.00 C ATOM 626 CG LEU A 86 0.612 15.245 -1.038 1.00 0.00 C ATOM 627 CD1 LEU A 86 0.416 13.983 -1.863 1.00 0.00 C ATOM 628 CD2 LEU A 86 -0.303 15.234 0.179 1.00 0.00 C ATOM 0 H LEU A 86 4.773 15.549 -0.748 1.00 0.00 H new ATOM 0 HA LEU A 86 2.515 16.173 -2.562 1.00 0.00 H new ATOM 0 HB2 LEU A 86 2.504 14.390 -0.504 1.00 0.00 H new ATOM 0 HB3 LEU A 86 2.105 15.853 0.374 1.00 0.00 H new ATOM 0 HG LEU A 86 0.352 16.104 -1.656 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -0.630 13.900 -2.158 1.00 0.00 H new ATOM 0 HD12 LEU A 86 1.042 14.030 -2.754 1.00 0.00 H new ATOM 0 HD13 LEU A 86 0.695 13.113 -1.269 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -1.339 15.133 -0.145 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -0.041 14.395 0.824 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.185 16.166 0.731 1.00 0.00 H new ATOM 640 N ARG A 87 4.036 17.982 -0.324 1.00 0.00 N ATOM 641 CA ARG A 87 4.204 19.340 0.184 1.00 0.00 C ATOM 642 C ARG A 87 4.760 20.275 -0.890 1.00 0.00 C ATOM 643 O ARG A 87 4.767 21.489 -0.711 1.00 0.00 O ATOM 644 CB ARG A 87 5.130 19.339 1.402 1.00 0.00 C ATOM 645 CG ARG A 87 4.489 18.758 2.653 1.00 0.00 C ATOM 646 CD ARG A 87 4.885 19.535 3.899 1.00 0.00 C ATOM 647 NE ARG A 87 3.723 19.912 4.701 1.00 0.00 N ATOM 648 CZ ARG A 87 3.776 20.748 5.734 1.00 0.00 C ATOM 649 NH1 ARG A 87 4.930 21.298 6.095 1.00 0.00 N ATOM 650 NH2 ARG A 87 2.671 21.038 6.409 1.00 0.00 N ATOM 0 H ARG A 87 4.761 17.328 -0.028 1.00 0.00 H new ATOM 0 HA ARG A 87 3.221 19.708 0.477 1.00 0.00 H new ATOM 0 HB2 ARG A 87 6.028 18.768 1.165 1.00 0.00 H new ATOM 0 HB3 ARG A 87 5.447 20.361 1.608 1.00 0.00 H new ATOM 0 HG2 ARG A 87 3.404 18.770 2.546 1.00 0.00 H new ATOM 0 HG3 ARG A 87 4.787 17.715 2.764 1.00 0.00 H new ATOM 0 HD2 ARG A 87 5.562 18.931 4.503 1.00 0.00 H new ATOM 0 HD3 ARG A 87 5.432 20.432 3.608 1.00 0.00 H new ATOM 0 HE ARG A 87 2.818 19.511 4.454 1.00 0.00 H new ATOM 0 HH11 ARG A 87 5.782 21.080 5.579 1.00 0.00 H new ATOM 0 HH12 ARG A 87 4.964 21.938 6.888 1.00 0.00 H new ATOM 0 HH21 ARG A 87 1.782 20.620 6.136 1.00 0.00 H new ATOM 0 HH22 ARG A 87 2.711 21.679 7.201 1.00 0.00 H new ATOM 664 N ASP A 88 5.222 19.711 -2.001 1.00 0.00 N ATOM 665 CA ASP A 88 5.771 20.517 -3.091 1.00 0.00 C ATOM 666 C ASP A 88 4.670 21.286 -3.822 1.00 0.00 C ATOM 667 O ASP A 88 4.952 22.175 -4.630 1.00 0.00 O ATOM 668 CB ASP A 88 6.529 19.626 -4.078 1.00 0.00 C ATOM 669 CG ASP A 88 8.006 19.530 -3.752 1.00 0.00 C ATOM 670 OD1 ASP A 88 8.632 20.586 -3.518 1.00 0.00 O ATOM 671 OD2 ASP A 88 8.538 18.400 -3.729 1.00 0.00 O ATOM 0 H ASP A 88 5.228 18.705 -2.172 1.00 0.00 H new ATOM 0 HA ASP A 88 6.461 21.241 -2.657 1.00 0.00 H new ATOM 0 HB2 ASP A 88 6.092 18.627 -4.071 1.00 0.00 H new ATOM 0 HB3 ASP A 88 6.407 20.020 -5.087 1.00 0.00 H new ATOM 676 N ILE A 89 3.418 20.954 -3.521 1.00 0.00 N ATOM 677 CA ILE A 89 2.274 21.617 -4.133 1.00 0.00 C ATOM 678 C ILE A 89 1.881 22.818 -3.299 1.00 0.00 C ATOM 679 O ILE A 89 1.845 23.947 -3.785 1.00 0.00 O ATOM 680 CB ILE A 89 1.066 20.669 -4.260 1.00 0.00 C ATOM 681 CG1 ILE A 89 1.501 19.329 -4.846 1.00 0.00 C ATOM 682 CG2 ILE A 89 -0.022 21.304 -5.112 1.00 0.00 C ATOM 683 CD1 ILE A 89 1.955 19.431 -6.280 1.00 0.00 C ATOM 0 H ILE A 89 3.170 20.225 -2.852 1.00 0.00 H new ATOM 0 HA ILE A 89 2.566 21.930 -5.136 1.00 0.00 H new ATOM 0 HB ILE A 89 0.658 20.491 -3.265 1.00 0.00 H new ATOM 0 HG12 ILE A 89 2.312 18.921 -4.242 1.00 0.00 H new ATOM 0 HG13 ILE A 89 0.671 18.625 -4.783 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -0.867 20.621 -5.191 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -0.350 22.235 -4.649 1.00 0.00 H new ATOM 0 HG23 ILE A 89 0.370 21.512 -6.107 1.00 0.00 H new ATOM 0 HD11 ILE A 89 2.251 18.445 -6.639 1.00 0.00 H new ATOM 0 HD12 ILE A 89 1.138 19.810 -6.894 1.00 0.00 H new ATOM 0 HD13 ILE A 89 2.804 20.111 -6.345 1.00 0.00 H new ATOM 695 N GLU A 90 1.624 22.565 -2.021 1.00 0.00 N ATOM 696 CA GLU A 90 1.275 23.624 -1.094 1.00 0.00 C ATOM 697 C GLU A 90 2.476 24.548 -0.908 1.00 0.00 C ATOM 698 O GLU A 90 2.341 25.678 -0.448 1.00 0.00 O ATOM 699 CB GLU A 90 0.848 23.029 0.250 1.00 0.00 C ATOM 700 CG GLU A 90 0.579 24.069 1.325 1.00 0.00 C ATOM 701 CD GLU A 90 0.264 23.447 2.672 1.00 0.00 C ATOM 702 OE1 GLU A 90 1.153 22.779 3.239 1.00 0.00 O ATOM 703 OE2 GLU A 90 -0.872 23.626 3.158 1.00 0.00 O ATOM 0 H GLU A 90 1.652 21.633 -1.607 1.00 0.00 H new ATOM 0 HA GLU A 90 0.440 24.197 -1.496 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -0.052 22.432 0.103 1.00 0.00 H new ATOM 0 HB3 GLU A 90 1.627 22.351 0.600 1.00 0.00 H new ATOM 0 HG2 GLU A 90 1.449 24.718 1.423 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -0.255 24.699 1.016 1.00 0.00 H new ATOM 710 N ALA A 91 3.654 24.045 -1.282 1.00 0.00 N ATOM 711 CA ALA A 91 4.891 24.805 -1.174 1.00 0.00 C ATOM 712 C ALA A 91 5.121 25.627 -2.432 1.00 0.00 C ATOM 713 O ALA A 91 5.308 26.840 -2.368 1.00 0.00 O ATOM 714 CB ALA A 91 6.066 23.870 -0.932 1.00 0.00 C ATOM 0 H ALA A 91 3.773 23.107 -1.665 1.00 0.00 H new ATOM 0 HA ALA A 91 4.806 25.485 -0.327 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.984 24.452 -0.853 1.00 0.00 H new ATOM 0 HB2 ALA A 91 5.906 23.317 -0.006 1.00 0.00 H new ATOM 0 HB3 ALA A 91 6.151 23.169 -1.763 1.00 0.00 H new ATOM 720 N LEU A 92 5.088 24.962 -3.582 1.00 0.00 N ATOM 721 CA LEU A 92 5.275 25.651 -4.853 1.00 0.00 C ATOM 722 C LEU A 92 4.212 26.732 -5.021 1.00 0.00 C ATOM 723 O LEU A 92 4.416 27.719 -5.731 1.00 0.00 O ATOM 724 CB LEU A 92 5.207 24.663 -6.019 1.00 0.00 C ATOM 725 CG LEU A 92 6.502 23.897 -6.296 1.00 0.00 C ATOM 726 CD1 LEU A 92 6.219 22.641 -7.106 1.00 0.00 C ATOM 727 CD2 LEU A 92 7.500 24.788 -7.020 1.00 0.00 C ATOM 0 H LEU A 92 4.935 23.957 -3.660 1.00 0.00 H new ATOM 0 HA LEU A 92 6.261 26.116 -4.852 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.413 23.943 -5.820 1.00 0.00 H new ATOM 0 HB3 LEU A 92 4.925 25.207 -6.920 1.00 0.00 H new ATOM 0 HG LEU A 92 6.936 23.597 -5.342 1.00 0.00 H new ATOM 0 HD11 LEU A 92 7.153 22.110 -7.293 1.00 0.00 H new ATOM 0 HD12 LEU A 92 5.539 21.995 -6.550 1.00 0.00 H new ATOM 0 HD13 LEU A 92 5.762 22.916 -8.057 1.00 0.00 H new ATOM 0 HD21 LEU A 92 8.416 24.229 -7.210 1.00 0.00 H new ATOM 0 HD22 LEU A 92 7.073 25.118 -7.967 1.00 0.00 H new ATOM 0 HD23 LEU A 92 7.727 25.657 -6.402 1.00 0.00 H new ATOM 739 N LEU A 93 3.077 26.540 -4.351 1.00 0.00 N ATOM 740 CA LEU A 93 1.981 27.493 -4.418 1.00 0.00 C ATOM 741 C LEU A 93 2.081 28.523 -3.298 1.00 0.00 C ATOM 742 O LEU A 93 1.815 29.703 -3.513 1.00 0.00 O ATOM 743 CB LEU A 93 0.636 26.767 -4.343 1.00 0.00 C ATOM 744 CG LEU A 93 0.010 26.430 -5.698 1.00 0.00 C ATOM 745 CD1 LEU A 93 0.357 25.007 -6.107 1.00 0.00 C ATOM 746 CD2 LEU A 93 -1.498 26.620 -5.651 1.00 0.00 C ATOM 0 H LEU A 93 2.896 25.731 -3.756 1.00 0.00 H new ATOM 0 HA LEU A 93 2.049 28.016 -5.372 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.769 25.843 -3.781 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -0.063 27.385 -3.780 1.00 0.00 H new ATOM 0 HG LEU A 93 0.419 27.111 -6.445 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.097 24.785 -7.073 1.00 0.00 H new ATOM 0 HD12 LEU A 93 1.439 24.904 -6.182 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -0.023 24.311 -5.359 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.926 26.376 -6.623 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -1.924 25.964 -4.892 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -1.727 27.657 -5.404 1.00 0.00 H new ATOM 758 N THR A 94 2.471 28.085 -2.102 1.00 0.00 N ATOM 759 CA THR A 94 2.596 29.018 -0.984 1.00 0.00 C ATOM 760 C THR A 94 3.794 29.947 -1.177 1.00 0.00 C ATOM 761 O THR A 94 3.943 30.936 -0.459 1.00 0.00 O ATOM 762 CB THR A 94 2.707 28.280 0.351 1.00 0.00 C ATOM 763 OG1 THR A 94 2.544 29.178 1.432 1.00 0.00 O ATOM 764 CG2 THR A 94 4.028 27.579 0.536 1.00 0.00 C ATOM 0 H THR A 94 2.701 27.115 -1.885 1.00 0.00 H new ATOM 0 HA THR A 94 1.689 29.622 -0.962 1.00 0.00 H new ATOM 0 HB THR A 94 1.915 27.531 0.335 1.00 0.00 H new ATOM 0 HG1 THR A 94 2.864 30.067 1.170 1.00 0.00 H new ATOM 0 HG21 THR A 94 4.041 27.076 1.503 1.00 0.00 H new ATOM 0 HG22 THR A 94 4.164 26.844 -0.257 1.00 0.00 H new ATOM 0 HG23 THR A 94 4.836 28.309 0.497 1.00 0.00 H new ATOM 772 N GLY A 95 4.646 29.623 -2.148 1.00 0.00 N ATOM 773 CA GLY A 95 5.817 30.440 -2.410 1.00 0.00 C ATOM 774 C GLY A 95 5.802 31.071 -3.791 1.00 0.00 C ATOM 775 O GLY A 95 6.279 32.191 -3.969 1.00 0.00 O ATOM 0 H GLY A 95 4.545 28.810 -2.756 1.00 0.00 H new ATOM 0 HA2 GLY A 95 5.881 31.226 -1.658 1.00 0.00 H new ATOM 0 HA3 GLY A 95 6.712 29.827 -2.306 1.00 0.00 H new ATOM 779 N LEU A 96 5.258 30.356 -4.776 1.00 0.00 N ATOM 780 CA LEU A 96 5.201 30.871 -6.143 1.00 0.00 C ATOM 781 C LEU A 96 3.839 31.476 -6.467 1.00 0.00 C ATOM 782 O LEU A 96 3.626 31.997 -7.561 1.00 0.00 O ATOM 783 CB LEU A 96 5.530 29.767 -7.144 1.00 0.00 C ATOM 784 CG LEU A 96 6.439 30.186 -8.301 1.00 0.00 C ATOM 785 CD1 LEU A 96 5.864 31.393 -9.024 1.00 0.00 C ATOM 786 CD2 LEU A 96 7.843 30.483 -7.794 1.00 0.00 C ATOM 0 H LEU A 96 4.854 29.427 -4.654 1.00 0.00 H new ATOM 0 HA LEU A 96 5.946 31.663 -6.221 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.005 28.944 -6.610 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.597 29.383 -7.557 1.00 0.00 H new ATOM 0 HG LEU A 96 6.497 29.360 -9.010 1.00 0.00 H new ATOM 0 HD11 LEU A 96 6.525 31.675 -9.843 1.00 0.00 H new ATOM 0 HD12 LEU A 96 4.880 31.144 -9.421 1.00 0.00 H new ATOM 0 HD13 LEU A 96 5.774 32.226 -8.327 1.00 0.00 H new ATOM 0 HD21 LEU A 96 8.477 30.780 -8.630 1.00 0.00 H new ATOM 0 HD22 LEU A 96 7.803 31.292 -7.064 1.00 0.00 H new ATOM 0 HD23 LEU A 96 8.256 29.591 -7.324 1.00 0.00 H new ATOM 798 N PHE A 97 2.926 31.403 -5.508 1.00 0.00 N ATOM 799 CA PHE A 97 1.576 31.937 -5.668 1.00 0.00 C ATOM 800 C PHE A 97 1.023 31.645 -7.074 1.00 0.00 C ATOM 801 O PHE A 97 1.002 30.490 -7.501 1.00 0.00 O ATOM 802 CB PHE A 97 1.564 33.439 -5.342 1.00 0.00 C ATOM 803 CG PHE A 97 2.748 34.197 -5.879 1.00 0.00 C ATOM 804 CD1 PHE A 97 3.970 34.145 -5.227 1.00 0.00 C ATOM 805 CD2 PHE A 97 2.639 34.966 -7.029 1.00 0.00 C ATOM 806 CE1 PHE A 97 5.061 34.841 -5.713 1.00 0.00 C ATOM 807 CE2 PHE A 97 3.727 35.663 -7.518 1.00 0.00 C ATOM 808 CZ PHE A 97 4.939 35.601 -6.859 1.00 0.00 C ATOM 0 H PHE A 97 3.097 30.974 -4.599 1.00 0.00 H new ATOM 0 HA PHE A 97 0.913 31.435 -4.963 1.00 0.00 H new ATOM 0 HB2 PHE A 97 0.652 33.879 -5.745 1.00 0.00 H new ATOM 0 HB3 PHE A 97 1.527 33.564 -4.260 1.00 0.00 H new ATOM 0 HD1 PHE A 97 4.071 33.554 -4.329 1.00 0.00 H new ATOM 0 HD2 PHE A 97 1.693 35.020 -7.547 1.00 0.00 H new ATOM 0 HE1 PHE A 97 6.008 34.790 -5.197 1.00 0.00 H new ATOM 0 HE2 PHE A 97 3.630 36.256 -8.415 1.00 0.00 H new ATOM 0 HZ PHE A 97 5.790 36.146 -7.240 1.00 0.00 H new ATOM 818 N VAL A 98 0.574 32.675 -7.790 1.00 0.00 N ATOM 819 CA VAL A 98 0.032 32.490 -9.130 1.00 0.00 C ATOM 820 C VAL A 98 1.035 32.918 -10.195 1.00 0.00 C ATOM 821 O VAL A 98 1.943 33.704 -9.926 1.00 0.00 O ATOM 822 CB VAL A 98 -1.279 33.280 -9.318 1.00 0.00 C ATOM 823 CG1 VAL A 98 -1.038 34.774 -9.156 1.00 0.00 C ATOM 824 CG2 VAL A 98 -1.898 32.973 -10.675 1.00 0.00 C ATOM 0 H VAL A 98 0.576 33.641 -7.464 1.00 0.00 H new ATOM 0 HA VAL A 98 -0.176 31.426 -9.244 1.00 0.00 H new ATOM 0 HB VAL A 98 -1.981 32.968 -8.545 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -1.977 35.311 -9.293 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -0.648 34.974 -8.158 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -0.316 35.109 -9.901 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -2.822 33.539 -10.790 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -1.201 33.253 -11.465 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -2.115 31.907 -10.743 1.00 0.00 H new ATOM 834 N GLN A 99 0.865 32.395 -11.405 1.00 0.00 N ATOM 835 CA GLN A 99 1.755 32.721 -12.513 1.00 0.00 C ATOM 836 C GLN A 99 1.081 33.683 -13.487 1.00 0.00 C ATOM 837 O GLN A 99 0.257 33.276 -14.306 1.00 0.00 O ATOM 838 CB GLN A 99 2.183 31.446 -13.243 1.00 0.00 C ATOM 839 CG GLN A 99 3.676 31.175 -13.172 1.00 0.00 C ATOM 840 CD GLN A 99 4.091 29.973 -13.997 1.00 0.00 C ATOM 841 OE1 GLN A 99 3.407 28.949 -14.009 1.00 0.00 O ATOM 842 NE2 GLN A 99 5.215 30.091 -14.694 1.00 0.00 N ATOM 0 H GLN A 99 0.118 31.743 -11.643 1.00 0.00 H new ATOM 0 HA GLN A 99 2.640 33.210 -12.106 1.00 0.00 H new ATOM 0 HB2 GLN A 99 1.648 30.597 -12.818 1.00 0.00 H new ATOM 0 HB3 GLN A 99 1.885 31.519 -14.289 1.00 0.00 H new ATOM 0 HG2 GLN A 99 4.218 32.054 -13.520 1.00 0.00 H new ATOM 0 HG3 GLN A 99 3.963 31.014 -12.133 1.00 0.00 H new ATOM 0 HE21 GLN A 99 5.751 30.958 -14.655 1.00 0.00 H new ATOM 0 HE22 GLN A 99 5.543 29.315 -15.269 1.00 0.00 H new ATOM 851 N ASP A 100 1.436 34.960 -13.392 1.00 0.00 N ATOM 852 CA ASP A 100 0.866 35.980 -14.266 1.00 0.00 C ATOM 853 C ASP A 100 1.370 35.816 -15.696 1.00 0.00 C ATOM 854 O ASP A 100 2.499 36.192 -16.013 1.00 0.00 O ATOM 855 CB ASP A 100 1.211 37.376 -13.747 1.00 0.00 C ATOM 856 CG ASP A 100 0.180 38.413 -14.146 1.00 0.00 C ATOM 857 OD1 ASP A 100 -1.026 38.156 -13.953 1.00 0.00 O ATOM 858 OD2 ASP A 100 0.580 39.483 -14.653 1.00 0.00 O ATOM 0 H ASP A 100 2.116 35.314 -12.719 1.00 0.00 H new ATOM 0 HA ASP A 100 -0.217 35.858 -14.267 1.00 0.00 H new ATOM 0 HB2 ASP A 100 1.291 37.347 -12.660 1.00 0.00 H new ATOM 0 HB3 ASP A 100 2.187 37.672 -14.131 1.00 0.00 H new ATOM 863 N ASN A 101 0.525 35.256 -16.555 1.00 0.00 N ATOM 864 CA ASN A 101 0.885 35.044 -17.952 1.00 0.00 C ATOM 865 C ASN A 101 -0.360 34.993 -18.832 1.00 0.00 C ATOM 866 O ASN A 101 -1.440 34.611 -18.377 1.00 0.00 O ATOM 867 CB ASN A 101 1.687 33.749 -18.104 1.00 0.00 C ATOM 868 CG ASN A 101 3.178 34.002 -18.217 1.00 0.00 C ATOM 869 OD1 ASN A 101 3.607 35.022 -18.759 1.00 0.00 O ATOM 870 ND2 ASN A 101 3.977 33.073 -17.705 1.00 0.00 N ATOM 0 H ASN A 101 -0.413 34.941 -16.308 1.00 0.00 H new ATOM 0 HA ASN A 101 1.501 35.883 -18.274 1.00 0.00 H new ATOM 0 HB2 ASN A 101 1.495 33.103 -17.247 1.00 0.00 H new ATOM 0 HB3 ASN A 101 1.344 33.214 -18.990 1.00 0.00 H new ATOM 0 HD21 ASN A 101 4.989 33.189 -17.752 1.00 0.00 H new ATOM 0 HD22 ASN A 101 3.578 32.244 -17.265 1.00 0.00 H new ATOM 877 N VAL A 102 -0.204 35.380 -20.094 1.00 0.00 N ATOM 878 CA VAL A 102 -1.315 35.378 -21.038 1.00 0.00 C ATOM 879 C VAL A 102 -1.139 34.290 -22.092 1.00 0.00 C ATOM 880 O VAL A 102 -2.117 33.752 -22.611 1.00 0.00 O ATOM 881 CB VAL A 102 -1.457 36.741 -21.742 1.00 0.00 C ATOM 882 CG1 VAL A 102 -2.036 37.776 -20.790 1.00 0.00 C ATOM 883 CG2 VAL A 102 -0.114 37.201 -22.288 1.00 0.00 C ATOM 0 H VAL A 102 0.682 35.699 -20.486 1.00 0.00 H new ATOM 0 HA VAL A 102 -2.219 35.179 -20.462 1.00 0.00 H new ATOM 0 HB VAL A 102 -2.145 36.627 -22.580 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -2.129 38.732 -21.305 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -3.019 37.449 -20.451 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -1.375 37.890 -19.930 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -0.233 38.165 -22.782 1.00 0.00 H new ATOM 0 HG22 VAL A 102 0.598 37.299 -21.468 1.00 0.00 H new ATOM 0 HG23 VAL A 102 0.257 36.469 -23.006 1.00 0.00 H new ATOM 893 N ASN A 103 0.113 33.970 -22.403 1.00 0.00 N ATOM 894 CA ASN A 103 0.417 32.944 -23.393 1.00 0.00 C ATOM 895 C ASN A 103 1.514 32.012 -22.892 1.00 0.00 C ATOM 896 O ASN A 103 2.019 32.173 -21.780 1.00 0.00 O ATOM 897 CB ASN A 103 0.842 33.593 -24.714 1.00 0.00 C ATOM 898 CG ASN A 103 -0.101 33.257 -25.854 1.00 0.00 C ATOM 899 OD1 ASN A 103 0.285 32.608 -26.824 1.00 0.00 O ATOM 900 ND2 ASN A 103 -1.348 33.700 -25.739 1.00 0.00 N ATOM 0 H ASN A 103 0.934 34.407 -21.983 1.00 0.00 H new ATOM 0 HA ASN A 103 -0.484 32.354 -23.559 1.00 0.00 H new ATOM 0 HB2 ASN A 103 0.883 34.675 -24.587 1.00 0.00 H new ATOM 0 HB3 ASN A 103 1.849 33.263 -24.970 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -2.028 33.505 -26.474 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -1.625 34.235 -24.916 1.00 0.00 H new ATOM 907 N LYS A 104 1.879 31.036 -23.715 1.00 0.00 N ATOM 908 CA LYS A 104 2.917 30.077 -23.354 1.00 0.00 C ATOM 909 C LYS A 104 4.284 30.549 -23.838 1.00 0.00 C ATOM 910 O LYS A 104 4.426 31.016 -24.969 1.00 0.00 O ATOM 911 CB LYS A 104 2.598 28.704 -23.945 1.00 0.00 C ATOM 912 CG LYS A 104 2.567 28.688 -25.466 1.00 0.00 C ATOM 913 CD LYS A 104 3.710 27.866 -26.041 1.00 0.00 C ATOM 914 CE LYS A 104 3.265 27.065 -27.255 1.00 0.00 C ATOM 915 NZ LYS A 104 4.273 26.043 -27.645 1.00 0.00 N ATOM 0 H LYS A 104 1.471 30.887 -24.638 1.00 0.00 H new ATOM 0 HA LYS A 104 2.944 29.999 -22.267 1.00 0.00 H new ATOM 0 HB2 LYS A 104 3.341 27.987 -23.597 1.00 0.00 H new ATOM 0 HB3 LYS A 104 1.632 28.370 -23.567 1.00 0.00 H new ATOM 0 HG2 LYS A 104 1.616 28.278 -25.807 1.00 0.00 H new ATOM 0 HG3 LYS A 104 2.627 29.709 -25.842 1.00 0.00 H new ATOM 0 HD2 LYS A 104 4.530 28.527 -26.321 1.00 0.00 H new ATOM 0 HD3 LYS A 104 4.093 27.189 -25.277 1.00 0.00 H new ATOM 0 HE2 LYS A 104 2.316 26.575 -27.038 1.00 0.00 H new ATOM 0 HE3 LYS A 104 3.091 27.741 -28.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 3.932 25.519 -28.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 5.172 26.512 -27.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 4.421 25.382 -26.856 1.00 0.00 H new ATOM 929 N ASP A 105 5.288 30.422 -22.976 1.00 0.00 N ATOM 930 CA ASP A 105 6.644 30.835 -23.317 1.00 0.00 C ATOM 931 C ASP A 105 7.473 29.645 -23.792 1.00 0.00 C ATOM 932 O ASP A 105 7.210 28.503 -23.415 1.00 0.00 O ATOM 933 CB ASP A 105 7.317 31.496 -22.110 1.00 0.00 C ATOM 934 CG ASP A 105 7.847 32.880 -22.428 1.00 0.00 C ATOM 935 OD1 ASP A 105 7.027 33.782 -22.696 1.00 0.00 O ATOM 936 OD2 ASP A 105 9.083 33.060 -22.410 1.00 0.00 O ATOM 0 H ASP A 105 5.188 30.037 -22.037 1.00 0.00 H new ATOM 0 HA ASP A 105 6.584 31.558 -24.130 1.00 0.00 H new ATOM 0 HB2 ASP A 105 6.601 31.564 -21.291 1.00 0.00 H new ATOM 0 HB3 ASP A 105 8.137 30.866 -21.765 1.00 0.00 H new ATOM 941 N ALA A 106 8.475 29.921 -24.621 1.00 0.00 N ATOM 942 CA ALA A 106 9.342 28.873 -25.146 1.00 0.00 C ATOM 943 C ALA A 106 10.689 29.442 -25.581 1.00 0.00 C ATOM 944 O ALA A 106 11.705 28.731 -25.438 1.00 0.00 O ATOM 945 CB ALA A 106 8.666 28.164 -26.310 1.00 0.00 C ATOM 946 OXT ALA A 106 10.715 30.594 -26.064 1.00 0.00 O ATOM 0 H ALA A 106 8.706 30.861 -24.943 1.00 0.00 H new ATOM 0 HA ALA A 106 9.522 28.151 -24.350 1.00 0.00 H new ATOM 0 HB1 ALA A 106 9.324 27.384 -26.693 1.00 0.00 H new ATOM 0 HB2 ALA A 106 7.732 27.716 -25.970 1.00 0.00 H new ATOM 0 HB3 ALA A 106 8.457 28.883 -27.102 1.00 0.00 H new TER 952 ALA A 106 ATOM 953 N THR B 50 1.658 -36.607 -10.792 1.00 0.00 N ATOM 954 CA THR B 50 0.332 -36.027 -10.452 1.00 0.00 C ATOM 955 C THR B 50 -0.605 -37.089 -9.883 1.00 0.00 C ATOM 956 O THR B 50 -1.780 -37.154 -10.248 1.00 0.00 O ATOM 957 CB THR B 50 -0.271 -35.413 -11.718 1.00 0.00 C ATOM 958 OG1 THR B 50 0.012 -36.218 -12.849 1.00 0.00 O ATOM 959 CG2 THR B 50 0.241 -34.018 -12.008 1.00 0.00 C ATOM 0 HA THR B 50 0.462 -35.261 -9.688 1.00 0.00 H new ATOM 0 HB THR B 50 -1.343 -35.358 -11.531 1.00 0.00 H new ATOM 0 HG1 THR B 50 0.816 -36.752 -12.678 1.00 0.00 H new ATOM 0 HG21 THR B 50 -0.226 -33.641 -12.918 1.00 0.00 H new ATOM 0 HG22 THR B 50 -0.005 -33.360 -11.175 1.00 0.00 H new ATOM 0 HG23 THR B 50 1.323 -34.048 -12.140 1.00 0.00 H new ATOM 969 N ARG B 51 -0.076 -37.919 -8.991 1.00 0.00 N ATOM 970 CA ARG B 51 -0.866 -38.980 -8.373 1.00 0.00 C ATOM 971 C ARG B 51 -0.609 -39.048 -6.869 1.00 0.00 C ATOM 972 O ARG B 51 -0.352 -40.119 -6.319 1.00 0.00 O ATOM 973 CB ARG B 51 -0.543 -40.326 -9.028 1.00 0.00 C ATOM 974 CG ARG B 51 -1.537 -40.729 -10.105 1.00 0.00 C ATOM 975 CD ARG B 51 -1.062 -40.308 -11.486 1.00 0.00 C ATOM 976 NE ARG B 51 0.234 -40.895 -11.824 1.00 0.00 N ATOM 977 CZ ARG B 51 0.793 -40.811 -13.027 1.00 0.00 C ATOM 978 NH1 ARG B 51 0.174 -40.170 -14.013 1.00 0.00 N ATOM 979 NH2 ARG B 51 1.976 -41.370 -13.249 1.00 0.00 N ATOM 0 H ARG B 51 0.894 -37.879 -8.679 1.00 0.00 H new ATOM 0 HA ARG B 51 -1.921 -38.754 -8.526 1.00 0.00 H new ATOM 0 HB2 ARG B 51 0.455 -40.279 -9.465 1.00 0.00 H new ATOM 0 HB3 ARG B 51 -0.518 -41.099 -8.260 1.00 0.00 H new ATOM 0 HG2 ARG B 51 -1.682 -41.809 -10.082 1.00 0.00 H new ATOM 0 HG3 ARG B 51 -2.505 -40.273 -9.897 1.00 0.00 H new ATOM 0 HD2 ARG B 51 -1.800 -40.607 -12.230 1.00 0.00 H new ATOM 0 HD3 ARG B 51 -0.990 -39.221 -11.528 1.00 0.00 H new ATOM 0 HE ARG B 51 0.738 -41.398 -11.094 1.00 0.00 H new ATOM 0 HH11 ARG B 51 -0.736 -39.739 -13.849 1.00 0.00 H new ATOM 0 HH12 ARG B 51 0.609 -40.109 -14.934 1.00 0.00 H new ATOM 0 HH21 ARG B 51 2.456 -41.864 -12.497 1.00 0.00 H new ATOM 0 HH22 ARG B 51 2.405 -41.306 -14.172 1.00 0.00 H new ATOM 993 N ALA B 52 -0.685 -37.897 -6.206 1.00 0.00 N ATOM 994 CA ALA B 52 -0.463 -37.833 -4.767 1.00 0.00 C ATOM 995 C ALA B 52 -1.360 -36.783 -4.116 1.00 0.00 C ATOM 996 O ALA B 52 -1.006 -36.203 -3.089 1.00 0.00 O ATOM 997 CB ALA B 52 0.998 -37.535 -4.467 1.00 0.00 C ATOM 0 H ALA B 52 -0.898 -37.000 -6.642 1.00 0.00 H new ATOM 0 HA ALA B 52 -0.719 -38.805 -4.346 1.00 0.00 H new ATOM 0 HB1 ALA B 52 1.146 -37.491 -3.388 1.00 0.00 H new ATOM 0 HB2 ALA B 52 1.624 -38.322 -4.887 1.00 0.00 H new ATOM 0 HB3 ALA B 52 1.273 -36.578 -4.911 1.00 0.00 H new ATOM 1003 N HIS B 53 -2.522 -36.545 -4.717 1.00 0.00 N ATOM 1004 CA HIS B 53 -3.467 -35.565 -4.191 1.00 0.00 C ATOM 1005 C HIS B 53 -2.838 -34.177 -4.140 1.00 0.00 C ATOM 1006 O HIS B 53 -1.921 -33.929 -3.357 1.00 0.00 O ATOM 1007 CB HIS B 53 -3.939 -35.981 -2.797 1.00 0.00 C ATOM 1008 CG HIS B 53 -4.648 -37.301 -2.776 1.00 0.00 C ATOM 1009 ND1 HIS B 53 -5.537 -37.692 -3.755 1.00 0.00 N ATOM 1010 CD2 HIS B 53 -4.594 -38.322 -1.888 1.00 0.00 C ATOM 1011 CE1 HIS B 53 -5.999 -38.898 -3.470 1.00 0.00 C ATOM 1012 NE2 HIS B 53 -5.442 -39.301 -2.343 1.00 0.00 N ATOM 0 H HIS B 53 -2.832 -37.016 -5.567 1.00 0.00 H new ATOM 0 HA HIS B 53 -4.327 -35.527 -4.860 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -3.078 -36.029 -2.130 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -4.605 -35.213 -2.403 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -3.996 -38.359 -0.990 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -6.711 -39.458 -4.059 1.00 0.00 H new ATOM 0 HE2 HIS B 53 -5.614 -40.196 -1.884 1.00 0.00 H new ATOM 1021 N LEU B 54 -3.329 -33.277 -4.985 1.00 0.00 N ATOM 1022 CA LEU B 54 -2.805 -31.915 -5.043 1.00 0.00 C ATOM 1023 C LEU B 54 -3.879 -30.879 -4.711 1.00 0.00 C ATOM 1024 O LEU B 54 -3.565 -29.729 -4.417 1.00 0.00 O ATOM 1025 CB LEU B 54 -2.235 -31.633 -6.434 1.00 0.00 C ATOM 1026 CG LEU B 54 -0.908 -32.329 -6.746 1.00 0.00 C ATOM 1027 CD1 LEU B 54 -0.975 -33.032 -8.094 1.00 0.00 C ATOM 1028 CD2 LEU B 54 0.237 -31.330 -6.721 1.00 0.00 C ATOM 0 H LEU B 54 -4.089 -33.465 -5.639 1.00 0.00 H new ATOM 0 HA LEU B 54 -2.016 -31.834 -4.295 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -2.970 -31.936 -7.179 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -2.097 -30.557 -6.542 1.00 0.00 H new ATOM 0 HG LEU B 54 -0.726 -33.080 -5.977 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -0.022 -33.521 -8.297 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -1.769 -33.779 -8.076 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -1.182 -32.301 -8.876 1.00 0.00 H new ATOM 0 HD21 LEU B 54 1.172 -31.843 -6.945 1.00 0.00 H new ATOM 0 HD22 LEU B 54 0.060 -30.555 -7.467 1.00 0.00 H new ATOM 0 HD23 LEU B 54 0.301 -30.874 -5.733 1.00 0.00 H new ATOM 1040 N THR B 55 -5.142 -31.284 -4.775 1.00 0.00 N ATOM 1041 CA THR B 55 -6.254 -30.378 -4.499 1.00 0.00 C ATOM 1042 C THR B 55 -6.116 -29.680 -3.140 1.00 0.00 C ATOM 1043 O THR B 55 -5.636 -28.549 -3.064 1.00 0.00 O ATOM 1044 CB THR B 55 -7.576 -31.142 -4.567 1.00 0.00 C ATOM 1045 OG1 THR B 55 -7.758 -31.716 -5.849 1.00 0.00 O ATOM 1046 CG2 THR B 55 -8.786 -30.281 -4.274 1.00 0.00 C ATOM 0 H THR B 55 -5.423 -32.234 -5.016 1.00 0.00 H new ATOM 0 HA THR B 55 -6.238 -29.600 -5.262 1.00 0.00 H new ATOM 0 HB THR B 55 -7.503 -31.909 -3.796 1.00 0.00 H new ATOM 0 HG1 THR B 55 -8.609 -32.202 -5.872 1.00 0.00 H new ATOM 0 HG21 THR B 55 -9.689 -30.888 -4.340 1.00 0.00 H new ATOM 0 HG22 THR B 55 -8.701 -29.864 -3.270 1.00 0.00 H new ATOM 0 HG23 THR B 55 -8.840 -29.470 -5.000 1.00 0.00 H new ATOM 1054 N GLU B 56 -6.561 -30.354 -2.079 1.00 0.00 N ATOM 1055 CA GLU B 56 -6.522 -29.809 -0.719 1.00 0.00 C ATOM 1056 C GLU B 56 -5.355 -28.844 -0.495 1.00 0.00 C ATOM 1057 O GLU B 56 -5.560 -27.679 -0.173 1.00 0.00 O ATOM 1058 CB GLU B 56 -6.455 -30.945 0.305 1.00 0.00 C ATOM 1059 CG GLU B 56 -5.518 -32.071 -0.092 1.00 0.00 C ATOM 1060 CD GLU B 56 -5.903 -33.398 0.532 1.00 0.00 C ATOM 1061 OE1 GLU B 56 -6.760 -34.099 -0.046 1.00 0.00 O ATOM 1062 OE2 GLU B 56 -5.346 -33.737 1.596 1.00 0.00 O ATOM 0 H GLU B 56 -6.958 -31.292 -2.137 1.00 0.00 H new ATOM 0 HA GLU B 56 -7.441 -29.239 -0.586 1.00 0.00 H new ATOM 0 HB2 GLU B 56 -6.134 -30.539 1.264 1.00 0.00 H new ATOM 0 HB3 GLU B 56 -7.456 -31.351 0.449 1.00 0.00 H new ATOM 0 HG2 GLU B 56 -5.516 -32.171 -1.177 1.00 0.00 H new ATOM 0 HG3 GLU B 56 -4.501 -31.815 0.206 1.00 0.00 H new ATOM 1069 N VAL B 57 -4.136 -29.337 -0.651 1.00 0.00 N ATOM 1070 CA VAL B 57 -2.947 -28.508 -0.444 1.00 0.00 C ATOM 1071 C VAL B 57 -2.958 -27.263 -1.330 1.00 0.00 C ATOM 1072 O VAL B 57 -2.575 -26.158 -0.890 1.00 0.00 O ATOM 1073 CB VAL B 57 -1.653 -29.298 -0.703 1.00 0.00 C ATOM 1074 CG1 VAL B 57 -0.466 -28.579 -0.083 1.00 0.00 C ATOM 1075 CG2 VAL B 57 -1.766 -30.718 -0.165 1.00 0.00 C ATOM 0 H VAL B 57 -3.939 -30.301 -0.919 1.00 0.00 H new ATOM 0 HA VAL B 57 -2.973 -28.197 0.600 1.00 0.00 H new ATOM 0 HB VAL B 57 -1.497 -29.361 -1.780 1.00 0.00 H new ATOM 0 HG11 VAL B 57 0.444 -29.148 -0.273 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -0.372 -27.586 -0.523 1.00 0.00 H new ATOM 0 HG13 VAL B 57 -0.618 -28.486 0.992 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -0.838 -31.256 -0.360 1.00 0.00 H new ATOM 0 HG22 VAL B 57 -1.948 -30.687 0.909 1.00 0.00 H new ATOM 0 HG23 VAL B 57 -2.593 -31.229 -0.658 1.00 0.00 H new ATOM 1085 N GLU B 58 -3.413 -27.427 -2.575 1.00 0.00 N ATOM 1086 CA GLU B 58 -3.480 -26.309 -3.500 1.00 0.00 C ATOM 1087 C GLU B 58 -4.362 -25.220 -2.913 1.00 0.00 C ATOM 1088 O GLU B 58 -3.928 -24.082 -2.737 1.00 0.00 O ATOM 1089 CB GLU B 58 -3.974 -26.766 -4.887 1.00 0.00 C ATOM 1090 CG GLU B 58 -5.451 -26.519 -5.154 1.00 0.00 C ATOM 1091 CD GLU B 58 -5.843 -26.823 -6.587 1.00 0.00 C ATOM 1092 OE1 GLU B 58 -5.484 -26.028 -7.482 1.00 0.00 O ATOM 1093 OE2 GLU B 58 -6.510 -27.854 -6.815 1.00 0.00 O ATOM 0 H GLU B 58 -3.736 -28.316 -2.956 1.00 0.00 H new ATOM 0 HA GLU B 58 -2.480 -25.900 -3.644 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -3.391 -26.253 -5.652 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -3.773 -27.832 -4.995 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -6.046 -27.135 -4.480 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -5.688 -25.479 -4.929 1.00 0.00 H new ATOM 1100 N SER B 59 -5.585 -25.590 -2.564 1.00 0.00 N ATOM 1101 CA SER B 59 -6.508 -24.652 -1.948 1.00 0.00 C ATOM 1102 C SER B 59 -5.954 -24.198 -0.601 1.00 0.00 C ATOM 1103 O SER B 59 -6.425 -23.222 -0.020 1.00 0.00 O ATOM 1104 CB SER B 59 -7.884 -25.297 -1.765 1.00 0.00 C ATOM 1105 OG SER B 59 -8.753 -24.448 -1.034 1.00 0.00 O ATOM 0 H SER B 59 -5.959 -26.530 -2.697 1.00 0.00 H new ATOM 0 HA SER B 59 -6.620 -23.785 -2.600 1.00 0.00 H new ATOM 0 HB2 SER B 59 -8.319 -25.515 -2.740 1.00 0.00 H new ATOM 0 HB3 SER B 59 -7.777 -26.248 -1.244 1.00 0.00 H new ATOM 0 HG SER B 59 -8.226 -23.777 -0.553 1.00 0.00 H new ATOM 1111 N ARG B 60 -4.957 -24.933 -0.105 1.00 0.00 N ATOM 1112 CA ARG B 60 -4.329 -24.639 1.168 1.00 0.00 C ATOM 1113 C ARG B 60 -3.493 -23.381 1.096 1.00 0.00 C ATOM 1114 O ARG B 60 -3.895 -22.333 1.621 1.00 0.00 O ATOM 1115 CB ARG B 60 -3.455 -25.811 1.609 1.00 0.00 C ATOM 1116 CG ARG B 60 -3.358 -25.970 3.118 1.00 0.00 C ATOM 1117 CD ARG B 60 -1.941 -26.307 3.556 1.00 0.00 C ATOM 1118 NE ARG B 60 -1.820 -26.384 5.010 1.00 0.00 N ATOM 1119 CZ ARG B 60 -0.806 -26.972 5.641 1.00 0.00 C ATOM 1120 NH1 ARG B 60 0.178 -27.535 4.950 1.00 0.00 N ATOM 1121 NH2 ARG B 60 -0.774 -26.997 6.967 1.00 0.00 N ATOM 0 H ARG B 60 -4.568 -25.747 -0.581 1.00 0.00 H new ATOM 0 HA ARG B 60 -5.122 -24.480 1.898 1.00 0.00 H new ATOM 0 HB2 ARG B 60 -3.854 -26.731 1.181 1.00 0.00 H new ATOM 0 HB3 ARG B 60 -2.453 -25.678 1.202 1.00 0.00 H new ATOM 0 HG2 ARG B 60 -3.680 -25.048 3.603 1.00 0.00 H new ATOM 0 HG3 ARG B 60 -4.038 -26.757 3.446 1.00 0.00 H new ATOM 0 HD2 ARG B 60 -1.643 -27.259 3.117 1.00 0.00 H new ATOM 0 HD3 ARG B 60 -1.254 -25.551 3.175 1.00 0.00 H new ATOM 0 HE ARG B 60 -2.557 -25.962 5.575 1.00 0.00 H new ATOM 0 HH11 ARG B 60 0.160 -27.518 3.930 1.00 0.00 H new ATOM 0 HH12 ARG B 60 0.952 -27.984 5.439 1.00 0.00 H new ATOM 0 HH21 ARG B 60 -1.527 -26.566 7.504 1.00 0.00 H new ATOM 0 HH22 ARG B 60 0.003 -27.448 7.450 1.00 0.00 H new ATOM 1135 N LEU B 61 -2.326 -23.450 0.453 1.00 0.00 N ATOM 1136 CA LEU B 61 -1.519 -22.244 0.387 1.00 0.00 C ATOM 1137 C LEU B 61 -2.232 -21.198 -0.450 1.00 0.00 C ATOM 1138 O LEU B 61 -1.998 -19.997 -0.304 1.00 0.00 O ATOM 1139 CB LEU B 61 -0.103 -22.510 -0.094 1.00 0.00 C ATOM 1140 CG LEU B 61 0.926 -22.420 1.038 1.00 0.00 C ATOM 1141 CD1 LEU B 61 1.789 -23.663 1.077 1.00 0.00 C ATOM 1142 CD2 LEU B 61 1.773 -21.163 0.910 1.00 0.00 C ATOM 0 H LEU B 61 -1.940 -24.277 -0.002 1.00 0.00 H new ATOM 0 HA LEU B 61 -1.404 -21.855 1.399 1.00 0.00 H new ATOM 0 HB2 LEU B 61 -0.056 -23.501 -0.546 1.00 0.00 H new ATOM 0 HB3 LEU B 61 0.154 -21.792 -0.873 1.00 0.00 H new ATOM 0 HG LEU B 61 0.386 -22.357 1.983 1.00 0.00 H new ATOM 0 HD11 LEU B 61 2.513 -23.578 1.888 1.00 0.00 H new ATOM 0 HD12 LEU B 61 1.160 -24.538 1.242 1.00 0.00 H new ATOM 0 HD13 LEU B 61 2.317 -23.769 0.129 1.00 0.00 H new ATOM 0 HD21 LEU B 61 2.494 -21.126 1.726 1.00 0.00 H new ATOM 0 HD22 LEU B 61 2.303 -21.177 -0.042 1.00 0.00 H new ATOM 0 HD23 LEU B 61 1.129 -20.284 0.954 1.00 0.00 H new ATOM 1154 N GLU B 62 -3.169 -21.663 -1.269 1.00 0.00 N ATOM 1155 CA GLU B 62 -3.985 -20.765 -2.060 1.00 0.00 C ATOM 1156 C GLU B 62 -4.817 -19.933 -1.099 1.00 0.00 C ATOM 1157 O GLU B 62 -5.005 -18.730 -1.288 1.00 0.00 O ATOM 1158 CB GLU B 62 -4.894 -21.550 -3.001 1.00 0.00 C ATOM 1159 CG GLU B 62 -5.734 -20.670 -3.913 1.00 0.00 C ATOM 1160 CD GLU B 62 -7.035 -20.233 -3.266 1.00 0.00 C ATOM 1161 OE1 GLU B 62 -7.675 -21.071 -2.598 1.00 0.00 O ATOM 1162 OE2 GLU B 62 -7.410 -19.053 -3.428 1.00 0.00 O ATOM 0 H GLU B 62 -3.378 -22.653 -1.398 1.00 0.00 H new ATOM 0 HA GLU B 62 -3.352 -20.124 -2.674 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -4.283 -22.214 -3.613 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -5.556 -22.182 -2.409 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -5.158 -19.788 -4.193 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -5.954 -21.212 -4.833 1.00 0.00 H new ATOM 1169 N ARG B 63 -5.279 -20.593 -0.031 1.00 0.00 N ATOM 1170 CA ARG B 63 -6.050 -19.922 0.999 1.00 0.00 C ATOM 1171 C ARG B 63 -5.127 -19.003 1.786 1.00 0.00 C ATOM 1172 O ARG B 63 -5.549 -17.962 2.289 1.00 0.00 O ATOM 1173 CB ARG B 63 -6.705 -20.942 1.934 1.00 0.00 C ATOM 1174 CG ARG B 63 -8.104 -21.354 1.504 1.00 0.00 C ATOM 1175 CD ARG B 63 -8.493 -22.704 2.087 1.00 0.00 C ATOM 1176 NE ARG B 63 -9.848 -23.096 1.710 1.00 0.00 N ATOM 1177 CZ ARG B 63 -10.305 -24.345 1.781 1.00 0.00 C ATOM 1178 NH1 ARG B 63 -9.516 -25.323 2.211 1.00 0.00 N ATOM 1179 NH2 ARG B 63 -11.552 -24.616 1.422 1.00 0.00 N ATOM 0 H ARG B 63 -5.128 -21.588 0.134 1.00 0.00 H new ATOM 0 HA ARG B 63 -6.842 -19.336 0.533 1.00 0.00 H new ATOM 0 HB2 ARG B 63 -6.075 -21.830 1.988 1.00 0.00 H new ATOM 0 HB3 ARG B 63 -6.752 -20.523 2.939 1.00 0.00 H new ATOM 0 HG2 ARG B 63 -8.821 -20.598 1.824 1.00 0.00 H new ATOM 0 HG3 ARG B 63 -8.153 -21.399 0.416 1.00 0.00 H new ATOM 0 HD2 ARG B 63 -7.789 -23.462 1.745 1.00 0.00 H new ATOM 0 HD3 ARG B 63 -8.417 -22.665 3.174 1.00 0.00 H new ATOM 0 HE ARG B 63 -10.481 -22.371 1.373 1.00 0.00 H new ATOM 0 HH11 ARG B 63 -8.556 -25.119 2.488 1.00 0.00 H new ATOM 0 HH12 ARG B 63 -9.870 -26.278 2.264 1.00 0.00 H new ATOM 0 HH21 ARG B 63 -12.162 -23.868 1.091 1.00 0.00 H new ATOM 0 HH22 ARG B 63 -11.902 -25.573 1.476 1.00 0.00 H new ATOM 1193 N LEU B 64 -3.850 -19.387 1.857 1.00 0.00 N ATOM 1194 CA LEU B 64 -2.855 -18.578 2.553 1.00 0.00 C ATOM 1195 C LEU B 64 -2.633 -17.275 1.797 1.00 0.00 C ATOM 1196 O LEU B 64 -2.293 -16.246 2.379 1.00 0.00 O ATOM 1197 CB LEU B 64 -1.537 -19.351 2.700 1.00 0.00 C ATOM 1198 CG LEU B 64 -0.264 -18.496 2.728 1.00 0.00 C ATOM 1199 CD1 LEU B 64 0.787 -19.128 3.629 1.00 0.00 C ATOM 1200 CD2 LEU B 64 0.282 -18.307 1.319 1.00 0.00 C ATOM 0 H LEU B 64 -3.486 -20.246 1.444 1.00 0.00 H new ATOM 0 HA LEU B 64 -3.222 -18.347 3.553 1.00 0.00 H new ATOM 0 HB2 LEU B 64 -1.580 -19.935 3.619 1.00 0.00 H new ATOM 0 HB3 LEU B 64 -1.459 -20.059 1.875 1.00 0.00 H new ATOM 0 HG LEU B 64 -0.517 -17.516 3.134 1.00 0.00 H new ATOM 0 HD11 LEU B 64 1.682 -18.506 3.635 1.00 0.00 H new ATOM 0 HD12 LEU B 64 0.395 -19.210 4.643 1.00 0.00 H new ATOM 0 HD13 LEU B 64 1.037 -20.121 3.255 1.00 0.00 H new ATOM 0 HD21 LEU B 64 1.185 -17.698 1.357 1.00 0.00 H new ATOM 0 HD22 LEU B 64 0.518 -19.279 0.887 1.00 0.00 H new ATOM 0 HD23 LEU B 64 -0.466 -17.808 0.703 1.00 0.00 H new ATOM 1212 N GLU B 65 -2.845 -17.343 0.495 1.00 0.00 N ATOM 1213 CA GLU B 65 -2.691 -16.189 -0.379 1.00 0.00 C ATOM 1214 C GLU B 65 -3.961 -15.349 -0.365 1.00 0.00 C ATOM 1215 O GLU B 65 -3.911 -14.126 -0.507 1.00 0.00 O ATOM 1216 CB GLU B 65 -2.380 -16.641 -1.807 1.00 0.00 C ATOM 1217 CG GLU B 65 -2.145 -15.491 -2.772 1.00 0.00 C ATOM 1218 CD GLU B 65 -3.351 -15.209 -3.646 1.00 0.00 C ATOM 1219 OE1 GLU B 65 -3.545 -15.936 -4.643 1.00 0.00 O ATOM 1220 OE2 GLU B 65 -4.103 -14.262 -3.333 1.00 0.00 O ATOM 0 H GLU B 65 -3.128 -18.196 0.013 1.00 0.00 H new ATOM 0 HA GLU B 65 -1.861 -15.584 -0.014 1.00 0.00 H new ATOM 0 HB2 GLU B 65 -1.496 -17.279 -1.793 1.00 0.00 H new ATOM 0 HB3 GLU B 65 -3.206 -17.250 -2.175 1.00 0.00 H new ATOM 0 HG2 GLU B 65 -1.892 -14.594 -2.207 1.00 0.00 H new ATOM 0 HG3 GLU B 65 -1.288 -15.722 -3.405 1.00 0.00 H new ATOM 1227 N GLN B 66 -5.099 -16.013 -0.180 1.00 0.00 N ATOM 1228 CA GLN B 66 -6.383 -15.325 -0.134 1.00 0.00 C ATOM 1229 C GLN B 66 -6.397 -14.308 1.003 1.00 0.00 C ATOM 1230 O GLN B 66 -7.081 -13.286 0.930 1.00 0.00 O ATOM 1231 CB GLN B 66 -7.520 -16.332 0.049 1.00 0.00 C ATOM 1232 CG GLN B 66 -8.775 -15.981 -0.732 1.00 0.00 C ATOM 1233 CD GLN B 66 -10.003 -15.855 0.151 1.00 0.00 C ATOM 1234 OE1 GLN B 66 -9.954 -16.135 1.348 1.00 0.00 O ATOM 1235 NE2 GLN B 66 -11.115 -15.433 -0.440 1.00 0.00 N ATOM 0 H GLN B 66 -5.157 -17.024 -0.060 1.00 0.00 H new ATOM 0 HA GLN B 66 -6.529 -14.800 -1.078 1.00 0.00 H new ATOM 0 HB2 GLN B 66 -7.174 -17.318 -0.260 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -7.768 -16.399 1.108 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -8.617 -15.042 -1.262 1.00 0.00 H new ATOM 0 HG3 GLN B 66 -8.953 -16.747 -1.487 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -11.111 -15.212 -1.436 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -11.973 -15.330 0.102 1.00 0.00 H new ATOM 1244 N LEU B 67 -5.630 -14.595 2.050 1.00 0.00 N ATOM 1245 CA LEU B 67 -5.541 -13.708 3.202 1.00 0.00 C ATOM 1246 C LEU B 67 -4.520 -12.597 2.966 1.00 0.00 C ATOM 1247 O LEU B 67 -4.460 -11.631 3.726 1.00 0.00 O ATOM 1248 CB LEU B 67 -5.160 -14.501 4.456 1.00 0.00 C ATOM 1249 CG LEU B 67 -6.202 -15.518 4.921 1.00 0.00 C ATOM 1250 CD1 LEU B 67 -5.525 -16.716 5.569 1.00 0.00 C ATOM 1251 CD2 LEU B 67 -7.182 -14.871 5.889 1.00 0.00 C ATOM 0 H LEU B 67 -5.060 -15.438 2.123 1.00 0.00 H new ATOM 0 HA LEU B 67 -6.520 -13.252 3.347 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -4.223 -15.025 4.265 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -4.973 -13.799 5.268 1.00 0.00 H new ATOM 0 HG LEU B 67 -6.757 -15.866 4.050 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -6.282 -17.430 5.894 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -4.862 -17.193 4.848 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -4.945 -16.384 6.430 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -7.917 -15.609 6.210 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -6.641 -14.496 6.758 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -7.691 -14.044 5.393 1.00 0.00 H new ATOM 1263 N PHE B 68 -3.714 -12.741 1.912 1.00 0.00 N ATOM 1264 CA PHE B 68 -2.697 -11.746 1.585 1.00 0.00 C ATOM 1265 C PHE B 68 -1.628 -11.689 2.673 1.00 0.00 C ATOM 1266 O PHE B 68 -1.788 -10.997 3.678 1.00 0.00 O ATOM 1267 CB PHE B 68 -3.339 -10.365 1.399 1.00 0.00 C ATOM 1268 CG PHE B 68 -2.346 -9.250 1.215 1.00 0.00 C ATOM 1269 CD1 PHE B 68 -1.732 -9.046 -0.011 1.00 0.00 C ATOM 1270 CD2 PHE B 68 -2.028 -8.408 2.268 1.00 0.00 C ATOM 1271 CE1 PHE B 68 -0.819 -8.022 -0.182 1.00 0.00 C ATOM 1272 CE2 PHE B 68 -1.116 -7.383 2.103 1.00 0.00 C ATOM 1273 CZ PHE B 68 -0.512 -7.189 0.875 1.00 0.00 C ATOM 0 H PHE B 68 -3.747 -13.536 1.273 1.00 0.00 H new ATOM 0 HA PHE B 68 -2.221 -12.040 0.649 1.00 0.00 H new ATOM 0 HB2 PHE B 68 -4.000 -10.396 0.533 1.00 0.00 H new ATOM 0 HB3 PHE B 68 -3.961 -10.145 2.267 1.00 0.00 H new ATOM 0 HD1 PHE B 68 -1.969 -9.694 -0.842 1.00 0.00 H new ATOM 0 HD2 PHE B 68 -2.498 -8.554 3.229 1.00 0.00 H new ATOM 0 HE1 PHE B 68 -0.346 -7.874 -1.142 1.00 0.00 H new ATOM 0 HE2 PHE B 68 -0.876 -6.734 2.932 1.00 0.00 H new ATOM 0 HZ PHE B 68 0.199 -6.387 0.743 1.00 0.00 H new ATOM 1283 N LEU B 69 -0.538 -12.421 2.463 1.00 0.00 N ATOM 1284 CA LEU B 69 0.557 -12.453 3.425 1.00 0.00 C ATOM 1285 C LEU B 69 1.872 -12.822 2.744 1.00 0.00 C ATOM 1286 O LEU B 69 1.882 -13.440 1.679 1.00 0.00 O ATOM 1287 CB LEU B 69 0.247 -13.450 4.547 1.00 0.00 C ATOM 1288 CG LEU B 69 0.210 -12.853 5.955 1.00 0.00 C ATOM 1289 CD1 LEU B 69 1.490 -12.083 6.242 1.00 0.00 C ATOM 1290 CD2 LEU B 69 -1.004 -11.954 6.119 1.00 0.00 C ATOM 0 H LEU B 69 -0.390 -12.999 1.636 1.00 0.00 H new ATOM 0 HA LEU B 69 0.662 -11.456 3.853 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -0.717 -13.916 4.342 1.00 0.00 H new ATOM 0 HB3 LEU B 69 0.995 -14.242 4.525 1.00 0.00 H new ATOM 0 HG LEU B 69 0.133 -13.669 6.674 1.00 0.00 H new ATOM 0 HD11 LEU B 69 1.446 -11.665 7.248 1.00 0.00 H new ATOM 0 HD12 LEU B 69 2.344 -12.756 6.166 1.00 0.00 H new ATOM 0 HD13 LEU B 69 1.599 -11.275 5.518 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -1.015 -11.538 7.126 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -0.957 -11.143 5.392 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -1.912 -12.535 5.957 1.00 0.00 H new ATOM 1302 N LEU B 70 2.981 -12.441 3.371 1.00 0.00 N ATOM 1303 CA LEU B 70 4.308 -12.729 2.840 1.00 0.00 C ATOM 1304 C LEU B 70 4.460 -12.228 1.403 1.00 0.00 C ATOM 1305 O LEU B 70 5.324 -12.701 0.664 1.00 0.00 O ATOM 1306 CB LEU B 70 4.579 -14.233 2.907 1.00 0.00 C ATOM 1307 CG LEU B 70 5.725 -14.639 3.834 1.00 0.00 C ATOM 1308 CD1 LEU B 70 5.749 -16.148 4.026 1.00 0.00 C ATOM 1309 CD2 LEU B 70 7.056 -14.149 3.283 1.00 0.00 C ATOM 0 H LEU B 70 2.986 -11.929 4.253 1.00 0.00 H new ATOM 0 HA LEU B 70 5.038 -12.201 3.453 1.00 0.00 H new ATOM 0 HB2 LEU B 70 3.670 -14.737 3.235 1.00 0.00 H new ATOM 0 HB3 LEU B 70 4.799 -14.593 1.902 1.00 0.00 H new ATOM 0 HG LEU B 70 5.562 -14.173 4.806 1.00 0.00 H new ATOM 0 HD11 LEU B 70 6.571 -16.417 4.689 1.00 0.00 H new ATOM 0 HD12 LEU B 70 4.807 -16.474 4.466 1.00 0.00 H new ATOM 0 HD13 LEU B 70 5.886 -16.635 3.061 1.00 0.00 H new ATOM 0 HD21 LEU B 70 7.860 -14.447 3.956 1.00 0.00 H new ATOM 0 HD22 LEU B 70 7.225 -14.586 2.299 1.00 0.00 H new ATOM 0 HD23 LEU B 70 7.037 -13.062 3.199 1.00 0.00 H new ATOM 1321 N ILE B 71 3.628 -11.267 1.014 1.00 0.00 N ATOM 1322 CA ILE B 71 3.686 -10.708 -0.330 1.00 0.00 C ATOM 1323 C ILE B 71 3.947 -9.202 -0.282 1.00 0.00 C ATOM 1324 O ILE B 71 4.830 -8.696 -0.976 1.00 0.00 O ATOM 1325 CB ILE B 71 2.388 -11.002 -1.119 1.00 0.00 C ATOM 1326 CG1 ILE B 71 2.613 -10.795 -2.620 1.00 0.00 C ATOM 1327 CG2 ILE B 71 1.231 -10.147 -0.621 1.00 0.00 C ATOM 1328 CD1 ILE B 71 2.776 -9.344 -3.022 1.00 0.00 C ATOM 0 H ILE B 71 2.907 -10.860 1.610 1.00 0.00 H new ATOM 0 HA ILE B 71 4.515 -11.189 -0.850 1.00 0.00 H new ATOM 0 HB ILE B 71 2.122 -12.046 -0.951 1.00 0.00 H new ATOM 0 HG12 ILE B 71 3.502 -11.348 -2.924 1.00 0.00 H new ATOM 0 HG13 ILE B 71 1.771 -11.221 -3.166 1.00 0.00 H new ATOM 0 HG21 ILE B 71 0.334 -10.378 -1.196 1.00 0.00 H new ATOM 0 HG22 ILE B 71 1.050 -10.357 0.433 1.00 0.00 H new ATOM 0 HG23 ILE B 71 1.479 -9.093 -0.743 1.00 0.00 H new ATOM 0 HD11 ILE B 71 2.931 -9.280 -4.099 1.00 0.00 H new ATOM 0 HD12 ILE B 71 1.878 -8.788 -2.751 1.00 0.00 H new ATOM 0 HD13 ILE B 71 3.636 -8.918 -2.506 1.00 0.00 H new ATOM 1340 N PHE B 72 3.184 -8.495 0.549 1.00 0.00 N ATOM 1341 CA PHE B 72 3.341 -7.051 0.696 1.00 0.00 C ATOM 1342 C PHE B 72 3.213 -6.339 -0.651 1.00 0.00 C ATOM 1343 O PHE B 72 3.269 -6.971 -1.706 1.00 0.00 O ATOM 1344 CB PHE B 72 4.695 -6.728 1.331 1.00 0.00 C ATOM 1345 CG PHE B 72 4.635 -6.554 2.821 1.00 0.00 C ATOM 1346 CD1 PHE B 72 4.362 -7.633 3.648 1.00 0.00 C ATOM 1347 CD2 PHE B 72 4.851 -5.313 3.396 1.00 0.00 C ATOM 1348 CE1 PHE B 72 4.306 -7.476 5.020 1.00 0.00 C ATOM 1349 CE2 PHE B 72 4.795 -5.149 4.768 1.00 0.00 C ATOM 1350 CZ PHE B 72 4.523 -6.232 5.580 1.00 0.00 C ATOM 0 H PHE B 72 2.451 -8.900 1.131 1.00 0.00 H new ATOM 0 HA PHE B 72 2.544 -6.692 1.347 1.00 0.00 H new ATOM 0 HB2 PHE B 72 5.397 -7.528 1.095 1.00 0.00 H new ATOM 0 HB3 PHE B 72 5.088 -5.816 0.883 1.00 0.00 H new ATOM 0 HD1 PHE B 72 4.191 -8.608 3.215 1.00 0.00 H new ATOM 0 HD2 PHE B 72 5.066 -4.463 2.765 1.00 0.00 H new ATOM 0 HE1 PHE B 72 4.093 -8.325 5.653 1.00 0.00 H new ATOM 0 HE2 PHE B 72 4.964 -4.175 5.204 1.00 0.00 H new ATOM 0 HZ PHE B 72 4.480 -6.107 6.652 1.00 0.00 H new ATOM 1360 N PRO B 73 3.041 -5.006 -0.632 1.00 0.00 N ATOM 1361 CA PRO B 73 2.908 -4.212 -1.854 1.00 0.00 C ATOM 1362 C PRO B 73 4.252 -3.958 -2.527 1.00 0.00 C ATOM 1363 O PRO B 73 5.188 -3.462 -1.899 1.00 0.00 O ATOM 1364 CB PRO B 73 2.305 -2.902 -1.348 1.00 0.00 C ATOM 1365 CG PRO B 73 2.819 -2.767 0.043 1.00 0.00 C ATOM 1366 CD PRO B 73 2.963 -4.167 0.582 1.00 0.00 C ATOM 0 HA PRO B 73 2.305 -4.714 -2.610 1.00 0.00 H new ATOM 0 HB2 PRO B 73 2.611 -2.059 -1.968 1.00 0.00 H new ATOM 0 HB3 PRO B 73 1.216 -2.933 -1.367 1.00 0.00 H new ATOM 0 HG2 PRO B 73 3.777 -2.246 0.054 1.00 0.00 H new ATOM 0 HG3 PRO B 73 2.132 -2.184 0.656 1.00 0.00 H new ATOM 0 HD2 PRO B 73 3.857 -4.269 1.197 1.00 0.00 H new ATOM 0 HD3 PRO B 73 2.114 -4.445 1.206 1.00 0.00 H new ATOM 1374 N ARG B 74 4.343 -4.303 -3.807 1.00 0.00 N ATOM 1375 CA ARG B 74 5.576 -4.115 -4.562 1.00 0.00 C ATOM 1376 C ARG B 74 5.485 -2.885 -5.460 1.00 0.00 C ATOM 1377 O ARG B 74 6.490 -2.228 -5.732 1.00 0.00 O ATOM 1378 CB ARG B 74 5.875 -5.357 -5.405 1.00 0.00 C ATOM 1379 CG ARG B 74 6.289 -6.565 -4.580 1.00 0.00 C ATOM 1380 CD ARG B 74 7.661 -6.371 -3.956 1.00 0.00 C ATOM 1381 NE ARG B 74 8.002 -7.453 -3.036 1.00 0.00 N ATOM 1382 CZ ARG B 74 8.951 -7.364 -2.106 1.00 0.00 C ATOM 1383 NH1 ARG B 74 9.654 -6.246 -1.969 1.00 0.00 N ATOM 1384 NH2 ARG B 74 9.197 -8.395 -1.309 1.00 0.00 N ATOM 0 H ARG B 74 3.578 -4.714 -4.343 1.00 0.00 H new ATOM 0 HA ARG B 74 6.388 -3.962 -3.851 1.00 0.00 H new ATOM 0 HB2 ARG B 74 4.990 -5.612 -5.989 1.00 0.00 H new ATOM 0 HB3 ARG B 74 6.669 -5.122 -6.115 1.00 0.00 H new ATOM 0 HG2 ARG B 74 5.553 -6.740 -3.795 1.00 0.00 H new ATOM 0 HG3 ARG B 74 6.298 -7.453 -5.212 1.00 0.00 H new ATOM 0 HD2 ARG B 74 8.413 -6.314 -4.743 1.00 0.00 H new ATOM 0 HD3 ARG B 74 7.686 -5.421 -3.423 1.00 0.00 H new ATOM 0 HE ARG B 74 7.483 -8.328 -3.110 1.00 0.00 H new ATOM 0 HH11 ARG B 74 9.468 -5.449 -2.578 1.00 0.00 H new ATOM 0 HH12 ARG B 74 10.380 -6.184 -1.255 1.00 0.00 H new ATOM 0 HH21 ARG B 74 8.659 -9.256 -1.408 1.00 0.00 H new ATOM 0 HH22 ARG B 74 9.924 -8.327 -0.597 1.00 0.00 H new ATOM 1398 N GLU B 75 4.276 -2.578 -5.918 1.00 0.00 N ATOM 1399 CA GLU B 75 4.059 -1.426 -6.786 1.00 0.00 C ATOM 1400 C GLU B 75 3.702 -0.189 -5.968 1.00 0.00 C ATOM 1401 O GLU B 75 3.401 -0.284 -4.778 1.00 0.00 O ATOM 1402 CB GLU B 75 2.949 -1.722 -7.796 1.00 0.00 C ATOM 1403 CG GLU B 75 3.124 -3.049 -8.516 1.00 0.00 C ATOM 1404 CD GLU B 75 1.876 -3.474 -9.265 1.00 0.00 C ATOM 1405 OE1 GLU B 75 0.777 -3.000 -8.907 1.00 0.00 O ATOM 1406 OE2 GLU B 75 1.997 -4.281 -10.211 1.00 0.00 O ATOM 0 H GLU B 75 3.433 -3.110 -5.703 1.00 0.00 H new ATOM 0 HA GLU B 75 4.986 -1.229 -7.324 1.00 0.00 H new ATOM 0 HB2 GLU B 75 1.989 -1.721 -7.280 1.00 0.00 H new ATOM 0 HB3 GLU B 75 2.915 -0.919 -8.533 1.00 0.00 H new ATOM 0 HG2 GLU B 75 3.955 -2.971 -9.217 1.00 0.00 H new ATOM 0 HG3 GLU B 75 3.389 -3.819 -7.792 1.00 0.00 H new ATOM 1413 N ASP B 76 3.739 0.972 -6.615 1.00 0.00 N ATOM 1414 CA ASP B 76 3.421 2.229 -5.948 1.00 0.00 C ATOM 1415 C ASP B 76 2.076 2.771 -6.420 1.00 0.00 C ATOM 1416 O ASP B 76 1.269 3.240 -5.617 1.00 0.00 O ATOM 1417 CB ASP B 76 4.520 3.262 -6.208 1.00 0.00 C ATOM 1418 CG ASP B 76 5.811 2.927 -5.489 1.00 0.00 C ATOM 1419 OD1 ASP B 76 5.743 2.366 -4.374 1.00 0.00 O ATOM 1420 OD2 ASP B 76 6.892 3.227 -6.038 1.00 0.00 O ATOM 0 H ASP B 76 3.986 1.068 -7.600 1.00 0.00 H new ATOM 0 HA ASP B 76 3.359 2.037 -4.877 1.00 0.00 H new ATOM 0 HB2 ASP B 76 4.710 3.324 -7.280 1.00 0.00 H new ATOM 0 HB3 ASP B 76 4.174 4.245 -5.888 1.00 0.00 H new ATOM 1425 N LEU B 77 1.840 2.703 -7.727 1.00 0.00 N ATOM 1426 CA LEU B 77 0.591 3.186 -8.307 1.00 0.00 C ATOM 1427 C LEU B 77 0.438 4.690 -8.100 1.00 0.00 C ATOM 1428 O LEU B 77 0.774 5.220 -7.041 1.00 0.00 O ATOM 1429 CB LEU B 77 -0.601 2.451 -7.689 1.00 0.00 C ATOM 1430 CG LEU B 77 -0.529 0.926 -7.762 1.00 0.00 C ATOM 1431 CD1 LEU B 77 -1.641 0.299 -6.935 1.00 0.00 C ATOM 1432 CD2 LEU B 77 -0.606 0.459 -9.207 1.00 0.00 C ATOM 0 H LEU B 77 2.498 2.318 -8.405 1.00 0.00 H new ATOM 0 HA LEU B 77 0.617 2.986 -9.378 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -0.688 2.746 -6.643 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -1.511 2.781 -8.190 1.00 0.00 H new ATOM 0 HG LEU B 77 0.427 0.605 -7.348 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -1.574 -0.787 -6.999 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -1.539 0.608 -5.895 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -2.608 0.626 -7.318 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -0.553 -0.629 -9.241 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -1.546 0.791 -9.647 1.00 0.00 H new ATOM 0 HD23 LEU B 77 0.227 0.880 -9.770 1.00 0.00 H new ATOM 1444 N ASP B 78 -0.073 5.372 -9.120 1.00 0.00 N ATOM 1445 CA ASP B 78 -0.273 6.814 -9.055 1.00 0.00 C ATOM 1446 C ASP B 78 -1.760 7.157 -8.993 1.00 0.00 C ATOM 1447 O ASP B 78 -2.145 8.204 -8.470 1.00 0.00 O ATOM 1448 CB ASP B 78 0.368 7.496 -10.265 1.00 0.00 C ATOM 1449 CG ASP B 78 1.037 8.808 -9.905 1.00 0.00 C ATOM 1450 OD1 ASP B 78 1.713 8.861 -8.855 1.00 0.00 O ATOM 1451 OD2 ASP B 78 0.886 9.782 -10.671 1.00 0.00 O ATOM 0 H ASP B 78 -0.356 4.947 -10.003 1.00 0.00 H new ATOM 0 HA ASP B 78 0.204 7.179 -8.146 1.00 0.00 H new ATOM 0 HB2 ASP B 78 1.105 6.826 -10.708 1.00 0.00 H new ATOM 0 HB3 ASP B 78 -0.395 7.677 -11.023 1.00 0.00 H new ATOM 1456 N MET B 79 -2.589 6.267 -9.532 1.00 0.00 N ATOM 1457 CA MET B 79 -4.034 6.473 -9.540 1.00 0.00 C ATOM 1458 C MET B 79 -4.565 6.683 -8.124 1.00 0.00 C ATOM 1459 O MET B 79 -5.568 7.369 -7.924 1.00 0.00 O ATOM 1460 CB MET B 79 -4.734 5.277 -10.186 1.00 0.00 C ATOM 1461 CG MET B 79 -4.475 3.960 -9.472 1.00 0.00 C ATOM 1462 SD MET B 79 -5.936 2.907 -9.398 1.00 0.00 S ATOM 1463 CE MET B 79 -5.425 1.545 -10.443 1.00 0.00 C ATOM 0 H MET B 79 -2.285 5.397 -9.969 1.00 0.00 H new ATOM 0 HA MET B 79 -4.244 7.370 -10.123 1.00 0.00 H new ATOM 0 HB2 MET B 79 -5.808 5.464 -10.208 1.00 0.00 H new ATOM 0 HB3 MET B 79 -4.405 5.190 -11.221 1.00 0.00 H new ATOM 0 HG2 MET B 79 -3.674 3.426 -9.983 1.00 0.00 H new ATOM 0 HG3 MET B 79 -4.127 4.163 -8.459 1.00 0.00 H new ATOM 0 HE1 MET B 79 -6.226 0.807 -10.497 1.00 0.00 H new ATOM 0 HE2 MET B 79 -5.206 1.917 -11.444 1.00 0.00 H new ATOM 0 HE3 MET B 79 -4.532 1.081 -10.025 1.00 0.00 H new ATOM 1473 N ILE B 80 -3.887 6.088 -7.147 1.00 0.00 N ATOM 1474 CA ILE B 80 -4.291 6.211 -5.753 1.00 0.00 C ATOM 1475 C ILE B 80 -4.163 7.652 -5.273 1.00 0.00 C ATOM 1476 O ILE B 80 -5.161 8.310 -4.973 1.00 0.00 O ATOM 1477 CB ILE B 80 -3.445 5.301 -4.840 1.00 0.00 C ATOM 1478 CG1 ILE B 80 -3.421 3.872 -5.385 1.00 0.00 C ATOM 1479 CG2 ILE B 80 -3.990 5.322 -3.419 1.00 0.00 C ATOM 1480 CD1 ILE B 80 -4.798 3.270 -5.566 1.00 0.00 C ATOM 0 H ILE B 80 -3.056 5.516 -7.296 1.00 0.00 H new ATOM 0 HA ILE B 80 -5.334 5.901 -5.696 1.00 0.00 H new ATOM 0 HB ILE B 80 -2.423 5.680 -4.823 1.00 0.00 H new ATOM 0 HG12 ILE B 80 -2.902 3.866 -6.344 1.00 0.00 H new ATOM 0 HG13 ILE B 80 -2.845 3.243 -4.707 1.00 0.00 H new ATOM 0 HG21 ILE B 80 -3.382 4.675 -2.787 1.00 0.00 H new ATOM 0 HG22 ILE B 80 -3.959 6.341 -3.032 1.00 0.00 H new ATOM 0 HG23 ILE B 80 -5.020 4.966 -3.419 1.00 0.00 H new ATOM 0 HD11 ILE B 80 -4.704 2.256 -5.955 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -5.313 3.243 -4.605 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -5.371 3.876 -6.268 1.00 0.00 H new ATOM 1492 N LEU B 81 -2.928 8.137 -5.205 1.00 0.00 N ATOM 1493 CA LEU B 81 -2.667 9.502 -4.763 1.00 0.00 C ATOM 1494 C LEU B 81 -3.352 10.517 -5.676 1.00 0.00 C ATOM 1495 O LEU B 81 -3.556 11.669 -5.293 1.00 0.00 O ATOM 1496 CB LEU B 81 -1.161 9.769 -4.727 1.00 0.00 C ATOM 1497 CG LEU B 81 -0.429 9.538 -6.052 1.00 0.00 C ATOM 1498 CD1 LEU B 81 0.389 10.763 -6.434 1.00 0.00 C ATOM 1499 CD2 LEU B 81 0.463 8.308 -5.963 1.00 0.00 C ATOM 0 H LEU B 81 -2.093 7.606 -5.450 1.00 0.00 H new ATOM 0 HA LEU B 81 -3.076 9.613 -3.759 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -0.998 10.800 -4.415 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -0.713 9.131 -3.966 1.00 0.00 H new ATOM 0 HG LEU B 81 -1.174 9.367 -6.829 1.00 0.00 H new ATOM 0 HD11 LEU B 81 0.901 10.578 -7.378 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -0.272 11.623 -6.542 1.00 0.00 H new ATOM 0 HD13 LEU B 81 1.125 10.966 -5.656 1.00 0.00 H new ATOM 0 HD21 LEU B 81 0.975 8.160 -6.914 1.00 0.00 H new ATOM 0 HD22 LEU B 81 1.200 8.449 -5.172 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -0.146 7.432 -5.739 1.00 0.00 H new ATOM 1511 N LYS B 82 -3.706 10.085 -6.884 1.00 0.00 N ATOM 1512 CA LYS B 82 -4.368 10.960 -7.845 1.00 0.00 C ATOM 1513 C LYS B 82 -5.862 11.067 -7.553 1.00 0.00 C ATOM 1514 O LYS B 82 -6.482 12.099 -7.808 1.00 0.00 O ATOM 1515 CB LYS B 82 -4.152 10.445 -9.269 1.00 0.00 C ATOM 1516 CG LYS B 82 -2.853 10.919 -9.900 1.00 0.00 C ATOM 1517 CD LYS B 82 -2.745 10.481 -11.352 1.00 0.00 C ATOM 1518 CE LYS B 82 -2.327 11.632 -12.254 1.00 0.00 C ATOM 1519 NZ LYS B 82 -2.968 11.547 -13.595 1.00 0.00 N ATOM 0 H LYS B 82 -3.545 9.135 -7.219 1.00 0.00 H new ATOM 0 HA LYS B 82 -3.928 11.953 -7.752 1.00 0.00 H new ATOM 0 HB2 LYS B 82 -4.163 9.355 -9.257 1.00 0.00 H new ATOM 0 HB3 LYS B 82 -4.987 10.766 -9.892 1.00 0.00 H new ATOM 0 HG2 LYS B 82 -2.795 12.006 -9.842 1.00 0.00 H new ATOM 0 HG3 LYS B 82 -2.008 10.524 -9.336 1.00 0.00 H new ATOM 0 HD2 LYS B 82 -2.020 9.671 -11.435 1.00 0.00 H new ATOM 0 HD3 LYS B 82 -3.705 10.086 -11.686 1.00 0.00 H new ATOM 0 HE2 LYS B 82 -2.594 12.578 -11.783 1.00 0.00 H new ATOM 0 HE3 LYS B 82 -1.243 11.628 -12.369 1.00 0.00 H new ATOM 0 HZ1 LYS B 82 -2.658 12.349 -14.180 1.00 0.00 H new ATOM 0 HZ2 LYS B 82 -2.693 10.656 -14.055 1.00 0.00 H new ATOM 0 HZ3 LYS B 82 -4.002 11.576 -13.488 1.00 0.00 H new ATOM 1533 N MET B 83 -6.436 9.992 -7.022 1.00 0.00 N ATOM 1534 CA MET B 83 -7.858 9.963 -6.701 1.00 0.00 C ATOM 1535 C MET B 83 -8.116 10.382 -5.254 1.00 0.00 C ATOM 1536 O MET B 83 -9.256 10.649 -4.872 1.00 0.00 O ATOM 1537 CB MET B 83 -8.428 8.563 -6.949 1.00 0.00 C ATOM 1538 CG MET B 83 -7.944 7.518 -5.955 1.00 0.00 C ATOM 1539 SD MET B 83 -8.850 5.966 -6.083 1.00 0.00 S ATOM 1540 CE MET B 83 -10.439 6.444 -5.409 1.00 0.00 C ATOM 0 H MET B 83 -5.937 9.129 -6.805 1.00 0.00 H new ATOM 0 HA MET B 83 -8.359 10.679 -7.353 1.00 0.00 H new ATOM 0 HB2 MET B 83 -9.516 8.612 -6.910 1.00 0.00 H new ATOM 0 HB3 MET B 83 -8.159 8.245 -7.956 1.00 0.00 H new ATOM 0 HG2 MET B 83 -6.883 7.330 -6.120 1.00 0.00 H new ATOM 0 HG3 MET B 83 -8.045 7.911 -4.943 1.00 0.00 H new ATOM 0 HE1 MET B 83 -10.989 5.553 -5.107 1.00 0.00 H new ATOM 0 HE2 MET B 83 -10.288 7.088 -4.543 1.00 0.00 H new ATOM 0 HE3 MET B 83 -11.009 6.982 -6.167 1.00 0.00 H new ATOM 1550 N ASP B 84 -7.058 10.434 -4.448 1.00 0.00 N ATOM 1551 CA ASP B 84 -7.185 10.814 -3.046 1.00 0.00 C ATOM 1552 C ASP B 84 -7.125 12.332 -2.872 1.00 0.00 C ATOM 1553 O ASP B 84 -6.353 12.843 -2.061 1.00 0.00 O ATOM 1554 CB ASP B 84 -6.084 10.148 -2.218 1.00 0.00 C ATOM 1555 CG ASP B 84 -6.588 9.654 -0.878 1.00 0.00 C ATOM 1556 OD1 ASP B 84 -7.625 10.166 -0.406 1.00 0.00 O ATOM 1557 OD2 ASP B 84 -5.948 8.750 -0.298 1.00 0.00 O ATOM 0 H ASP B 84 -6.106 10.218 -4.742 1.00 0.00 H new ATOM 0 HA ASP B 84 -8.158 10.472 -2.693 1.00 0.00 H new ATOM 0 HB2 ASP B 84 -5.668 9.310 -2.778 1.00 0.00 H new ATOM 0 HB3 ASP B 84 -5.273 10.859 -2.059 1.00 0.00 H new ATOM 1562 N SER B 85 -7.953 13.046 -3.633 1.00 0.00 N ATOM 1563 CA SER B 85 -8.006 14.507 -3.562 1.00 0.00 C ATOM 1564 C SER B 85 -6.604 15.118 -3.540 1.00 0.00 C ATOM 1565 O SER B 85 -6.001 15.270 -2.477 1.00 0.00 O ATOM 1566 CB SER B 85 -8.784 14.947 -2.320 1.00 0.00 C ATOM 1567 OG SER B 85 -9.992 14.217 -2.189 1.00 0.00 O ATOM 0 H SER B 85 -8.598 12.636 -4.308 1.00 0.00 H new ATOM 0 HA SER B 85 -8.517 14.865 -4.456 1.00 0.00 H new ATOM 0 HB2 SER B 85 -8.169 14.801 -1.432 1.00 0.00 H new ATOM 0 HB3 SER B 85 -9.005 16.013 -2.384 1.00 0.00 H new ATOM 0 HG SER B 85 -10.469 14.516 -1.387 1.00 0.00 H new ATOM 1573 N LEU B 86 -6.098 15.468 -4.717 1.00 0.00 N ATOM 1574 CA LEU B 86 -4.769 16.064 -4.829 1.00 0.00 C ATOM 1575 C LEU B 86 -4.852 17.493 -5.360 1.00 0.00 C ATOM 1576 O LEU B 86 -3.998 18.327 -5.058 1.00 0.00 O ATOM 1577 CB LEU B 86 -3.885 15.219 -5.747 1.00 0.00 C ATOM 1578 CG LEU B 86 -2.405 15.610 -5.758 1.00 0.00 C ATOM 1579 CD1 LEU B 86 -1.649 14.863 -4.671 1.00 0.00 C ATOM 1580 CD2 LEU B 86 -1.793 15.333 -7.123 1.00 0.00 C ATOM 0 H LEU B 86 -6.585 15.350 -5.606 1.00 0.00 H new ATOM 0 HA LEU B 86 -4.328 16.092 -3.833 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -3.967 14.175 -5.446 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -4.271 15.289 -6.764 1.00 0.00 H new ATOM 0 HG LEU B 86 -2.328 16.678 -5.557 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -0.599 15.153 -4.693 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -2.073 15.110 -3.698 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -1.733 13.790 -4.842 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -0.741 15.616 -7.114 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -1.881 14.271 -7.352 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -2.319 15.913 -7.882 1.00 0.00 H new ATOM 1592 N ARG B 87 -5.880 17.768 -6.156 1.00 0.00 N ATOM 1593 CA ARG B 87 -6.067 19.096 -6.733 1.00 0.00 C ATOM 1594 C ARG B 87 -6.635 20.078 -5.709 1.00 0.00 C ATOM 1595 O ARG B 87 -6.657 21.281 -5.949 1.00 0.00 O ATOM 1596 CB ARG B 87 -6.996 19.019 -7.948 1.00 0.00 C ATOM 1597 CG ARG B 87 -6.348 18.383 -9.167 1.00 0.00 C ATOM 1598 CD ARG B 87 -6.755 19.089 -10.452 1.00 0.00 C ATOM 1599 NE ARG B 87 -5.600 19.439 -11.274 1.00 0.00 N ATOM 1600 CZ ARG B 87 -5.665 20.220 -12.351 1.00 0.00 C ATOM 1601 NH1 ARG B 87 -6.826 20.733 -12.737 1.00 0.00 N ATOM 1602 NH2 ARG B 87 -4.566 20.489 -13.041 1.00 0.00 N ATOM 0 H ARG B 87 -6.596 17.090 -6.417 1.00 0.00 H new ATOM 0 HA ARG B 87 -5.089 19.461 -7.046 1.00 0.00 H new ATOM 0 HB2 ARG B 87 -7.885 18.449 -7.680 1.00 0.00 H new ATOM 0 HB3 ARG B 87 -7.328 20.025 -8.206 1.00 0.00 H new ATOM 0 HG2 ARG B 87 -5.264 18.415 -9.061 1.00 0.00 H new ATOM 0 HG3 ARG B 87 -6.632 17.332 -9.223 1.00 0.00 H new ATOM 0 HD2 ARG B 87 -7.424 18.445 -11.023 1.00 0.00 H new ATOM 0 HD3 ARG B 87 -7.313 19.993 -10.208 1.00 0.00 H new ATOM 0 HE ARG B 87 -4.690 19.063 -11.008 1.00 0.00 H new ATOM 0 HH11 ARG B 87 -7.674 20.530 -12.208 1.00 0.00 H new ATOM 0 HH12 ARG B 87 -6.870 21.331 -13.562 1.00 0.00 H new ATOM 0 HH21 ARG B 87 -3.671 20.098 -12.747 1.00 0.00 H new ATOM 0 HH22 ARG B 87 -4.615 21.087 -13.866 1.00 0.00 H new ATOM 1616 N ASP B 88 -7.088 19.567 -4.567 1.00 0.00 N ATOM 1617 CA ASP B 88 -7.646 20.420 -3.520 1.00 0.00 C ATOM 1618 C ASP B 88 -6.555 21.241 -2.832 1.00 0.00 C ATOM 1619 O ASP B 88 -6.847 22.166 -2.071 1.00 0.00 O ATOM 1620 CB ASP B 88 -8.391 19.571 -2.488 1.00 0.00 C ATOM 1621 CG ASP B 88 -9.867 19.441 -2.804 1.00 0.00 C ATOM 1622 OD1 ASP B 88 -10.508 20.473 -3.092 1.00 0.00 O ATOM 1623 OD2 ASP B 88 -10.383 18.302 -2.766 1.00 0.00 O ATOM 0 H ASP B 88 -7.080 18.572 -4.343 1.00 0.00 H new ATOM 0 HA ASP B 88 -8.346 21.112 -3.989 1.00 0.00 H new ATOM 0 HB2 ASP B 88 -7.942 18.578 -2.446 1.00 0.00 H new ATOM 0 HB3 ASP B 88 -8.272 20.017 -1.500 1.00 0.00 H new ATOM 1628 N ILE B 89 -5.298 20.910 -3.119 1.00 0.00 N ATOM 1629 CA ILE B 89 -4.163 21.619 -2.544 1.00 0.00 C ATOM 1630 C ILE B 89 -3.787 22.779 -3.440 1.00 0.00 C ATOM 1631 O ILE B 89 -3.765 23.932 -3.011 1.00 0.00 O ATOM 1632 CB ILE B 89 -2.941 20.695 -2.371 1.00 0.00 C ATOM 1633 CG1 ILE B 89 -3.358 19.382 -1.713 1.00 0.00 C ATOM 1634 CG2 ILE B 89 -1.860 21.388 -1.554 1.00 0.00 C ATOM 1635 CD1 ILE B 89 -3.812 19.551 -0.287 1.00 0.00 C ATOM 0 H ILE B 89 -5.042 20.151 -3.750 1.00 0.00 H new ATOM 0 HA ILE B 89 -4.458 21.979 -1.558 1.00 0.00 H new ATOM 0 HB ILE B 89 -2.532 20.471 -3.356 1.00 0.00 H new ATOM 0 HG12 ILE B 89 -4.164 18.932 -2.293 1.00 0.00 H new ATOM 0 HG13 ILE B 89 -2.519 18.687 -1.740 1.00 0.00 H new ATOM 0 HG21 ILE B 89 -1.005 20.721 -1.442 1.00 0.00 H new ATOM 0 HG22 ILE B 89 -1.546 22.298 -2.064 1.00 0.00 H new ATOM 0 HG23 ILE B 89 -2.254 21.641 -0.570 1.00 0.00 H new ATOM 0 HD11 ILE B 89 -4.094 18.581 0.122 1.00 0.00 H new ATOM 0 HD12 ILE B 89 -3.000 19.973 0.306 1.00 0.00 H new ATOM 0 HD13 ILE B 89 -4.671 20.222 -0.256 1.00 0.00 H new ATOM 1647 N GLU B 90 -3.526 22.465 -4.701 1.00 0.00 N ATOM 1648 CA GLU B 90 -3.194 23.478 -5.684 1.00 0.00 C ATOM 1649 C GLU B 90 -4.408 24.374 -5.914 1.00 0.00 C ATOM 1650 O GLU B 90 -4.287 25.482 -6.433 1.00 0.00 O ATOM 1651 CB GLU B 90 -2.761 22.819 -6.997 1.00 0.00 C ATOM 1652 CG GLU B 90 -2.506 23.806 -8.124 1.00 0.00 C ATOM 1653 CD GLU B 90 -2.185 23.120 -9.438 1.00 0.00 C ATOM 1654 OE1 GLU B 90 -3.066 22.412 -9.968 1.00 0.00 O ATOM 1655 OE2 GLU B 90 -1.052 23.289 -9.934 1.00 0.00 O ATOM 0 H GLU B 90 -3.539 21.512 -5.065 1.00 0.00 H new ATOM 0 HA GLU B 90 -2.366 24.083 -5.315 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -1.854 22.241 -6.821 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -3.532 22.115 -7.311 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -3.384 24.439 -8.254 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -1.679 24.461 -7.849 1.00 0.00 H new ATOM 1662 N ALA B 91 -5.578 23.878 -5.514 1.00 0.00 N ATOM 1663 CA ALA B 91 -6.825 24.614 -5.658 1.00 0.00 C ATOM 1664 C ALA B 91 -7.066 25.497 -4.443 1.00 0.00 C ATOM 1665 O ALA B 91 -7.269 26.703 -4.569 1.00 0.00 O ATOM 1666 CB ALA B 91 -7.987 23.651 -5.849 1.00 0.00 C ATOM 0 H ALA B 91 -5.684 22.959 -5.084 1.00 0.00 H new ATOM 0 HA ALA B 91 -6.750 25.251 -6.539 1.00 0.00 H new ATOM 0 HB1 ALA B 91 -8.913 24.215 -5.955 1.00 0.00 H new ATOM 0 HB2 ALA B 91 -7.821 23.054 -6.746 1.00 0.00 H new ATOM 0 HB3 ALA B 91 -8.060 22.993 -4.983 1.00 0.00 H new ATOM 1672 N LEU B 92 -7.022 24.892 -3.260 1.00 0.00 N ATOM 1673 CA LEU B 92 -7.216 25.644 -2.028 1.00 0.00 C ATOM 1674 C LEU B 92 -6.168 26.747 -1.917 1.00 0.00 C ATOM 1675 O LEU B 92 -6.384 27.765 -1.259 1.00 0.00 O ATOM 1676 CB LEU B 92 -7.134 24.719 -0.813 1.00 0.00 C ATOM 1677 CG LEU B 92 -8.418 23.952 -0.494 1.00 0.00 C ATOM 1678 CD1 LEU B 92 -8.115 22.743 0.381 1.00 0.00 C ATOM 1679 CD2 LEU B 92 -9.427 24.867 0.187 1.00 0.00 C ATOM 0 H LEU B 92 -6.856 23.894 -3.130 1.00 0.00 H new ATOM 0 HA LEU B 92 -8.208 26.096 -2.052 1.00 0.00 H new ATOM 0 HB2 LEU B 92 -6.331 24.000 -0.976 1.00 0.00 H new ATOM 0 HB3 LEU B 92 -6.858 25.313 0.058 1.00 0.00 H new ATOM 0 HG LEU B 92 -8.851 23.597 -1.429 1.00 0.00 H new ATOM 0 HD11 LEU B 92 -9.041 22.210 0.598 1.00 0.00 H new ATOM 0 HD12 LEU B 92 -7.427 22.079 -0.142 1.00 0.00 H new ATOM 0 HD13 LEU B 92 -7.660 23.074 1.315 1.00 0.00 H new ATOM 0 HD21 LEU B 92 -10.335 24.307 0.408 1.00 0.00 H new ATOM 0 HD22 LEU B 92 -9.002 25.250 1.115 1.00 0.00 H new ATOM 0 HD23 LEU B 92 -9.666 25.700 -0.474 1.00 0.00 H new ATOM 1691 N LEU B 93 -5.032 26.535 -2.578 1.00 0.00 N ATOM 1692 CA LEU B 93 -3.948 27.505 -2.564 1.00 0.00 C ATOM 1693 C LEU B 93 -4.063 28.474 -3.735 1.00 0.00 C ATOM 1694 O LEU B 93 -3.811 29.668 -3.583 1.00 0.00 O ATOM 1695 CB LEU B 93 -2.594 26.794 -2.603 1.00 0.00 C ATOM 1696 CG LEU B 93 -1.961 26.536 -1.234 1.00 0.00 C ATOM 1697 CD1 LEU B 93 -2.288 25.132 -0.751 1.00 0.00 C ATOM 1698 CD2 LEU B 93 -0.455 26.743 -1.293 1.00 0.00 C ATOM 0 H LEU B 93 -4.842 25.698 -3.129 1.00 0.00 H new ATOM 0 HA LEU B 93 -4.022 28.076 -1.639 1.00 0.00 H new ATOM 0 HB2 LEU B 93 -2.716 25.840 -3.116 1.00 0.00 H new ATOM 0 HB3 LEU B 93 -1.904 27.391 -3.199 1.00 0.00 H new ATOM 0 HG LEU B 93 -2.378 27.250 -0.524 1.00 0.00 H new ATOM 0 HD11 LEU B 93 -1.829 24.967 0.224 1.00 0.00 H new ATOM 0 HD12 LEU B 93 -3.369 25.018 -0.668 1.00 0.00 H new ATOM 0 HD13 LEU B 93 -1.900 24.403 -1.463 1.00 0.00 H new ATOM 0 HD21 LEU B 93 -0.023 26.555 -0.310 1.00 0.00 H new ATOM 0 HD22 LEU B 93 -0.021 26.054 -2.018 1.00 0.00 H new ATOM 0 HD23 LEU B 93 -0.240 27.769 -1.593 1.00 0.00 H new ATOM 1710 N THR B 94 -4.448 27.970 -4.906 1.00 0.00 N ATOM 1711 CA THR B 94 -4.586 28.842 -6.071 1.00 0.00 C ATOM 1712 C THR B 94 -5.796 29.764 -5.923 1.00 0.00 C ATOM 1713 O THR B 94 -5.960 30.713 -6.691 1.00 0.00 O ATOM 1714 CB THR B 94 -4.689 28.033 -7.365 1.00 0.00 C ATOM 1715 OG1 THR B 94 -4.539 28.877 -8.493 1.00 0.00 O ATOM 1716 CG2 THR B 94 -6.002 27.307 -7.511 1.00 0.00 C ATOM 0 H THR B 94 -4.665 26.987 -5.072 1.00 0.00 H new ATOM 0 HA THR B 94 -3.687 29.456 -6.127 1.00 0.00 H new ATOM 0 HB THR B 94 -3.888 27.295 -7.311 1.00 0.00 H new ATOM 0 HG1 THR B 94 -4.825 29.785 -8.262 1.00 0.00 H new ATOM 0 HG21 THR B 94 -6.009 26.753 -8.450 1.00 0.00 H new ATOM 0 HG22 THR B 94 -6.129 26.614 -6.680 1.00 0.00 H new ATOM 0 HG23 THR B 94 -6.819 28.029 -7.509 1.00 0.00 H new ATOM 1724 N GLY B 95 -6.644 29.479 -4.936 1.00 0.00 N ATOM 1725 CA GLY B 95 -7.824 30.293 -4.714 1.00 0.00 C ATOM 1726 C GLY B 95 -7.816 30.995 -3.367 1.00 0.00 C ATOM 1727 O GLY B 95 -8.309 32.115 -3.247 1.00 0.00 O ATOM 0 H GLY B 95 -6.533 28.699 -4.288 1.00 0.00 H new ATOM 0 HA2 GLY B 95 -7.898 31.039 -5.506 1.00 0.00 H new ATOM 0 HA3 GLY B 95 -8.711 29.664 -4.784 1.00 0.00 H new ATOM 1731 N LEU B 96 -7.261 30.338 -2.348 1.00 0.00 N ATOM 1732 CA LEU B 96 -7.209 30.926 -1.012 1.00 0.00 C ATOM 1733 C LEU B 96 -5.855 31.563 -0.721 1.00 0.00 C ATOM 1734 O LEU B 96 -5.649 32.145 0.345 1.00 0.00 O ATOM 1735 CB LEU B 96 -7.522 29.870 0.047 1.00 0.00 C ATOM 1736 CG LEU B 96 -8.436 30.335 1.183 1.00 0.00 C ATOM 1737 CD1 LEU B 96 -7.876 31.587 1.842 1.00 0.00 C ATOM 1738 CD2 LEU B 96 -9.843 30.588 0.665 1.00 0.00 C ATOM 0 H LEU B 96 -6.846 29.409 -2.421 1.00 0.00 H new ATOM 0 HA LEU B 96 -7.963 31.712 -0.976 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -7.986 29.014 -0.443 1.00 0.00 H new ATOM 0 HB3 LEU B 96 -6.583 29.521 0.477 1.00 0.00 H new ATOM 0 HG LEU B 96 -8.482 29.545 1.932 1.00 0.00 H new ATOM 0 HD11 LEU B 96 -8.540 31.902 2.647 1.00 0.00 H new ATOM 0 HD12 LEU B 96 -6.888 31.373 2.249 1.00 0.00 H new ATOM 0 HD13 LEU B 96 -7.799 32.384 1.102 1.00 0.00 H new ATOM 0 HD21 LEU B 96 -10.479 30.918 1.486 1.00 0.00 H new ATOM 0 HD22 LEU B 96 -9.814 31.360 -0.104 1.00 0.00 H new ATOM 0 HD23 LEU B 96 -10.246 29.668 0.241 1.00 0.00 H new ATOM 1750 N PHE B 97 -4.943 31.453 -1.675 1.00 0.00 N ATOM 1751 CA PHE B 97 -3.599 32.013 -1.545 1.00 0.00 C ATOM 1752 C PHE B 97 -3.040 31.801 -0.128 1.00 0.00 C ATOM 1753 O PHE B 97 -3.005 30.671 0.358 1.00 0.00 O ATOM 1754 CB PHE B 97 -3.609 33.496 -1.950 1.00 0.00 C ATOM 1755 CG PHE B 97 -4.801 34.266 -1.450 1.00 0.00 C ATOM 1756 CD1 PHE B 97 -6.024 34.163 -2.096 1.00 0.00 C ATOM 1757 CD2 PHE B 97 -4.702 35.094 -0.341 1.00 0.00 C ATOM 1758 CE1 PHE B 97 -7.123 34.869 -1.644 1.00 0.00 C ATOM 1759 CE2 PHE B 97 -5.798 35.801 0.113 1.00 0.00 C ATOM 1760 CZ PHE B 97 -7.009 35.689 -0.540 1.00 0.00 C ATOM 0 H PHE B 97 -5.109 30.975 -2.561 1.00 0.00 H new ATOM 0 HA PHE B 97 -2.929 31.484 -2.223 1.00 0.00 H new ATOM 0 HB2 PHE B 97 -2.702 33.969 -1.574 1.00 0.00 H new ATOM 0 HB3 PHE B 97 -3.577 33.564 -3.037 1.00 0.00 H new ATOM 0 HD1 PHE B 97 -6.119 33.524 -2.962 1.00 0.00 H new ATOM 0 HD2 PHE B 97 -3.757 35.187 0.173 1.00 0.00 H new ATOM 0 HE1 PHE B 97 -8.070 34.779 -2.155 1.00 0.00 H new ATOM 0 HE2 PHE B 97 -5.708 36.441 0.978 1.00 0.00 H new ATOM 0 HZ PHE B 97 -7.867 36.243 -0.187 1.00 0.00 H new ATOM 1770 N VAL B 98 -2.604 32.872 0.534 1.00 0.00 N ATOM 1771 CA VAL B 98 -2.059 32.764 1.880 1.00 0.00 C ATOM 1772 C VAL B 98 -3.067 33.234 2.923 1.00 0.00 C ATOM 1773 O VAL B 98 -3.986 33.994 2.616 1.00 0.00 O ATOM 1774 CB VAL B 98 -0.758 33.580 2.025 1.00 0.00 C ATOM 1775 CG1 VAL B 98 -1.020 35.061 1.786 1.00 0.00 C ATOM 1776 CG2 VAL B 98 -0.135 33.352 3.394 1.00 0.00 C ATOM 0 H VAL B 98 -2.619 33.820 0.159 1.00 0.00 H new ATOM 0 HA VAL B 98 -1.837 31.710 2.049 1.00 0.00 H new ATOM 0 HB VAL B 98 -0.052 33.238 1.269 1.00 0.00 H new ATOM 0 HG11 VAL B 98 -0.089 35.617 1.893 1.00 0.00 H new ATOM 0 HG12 VAL B 98 -1.414 35.203 0.780 1.00 0.00 H new ATOM 0 HG13 VAL B 98 -1.746 35.424 2.514 1.00 0.00 H new ATOM 0 HG21 VAL B 98 0.782 33.936 3.478 1.00 0.00 H new ATOM 0 HG22 VAL B 98 -0.836 33.663 4.169 1.00 0.00 H new ATOM 0 HG23 VAL B 98 0.096 32.294 3.517 1.00 0.00 H new ATOM 1786 N GLN B 99 -2.888 32.776 4.158 1.00 0.00 N ATOM 1787 CA GLN B 99 -3.782 33.149 5.249 1.00 0.00 C ATOM 1788 C GLN B 99 -3.118 34.168 6.171 1.00 0.00 C ATOM 1789 O GLN B 99 -2.288 33.814 7.008 1.00 0.00 O ATOM 1790 CB GLN B 99 -4.190 31.907 6.045 1.00 0.00 C ATOM 1791 CG GLN B 99 -5.681 31.613 5.992 1.00 0.00 C ATOM 1792 CD GLN B 99 -6.078 30.450 6.878 1.00 0.00 C ATOM 1793 OE1 GLN B 99 -5.381 29.435 6.941 1.00 0.00 O ATOM 1794 NE2 GLN B 99 -7.203 30.589 7.570 1.00 0.00 N ATOM 0 H GLN B 99 -2.132 32.146 4.428 1.00 0.00 H new ATOM 0 HA GLN B 99 -4.674 33.605 4.819 1.00 0.00 H new ATOM 0 HB2 GLN B 99 -3.644 31.045 5.662 1.00 0.00 H new ATOM 0 HB3 GLN B 99 -3.891 32.038 7.085 1.00 0.00 H new ATOM 0 HG2 GLN B 99 -6.234 32.502 6.296 1.00 0.00 H new ATOM 0 HG3 GLN B 99 -5.968 31.396 4.963 1.00 0.00 H new ATOM 0 HE21 GLN B 99 -7.750 31.446 7.488 1.00 0.00 H new ATOM 0 HE22 GLN B 99 -7.520 29.838 8.183 1.00 0.00 H new ATOM 1803 N ASP B 100 -3.491 35.433 6.012 1.00 0.00 N ATOM 1804 CA ASP B 100 -2.932 36.504 6.829 1.00 0.00 C ATOM 1805 C ASP B 100 -3.433 36.409 8.267 1.00 0.00 C ATOM 1806 O ASP B 100 -4.566 36.785 8.567 1.00 0.00 O ATOM 1807 CB ASP B 100 -3.297 37.867 6.239 1.00 0.00 C ATOM 1808 CG ASP B 100 -2.280 38.937 6.583 1.00 0.00 C ATOM 1809 OD1 ASP B 100 -1.071 38.687 6.401 1.00 0.00 O ATOM 1810 OD2 ASP B 100 -2.693 40.027 7.034 1.00 0.00 O ATOM 0 H ASP B 100 -4.178 35.742 5.325 1.00 0.00 H new ATOM 0 HA ASP B 100 -1.847 36.396 6.833 1.00 0.00 H new ATOM 0 HB2 ASP B 100 -3.377 37.781 5.155 1.00 0.00 H new ATOM 0 HB3 ASP B 100 -4.277 38.169 6.608 1.00 0.00 H new ATOM 1815 N ASN B 101 -2.580 35.904 9.153 1.00 0.00 N ATOM 1816 CA ASN B 101 -2.935 35.761 10.560 1.00 0.00 C ATOM 1817 C ASN B 101 -1.688 35.772 11.439 1.00 0.00 C ATOM 1818 O ASN B 101 -0.605 35.382 11.001 1.00 0.00 O ATOM 1819 CB ASN B 101 -3.719 34.465 10.780 1.00 0.00 C ATOM 1820 CG ASN B 101 -5.213 34.704 10.882 1.00 0.00 C ATOM 1821 OD1 ASN B 101 -5.654 35.744 11.372 1.00 0.00 O ATOM 1822 ND2 ASN B 101 -6.001 33.740 10.420 1.00 0.00 N ATOM 0 H ASN B 101 -1.639 35.587 8.921 1.00 0.00 H new ATOM 0 HA ASN B 101 -3.562 36.608 10.840 1.00 0.00 H new ATOM 0 HB2 ASN B 101 -3.519 33.778 9.957 1.00 0.00 H new ATOM 0 HB3 ASN B 101 -3.368 33.981 11.692 1.00 0.00 H new ATOM 0 HD21 ASN B 101 -7.015 33.845 10.463 1.00 0.00 H new ATOM 0 HD22 ASN B 101 -5.593 32.894 10.022 1.00 0.00 H new ATOM 1829 N VAL B 102 -1.849 36.221 12.679 1.00 0.00 N ATOM 1830 CA VAL B 102 -0.736 36.283 13.620 1.00 0.00 C ATOM 1831 C VAL B 102 -0.896 35.249 14.728 1.00 0.00 C ATOM 1832 O VAL B 102 0.090 34.752 15.273 1.00 0.00 O ATOM 1833 CB VAL B 102 -0.612 37.682 14.251 1.00 0.00 C ATOM 1834 CG1 VAL B 102 -0.048 38.675 13.246 1.00 0.00 C ATOM 1835 CG2 VAL B 102 -1.961 38.153 14.777 1.00 0.00 C ATOM 0 H VAL B 102 -2.739 36.547 13.056 1.00 0.00 H new ATOM 0 HA VAL B 102 0.170 36.067 13.054 1.00 0.00 H new ATOM 0 HB VAL B 102 0.079 37.620 15.092 1.00 0.00 H new ATOM 0 HG11 VAL B 102 0.032 39.658 13.711 1.00 0.00 H new ATOM 0 HG12 VAL B 102 0.939 38.345 12.923 1.00 0.00 H new ATOM 0 HG13 VAL B 102 -0.711 38.735 12.383 1.00 0.00 H new ATOM 0 HG21 VAL B 102 -1.853 39.143 15.219 1.00 0.00 H new ATOM 0 HG22 VAL B 102 -2.676 38.198 13.956 1.00 0.00 H new ATOM 0 HG23 VAL B 102 -2.320 37.455 15.533 1.00 0.00 H new ATOM 1845 N ASN B 103 -2.143 34.929 15.059 1.00 0.00 N ATOM 1846 CA ASN B 103 -2.432 33.952 16.102 1.00 0.00 C ATOM 1847 C ASN B 103 -3.518 32.981 15.651 1.00 0.00 C ATOM 1848 O ASN B 103 -4.027 33.078 14.534 1.00 0.00 O ATOM 1849 CB ASN B 103 -2.864 34.663 17.388 1.00 0.00 C ATOM 1850 CG ASN B 103 -1.914 34.399 18.540 1.00 0.00 C ATOM 1851 OD1 ASN B 103 -2.292 33.796 19.545 1.00 0.00 O ATOM 1852 ND2 ASN B 103 -0.674 34.852 18.400 1.00 0.00 N ATOM 0 H ASN B 103 -2.970 35.333 14.619 1.00 0.00 H new ATOM 0 HA ASN B 103 -1.523 33.384 16.298 1.00 0.00 H new ATOM 0 HB2 ASN B 103 -2.920 35.736 17.206 1.00 0.00 H new ATOM 0 HB3 ASN B 103 -3.866 34.333 17.664 1.00 0.00 H new ATOM 0 HD21 ASN B 103 0.009 34.705 19.143 1.00 0.00 H new ATOM 0 HD22 ASN B 103 -0.405 35.347 17.550 1.00 0.00 H new ATOM 1859 N LYS B 104 -3.869 32.045 16.526 1.00 0.00 N ATOM 1860 CA LYS B 104 -4.894 31.056 16.217 1.00 0.00 C ATOM 1861 C LYS B 104 -6.267 31.534 16.678 1.00 0.00 C ATOM 1862 O LYS B 104 -6.415 32.059 17.781 1.00 0.00 O ATOM 1863 CB LYS B 104 -4.560 29.718 16.881 1.00 0.00 C ATOM 1864 CG LYS B 104 -4.258 29.835 18.366 1.00 0.00 C ATOM 1865 CD LYS B 104 -2.761 29.891 18.629 1.00 0.00 C ATOM 1866 CE LYS B 104 -2.230 28.546 19.104 1.00 0.00 C ATOM 1867 NZ LYS B 104 -1.189 28.703 20.159 1.00 0.00 N ATOM 0 H LYS B 104 -3.458 31.951 17.455 1.00 0.00 H new ATOM 0 HA LYS B 104 -4.918 30.922 15.136 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -5.397 29.034 16.742 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -3.700 29.277 16.377 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -4.732 30.732 18.765 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -4.689 28.985 18.894 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -2.241 30.188 17.718 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -2.550 30.653 19.380 1.00 0.00 H new ATOM 0 HE2 LYS B 104 -3.054 27.947 19.492 1.00 0.00 H new ATOM 0 HE3 LYS B 104 -1.811 28.001 18.258 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 -0.852 27.765 20.457 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 -0.392 29.253 19.781 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -1.596 29.200 20.977 1.00 0.00 H new ATOM 1881 N ASP B 105 -7.271 31.349 15.825 1.00 0.00 N ATOM 1882 CA ASP B 105 -8.632 31.760 16.146 1.00 0.00 C ATOM 1883 C ASP B 105 -9.444 30.586 16.683 1.00 0.00 C ATOM 1884 O ASP B 105 -9.166 29.429 16.365 1.00 0.00 O ATOM 1885 CB ASP B 105 -9.313 32.348 14.907 1.00 0.00 C ATOM 1886 CG ASP B 105 -9.862 33.739 15.155 1.00 0.00 C ATOM 1887 OD1 ASP B 105 -9.053 34.666 15.374 1.00 0.00 O ATOM 1888 OD2 ASP B 105 -11.100 33.903 15.129 1.00 0.00 O ATOM 0 H ASP B 105 -7.166 30.917 14.907 1.00 0.00 H new ATOM 0 HA ASP B 105 -8.582 32.524 16.921 1.00 0.00 H new ATOM 0 HB2 ASP B 105 -8.598 32.384 14.085 1.00 0.00 H new ATOM 0 HB3 ASP B 105 -10.124 31.690 14.595 1.00 0.00 H new ATOM 1893 N ALA B 106 -10.448 30.889 17.498 1.00 0.00 N ATOM 1894 CA ALA B 106 -11.300 29.860 18.080 1.00 0.00 C ATOM 1895 C ALA B 106 -12.653 30.433 18.488 1.00 0.00 C ATOM 1896 O ALA B 106 -13.660 29.701 18.382 1.00 0.00 O ATOM 1897 CB ALA B 106 -10.613 29.221 19.277 1.00 0.00 C ATOM 1898 OXT ALA B 106 -12.695 31.608 18.910 1.00 0.00 O ATOM 0 H ALA B 106 -10.692 31.841 17.771 1.00 0.00 H new ATOM 0 HA ALA B 106 -11.472 29.095 17.323 1.00 0.00 H new ATOM 0 HB1 ALA B 106 -11.261 28.454 19.702 1.00 0.00 H new ATOM 0 HB2 ALA B 106 -9.674 28.767 18.958 1.00 0.00 H new ATOM 0 HB3 ALA B 106 -10.411 29.983 20.030 1.00 0.00 H new TER 1904 ALA B 106