USER MOD reduce.3.24.130724 H: found=0, std=0, add=958, rem=0, adj=15 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 -33:sc= 0.475 USER MOD Single : A 53 HIS :FLIP no HD1:sc= -0.136 F(o=-1.7,f=-0.14) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=-0.033) 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 -124:sc= -0.245 (180deg=-1.44) USER MOD Single : A 85 SER OG : rot 180:sc= -0.574 USER MOD Single : A 94 THR OG1 : rot 52:sc= 0.263 USER MOD Single : A 99 GLN : amide:sc= -0.0717 X(o=-0.072,f=-0.32) USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=-0.068) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 THR OG1 : rot 180:sc= 0 USER MOD Single : B 53 HIS :FLIP no HD1:sc= -0.143 F(o=-1.7,f=-0.14) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD Single : B 59 SER OG : rot 180:sc= 0 USER MOD Single : B 66 GLN : amide:sc= 0 X(o=0,f=-0.032) 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 -125:sc= -0.205 (180deg=-1.41) USER MOD Single : B 85 SER OG : rot 180:sc= -0.617 USER MOD Single : B 94 THR OG1 : rot 51:sc= 0.315 USER MOD Single : B 99 GLN : amide:sc= -0.0297 X(o=-0.03,f=-0.28) USER MOD Single : B 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 103 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : B 104 LYS NZ :NH3+ -157:sc= -0.0614 (180deg=-0.376) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 50 -8.024 -32.452 -7.925 1.00 0.00 N ATOM 2 CA THR A 50 -8.407 -32.067 -6.541 1.00 0.00 C ATOM 3 C THR A 50 -8.846 -33.284 -5.733 1.00 0.00 C ATOM 4 O THR A 50 -10.029 -33.620 -5.692 1.00 0.00 O ATOM 5 CB THR A 50 -9.542 -31.045 -6.616 1.00 0.00 C ATOM 6 OG1 THR A 50 -10.464 -31.391 -7.634 1.00 0.00 O ATOM 7 CG2 THR A 50 -9.061 -29.637 -6.891 1.00 0.00 C ATOM 0 HA THR A 50 -7.543 -31.633 -6.038 1.00 0.00 H new ATOM 0 HB THR A 50 -10.014 -31.066 -5.634 1.00 0.00 H new ATOM 0 HG1 THR A 50 -9.988 -31.827 -8.372 1.00 0.00 H new ATOM 0 HG21 THR A 50 -9.916 -28.962 -6.932 1.00 0.00 H new ATOM 0 HG22 THR A 50 -8.387 -29.321 -6.095 1.00 0.00 H new ATOM 0 HG23 THR A 50 -8.534 -29.612 -7.845 1.00 0.00 H new ATOM 17 N ARG A 51 -7.884 -33.940 -5.093 1.00 0.00 N ATOM 18 CA ARG A 51 -8.172 -35.121 -4.287 1.00 0.00 C ATOM 19 C ARG A 51 -7.672 -34.940 -2.857 1.00 0.00 C ATOM 20 O ARG A 51 -8.463 -34.748 -1.933 1.00 0.00 O ATOM 21 CB ARG A 51 -7.532 -36.361 -4.915 1.00 0.00 C ATOM 22 CG ARG A 51 -7.773 -37.639 -4.128 1.00 0.00 C ATOM 23 CD ARG A 51 -6.712 -38.684 -4.428 1.00 0.00 C ATOM 24 NE ARG A 51 -6.699 -39.754 -3.433 1.00 0.00 N ATOM 25 CZ ARG A 51 -7.612 -40.722 -3.374 1.00 0.00 C ATOM 26 NH1 ARG A 51 -8.611 -40.755 -4.244 1.00 0.00 N ATOM 27 NH2 ARG A 51 -7.523 -41.659 -2.442 1.00 0.00 N ATOM 0 H ARG A 51 -6.899 -33.675 -5.117 1.00 0.00 H new ATOM 0 HA ARG A 51 -9.253 -35.256 -4.258 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -7.922 -36.488 -5.925 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -6.458 -36.198 -5.006 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -7.775 -37.416 -3.061 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -8.758 -38.038 -4.372 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -6.892 -39.110 -5.415 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -5.732 -38.207 -4.460 1.00 0.00 H new ATOM 0 HE ARG A 51 -5.947 -39.760 -2.744 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -8.684 -40.036 -4.964 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -9.307 -41.499 -4.193 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -6.756 -41.639 -1.770 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -8.222 -42.401 -2.396 1.00 0.00 H new ATOM 41 N ALA A 52 -6.354 -35.004 -2.680 1.00 0.00 N ATOM 42 CA ALA A 52 -5.756 -34.848 -1.359 1.00 0.00 C ATOM 43 C ALA A 52 -4.528 -33.943 -1.411 1.00 0.00 C ATOM 44 O ALA A 52 -3.613 -34.075 -0.599 1.00 0.00 O ATOM 45 CB ALA A 52 -5.387 -36.208 -0.786 1.00 0.00 C ATOM 0 H ALA A 52 -5.683 -35.162 -3.432 1.00 0.00 H new ATOM 0 HA ALA A 52 -6.492 -34.376 -0.708 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -4.941 -36.079 0.200 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -6.283 -36.823 -0.702 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -4.671 -36.699 -1.446 1.00 0.00 H new ATOM 51 N HIS A 53 -4.517 -33.019 -2.367 1.00 0.00 N ATOM 52 CA HIS A 53 -3.403 -32.089 -2.521 1.00 0.00 C ATOM 53 C HIS A 53 -3.900 -30.647 -2.535 1.00 0.00 C ATOM 54 O HIS A 53 -4.132 -30.074 -3.599 1.00 0.00 O ATOM 55 CB HIS A 53 -2.635 -32.383 -3.812 1.00 0.00 C ATOM 56 CG HIS A 53 -1.857 -33.662 -3.776 1.00 0.00 C ATOM 57 ND1 HIS A 53 -2.229 -34.917 -3.429 1.00 0.00 N flip ATOM 58 CD2 HIS A 53 -0.527 -33.744 -4.133 1.00 0.00 C flip ATOM 59 CE1 HIS A 53 -1.128 -35.724 -3.582 1.00 0.00 C flip ATOM 60 NE2 HIS A 53 -0.116 -34.992 -4.009 1.00 0.00 N flip ATOM 0 H HIS A 53 -5.267 -32.894 -3.047 1.00 0.00 H new ATOM 0 HA HIS A 53 -2.734 -32.221 -1.670 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -3.340 -32.421 -4.642 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -1.951 -31.558 -4.012 1.00 0.00 H new ATOM 0 HD2 HIS A 53 0.083 -32.916 -4.463 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -1.096 -36.785 -3.385 1.00 0.00 H new ATOM 0 HE2 HIS A 53 0.824 -35.333 -4.209 1.00 0.00 H new ATOM 69 N LEU A 54 -4.064 -30.065 -1.350 1.00 0.00 N ATOM 70 CA LEU A 54 -4.534 -28.689 -1.241 1.00 0.00 C ATOM 71 C LEU A 54 -4.466 -28.197 0.213 1.00 0.00 C ATOM 72 O LEU A 54 -3.392 -27.829 0.684 1.00 0.00 O ATOM 73 CB LEU A 54 -5.955 -28.581 -1.809 1.00 0.00 C ATOM 74 CG LEU A 54 -6.492 -27.159 -1.953 1.00 0.00 C ATOM 75 CD1 LEU A 54 -5.832 -26.457 -3.130 1.00 0.00 C ATOM 76 CD2 LEU A 54 -8.003 -27.176 -2.120 1.00 0.00 C ATOM 0 H LEU A 54 -3.879 -30.522 -0.457 1.00 0.00 H new ATOM 0 HA LEU A 54 -3.880 -28.043 -1.827 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -5.975 -29.061 -2.788 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -6.630 -29.144 -1.164 1.00 0.00 H new ATOM 0 HG LEU A 54 -6.252 -26.606 -1.045 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -6.227 -25.445 -3.218 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -4.755 -26.414 -2.970 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -6.041 -27.009 -4.047 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -8.369 -26.154 -2.221 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -8.264 -27.745 -3.012 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -8.460 -27.641 -1.246 1.00 0.00 H new ATOM 88 N THR A 55 -5.611 -28.202 0.911 1.00 0.00 N ATOM 89 CA THR A 55 -5.713 -27.768 2.314 1.00 0.00 C ATOM 90 C THR A 55 -4.422 -27.161 2.871 1.00 0.00 C ATOM 91 O THR A 55 -4.338 -25.952 3.094 1.00 0.00 O ATOM 92 CB THR A 55 -6.125 -28.950 3.187 1.00 0.00 C ATOM 93 OG1 THR A 55 -7.310 -29.549 2.695 1.00 0.00 O ATOM 94 CG2 THR A 55 -6.364 -28.576 4.634 1.00 0.00 C ATOM 0 H THR A 55 -6.500 -28.509 0.516 1.00 0.00 H new ATOM 0 HA THR A 55 -6.465 -26.980 2.334 1.00 0.00 H new ATOM 0 HB THR A 55 -5.285 -29.644 3.145 1.00 0.00 H new ATOM 0 HG1 THR A 55 -7.556 -30.305 3.267 1.00 0.00 H new ATOM 0 HG21 THR A 55 -6.653 -29.464 5.196 1.00 0.00 H new ATOM 0 HG22 THR A 55 -5.450 -28.160 5.058 1.00 0.00 H new ATOM 0 HG23 THR A 55 -7.161 -27.834 4.691 1.00 0.00 H new ATOM 102 N GLU A 56 -3.433 -28.013 3.116 1.00 0.00 N ATOM 103 CA GLU A 56 -2.156 -27.576 3.669 1.00 0.00 C ATOM 104 C GLU A 56 -1.459 -26.562 2.766 1.00 0.00 C ATOM 105 O GLU A 56 -1.318 -25.397 3.125 1.00 0.00 O ATOM 106 CB GLU A 56 -1.242 -28.782 3.898 1.00 0.00 C ATOM 107 CG GLU A 56 -0.681 -28.858 5.308 1.00 0.00 C ATOM 108 CD GLU A 56 -1.607 -29.581 6.265 1.00 0.00 C ATOM 109 OE1 GLU A 56 -2.619 -28.978 6.681 1.00 0.00 O ATOM 110 OE2 GLU A 56 -1.323 -30.751 6.597 1.00 0.00 O ATOM 0 H GLU A 56 -3.492 -29.016 2.939 1.00 0.00 H new ATOM 0 HA GLU A 56 -2.363 -27.086 4.620 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -1.799 -29.695 3.687 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -0.416 -28.742 3.188 1.00 0.00 H new ATOM 0 HG2 GLU A 56 0.282 -29.368 5.285 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -0.498 -27.849 5.677 1.00 0.00 H new ATOM 117 N VAL A 57 -1.007 -27.014 1.604 1.00 0.00 N ATOM 118 CA VAL A 57 -0.300 -26.143 0.665 1.00 0.00 C ATOM 119 C VAL A 57 -1.121 -24.906 0.301 1.00 0.00 C ATOM 120 O VAL A 57 -0.615 -23.772 0.347 1.00 0.00 O ATOM 121 CB VAL A 57 0.085 -26.893 -0.616 1.00 0.00 C ATOM 122 CG1 VAL A 57 0.963 -26.017 -1.496 1.00 0.00 C ATOM 123 CG2 VAL A 57 0.790 -28.199 -0.283 1.00 0.00 C ATOM 0 H VAL A 57 -1.115 -27.977 1.286 1.00 0.00 H new ATOM 0 HA VAL A 57 0.607 -25.818 1.174 1.00 0.00 H new ATOM 0 HB VAL A 57 -0.826 -27.131 -1.165 1.00 0.00 H new ATOM 0 HG11 VAL A 57 1.229 -26.562 -2.402 1.00 0.00 H new ATOM 0 HG12 VAL A 57 0.420 -25.110 -1.764 1.00 0.00 H new ATOM 0 HG13 VAL A 57 1.870 -25.750 -0.954 1.00 0.00 H new ATOM 0 HG21 VAL A 57 1.054 -28.715 -1.206 1.00 0.00 H new ATOM 0 HG22 VAL A 57 1.695 -27.989 0.287 1.00 0.00 H new ATOM 0 HG23 VAL A 57 0.127 -28.830 0.308 1.00 0.00 H new ATOM 133 N GLU A 58 -2.390 -25.110 -0.057 1.00 0.00 N ATOM 134 CA GLU A 58 -3.259 -23.994 -0.411 1.00 0.00 C ATOM 135 C GLU A 58 -3.212 -22.945 0.691 1.00 0.00 C ATOM 136 O GLU A 58 -3.024 -21.759 0.437 1.00 0.00 O ATOM 137 CB GLU A 58 -4.697 -24.479 -0.655 1.00 0.00 C ATOM 138 CG GLU A 58 -5.602 -24.431 0.569 1.00 0.00 C ATOM 139 CD GLU A 58 -7.058 -24.682 0.230 1.00 0.00 C ATOM 140 OE1 GLU A 58 -7.682 -23.801 -0.399 1.00 0.00 O ATOM 141 OE2 GLU A 58 -7.574 -25.761 0.593 1.00 0.00 O ATOM 0 H GLU A 58 -2.832 -26.028 -0.108 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.905 -23.544 -1.339 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -5.142 -23.871 -1.443 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -4.662 -25.504 -1.024 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -5.268 -25.175 1.292 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -5.507 -23.456 1.048 1.00 0.00 H new ATOM 148 N SER A 59 -3.345 -23.410 1.920 1.00 0.00 N ATOM 149 CA SER A 59 -3.284 -22.528 3.076 1.00 0.00 C ATOM 150 C SER A 59 -1.868 -21.974 3.223 1.00 0.00 C ATOM 151 O SER A 59 -1.647 -20.967 3.890 1.00 0.00 O ATOM 152 CB SER A 59 -3.691 -23.279 4.347 1.00 0.00 C ATOM 153 OG SER A 59 -4.077 -22.380 5.370 1.00 0.00 O ATOM 0 H SER A 59 -3.496 -24.393 2.145 1.00 0.00 H new ATOM 0 HA SER A 59 -3.980 -21.703 2.928 1.00 0.00 H new ATOM 0 HB2 SER A 59 -4.515 -23.957 4.124 1.00 0.00 H new ATOM 0 HB3 SER A 59 -2.859 -23.892 4.693 1.00 0.00 H new ATOM 0 HG SER A 59 -4.333 -22.885 6.170 1.00 0.00 H new ATOM 159 N ARG A 60 -0.915 -22.657 2.597 1.00 0.00 N ATOM 160 CA ARG A 60 0.483 -22.267 2.642 1.00 0.00 C ATOM 161 C ARG A 60 0.725 -20.987 1.876 1.00 0.00 C ATOM 162 O ARG A 60 1.029 -19.960 2.478 1.00 0.00 O ATOM 163 CB ARG A 60 1.367 -23.376 2.074 1.00 0.00 C ATOM 164 CG ARG A 60 2.789 -23.363 2.609 1.00 0.00 C ATOM 165 CD ARG A 60 2.964 -24.350 3.753 1.00 0.00 C ATOM 166 NE ARG A 60 4.260 -25.021 3.704 1.00 0.00 N ATOM 167 CZ ARG A 60 4.534 -26.155 4.345 1.00 0.00 C ATOM 168 NH1 ARG A 60 3.605 -26.745 5.087 1.00 0.00 N ATOM 169 NH2 ARG A 60 5.739 -26.699 4.246 1.00 0.00 N ATOM 0 H ARG A 60 -1.094 -23.496 2.045 1.00 0.00 H new ATOM 0 HA ARG A 60 0.740 -22.097 3.688 1.00 0.00 H new ATOM 0 HB2 ARG A 60 0.913 -24.341 2.300 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.397 -23.284 0.988 1.00 0.00 H new ATOM 0 HG2 ARG A 60 3.483 -23.609 1.806 1.00 0.00 H new ATOM 0 HG3 ARG A 60 3.041 -22.359 2.951 1.00 0.00 H new ATOM 0 HD2 ARG A 60 2.863 -23.825 4.703 1.00 0.00 H new ATOM 0 HD3 ARG A 60 2.169 -25.094 3.714 1.00 0.00 H new ATOM 0 HE ARG A 60 5.000 -24.595 3.145 1.00 0.00 H new ATOM 0 HH11 ARG A 60 2.677 -26.330 5.168 1.00 0.00 H new ATOM 0 HH12 ARG A 60 3.819 -27.614 5.577 1.00 0.00 H new ATOM 0 HH21 ARG A 60 6.457 -26.249 3.678 1.00 0.00 H new ATOM 0 HH22 ARG A 60 5.948 -27.568 4.737 1.00 0.00 H new ATOM 183 N LEU A 61 0.595 -21.031 0.553 1.00 0.00 N ATOM 184 CA LEU A 61 0.815 -19.818 -0.227 1.00 0.00 C ATOM 185 C LEU A 61 -0.221 -18.785 0.173 1.00 0.00 C ATOM 186 O LEU A 61 0.082 -17.599 0.388 1.00 0.00 O ATOM 187 CB LEU A 61 0.758 -20.112 -1.718 1.00 0.00 C ATOM 188 CG LEU A 61 2.121 -20.339 -2.361 1.00 0.00 C ATOM 189 CD1 LEU A 61 2.953 -19.066 -2.315 1.00 0.00 C ATOM 190 CD2 LEU A 61 2.851 -21.479 -1.669 1.00 0.00 C ATOM 0 H LEU A 61 0.348 -21.861 0.014 1.00 0.00 H new ATOM 0 HA LEU A 61 1.810 -19.425 -0.019 1.00 0.00 H new ATOM 0 HB2 LEU A 61 0.141 -20.996 -1.880 1.00 0.00 H new ATOM 0 HB3 LEU A 61 0.264 -19.281 -2.222 1.00 0.00 H new ATOM 0 HG LEU A 61 1.968 -20.610 -3.406 1.00 0.00 H new ATOM 0 HD11 LEU A 61 3.923 -19.248 -2.779 1.00 0.00 H new ATOM 0 HD12 LEU A 61 2.435 -18.273 -2.855 1.00 0.00 H new ATOM 0 HD13 LEU A 61 3.098 -18.763 -1.278 1.00 0.00 H new ATOM 0 HD21 LEU A 61 3.822 -21.628 -2.140 1.00 0.00 H new ATOM 0 HD22 LEU A 61 2.992 -21.235 -0.616 1.00 0.00 H new ATOM 0 HD23 LEU A 61 2.263 -22.393 -1.754 1.00 0.00 H new ATOM 202 N GLU A 62 -1.446 -19.263 0.324 1.00 0.00 N ATOM 203 CA GLU A 62 -2.541 -18.417 0.757 1.00 0.00 C ATOM 204 C GLU A 62 -2.126 -17.662 2.015 1.00 0.00 C ATOM 205 O GLU A 62 -2.487 -16.503 2.197 1.00 0.00 O ATOM 206 CB GLU A 62 -3.790 -19.255 1.027 1.00 0.00 C ATOM 207 CG GLU A 62 -4.948 -18.467 1.616 1.00 0.00 C ATOM 208 CD GLU A 62 -6.204 -19.303 1.762 1.00 0.00 C ATOM 209 OE1 GLU A 62 -6.095 -20.547 1.744 1.00 0.00 O ATOM 210 OE2 GLU A 62 -7.297 -18.713 1.897 1.00 0.00 O ATOM 0 H GLU A 62 -1.705 -20.235 0.152 1.00 0.00 H new ATOM 0 HA GLU A 62 -2.777 -17.703 -0.032 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.115 -19.715 0.094 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -3.531 -20.065 1.709 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -4.659 -18.078 2.592 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.159 -17.608 0.980 1.00 0.00 H new ATOM 217 N ARG A 63 -1.344 -18.325 2.876 1.00 0.00 N ATOM 218 CA ARG A 63 -0.866 -17.692 4.098 1.00 0.00 C ATOM 219 C ARG A 63 0.304 -16.768 3.784 1.00 0.00 C ATOM 220 O ARG A 63 0.544 -15.788 4.491 1.00 0.00 O ATOM 221 CB ARG A 63 -0.445 -18.745 5.127 1.00 0.00 C ATOM 222 CG ARG A 63 0.072 -18.148 6.427 1.00 0.00 C ATOM 223 CD ARG A 63 1.492 -18.599 6.728 1.00 0.00 C ATOM 224 NE ARG A 63 1.527 -19.928 7.333 1.00 0.00 N ATOM 225 CZ ARG A 63 2.534 -20.380 8.079 1.00 0.00 C ATOM 226 NH1 ARG A 63 3.593 -19.615 8.310 1.00 0.00 N ATOM 227 NH2 ARG A 63 2.480 -21.601 8.592 1.00 0.00 N ATOM 0 H ARG A 63 -1.035 -19.288 2.746 1.00 0.00 H new ATOM 0 HA ARG A 63 -1.680 -17.105 4.523 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -1.297 -19.389 5.345 1.00 0.00 H new ATOM 0 HB3 ARG A 63 0.330 -19.377 4.693 1.00 0.00 H new ATOM 0 HG2 ARG A 63 0.041 -17.060 6.365 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -0.584 -18.439 7.247 1.00 0.00 H new ATOM 0 HD2 ARG A 63 2.074 -18.605 5.806 1.00 0.00 H new ATOM 0 HD3 ARG A 63 1.965 -17.882 7.399 1.00 0.00 H new ATOM 0 HE ARG A 63 0.732 -20.548 7.175 1.00 0.00 H new ATOM 0 HH11 ARG A 63 3.639 -18.675 7.916 1.00 0.00 H new ATOM 0 HH12 ARG A 63 4.361 -19.966 8.882 1.00 0.00 H new ATOM 0 HH21 ARG A 63 1.668 -22.193 8.415 1.00 0.00 H new ATOM 0 HH22 ARG A 63 3.250 -21.949 9.163 1.00 0.00 H new ATOM 241 N LEU A 64 1.021 -17.077 2.704 1.00 0.00 N ATOM 242 CA LEU A 64 2.152 -16.266 2.279 1.00 0.00 C ATOM 243 C LEU A 64 1.667 -14.893 1.854 1.00 0.00 C ATOM 244 O LEU A 64 2.389 -13.900 1.954 1.00 0.00 O ATOM 245 CB LEU A 64 2.919 -16.960 1.142 1.00 0.00 C ATOM 246 CG LEU A 64 3.547 -16.032 0.094 1.00 0.00 C ATOM 247 CD1 LEU A 64 4.854 -16.616 -0.421 1.00 0.00 C ATOM 248 CD2 LEU A 64 2.576 -15.799 -1.055 1.00 0.00 C ATOM 0 H LEU A 64 0.835 -17.885 2.110 1.00 0.00 H new ATOM 0 HA LEU A 64 2.840 -16.147 3.116 1.00 0.00 H new ATOM 0 HB2 LEU A 64 3.710 -17.568 1.581 1.00 0.00 H new ATOM 0 HB3 LEU A 64 2.238 -17.642 0.634 1.00 0.00 H new ATOM 0 HG LEU A 64 3.763 -15.073 0.565 1.00 0.00 H new ATOM 0 HD11 LEU A 64 5.285 -15.944 -1.163 1.00 0.00 H new ATOM 0 HD12 LEU A 64 5.551 -16.735 0.408 1.00 0.00 H new ATOM 0 HD13 LEU A 64 4.664 -17.587 -0.878 1.00 0.00 H new ATOM 0 HD21 LEU A 64 3.035 -15.139 -1.791 1.00 0.00 H new ATOM 0 HD22 LEU A 64 2.332 -16.752 -1.524 1.00 0.00 H new ATOM 0 HD23 LEU A 64 1.664 -15.339 -0.673 1.00 0.00 H new ATOM 260 N GLU A 65 0.424 -14.847 1.408 1.00 0.00 N ATOM 261 CA GLU A 65 -0.193 -13.599 0.997 1.00 0.00 C ATOM 262 C GLU A 65 -1.081 -13.065 2.118 1.00 0.00 C ATOM 263 O GLU A 65 -1.397 -11.880 2.157 1.00 0.00 O ATOM 264 CB GLU A 65 -1.018 -13.806 -0.276 1.00 0.00 C ATOM 265 CG GLU A 65 -1.808 -12.575 -0.696 1.00 0.00 C ATOM 266 CD GLU A 65 -2.244 -12.627 -2.147 1.00 0.00 C ATOM 267 OE1 GLU A 65 -2.898 -13.618 -2.537 1.00 0.00 O ATOM 268 OE2 GLU A 65 -1.932 -11.677 -2.896 1.00 0.00 O ATOM 0 H GLU A 65 -0.180 -15.664 1.321 1.00 0.00 H new ATOM 0 HA GLU A 65 0.591 -12.872 0.787 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -0.351 -14.094 -1.089 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -1.708 -14.635 -0.121 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -2.688 -12.478 -0.060 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -1.199 -11.685 -0.535 1.00 0.00 H new ATOM 275 N GLN A 66 -1.489 -13.963 3.020 1.00 0.00 N ATOM 276 CA GLN A 66 -2.353 -13.609 4.142 1.00 0.00 C ATOM 277 C GLN A 66 -3.569 -12.833 3.654 1.00 0.00 C ATOM 278 O GLN A 66 -4.059 -11.926 4.328 1.00 0.00 O ATOM 279 CB GLN A 66 -1.577 -12.809 5.198 1.00 0.00 C ATOM 280 CG GLN A 66 -1.232 -11.388 4.780 1.00 0.00 C ATOM 281 CD GLN A 66 -0.810 -10.524 5.951 1.00 0.00 C ATOM 282 OE1 GLN A 66 -1.566 -10.339 6.905 1.00 0.00 O ATOM 283 NE2 GLN A 66 0.403 -9.989 5.885 1.00 0.00 N ATOM 0 H GLN A 66 -1.230 -14.949 2.991 1.00 0.00 H new ATOM 0 HA GLN A 66 -2.702 -14.529 4.611 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -2.166 -12.772 6.114 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -0.655 -13.340 5.433 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -0.428 -11.414 4.044 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -2.096 -10.936 4.292 1.00 0.00 H new ATOM 0 HE21 GLN A 66 0.996 -10.169 5.075 1.00 0.00 H new ATOM 0 HE22 GLN A 66 0.742 -9.398 6.644 1.00 0.00 H new ATOM 292 N LEU A 67 -4.048 -13.202 2.468 1.00 0.00 N ATOM 293 CA LEU A 67 -5.205 -12.551 1.864 1.00 0.00 C ATOM 294 C LEU A 67 -4.864 -11.127 1.428 1.00 0.00 C ATOM 295 O LEU A 67 -5.755 -10.354 1.081 1.00 0.00 O ATOM 296 CB LEU A 67 -6.380 -12.531 2.848 1.00 0.00 C ATOM 297 CG LEU A 67 -7.707 -13.049 2.286 1.00 0.00 C ATOM 298 CD1 LEU A 67 -8.022 -14.429 2.841 1.00 0.00 C ATOM 299 CD2 LEU A 67 -8.835 -12.076 2.598 1.00 0.00 C ATOM 0 H LEU A 67 -3.649 -13.953 1.905 1.00 0.00 H new ATOM 0 HA LEU A 67 -5.491 -13.122 0.981 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -6.114 -13.129 3.719 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -6.525 -11.508 3.196 1.00 0.00 H new ATOM 0 HG LEU A 67 -7.612 -13.130 1.203 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -8.969 -14.779 2.430 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -7.228 -15.122 2.565 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -8.096 -14.376 3.927 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -9.770 -12.461 2.191 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -8.929 -11.962 3.678 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -8.615 -11.108 2.149 1.00 0.00 H new ATOM 311 N PHE A 68 -3.568 -10.793 1.446 1.00 0.00 N ATOM 312 CA PHE A 68 -3.093 -9.459 1.056 1.00 0.00 C ATOM 313 C PHE A 68 -1.716 -9.187 1.654 1.00 0.00 C ATOM 314 O PHE A 68 -1.469 -9.493 2.819 1.00 0.00 O ATOM 315 CB PHE A 68 -4.066 -8.362 1.518 1.00 0.00 C ATOM 316 CG PHE A 68 -4.824 -7.715 0.392 1.00 0.00 C ATOM 317 CD1 PHE A 68 -4.152 -7.025 -0.603 1.00 0.00 C ATOM 318 CD2 PHE A 68 -6.206 -7.794 0.333 1.00 0.00 C ATOM 319 CE1 PHE A 68 -4.844 -6.426 -1.638 1.00 0.00 C ATOM 320 CE2 PHE A 68 -6.903 -7.197 -0.699 1.00 0.00 C ATOM 321 CZ PHE A 68 -6.223 -6.513 -1.687 1.00 0.00 C ATOM 0 H PHE A 68 -2.825 -11.432 1.728 1.00 0.00 H new ATOM 0 HA PHE A 68 -3.032 -9.440 -0.032 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -4.777 -8.792 2.223 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -3.508 -7.596 2.056 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -3.075 -6.954 -0.570 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -6.744 -8.328 1.102 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -4.308 -5.890 -2.408 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -7.980 -7.265 -0.733 1.00 0.00 H new ATOM 0 HZ PHE A 68 -6.767 -6.047 -2.496 1.00 0.00 H new ATOM 331 N LEU A 69 -0.824 -8.601 0.864 1.00 0.00 N ATOM 332 CA LEU A 69 0.516 -8.288 1.345 1.00 0.00 C ATOM 333 C LEU A 69 0.453 -7.216 2.434 1.00 0.00 C ATOM 334 O LEU A 69 -0.614 -6.944 2.984 1.00 0.00 O ATOM 335 CB LEU A 69 1.413 -7.836 0.187 1.00 0.00 C ATOM 336 CG LEU A 69 1.025 -6.506 -0.463 1.00 0.00 C ATOM 337 CD1 LEU A 69 2.192 -5.531 -0.428 1.00 0.00 C ATOM 338 CD2 LEU A 69 0.558 -6.727 -1.895 1.00 0.00 C ATOM 0 H LEU A 69 -1.002 -8.335 -0.104 1.00 0.00 H new ATOM 0 HA LEU A 69 0.950 -9.190 1.776 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.437 -7.757 0.552 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.406 -8.611 -0.579 1.00 0.00 H new ATOM 0 HG LEU A 69 0.201 -6.075 0.106 1.00 0.00 H new ATOM 0 HD11 LEU A 69 1.896 -4.592 -0.895 1.00 0.00 H new ATOM 0 HD12 LEU A 69 2.481 -5.346 0.607 1.00 0.00 H new ATOM 0 HD13 LEU A 69 3.037 -5.955 -0.971 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.286 -5.770 -2.341 1.00 0.00 H new ATOM 0 HD22 LEU A 69 1.362 -7.182 -2.474 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.309 -7.387 -1.897 1.00 0.00 H new ATOM 350 N LEU A 70 1.598 -6.620 2.751 1.00 0.00 N ATOM 351 CA LEU A 70 1.665 -5.589 3.785 1.00 0.00 C ATOM 352 C LEU A 70 0.851 -4.350 3.409 1.00 0.00 C ATOM 353 O LEU A 70 0.562 -3.508 4.257 1.00 0.00 O ATOM 354 CB LEU A 70 3.120 -5.195 4.044 1.00 0.00 C ATOM 355 CG LEU A 70 3.862 -6.078 5.049 1.00 0.00 C ATOM 356 CD1 LEU A 70 5.354 -5.790 5.014 1.00 0.00 C ATOM 357 CD2 LEU A 70 3.308 -5.870 6.450 1.00 0.00 C ATOM 0 H LEU A 70 2.492 -6.832 2.308 1.00 0.00 H new ATOM 0 HA LEU A 70 1.233 -6.009 4.693 1.00 0.00 H new ATOM 0 HB2 LEU A 70 3.660 -5.216 3.097 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.143 -4.166 4.402 1.00 0.00 H new ATOM 0 HG LEU A 70 3.709 -7.121 4.771 1.00 0.00 H new ATOM 0 HD11 LEU A 70 5.865 -6.428 5.736 1.00 0.00 H new ATOM 0 HD12 LEU A 70 5.740 -5.991 4.015 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.529 -4.744 5.267 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.847 -6.506 7.152 1.00 0.00 H new ATOM 0 HD22 LEU A 70 3.430 -4.826 6.738 1.00 0.00 H new ATOM 0 HD23 LEU A 70 2.249 -6.129 6.465 1.00 0.00 H new ATOM 369 N ILE A 71 0.488 -4.240 2.135 1.00 0.00 N ATOM 370 CA ILE A 71 -0.285 -3.101 1.654 1.00 0.00 C ATOM 371 C ILE A 71 -1.599 -2.953 2.417 1.00 0.00 C ATOM 372 O ILE A 71 -2.124 -1.848 2.557 1.00 0.00 O ATOM 373 CB ILE A 71 -0.586 -3.218 0.146 1.00 0.00 C ATOM 374 CG1 ILE A 71 -1.199 -1.917 -0.379 1.00 0.00 C ATOM 375 CG2 ILE A 71 -1.512 -4.396 -0.127 1.00 0.00 C ATOM 376 CD1 ILE A 71 -0.248 -1.101 -1.227 1.00 0.00 C ATOM 0 H ILE A 71 0.717 -4.927 1.417 1.00 0.00 H new ATOM 0 HA ILE A 71 0.327 -2.216 1.827 1.00 0.00 H new ATOM 0 HB ILE A 71 0.352 -3.394 -0.380 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -2.086 -2.154 -0.967 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -1.529 -1.313 0.466 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -1.712 -4.461 -1.196 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -1.038 -5.318 0.210 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -2.450 -4.253 0.410 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -0.749 -0.194 -1.565 1.00 0.00 H new ATOM 0 HD12 ILE A 71 0.628 -0.834 -0.636 1.00 0.00 H new ATOM 0 HD13 ILE A 71 0.063 -1.687 -2.092 1.00 0.00 H new ATOM 388 N PHE A 72 -2.128 -4.071 2.904 1.00 0.00 N ATOM 389 CA PHE A 72 -3.384 -4.060 3.646 1.00 0.00 C ATOM 390 C PHE A 72 -3.140 -4.219 5.146 1.00 0.00 C ATOM 391 O PHE A 72 -3.056 -5.338 5.653 1.00 0.00 O ATOM 392 CB PHE A 72 -4.303 -5.176 3.145 1.00 0.00 C ATOM 393 CG PHE A 72 -5.704 -4.715 2.858 1.00 0.00 C ATOM 394 CD1 PHE A 72 -6.542 -4.319 3.888 1.00 0.00 C ATOM 395 CD2 PHE A 72 -6.182 -4.677 1.559 1.00 0.00 C ATOM 396 CE1 PHE A 72 -7.830 -3.894 3.627 1.00 0.00 C ATOM 397 CE2 PHE A 72 -7.470 -4.254 1.292 1.00 0.00 C ATOM 398 CZ PHE A 72 -8.295 -3.862 2.327 1.00 0.00 C ATOM 0 H PHE A 72 -1.708 -4.994 2.799 1.00 0.00 H new ATOM 0 HA PHE A 72 -3.865 -3.096 3.479 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -3.878 -5.607 2.238 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -4.336 -5.971 3.890 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -6.184 -4.343 4.907 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -5.541 -4.982 0.745 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -8.473 -3.587 4.439 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -7.831 -4.230 0.274 1.00 0.00 H new ATOM 0 HZ PHE A 72 -9.302 -3.531 2.121 1.00 0.00 H new ATOM 408 N PRO A 73 -3.024 -3.097 5.880 1.00 0.00 N ATOM 409 CA PRO A 73 -2.791 -3.121 7.328 1.00 0.00 C ATOM 410 C PRO A 73 -4.027 -3.551 8.116 1.00 0.00 C ATOM 411 O PRO A 73 -3.959 -3.756 9.329 1.00 0.00 O ATOM 412 CB PRO A 73 -2.434 -1.669 7.650 1.00 0.00 C ATOM 413 CG PRO A 73 -3.125 -0.871 6.599 1.00 0.00 C ATOM 414 CD PRO A 73 -3.113 -1.720 5.357 1.00 0.00 C ATOM 0 HA PRO A 73 -2.019 -3.840 7.602 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -2.773 -1.389 8.647 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -1.356 -1.510 7.624 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -4.146 -0.632 6.898 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -2.613 0.076 6.429 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -4.015 -1.574 4.763 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -2.266 -1.479 4.715 1.00 0.00 H new ATOM 422 N ARG A 74 -5.156 -3.686 7.425 1.00 0.00 N ATOM 423 CA ARG A 74 -6.404 -4.090 8.066 1.00 0.00 C ATOM 424 C ARG A 74 -6.884 -3.023 9.044 1.00 0.00 C ATOM 425 O ARG A 74 -7.208 -3.321 10.195 1.00 0.00 O ATOM 426 CB ARG A 74 -6.224 -5.426 8.792 1.00 0.00 C ATOM 427 CG ARG A 74 -7.534 -6.125 9.116 1.00 0.00 C ATOM 428 CD ARG A 74 -7.354 -7.632 9.208 1.00 0.00 C ATOM 429 NE ARG A 74 -8.575 -8.304 9.645 1.00 0.00 N ATOM 430 CZ ARG A 74 -9.607 -8.561 8.845 1.00 0.00 C ATOM 431 NH1 ARG A 74 -9.571 -8.202 7.568 1.00 0.00 N ATOM 432 NH2 ARG A 74 -10.679 -9.179 9.321 1.00 0.00 N ATOM 0 H ARG A 74 -5.232 -3.522 6.421 1.00 0.00 H new ATOM 0 HA ARG A 74 -7.159 -4.209 7.289 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -5.613 -6.085 8.175 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -5.674 -5.256 9.718 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -7.926 -5.746 10.060 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -8.272 -5.892 8.348 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -7.055 -8.021 8.235 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -6.547 -7.859 9.904 1.00 0.00 H new ATOM 0 HE ARG A 74 -8.641 -8.593 10.621 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -8.749 -7.726 7.195 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -10.365 -8.402 6.960 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -10.713 -9.458 10.301 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -11.469 -9.375 8.707 1.00 0.00 H new ATOM 446 N GLU A 75 -6.928 -1.780 8.581 1.00 0.00 N ATOM 447 CA GLU A 75 -7.371 -0.668 9.416 1.00 0.00 C ATOM 448 C GLU A 75 -7.413 0.630 8.615 1.00 0.00 C ATOM 449 O GLU A 75 -8.419 1.339 8.617 1.00 0.00 O ATOM 450 CB GLU A 75 -6.444 -0.508 10.622 1.00 0.00 C ATOM 451 CG GLU A 75 -7.158 -0.022 11.873 1.00 0.00 C ATOM 452 CD GLU A 75 -6.204 0.550 12.904 1.00 0.00 C ATOM 453 OE1 GLU A 75 -5.025 0.137 12.914 1.00 0.00 O ATOM 454 OE2 GLU A 75 -6.636 1.409 13.700 1.00 0.00 O ATOM 0 H GLU A 75 -6.663 -1.516 7.632 1.00 0.00 H new ATOM 0 HA GLU A 75 -8.379 -0.889 9.768 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -5.967 -1.465 10.834 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -5.650 0.195 10.370 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -7.888 0.739 11.598 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -7.712 -0.850 12.316 1.00 0.00 H new ATOM 461 N ASP A 76 -6.315 0.936 7.933 1.00 0.00 N ATOM 462 CA ASP A 76 -6.227 2.149 7.129 1.00 0.00 C ATOM 463 C ASP A 76 -6.246 1.819 5.639 1.00 0.00 C ATOM 464 O ASP A 76 -5.560 0.902 5.188 1.00 0.00 O ATOM 465 CB ASP A 76 -4.955 2.925 7.474 1.00 0.00 C ATOM 466 CG ASP A 76 -5.172 4.425 7.466 1.00 0.00 C ATOM 467 OD1 ASP A 76 -5.568 4.961 6.411 1.00 0.00 O ATOM 468 OD2 ASP A 76 -4.945 5.064 8.515 1.00 0.00 O ATOM 0 H ASP A 76 -5.473 0.360 7.921 1.00 0.00 H new ATOM 0 HA ASP A 76 -7.095 2.768 7.357 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -4.601 2.617 8.458 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -4.172 2.670 6.759 1.00 0.00 H new ATOM 473 N LEU A 77 -7.035 2.574 4.882 1.00 0.00 N ATOM 474 CA LEU A 77 -7.142 2.362 3.442 1.00 0.00 C ATOM 475 C LEU A 77 -6.475 3.498 2.672 1.00 0.00 C ATOM 476 O LEU A 77 -6.882 3.830 1.559 1.00 0.00 O ATOM 477 CB LEU A 77 -8.611 2.246 3.031 1.00 0.00 C ATOM 478 CG LEU A 77 -9.486 3.447 3.402 1.00 0.00 C ATOM 479 CD1 LEU A 77 -9.809 4.278 2.169 1.00 0.00 C ATOM 480 CD2 LEU A 77 -10.765 2.987 4.086 1.00 0.00 C ATOM 0 H LEU A 77 -7.609 3.337 5.240 1.00 0.00 H new ATOM 0 HA LEU A 77 -6.628 1.432 3.198 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -8.660 2.100 1.952 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -9.032 1.353 3.493 1.00 0.00 H new ATOM 0 HG LEU A 77 -8.929 4.072 4.100 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -10.431 5.126 2.455 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -8.883 4.641 1.722 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -10.344 3.663 1.445 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -11.373 3.855 4.342 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -11.324 2.338 3.413 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -10.515 2.439 4.994 1.00 0.00 H new ATOM 492 N ASP A 78 -5.448 4.088 3.273 1.00 0.00 N ATOM 493 CA ASP A 78 -4.722 5.186 2.645 1.00 0.00 C ATOM 494 C ASP A 78 -3.364 5.394 3.310 1.00 0.00 C ATOM 495 O ASP A 78 -2.850 6.511 3.357 1.00 0.00 O ATOM 496 CB ASP A 78 -5.542 6.476 2.719 1.00 0.00 C ATOM 497 CG ASP A 78 -5.869 6.873 4.145 1.00 0.00 C ATOM 498 OD1 ASP A 78 -4.937 7.257 4.884 1.00 0.00 O ATOM 499 OD2 ASP A 78 -7.056 6.800 4.523 1.00 0.00 O ATOM 0 H ASP A 78 -5.099 3.824 4.195 1.00 0.00 H new ATOM 0 HA ASP A 78 -4.557 4.927 1.599 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -4.989 7.283 2.238 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.468 6.347 2.159 1.00 0.00 H new ATOM 504 N MET A 79 -2.788 4.311 3.820 1.00 0.00 N ATOM 505 CA MET A 79 -1.491 4.375 4.480 1.00 0.00 C ATOM 506 C MET A 79 -0.384 4.684 3.475 1.00 0.00 C ATOM 507 O MET A 79 0.431 5.582 3.690 1.00 0.00 O ATOM 508 CB MET A 79 -1.194 3.054 5.196 1.00 0.00 C ATOM 509 CG MET A 79 -0.704 3.233 6.624 1.00 0.00 C ATOM 510 SD MET A 79 -0.863 1.731 7.606 1.00 0.00 S ATOM 511 CE MET A 79 0.575 1.868 8.666 1.00 0.00 C ATOM 0 H MET A 79 -3.200 3.378 3.789 1.00 0.00 H new ATOM 0 HA MET A 79 -1.524 5.179 5.215 1.00 0.00 H new ATOM 0 HB2 MET A 79 -2.097 2.444 5.204 1.00 0.00 H new ATOM 0 HB3 MET A 79 -0.443 2.504 4.629 1.00 0.00 H new ATOM 0 HG2 MET A 79 0.341 3.544 6.609 1.00 0.00 H new ATOM 0 HG3 MET A 79 -1.268 4.035 7.100 1.00 0.00 H new ATOM 0 HE1 MET A 79 0.617 1.009 9.335 1.00 0.00 H new ATOM 0 HE2 MET A 79 1.477 1.896 8.054 1.00 0.00 H new ATOM 0 HE3 MET A 79 0.507 2.783 9.254 1.00 0.00 H new ATOM 521 N ILE A 80 -0.365 3.934 2.378 1.00 0.00 N ATOM 522 CA ILE A 80 0.638 4.127 1.339 1.00 0.00 C ATOM 523 C ILE A 80 0.535 5.522 0.733 1.00 0.00 C ATOM 524 O ILE A 80 1.543 6.205 0.548 1.00 0.00 O ATOM 525 CB ILE A 80 0.501 3.077 0.219 1.00 0.00 C ATOM 526 CG1 ILE A 80 0.463 1.668 0.812 1.00 0.00 C ATOM 527 CG2 ILE A 80 1.646 3.207 -0.774 1.00 0.00 C ATOM 528 CD1 ILE A 80 1.665 1.339 1.670 1.00 0.00 C ATOM 0 H ILE A 80 -1.033 3.187 2.186 1.00 0.00 H new ATOM 0 HA ILE A 80 1.612 4.010 1.813 1.00 0.00 H new ATOM 0 HB ILE A 80 -0.435 3.254 -0.310 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -0.441 1.559 1.411 1.00 0.00 H new ATOM 0 HG13 ILE A 80 0.397 0.943 0.001 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.534 2.458 -1.558 1.00 0.00 H new ATOM 0 HG22 ILE A 80 1.631 4.202 -1.218 1.00 0.00 H new ATOM 0 HG23 ILE A 80 2.594 3.053 -0.258 1.00 0.00 H new ATOM 0 HD11 ILE A 80 1.569 0.324 2.057 1.00 0.00 H new ATOM 0 HD12 ILE A 80 2.572 1.415 1.070 1.00 0.00 H new ATOM 0 HD13 ILE A 80 1.721 2.041 2.502 1.00 0.00 H new ATOM 540 N LEU A 81 -0.688 5.942 0.428 1.00 0.00 N ATOM 541 CA LEU A 81 -0.918 7.259 -0.154 1.00 0.00 C ATOM 542 C LEU A 81 -0.558 8.355 0.844 1.00 0.00 C ATOM 543 O LEU A 81 -0.139 9.447 0.457 1.00 0.00 O ATOM 544 CB LEU A 81 -2.380 7.412 -0.589 1.00 0.00 C ATOM 545 CG LEU A 81 -3.041 6.143 -1.134 1.00 0.00 C ATOM 546 CD1 LEU A 81 -4.417 6.463 -1.698 1.00 0.00 C ATOM 547 CD2 LEU A 81 -2.165 5.498 -2.197 1.00 0.00 C ATOM 0 H LEU A 81 -1.534 5.391 0.574 1.00 0.00 H new ATOM 0 HA LEU A 81 -0.279 7.356 -1.032 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.960 7.765 0.264 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -2.434 8.186 -1.354 1.00 0.00 H new ATOM 0 HG LEU A 81 -3.160 5.436 -0.313 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -4.874 5.551 -2.082 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -5.045 6.880 -0.911 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.319 7.188 -2.506 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.652 4.598 -2.572 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -2.014 6.198 -3.019 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -1.200 5.235 -1.763 1.00 0.00 H new ATOM 559 N LYS A 82 -0.721 8.055 2.127 1.00 0.00 N ATOM 560 CA LYS A 82 -0.412 9.012 3.184 1.00 0.00 C ATOM 561 C LYS A 82 1.095 9.143 3.374 1.00 0.00 C ATOM 562 O LYS A 82 1.590 10.196 3.776 1.00 0.00 O ATOM 563 CB LYS A 82 -1.069 8.583 4.495 1.00 0.00 C ATOM 564 CG LYS A 82 -2.451 9.180 4.706 1.00 0.00 C ATOM 565 CD LYS A 82 -2.796 9.276 6.184 1.00 0.00 C ATOM 566 CE LYS A 82 -3.643 10.504 6.479 1.00 0.00 C ATOM 567 NZ LYS A 82 -4.779 10.189 7.388 1.00 0.00 N ATOM 0 H LYS A 82 -1.066 7.155 2.462 1.00 0.00 H new ATOM 0 HA LYS A 82 -0.808 9.984 2.889 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -1.145 7.496 4.515 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -0.426 8.873 5.326 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.493 10.172 4.256 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -3.195 8.568 4.197 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -3.333 8.379 6.492 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -1.879 9.316 6.771 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -3.019 11.275 6.931 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -4.028 10.913 5.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -5.332 11.052 7.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -5.389 9.472 6.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -4.411 9.823 8.289 1.00 0.00 H new ATOM 581 N MET A 83 1.823 8.070 3.078 1.00 0.00 N ATOM 582 CA MET A 83 3.275 8.071 3.216 1.00 0.00 C ATOM 583 C MET A 83 3.933 8.622 1.955 1.00 0.00 C ATOM 584 O MET A 83 4.426 9.749 1.941 1.00 0.00 O ATOM 585 CB MET A 83 3.786 6.657 3.497 1.00 0.00 C ATOM 586 CG MET A 83 3.483 6.169 4.903 1.00 0.00 C ATOM 587 SD MET A 83 4.264 4.587 5.273 1.00 0.00 S ATOM 588 CE MET A 83 2.855 3.484 5.186 1.00 0.00 C ATOM 0 H MET A 83 1.431 7.190 2.742 1.00 0.00 H new ATOM 0 HA MET A 83 3.537 8.714 4.057 1.00 0.00 H new ATOM 0 HB2 MET A 83 3.340 5.969 2.779 1.00 0.00 H new ATOM 0 HB3 MET A 83 4.864 6.631 3.337 1.00 0.00 H new ATOM 0 HG2 MET A 83 3.822 6.914 5.623 1.00 0.00 H new ATOM 0 HG3 MET A 83 2.404 6.075 5.026 1.00 0.00 H new ATOM 0 HE1 MET A 83 2.763 2.937 6.124 1.00 0.00 H new ATOM 0 HE2 MET A 83 1.949 4.064 5.014 1.00 0.00 H new ATOM 0 HE3 MET A 83 2.995 2.779 4.367 1.00 0.00 H new ATOM 598 N ASP A 84 3.930 7.819 0.895 1.00 0.00 N ATOM 599 CA ASP A 84 4.523 8.230 -0.371 1.00 0.00 C ATOM 600 C ASP A 84 3.682 9.316 -1.030 1.00 0.00 C ATOM 601 O ASP A 84 2.528 9.089 -1.391 1.00 0.00 O ATOM 602 CB ASP A 84 4.656 7.029 -1.310 1.00 0.00 C ATOM 603 CG ASP A 84 5.907 6.217 -1.037 1.00 0.00 C ATOM 604 OD1 ASP A 84 6.370 6.213 0.123 1.00 0.00 O ATOM 605 OD2 ASP A 84 6.421 5.583 -1.982 1.00 0.00 O ATOM 0 H ASP A 84 3.525 6.883 0.888 1.00 0.00 H new ATOM 0 HA ASP A 84 5.515 8.633 -0.169 1.00 0.00 H new ATOM 0 HB2 ASP A 84 3.780 6.389 -1.203 1.00 0.00 H new ATOM 0 HB3 ASP A 84 4.671 7.378 -2.342 1.00 0.00 H new ATOM 610 N SER A 85 4.268 10.502 -1.181 1.00 0.00 N ATOM 611 CA SER A 85 3.574 11.633 -1.793 1.00 0.00 C ATOM 612 C SER A 85 2.561 12.237 -0.822 1.00 0.00 C ATOM 613 O SER A 85 2.639 12.011 0.386 1.00 0.00 O ATOM 614 CB SER A 85 2.874 11.200 -3.087 1.00 0.00 C ATOM 615 OG SER A 85 3.540 10.102 -3.686 1.00 0.00 O ATOM 0 H SER A 85 5.224 10.705 -0.887 1.00 0.00 H new ATOM 0 HA SER A 85 4.316 12.394 -2.035 1.00 0.00 H new ATOM 0 HB2 SER A 85 1.841 10.929 -2.871 1.00 0.00 H new ATOM 0 HB3 SER A 85 2.845 12.036 -3.785 1.00 0.00 H new ATOM 0 HG SER A 85 3.073 9.845 -4.508 1.00 0.00 H new ATOM 621 N LEU A 86 1.617 13.010 -1.351 1.00 0.00 N ATOM 622 CA LEU A 86 0.597 13.647 -0.524 1.00 0.00 C ATOM 623 C LEU A 86 1.227 14.666 0.423 1.00 0.00 C ATOM 624 O LEU A 86 0.682 14.957 1.487 1.00 0.00 O ATOM 625 CB LEU A 86 -0.174 12.593 0.276 1.00 0.00 C ATOM 626 CG LEU A 86 -1.680 12.842 0.394 1.00 0.00 C ATOM 627 CD1 LEU A 86 -2.444 11.984 -0.603 1.00 0.00 C ATOM 628 CD2 LEU A 86 -2.158 12.566 1.812 1.00 0.00 C ATOM 0 H LEU A 86 1.537 13.210 -2.348 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.098 14.170 -1.182 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.018 11.620 -0.189 1.00 0.00 H new ATOM 0 HB3 LEU A 86 0.249 12.539 1.279 1.00 0.00 H new ATOM 0 HG LEU A 86 -1.873 13.890 0.164 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.513 12.175 -0.504 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -2.124 12.230 -1.615 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -2.244 10.931 -0.405 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -3.231 12.748 1.876 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -1.950 11.528 2.070 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -1.636 13.224 2.507 1.00 0.00 H new ATOM 640 N ARG A 87 2.376 15.201 0.026 1.00 0.00 N ATOM 641 CA ARG A 87 3.085 16.187 0.837 1.00 0.00 C ATOM 642 C ARG A 87 3.856 17.163 -0.044 1.00 0.00 C ATOM 643 O ARG A 87 3.877 18.361 0.218 1.00 0.00 O ATOM 644 CB ARG A 87 4.042 15.491 1.806 1.00 0.00 C ATOM 645 CG ARG A 87 3.340 14.755 2.934 1.00 0.00 C ATOM 646 CD ARG A 87 4.275 13.778 3.629 1.00 0.00 C ATOM 647 NE ARG A 87 5.045 14.422 4.692 1.00 0.00 N ATOM 648 CZ ARG A 87 6.073 13.848 5.313 1.00 0.00 C ATOM 649 NH1 ARG A 87 6.459 12.623 4.981 1.00 0.00 N ATOM 650 NH2 ARG A 87 6.720 14.502 6.270 1.00 0.00 N ATOM 0 H ARG A 87 2.838 14.969 -0.853 1.00 0.00 H new ATOM 0 HA ARG A 87 2.346 16.748 1.409 1.00 0.00 H new ATOM 0 HB2 ARG A 87 4.657 14.784 1.250 1.00 0.00 H new ATOM 0 HB3 ARG A 87 4.716 16.233 2.233 1.00 0.00 H new ATOM 0 HG2 ARG A 87 2.960 15.475 3.659 1.00 0.00 H new ATOM 0 HG3 ARG A 87 2.479 14.217 2.538 1.00 0.00 H new ATOM 0 HD2 ARG A 87 3.695 12.956 4.048 1.00 0.00 H new ATOM 0 HD3 ARG A 87 4.958 13.346 2.897 1.00 0.00 H new ATOM 0 HE ARG A 87 4.779 15.366 4.974 1.00 0.00 H new ATOM 0 HH11 ARG A 87 5.967 12.115 4.246 1.00 0.00 H new ATOM 0 HH12 ARG A 87 7.248 12.189 5.461 1.00 0.00 H new ATOM 0 HH21 ARG A 87 6.429 15.445 6.530 1.00 0.00 H new ATOM 0 HH22 ARG A 87 7.508 14.062 6.746 1.00 0.00 H new ATOM 664 N ASP A 88 4.485 16.645 -1.096 1.00 0.00 N ATOM 665 CA ASP A 88 5.246 17.483 -2.020 1.00 0.00 C ATOM 666 C ASP A 88 4.311 18.347 -2.869 1.00 0.00 C ATOM 667 O ASP A 88 4.757 19.243 -3.589 1.00 0.00 O ATOM 668 CB ASP A 88 6.124 16.616 -2.924 1.00 0.00 C ATOM 669 CG ASP A 88 7.512 17.197 -3.114 1.00 0.00 C ATOM 670 OD1 ASP A 88 8.323 17.117 -2.169 1.00 0.00 O ATOM 671 OD2 ASP A 88 7.786 17.730 -4.209 1.00 0.00 O ATOM 0 H ASP A 88 4.483 15.652 -1.330 1.00 0.00 H new ATOM 0 HA ASP A 88 5.885 18.142 -1.432 1.00 0.00 H new ATOM 0 HB2 ASP A 88 6.207 15.617 -2.495 1.00 0.00 H new ATOM 0 HB3 ASP A 88 5.643 16.507 -3.896 1.00 0.00 H new ATOM 676 N ILE A 89 3.009 18.083 -2.764 1.00 0.00 N ATOM 677 CA ILE A 89 2.008 18.835 -3.499 1.00 0.00 C ATOM 678 C ILE A 89 1.574 20.029 -2.675 1.00 0.00 C ATOM 679 O ILE A 89 1.697 21.173 -3.103 1.00 0.00 O ATOM 680 CB ILE A 89 0.773 17.972 -3.823 1.00 0.00 C ATOM 681 CG1 ILE A 89 1.202 16.636 -4.429 1.00 0.00 C ATOM 682 CG2 ILE A 89 -0.165 18.718 -4.762 1.00 0.00 C ATOM 683 CD1 ILE A 89 1.735 16.760 -5.837 1.00 0.00 C ATOM 0 H ILE A 89 2.627 17.347 -2.171 1.00 0.00 H new ATOM 0 HA ILE A 89 2.454 19.159 -4.439 1.00 0.00 H new ATOM 0 HB ILE A 89 0.235 17.769 -2.897 1.00 0.00 H new ATOM 0 HG12 ILE A 89 1.968 16.188 -3.796 1.00 0.00 H new ATOM 0 HG13 ILE A 89 0.351 15.955 -4.429 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -1.032 18.095 -4.981 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -0.493 19.643 -4.289 1.00 0.00 H new ATOM 0 HG23 ILE A 89 0.358 18.951 -5.690 1.00 0.00 H new ATOM 0 HD11 ILE A 89 2.021 15.775 -6.206 1.00 0.00 H new ATOM 0 HD12 ILE A 89 0.963 17.179 -6.483 1.00 0.00 H new ATOM 0 HD13 ILE A 89 2.606 17.415 -5.840 1.00 0.00 H new ATOM 695 N GLU A 90 1.100 19.745 -1.470 1.00 0.00 N ATOM 696 CA GLU A 90 0.685 20.789 -0.551 1.00 0.00 C ATOM 697 C GLU A 90 1.894 21.629 -0.156 1.00 0.00 C ATOM 698 O GLU A 90 1.759 22.762 0.301 1.00 0.00 O ATOM 699 CB GLU A 90 0.044 20.167 0.693 1.00 0.00 C ATOM 700 CG GLU A 90 -0.285 21.175 1.784 1.00 0.00 C ATOM 701 CD GLU A 90 0.558 20.984 3.030 1.00 0.00 C ATOM 702 OE1 GLU A 90 0.644 19.838 3.518 1.00 0.00 O ATOM 703 OE2 GLU A 90 1.132 21.981 3.518 1.00 0.00 O ATOM 0 H GLU A 90 0.994 18.797 -1.108 1.00 0.00 H new ATOM 0 HA GLU A 90 -0.050 21.429 -1.039 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -0.871 19.652 0.400 1.00 0.00 H new ATOM 0 HB3 GLU A 90 0.718 19.413 1.099 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -0.134 22.183 1.399 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -1.339 21.089 2.047 1.00 0.00 H new ATOM 710 N ALA A 91 3.081 21.056 -0.346 1.00 0.00 N ATOM 711 CA ALA A 91 4.331 21.729 -0.018 1.00 0.00 C ATOM 712 C ALA A 91 4.811 22.570 -1.191 1.00 0.00 C ATOM 713 O ALA A 91 4.974 23.783 -1.073 1.00 0.00 O ATOM 714 CB ALA A 91 5.390 20.710 0.373 1.00 0.00 C ATOM 0 H ALA A 91 3.201 20.118 -0.729 1.00 0.00 H new ATOM 0 HA ALA A 91 4.155 22.392 0.829 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.319 21.226 0.616 1.00 0.00 H new ATOM 0 HB2 ALA A 91 5.050 20.147 1.242 1.00 0.00 H new ATOM 0 HB3 ALA A 91 5.561 20.026 -0.458 1.00 0.00 H new ATOM 720 N LEU A 92 5.026 21.922 -2.329 1.00 0.00 N ATOM 721 CA LEU A 92 5.474 22.627 -3.521 1.00 0.00 C ATOM 722 C LEU A 92 4.505 23.759 -3.863 1.00 0.00 C ATOM 723 O LEU A 92 4.879 24.741 -4.506 1.00 0.00 O ATOM 724 CB LEU A 92 5.594 21.660 -4.702 1.00 0.00 C ATOM 725 CG LEU A 92 6.316 22.222 -5.929 1.00 0.00 C ATOM 726 CD1 LEU A 92 7.750 22.586 -5.583 1.00 0.00 C ATOM 727 CD2 LEU A 92 6.278 21.218 -7.071 1.00 0.00 C ATOM 0 H LEU A 92 4.898 20.917 -2.451 1.00 0.00 H new ATOM 0 HA LEU A 92 6.456 23.054 -3.321 1.00 0.00 H new ATOM 0 HB2 LEU A 92 6.120 20.766 -4.368 1.00 0.00 H new ATOM 0 HB3 LEU A 92 4.593 21.348 -5.000 1.00 0.00 H new ATOM 0 HG LEU A 92 5.802 23.128 -6.249 1.00 0.00 H new ATOM 0 HD11 LEU A 92 8.248 22.984 -6.467 1.00 0.00 H new ATOM 0 HD12 LEU A 92 7.754 23.339 -4.795 1.00 0.00 H new ATOM 0 HD13 LEU A 92 8.278 21.697 -5.238 1.00 0.00 H new ATOM 0 HD21 LEU A 92 6.795 21.632 -7.937 1.00 0.00 H new ATOM 0 HD22 LEU A 92 6.769 20.296 -6.761 1.00 0.00 H new ATOM 0 HD23 LEU A 92 5.242 21.006 -7.335 1.00 0.00 H new ATOM 739 N LEU A 93 3.258 23.618 -3.411 1.00 0.00 N ATOM 740 CA LEU A 93 2.238 24.626 -3.660 1.00 0.00 C ATOM 741 C LEU A 93 2.176 25.637 -2.519 1.00 0.00 C ATOM 742 O LEU A 93 2.017 26.833 -2.757 1.00 0.00 O ATOM 743 CB LEU A 93 0.867 23.976 -3.855 1.00 0.00 C ATOM 744 CG LEU A 93 0.544 23.570 -5.295 1.00 0.00 C ATOM 745 CD1 LEU A 93 0.799 22.086 -5.506 1.00 0.00 C ATOM 746 CD2 LEU A 93 -0.897 23.918 -5.639 1.00 0.00 C ATOM 0 H LEU A 93 2.935 22.815 -2.872 1.00 0.00 H new ATOM 0 HA LEU A 93 2.511 25.152 -4.575 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.808 23.091 -3.222 1.00 0.00 H new ATOM 0 HB3 LEU A 93 0.100 24.669 -3.508 1.00 0.00 H new ATOM 0 HG LEU A 93 1.202 24.128 -5.962 1.00 0.00 H new ATOM 0 HD11 LEU A 93 0.563 21.819 -6.536 1.00 0.00 H new ATOM 0 HD12 LEU A 93 1.847 21.865 -5.305 1.00 0.00 H new ATOM 0 HD13 LEU A 93 0.170 21.509 -4.828 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.107 23.622 -6.667 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -1.570 23.389 -4.964 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -1.047 24.992 -5.533 1.00 0.00 H new ATOM 758 N THR A 94 2.308 25.165 -1.278 1.00 0.00 N ATOM 759 CA THR A 94 2.266 26.081 -0.138 1.00 0.00 C ATOM 760 C THR A 94 3.516 26.961 -0.099 1.00 0.00 C ATOM 761 O THR A 94 3.577 27.930 0.657 1.00 0.00 O ATOM 762 CB THR A 94 2.112 25.325 1.183 1.00 0.00 C ATOM 763 OG1 THR A 94 1.802 26.221 2.234 1.00 0.00 O ATOM 764 CG2 THR A 94 3.350 24.564 1.583 1.00 0.00 C ATOM 0 H THR A 94 2.441 24.182 -1.040 1.00 0.00 H new ATOM 0 HA THR A 94 1.392 26.720 -0.267 1.00 0.00 H new ATOM 0 HB THR A 94 1.305 24.611 1.017 1.00 0.00 H new ATOM 0 HG1 THR A 94 1.035 26.774 1.977 1.00 0.00 H new ATOM 0 HG21 THR A 94 3.172 24.051 2.528 1.00 0.00 H new ATOM 0 HG22 THR A 94 3.592 23.832 0.813 1.00 0.00 H new ATOM 0 HG23 THR A 94 4.183 25.258 1.698 1.00 0.00 H new ATOM 772 N GLY A 95 4.513 26.616 -0.912 1.00 0.00 N ATOM 773 CA GLY A 95 5.742 27.385 -0.946 1.00 0.00 C ATOM 774 C GLY A 95 6.008 28.028 -2.296 1.00 0.00 C ATOM 775 O GLY A 95 6.539 29.136 -2.362 1.00 0.00 O ATOM 0 H GLY A 95 4.489 25.818 -1.547 1.00 0.00 H new ATOM 0 HA2 GLY A 95 5.698 28.162 -0.183 1.00 0.00 H new ATOM 0 HA3 GLY A 95 6.578 26.734 -0.690 1.00 0.00 H new ATOM 779 N LEU A 96 5.648 27.337 -3.377 1.00 0.00 N ATOM 780 CA LEU A 96 5.872 27.869 -4.720 1.00 0.00 C ATOM 781 C LEU A 96 4.635 28.573 -5.270 1.00 0.00 C ATOM 782 O LEU A 96 4.678 29.174 -6.343 1.00 0.00 O ATOM 783 CB LEU A 96 6.311 26.755 -5.672 1.00 0.00 C ATOM 784 CG LEU A 96 7.412 27.141 -6.663 1.00 0.00 C ATOM 785 CD1 LEU A 96 6.970 28.311 -7.526 1.00 0.00 C ATOM 786 CD2 LEU A 96 8.700 27.477 -5.924 1.00 0.00 C ATOM 0 H LEU A 96 5.205 26.418 -3.351 1.00 0.00 H new ATOM 0 HA LEU A 96 6.668 28.610 -4.645 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.658 25.908 -5.080 1.00 0.00 H new ATOM 0 HB3 LEU A 96 5.441 26.415 -6.234 1.00 0.00 H new ATOM 0 HG LEU A 96 7.601 26.288 -7.315 1.00 0.00 H new ATOM 0 HD11 LEU A 96 7.767 28.570 -8.224 1.00 0.00 H new ATOM 0 HD12 LEU A 96 6.075 28.034 -8.083 1.00 0.00 H new ATOM 0 HD13 LEU A 96 6.751 29.169 -6.891 1.00 0.00 H new ATOM 0 HD21 LEU A 96 9.472 27.749 -6.644 1.00 0.00 H new ATOM 0 HD22 LEU A 96 8.524 28.313 -5.247 1.00 0.00 H new ATOM 0 HD23 LEU A 96 9.028 26.610 -5.351 1.00 0.00 H new ATOM 798 N PHE A 97 3.544 28.500 -4.522 1.00 0.00 N ATOM 799 CA PHE A 97 2.276 29.130 -4.907 1.00 0.00 C ATOM 800 C PHE A 97 2.026 29.043 -6.415 1.00 0.00 C ATOM 801 O PHE A 97 2.479 29.893 -7.180 1.00 0.00 O ATOM 802 CB PHE A 97 2.250 30.593 -4.458 1.00 0.00 C ATOM 803 CG PHE A 97 3.454 31.382 -4.888 1.00 0.00 C ATOM 804 CD1 PHE A 97 4.628 31.341 -4.151 1.00 0.00 C ATOM 805 CD2 PHE A 97 3.412 32.170 -6.028 1.00 0.00 C ATOM 806 CE1 PHE A 97 5.734 32.068 -4.542 1.00 0.00 C ATOM 807 CE2 PHE A 97 4.515 32.901 -6.424 1.00 0.00 C ATOM 808 CZ PHE A 97 5.679 32.849 -5.681 1.00 0.00 C ATOM 0 H PHE A 97 3.506 28.005 -3.631 1.00 0.00 H new ATOM 0 HA PHE A 97 1.478 28.582 -4.406 1.00 0.00 H new ATOM 0 HB2 PHE A 97 1.354 31.069 -4.856 1.00 0.00 H new ATOM 0 HB3 PHE A 97 2.174 30.628 -3.371 1.00 0.00 H new ATOM 0 HD1 PHE A 97 4.677 30.733 -3.260 1.00 0.00 H new ATOM 0 HD2 PHE A 97 2.506 32.213 -6.614 1.00 0.00 H new ATOM 0 HE1 PHE A 97 6.642 32.027 -3.958 1.00 0.00 H new ATOM 0 HE2 PHE A 97 4.468 33.512 -7.313 1.00 0.00 H new ATOM 0 HZ PHE A 97 6.544 33.417 -5.990 1.00 0.00 H new ATOM 818 N VAL A 98 1.297 28.013 -6.831 1.00 0.00 N ATOM 819 CA VAL A 98 0.985 27.823 -8.243 1.00 0.00 C ATOM 820 C VAL A 98 -0.465 28.193 -8.542 1.00 0.00 C ATOM 821 O VAL A 98 -1.393 27.535 -8.072 1.00 0.00 O ATOM 822 CB VAL A 98 1.241 26.368 -8.689 1.00 0.00 C ATOM 823 CG1 VAL A 98 0.344 25.402 -7.928 1.00 0.00 C ATOM 824 CG2 VAL A 98 1.036 26.225 -10.190 1.00 0.00 C ATOM 0 H VAL A 98 0.912 27.299 -6.213 1.00 0.00 H new ATOM 0 HA VAL A 98 1.646 28.484 -8.803 1.00 0.00 H new ATOM 0 HB VAL A 98 2.277 26.119 -8.459 1.00 0.00 H new ATOM 0 HG11 VAL A 98 0.543 24.383 -8.260 1.00 0.00 H new ATOM 0 HG12 VAL A 98 0.547 25.482 -6.860 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -0.701 25.648 -8.119 1.00 0.00 H new ATOM 0 HG21 VAL A 98 1.221 25.192 -10.486 1.00 0.00 H new ATOM 0 HG22 VAL A 98 0.012 26.498 -10.445 1.00 0.00 H new ATOM 0 HG23 VAL A 98 1.728 26.883 -10.716 1.00 0.00 H new ATOM 834 N GLN A 99 -0.649 29.249 -9.328 1.00 0.00 N ATOM 835 CA GLN A 99 -1.986 29.707 -9.690 1.00 0.00 C ATOM 836 C GLN A 99 -2.443 29.076 -11.001 1.00 0.00 C ATOM 837 O GLN A 99 -1.623 28.694 -11.837 1.00 0.00 O ATOM 838 CB GLN A 99 -2.009 31.232 -9.810 1.00 0.00 C ATOM 839 CG GLN A 99 -3.396 31.834 -9.642 1.00 0.00 C ATOM 840 CD GLN A 99 -3.496 32.742 -8.432 1.00 0.00 C ATOM 841 OE1 GLN A 99 -2.611 33.558 -8.178 1.00 0.00 O ATOM 842 NE2 GLN A 99 -4.580 32.603 -7.676 1.00 0.00 N ATOM 0 H GLN A 99 0.109 29.803 -9.726 1.00 0.00 H new ATOM 0 HA GLN A 99 -2.673 29.400 -8.902 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -1.344 31.658 -9.059 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -1.613 31.518 -10.785 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -3.653 32.399 -10.538 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -4.128 31.031 -9.550 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -5.290 31.913 -7.924 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -4.703 33.186 -6.848 1.00 0.00 H new ATOM 851 N ASP A 100 -3.757 28.967 -11.173 1.00 0.00 N ATOM 852 CA ASP A 100 -4.324 28.383 -12.381 1.00 0.00 C ATOM 853 C ASP A 100 -5.775 28.816 -12.565 1.00 0.00 C ATOM 854 O ASP A 100 -6.517 28.958 -11.593 1.00 0.00 O ATOM 855 CB ASP A 100 -4.239 26.855 -12.325 1.00 0.00 C ATOM 856 CG ASP A 100 -4.524 26.211 -13.668 1.00 0.00 C ATOM 857 OD1 ASP A 100 -5.716 26.056 -14.010 1.00 0.00 O ATOM 858 OD2 ASP A 100 -3.557 25.860 -14.376 1.00 0.00 O ATOM 0 H ASP A 100 -4.448 29.276 -10.490 1.00 0.00 H new ATOM 0 HA ASP A 100 -3.745 28.741 -13.233 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -3.245 26.561 -11.988 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.949 26.481 -11.588 1.00 0.00 H new ATOM 863 N ASN A 101 -6.172 29.025 -13.815 1.00 0.00 N ATOM 864 CA ASN A 101 -7.535 29.442 -14.125 1.00 0.00 C ATOM 865 C ASN A 101 -8.356 28.274 -14.656 1.00 0.00 C ATOM 866 O ASN A 101 -7.884 27.493 -15.483 1.00 0.00 O ATOM 867 CB ASN A 101 -7.520 30.578 -15.150 1.00 0.00 C ATOM 868 CG ASN A 101 -8.631 31.584 -14.916 1.00 0.00 C ATOM 869 OD1 ASN A 101 -9.605 31.636 -15.667 1.00 0.00 O ATOM 870 ND2 ASN A 101 -8.488 32.389 -13.869 1.00 0.00 N ATOM 0 H ASN A 101 -5.570 28.913 -14.630 1.00 0.00 H new ATOM 0 HA ASN A 101 -7.998 29.797 -13.204 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -6.558 31.088 -15.109 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -7.617 30.161 -16.152 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -9.203 33.086 -13.660 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -7.664 32.310 -13.274 1.00 0.00 H new ATOM 877 N VAL A 102 -9.592 28.158 -14.178 1.00 0.00 N ATOM 878 CA VAL A 102 -10.480 27.084 -14.605 1.00 0.00 C ATOM 879 C VAL A 102 -11.936 27.535 -14.581 1.00 0.00 C ATOM 880 O VAL A 102 -12.681 27.312 -15.536 1.00 0.00 O ATOM 881 CB VAL A 102 -10.326 25.838 -13.713 1.00 0.00 C ATOM 882 CG1 VAL A 102 -9.031 25.109 -14.029 1.00 0.00 C ATOM 883 CG2 VAL A 102 -10.384 26.225 -12.241 1.00 0.00 C ATOM 0 H VAL A 102 -10.000 28.796 -13.494 1.00 0.00 H new ATOM 0 HA VAL A 102 -10.197 26.827 -15.626 1.00 0.00 H new ATOM 0 HB VAL A 102 -11.155 25.161 -13.921 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -8.941 24.232 -13.388 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -9.035 24.796 -15.073 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -8.186 25.775 -13.853 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -10.274 25.332 -11.625 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -9.577 26.923 -12.016 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -11.343 26.697 -12.026 1.00 0.00 H new ATOM 893 N ASN A 103 -12.336 28.169 -13.485 1.00 0.00 N ATOM 894 CA ASN A 103 -13.703 28.653 -13.335 1.00 0.00 C ATOM 895 C ASN A 103 -13.820 30.103 -13.797 1.00 0.00 C ATOM 896 O ASN A 103 -13.054 30.964 -13.365 1.00 0.00 O ATOM 897 CB ASN A 103 -14.155 28.530 -11.880 1.00 0.00 C ATOM 898 CG ASN A 103 -14.846 27.212 -11.598 1.00 0.00 C ATOM 899 OD1 ASN A 103 -15.842 26.871 -12.236 1.00 0.00 O ATOM 900 ND2 ASN A 103 -14.321 26.461 -10.636 1.00 0.00 N ATOM 0 H ASN A 103 -11.732 28.360 -12.686 1.00 0.00 H new ATOM 0 HA ASN A 103 -14.350 28.038 -13.960 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -13.290 28.631 -11.224 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -14.833 29.350 -11.643 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -14.745 25.563 -10.401 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -13.494 26.782 -10.132 1.00 0.00 H new ATOM 907 N LYS A 104 -14.785 30.363 -14.671 1.00 0.00 N ATOM 908 CA LYS A 104 -15.003 31.709 -15.189 1.00 0.00 C ATOM 909 C LYS A 104 -16.310 32.289 -14.660 1.00 0.00 C ATOM 910 O LYS A 104 -17.319 31.590 -14.569 1.00 0.00 O ATOM 911 CB LYS A 104 -15.017 31.695 -16.720 1.00 0.00 C ATOM 912 CG LYS A 104 -16.151 30.874 -17.312 1.00 0.00 C ATOM 913 CD LYS A 104 -15.785 29.399 -17.403 1.00 0.00 C ATOM 914 CE LYS A 104 -16.805 28.526 -16.689 1.00 0.00 C ATOM 915 NZ LYS A 104 -17.873 28.053 -17.612 1.00 0.00 N ATOM 0 H LYS A 104 -15.429 29.661 -15.036 1.00 0.00 H new ATOM 0 HA LYS A 104 -14.182 32.340 -14.848 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -15.094 32.720 -17.083 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -14.067 31.299 -17.080 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -17.045 30.991 -16.699 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -16.394 31.251 -18.305 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -15.721 29.103 -18.450 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -14.799 29.240 -16.966 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -16.301 27.667 -16.246 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -17.255 29.088 -15.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -18.548 27.461 -17.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -18.371 28.872 -18.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -17.447 27.495 -18.379 1.00 0.00 H new ATOM 929 N ASP A 105 -16.285 33.572 -14.311 1.00 0.00 N ATOM 930 CA ASP A 105 -17.468 34.246 -13.791 1.00 0.00 C ATOM 931 C ASP A 105 -17.994 33.543 -12.544 1.00 0.00 C ATOM 932 O ASP A 105 -18.663 32.514 -12.635 1.00 0.00 O ATOM 933 CB ASP A 105 -18.562 34.300 -14.859 1.00 0.00 C ATOM 934 CG ASP A 105 -19.338 35.602 -14.829 1.00 0.00 C ATOM 935 OD1 ASP A 105 -19.697 36.053 -13.722 1.00 0.00 O ATOM 936 OD2 ASP A 105 -19.583 36.171 -15.914 1.00 0.00 O ATOM 0 H ASP A 105 -15.458 34.165 -14.379 1.00 0.00 H new ATOM 0 HA ASP A 105 -17.184 35.263 -13.519 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -18.111 34.172 -15.843 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -19.250 33.467 -14.713 1.00 0.00 H new ATOM 941 N ALA A 106 -17.688 34.107 -11.379 1.00 0.00 N ATOM 942 CA ALA A 106 -18.128 33.535 -10.113 1.00 0.00 C ATOM 943 C ALA A 106 -17.552 32.137 -9.910 1.00 0.00 C ATOM 944 O ALA A 106 -17.544 31.663 -8.754 1.00 0.00 O ATOM 945 CB ALA A 106 -19.647 33.495 -10.052 1.00 0.00 C ATOM 946 OXT ALA A 106 -17.112 31.529 -10.908 1.00 0.00 O ATOM 0 H ALA A 106 -17.137 34.960 -11.287 1.00 0.00 H new ATOM 0 HA ALA A 106 -17.759 34.171 -9.309 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -19.962 33.065 -9.101 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -20.042 34.507 -10.141 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -20.028 32.884 -10.870 1.00 0.00 H new TER 952 ALA A 106 ATOM 953 N THR B 50 5.272 -37.640 4.128 1.00 0.00 N ATOM 954 CA THR B 50 5.401 -37.621 2.648 1.00 0.00 C ATOM 955 C THR B 50 5.706 -36.217 2.138 1.00 0.00 C ATOM 956 O THR B 50 5.152 -35.233 2.628 1.00 0.00 O ATOM 957 CB THR B 50 4.093 -38.127 2.036 1.00 0.00 C ATOM 958 OG1 THR B 50 4.196 -38.204 0.625 1.00 0.00 O ATOM 959 CG2 THR B 50 2.902 -37.252 2.362 1.00 0.00 C ATOM 0 HA THR B 50 6.230 -38.266 2.356 1.00 0.00 H new ATOM 0 HB THR B 50 3.931 -39.112 2.474 1.00 0.00 H new ATOM 0 HG1 THR B 50 3.351 -38.531 0.253 1.00 0.00 H new ATOM 0 HG21 THR B 50 2.008 -37.667 1.898 1.00 0.00 H new ATOM 0 HG22 THR B 50 2.765 -37.212 3.443 1.00 0.00 H new ATOM 0 HG23 THR B 50 3.075 -36.246 1.981 1.00 0.00 H new ATOM 969 N ARG B 51 6.591 -36.132 1.151 1.00 0.00 N ATOM 970 CA ARG B 51 6.971 -34.848 0.572 1.00 0.00 C ATOM 971 C ARG B 51 6.489 -34.744 -0.872 1.00 0.00 C ATOM 972 O ARG B 51 7.280 -34.543 -1.793 1.00 0.00 O ATOM 973 CB ARG B 51 8.491 -34.667 0.641 1.00 0.00 C ATOM 974 CG ARG B 51 8.919 -33.298 1.146 1.00 0.00 C ATOM 975 CD ARG B 51 8.339 -32.181 0.293 1.00 0.00 C ATOM 976 NE ARG B 51 9.294 -31.697 -0.700 1.00 0.00 N ATOM 977 CZ ARG B 51 8.965 -30.915 -1.725 1.00 0.00 C ATOM 978 NH1 ARG B 51 7.707 -30.525 -1.894 1.00 0.00 N ATOM 979 NH2 ARG B 51 9.896 -30.520 -2.584 1.00 0.00 N ATOM 0 H ARG B 51 7.059 -36.937 0.735 1.00 0.00 H new ATOM 0 HA ARG B 51 6.496 -34.055 1.149 1.00 0.00 H new ATOM 0 HB2 ARG B 51 8.910 -35.433 1.293 1.00 0.00 H new ATOM 0 HB3 ARG B 51 8.913 -34.827 -0.351 1.00 0.00 H new ATOM 0 HG2 ARG B 51 8.595 -33.173 2.179 1.00 0.00 H new ATOM 0 HG3 ARG B 51 10.007 -33.232 1.143 1.00 0.00 H new ATOM 0 HD2 ARG B 51 7.442 -32.539 -0.212 1.00 0.00 H new ATOM 0 HD3 ARG B 51 8.035 -31.355 0.936 1.00 0.00 H new ATOM 0 HE ARG B 51 10.271 -31.975 -0.602 1.00 0.00 H new ATOM 0 HH11 ARG B 51 6.987 -30.825 -1.236 1.00 0.00 H new ATOM 0 HH12 ARG B 51 7.460 -29.925 -2.681 1.00 0.00 H new ATOM 0 HH21 ARG B 51 10.864 -30.816 -2.459 1.00 0.00 H new ATOM 0 HH22 ARG B 51 9.644 -29.921 -3.370 1.00 0.00 H new ATOM 993 N ALA B 52 5.181 -34.883 -1.061 1.00 0.00 N ATOM 994 CA ALA B 52 4.587 -34.806 -2.390 1.00 0.00 C ATOM 995 C ALA B 52 3.348 -33.917 -2.392 1.00 0.00 C ATOM 996 O ALA B 52 2.438 -34.105 -3.199 1.00 0.00 O ATOM 997 CB ALA B 52 4.241 -36.200 -2.892 1.00 0.00 C ATOM 0 H ALA B 52 4.512 -35.050 -0.310 1.00 0.00 H new ATOM 0 HA ALA B 52 5.319 -34.359 -3.062 1.00 0.00 H new ATOM 0 HB1 ALA B 52 3.798 -36.129 -3.885 1.00 0.00 H new ATOM 0 HB2 ALA B 52 5.147 -36.804 -2.941 1.00 0.00 H new ATOM 0 HB3 ALA B 52 3.530 -36.666 -2.210 1.00 0.00 H new ATOM 1003 N HIS B 53 3.320 -32.946 -1.483 1.00 0.00 N ATOM 1004 CA HIS B 53 2.194 -32.025 -1.381 1.00 0.00 C ATOM 1005 C HIS B 53 2.672 -30.578 -1.439 1.00 0.00 C ATOM 1006 O HIS B 53 2.893 -29.948 -0.406 1.00 0.00 O ATOM 1007 CB HIS B 53 1.425 -32.263 -0.079 1.00 0.00 C ATOM 1008 CG HIS B 53 0.663 -33.552 -0.053 1.00 0.00 C ATOM 1009 ND1 HIS B 53 1.053 -34.818 -0.334 1.00 0.00 N flip ATOM 1010 CD2 HIS B 53 -0.667 -33.634 0.304 1.00 0.00 C flip ATOM 1011 CE1 HIS B 53 -0.036 -35.632 -0.143 1.00 0.00 C flip ATOM 1012 NE2 HIS B 53 -1.061 -34.894 0.243 1.00 0.00 N flip ATOM 0 H HIS B 53 4.065 -32.777 -0.807 1.00 0.00 H new ATOM 0 HA HIS B 53 1.530 -32.209 -2.226 1.00 0.00 H new ATOM 0 HB2 HIS B 53 2.128 -32.250 0.754 1.00 0.00 H new ATOM 0 HB3 HIS B 53 0.730 -31.438 0.077 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -1.289 -32.799 0.589 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -0.052 -36.702 -0.285 1.00 0.00 H new ATOM 0 HE2 HIS B 53 -1.997 -35.238 0.457 1.00 0.00 H new ATOM 1021 N LEU B 54 2.833 -30.054 -2.650 1.00 0.00 N ATOM 1022 CA LEU B 54 3.288 -28.682 -2.827 1.00 0.00 C ATOM 1023 C LEU B 54 3.221 -28.265 -4.305 1.00 0.00 C ATOM 1024 O LEU B 54 2.145 -27.935 -4.800 1.00 0.00 O ATOM 1025 CB LEU B 54 4.706 -28.527 -2.261 1.00 0.00 C ATOM 1026 CG LEU B 54 5.223 -27.091 -2.188 1.00 0.00 C ATOM 1027 CD1 LEU B 54 4.547 -26.339 -1.051 1.00 0.00 C ATOM 1028 CD2 LEU B 54 6.734 -27.078 -2.012 1.00 0.00 C ATOM 0 H LEU B 54 2.656 -30.557 -3.519 1.00 0.00 H new ATOM 0 HA LEU B 54 2.624 -28.016 -2.276 1.00 0.00 H new ATOM 0 HB2 LEU B 54 4.729 -28.956 -1.259 1.00 0.00 H new ATOM 0 HB3 LEU B 54 5.391 -29.112 -2.874 1.00 0.00 H new ATOM 0 HG LEU B 54 4.981 -26.589 -3.125 1.00 0.00 H new ATOM 0 HD11 LEU B 54 4.927 -25.318 -1.013 1.00 0.00 H new ATOM 0 HD12 LEU B 54 3.470 -26.319 -1.217 1.00 0.00 H new ATOM 0 HD13 LEU B 54 4.759 -26.840 -0.107 1.00 0.00 H new ATOM 0 HD21 LEU B 54 7.086 -26.047 -1.962 1.00 0.00 H new ATOM 0 HD22 LEU B 54 6.997 -27.597 -1.090 1.00 0.00 H new ATOM 0 HD23 LEU B 54 7.203 -27.581 -2.858 1.00 0.00 H new ATOM 1040 N THR B 55 4.370 -28.290 -4.998 1.00 0.00 N ATOM 1041 CA THR B 55 4.473 -27.928 -6.422 1.00 0.00 C ATOM 1042 C THR B 55 3.177 -27.367 -7.013 1.00 0.00 C ATOM 1043 O THR B 55 3.079 -26.172 -7.299 1.00 0.00 O ATOM 1044 CB THR B 55 4.903 -29.147 -7.230 1.00 0.00 C ATOM 1045 OG1 THR B 55 6.095 -29.705 -6.704 1.00 0.00 O ATOM 1046 CG2 THR B 55 5.145 -28.844 -8.694 1.00 0.00 C ATOM 0 H THR B 55 5.261 -28.564 -4.584 1.00 0.00 H new ATOM 0 HA THR B 55 5.216 -27.133 -6.481 1.00 0.00 H new ATOM 0 HB THR B 55 4.072 -29.848 -7.154 1.00 0.00 H new ATOM 0 HG1 THR B 55 6.353 -30.487 -7.236 1.00 0.00 H new ATOM 0 HG21 THR B 55 5.448 -29.756 -9.209 1.00 0.00 H new ATOM 0 HG22 THR B 55 4.228 -28.461 -9.143 1.00 0.00 H new ATOM 0 HG23 THR B 55 5.933 -28.097 -8.785 1.00 0.00 H new ATOM 1054 N GLU B 56 2.199 -28.244 -7.219 1.00 0.00 N ATOM 1055 CA GLU B 56 0.919 -27.852 -7.798 1.00 0.00 C ATOM 1056 C GLU B 56 0.205 -26.803 -6.950 1.00 0.00 C ATOM 1057 O GLU B 56 0.049 -25.660 -7.370 1.00 0.00 O ATOM 1058 CB GLU B 56 0.022 -29.080 -7.968 1.00 0.00 C ATOM 1059 CG GLU B 56 -0.532 -29.237 -9.376 1.00 0.00 C ATOM 1060 CD GLU B 56 0.411 -29.995 -10.290 1.00 0.00 C ATOM 1061 OE1 GLU B 56 1.414 -29.399 -10.734 1.00 0.00 O ATOM 1062 OE2 GLU B 56 0.144 -31.184 -10.563 1.00 0.00 O ATOM 0 H GLU B 56 2.270 -29.236 -6.992 1.00 0.00 H new ATOM 0 HA GLU B 56 1.123 -27.408 -8.772 1.00 0.00 H new ATOM 0 HB2 GLU B 56 0.590 -29.973 -7.708 1.00 0.00 H new ATOM 0 HB3 GLU B 56 -0.808 -29.014 -7.265 1.00 0.00 H new ATOM 0 HG2 GLU B 56 -1.487 -29.760 -9.331 1.00 0.00 H new ATOM 0 HG3 GLU B 56 -0.728 -28.251 -9.798 1.00 0.00 H new ATOM 1069 N VAL B 57 -0.247 -27.202 -5.767 1.00 0.00 N ATOM 1070 CA VAL B 57 -0.970 -26.293 -4.880 1.00 0.00 C ATOM 1071 C VAL B 57 -0.167 -25.028 -4.574 1.00 0.00 C ATOM 1072 O VAL B 57 -0.686 -23.904 -4.680 1.00 0.00 O ATOM 1073 CB VAL B 57 -1.352 -26.981 -3.562 1.00 0.00 C ATOM 1074 CG1 VAL B 57 -2.244 -26.071 -2.732 1.00 0.00 C ATOM 1075 CG2 VAL B 57 -2.038 -28.312 -3.832 1.00 0.00 C ATOM 0 H VAL B 57 -0.127 -28.146 -5.399 1.00 0.00 H new ATOM 0 HA VAL B 57 -1.877 -26.007 -5.412 1.00 0.00 H new ATOM 0 HB VAL B 57 -0.442 -27.179 -2.996 1.00 0.00 H new ATOM 0 HG11 VAL B 57 -2.507 -26.571 -1.800 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -1.713 -25.145 -2.510 1.00 0.00 H new ATOM 0 HG13 VAL B 57 -3.152 -25.843 -3.291 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -2.301 -28.784 -2.886 1.00 0.00 H new ATOM 0 HG22 VAL B 57 -2.942 -28.143 -4.417 1.00 0.00 H new ATOM 0 HG23 VAL B 57 -1.363 -28.963 -4.387 1.00 0.00 H new ATOM 1085 N GLU B 58 1.103 -25.197 -4.205 1.00 0.00 N ATOM 1086 CA GLU B 58 1.956 -24.051 -3.904 1.00 0.00 C ATOM 1087 C GLU B 58 1.901 -23.062 -5.059 1.00 0.00 C ATOM 1088 O GLU B 58 1.695 -21.867 -4.866 1.00 0.00 O ATOM 1089 CB GLU B 58 3.399 -24.504 -3.628 1.00 0.00 C ATOM 1090 CG GLU B 58 4.308 -24.509 -4.849 1.00 0.00 C ATOM 1091 CD GLU B 58 5.767 -24.723 -4.493 1.00 0.00 C ATOM 1092 OE1 GLU B 58 6.376 -23.803 -3.909 1.00 0.00 O ATOM 1093 OE2 GLU B 58 6.298 -25.811 -4.798 1.00 0.00 O ATOM 0 H GLU B 58 1.558 -26.105 -4.109 1.00 0.00 H new ATOM 0 HA GLU B 58 1.591 -23.558 -3.003 1.00 0.00 H new ATOM 0 HB2 GLU B 58 3.833 -23.850 -2.872 1.00 0.00 H new ATOM 0 HB3 GLU B 58 3.376 -25.508 -3.205 1.00 0.00 H new ATOM 0 HG2 GLU B 58 3.986 -25.294 -5.533 1.00 0.00 H new ATOM 0 HG3 GLU B 58 4.203 -23.562 -5.379 1.00 0.00 H new ATOM 1100 N SER B 59 2.047 -23.587 -6.261 1.00 0.00 N ATOM 1101 CA SER B 59 1.977 -22.767 -7.462 1.00 0.00 C ATOM 1102 C SER B 59 0.556 -22.240 -7.642 1.00 0.00 C ATOM 1103 O SER B 59 0.325 -21.272 -8.359 1.00 0.00 O ATOM 1104 CB SER B 59 2.402 -23.576 -8.689 1.00 0.00 C ATOM 1105 OG SER B 59 2.781 -22.725 -9.756 1.00 0.00 O ATOM 0 H SER B 59 2.215 -24.578 -6.435 1.00 0.00 H new ATOM 0 HA SER B 59 2.660 -21.924 -7.355 1.00 0.00 H new ATOM 0 HB2 SER B 59 3.235 -24.229 -8.427 1.00 0.00 H new ATOM 0 HB3 SER B 59 1.581 -24.219 -9.007 1.00 0.00 H new ATOM 0 HG SER B 59 3.050 -23.267 -10.527 1.00 0.00 H new ATOM 1111 N ARG B 60 -0.391 -22.903 -6.984 1.00 0.00 N ATOM 1112 CA ARG B 60 -1.794 -22.534 -7.055 1.00 0.00 C ATOM 1113 C ARG B 60 -2.055 -21.220 -6.357 1.00 0.00 C ATOM 1114 O ARG B 60 -2.369 -20.228 -7.012 1.00 0.00 O ATOM 1115 CB ARG B 60 -2.665 -23.624 -6.432 1.00 0.00 C ATOM 1116 CG ARG B 60 -4.086 -23.657 -6.975 1.00 0.00 C ATOM 1117 CD ARG B 60 -4.241 -24.703 -8.068 1.00 0.00 C ATOM 1118 NE ARG B 60 -5.531 -25.387 -7.992 1.00 0.00 N ATOM 1119 CZ ARG B 60 -5.785 -26.556 -8.575 1.00 0.00 C ATOM 1120 NH1 ARG B 60 -4.845 -27.173 -9.282 1.00 0.00 N ATOM 1121 NH2 ARG B 60 -6.983 -27.110 -8.453 1.00 0.00 N ATOM 0 H ARG B 60 -0.204 -23.710 -6.388 1.00 0.00 H new ATOM 0 HA ARG B 60 -2.050 -22.422 -8.109 1.00 0.00 H new ATOM 0 HB2 ARG B 60 -2.197 -24.593 -6.604 1.00 0.00 H new ATOM 0 HB3 ARG B 60 -2.701 -23.475 -5.353 1.00 0.00 H new ATOM 0 HG2 ARG B 60 -4.782 -23.871 -6.164 1.00 0.00 H new ATOM 0 HG3 ARG B 60 -4.349 -22.675 -7.369 1.00 0.00 H new ATOM 0 HD2 ARG B 60 -4.140 -24.226 -9.043 1.00 0.00 H new ATOM 0 HD3 ARG B 60 -3.437 -25.435 -7.986 1.00 0.00 H new ATOM 0 HE ARG B 60 -6.280 -24.942 -7.461 1.00 0.00 H new ATOM 0 HH11 ARG B 60 -3.922 -26.751 -9.381 1.00 0.00 H new ATOM 0 HH12 ARG B 60 -5.046 -28.069 -9.726 1.00 0.00 H new ATOM 0 HH21 ARG B 60 -7.709 -26.640 -7.913 1.00 0.00 H new ATOM 0 HH22 ARG B 60 -7.178 -28.006 -8.900 1.00 0.00 H new ATOM 1135 N LEU B 61 -1.932 -21.193 -5.031 1.00 0.00 N ATOM 1136 CA LEU B 61 -2.172 -19.946 -4.316 1.00 0.00 C ATOM 1137 C LEU B 61 -1.146 -18.921 -4.765 1.00 0.00 C ATOM 1138 O LEU B 61 -1.464 -17.752 -5.043 1.00 0.00 O ATOM 1139 CB LEU B 61 -2.117 -20.162 -2.811 1.00 0.00 C ATOM 1140 CG LEU B 61 -3.480 -20.375 -2.163 1.00 0.00 C ATOM 1141 CD1 LEU B 61 -4.327 -19.116 -2.277 1.00 0.00 C ATOM 1142 CD2 LEU B 61 -4.193 -21.558 -2.800 1.00 0.00 C ATOM 0 H LEU B 61 -1.677 -21.991 -4.449 1.00 0.00 H new ATOM 0 HA LEU B 61 -3.172 -19.578 -4.547 1.00 0.00 H new ATOM 0 HB2 LEU B 61 -1.488 -21.027 -2.602 1.00 0.00 H new ATOM 0 HB3 LEU B 61 -1.637 -19.300 -2.348 1.00 0.00 H new ATOM 0 HG LEU B 61 -3.329 -20.593 -1.106 1.00 0.00 H new ATOM 0 HD11 LEU B 61 -5.297 -19.286 -1.809 1.00 0.00 H new ATOM 0 HD12 LEU B 61 -3.822 -18.291 -1.775 1.00 0.00 H new ATOM 0 HD13 LEU B 61 -4.470 -18.868 -3.329 1.00 0.00 H new ATOM 0 HD21 LEU B 61 -5.165 -21.696 -2.325 1.00 0.00 H new ATOM 0 HD22 LEU B 61 -4.333 -21.369 -3.864 1.00 0.00 H new ATOM 0 HD23 LEU B 61 -3.593 -22.459 -2.667 1.00 0.00 H new ATOM 1154 N GLU B 62 0.085 -19.391 -4.886 1.00 0.00 N ATOM 1155 CA GLU B 62 1.172 -18.552 -5.358 1.00 0.00 C ATOM 1156 C GLU B 62 0.753 -17.869 -6.655 1.00 0.00 C ATOM 1157 O GLU B 62 1.099 -16.715 -6.894 1.00 0.00 O ATOM 1158 CB GLU B 62 2.432 -19.388 -5.581 1.00 0.00 C ATOM 1159 CG GLU B 62 3.582 -18.614 -6.204 1.00 0.00 C ATOM 1160 CD GLU B 62 4.850 -19.438 -6.302 1.00 0.00 C ATOM 1161 OE1 GLU B 62 4.759 -20.683 -6.222 1.00 0.00 O ATOM 1162 OE2 GLU B 62 5.936 -18.842 -6.460 1.00 0.00 O ATOM 0 H GLU B 62 0.355 -20.349 -4.664 1.00 0.00 H new ATOM 0 HA GLU B 62 1.395 -17.795 -4.606 1.00 0.00 H new ATOM 0 HB2 GLU B 62 2.758 -19.798 -4.625 1.00 0.00 H new ATOM 0 HB3 GLU B 62 2.186 -20.234 -6.223 1.00 0.00 H new ATOM 0 HG2 GLU B 62 3.293 -18.278 -7.200 1.00 0.00 H new ATOM 0 HG3 GLU B 62 3.778 -17.721 -5.611 1.00 0.00 H new ATOM 1169 N ARG B 63 -0.017 -18.584 -7.483 1.00 0.00 N ATOM 1170 CA ARG B 63 -0.496 -18.021 -8.738 1.00 0.00 C ATOM 1171 C ARG B 63 -1.681 -17.097 -8.477 1.00 0.00 C ATOM 1172 O ARG B 63 -1.930 -16.158 -9.234 1.00 0.00 O ATOM 1173 CB ARG B 63 -0.900 -19.130 -9.712 1.00 0.00 C ATOM 1174 CG ARG B 63 -1.419 -18.607 -11.045 1.00 0.00 C ATOM 1175 CD ARG B 63 -2.831 -19.094 -11.327 1.00 0.00 C ATOM 1176 NE ARG B 63 -2.844 -20.451 -11.865 1.00 0.00 N ATOM 1177 CZ ARG B 63 -3.842 -20.954 -12.590 1.00 0.00 C ATOM 1178 NH1 ARG B 63 -4.911 -20.215 -12.866 1.00 0.00 N ATOM 1179 NH2 ARG B 63 -3.770 -22.198 -13.040 1.00 0.00 N ATOM 0 H ARG B 63 -0.316 -19.543 -7.305 1.00 0.00 H new ATOM 0 HA ARG B 63 0.313 -17.447 -9.188 1.00 0.00 H new ATOM 0 HB2 ARG B 63 -0.040 -19.775 -9.893 1.00 0.00 H new ATOM 0 HB3 ARG B 63 -1.669 -19.748 -9.248 1.00 0.00 H new ATOM 0 HG2 ARG B 63 -1.404 -17.517 -11.039 1.00 0.00 H new ATOM 0 HG3 ARG B 63 -0.755 -18.931 -11.847 1.00 0.00 H new ATOM 0 HD2 ARG B 63 -3.416 -19.063 -10.408 1.00 0.00 H new ATOM 0 HD3 ARG B 63 -3.313 -18.419 -12.034 1.00 0.00 H new ATOM 0 HE ARG B 63 -2.041 -21.050 -11.674 1.00 0.00 H new ATOM 0 HH11 ARG B 63 -4.971 -19.257 -12.522 1.00 0.00 H new ATOM 0 HH12 ARG B 63 -5.672 -20.606 -13.422 1.00 0.00 H new ATOM 0 HH21 ARG B 63 -2.951 -22.769 -12.831 1.00 0.00 H new ATOM 0 HH22 ARG B 63 -4.533 -22.584 -13.595 1.00 0.00 H new ATOM 1193 N LEU B 64 -2.400 -17.360 -7.385 1.00 0.00 N ATOM 1194 CA LEU B 64 -3.543 -16.544 -7.007 1.00 0.00 C ATOM 1195 C LEU B 64 -3.078 -15.145 -6.652 1.00 0.00 C ATOM 1196 O LEU B 64 -3.812 -14.168 -6.805 1.00 0.00 O ATOM 1197 CB LEU B 64 -4.306 -17.190 -5.838 1.00 0.00 C ATOM 1198 CG LEU B 64 -4.949 -16.219 -4.841 1.00 0.00 C ATOM 1199 CD1 LEU B 64 -6.251 -16.791 -4.302 1.00 0.00 C ATOM 1200 CD2 LEU B 64 -3.988 -15.914 -3.702 1.00 0.00 C ATOM 0 H LEU B 64 -2.207 -18.134 -6.749 1.00 0.00 H new ATOM 0 HA LEU B 64 -4.229 -16.477 -7.851 1.00 0.00 H new ATOM 0 HB2 LEU B 64 -5.087 -17.829 -6.249 1.00 0.00 H new ATOM 0 HB3 LEU B 64 -3.618 -17.837 -5.294 1.00 0.00 H new ATOM 0 HG LEU B 64 -5.173 -15.288 -5.362 1.00 0.00 H new ATOM 0 HD11 LEU B 64 -6.693 -16.088 -3.596 1.00 0.00 H new ATOM 0 HD12 LEU B 64 -6.943 -16.960 -5.127 1.00 0.00 H new ATOM 0 HD13 LEU B 64 -6.052 -17.736 -3.796 1.00 0.00 H new ATOM 0 HD21 LEU B 64 -4.460 -15.223 -3.003 1.00 0.00 H new ATOM 0 HD22 LEU B 64 -3.734 -16.838 -3.183 1.00 0.00 H new ATOM 0 HD23 LEU B 64 -3.081 -15.462 -4.103 1.00 0.00 H new ATOM 1212 N GLU B 65 -1.839 -15.060 -6.204 1.00 0.00 N ATOM 1213 CA GLU B 65 -1.238 -13.785 -5.853 1.00 0.00 C ATOM 1214 C GLU B 65 -0.352 -13.298 -6.996 1.00 0.00 C ATOM 1215 O GLU B 65 -0.051 -12.111 -7.095 1.00 0.00 O ATOM 1216 CB GLU B 65 -0.418 -13.914 -4.567 1.00 0.00 C ATOM 1217 CG GLU B 65 0.355 -12.653 -4.208 1.00 0.00 C ATOM 1218 CD GLU B 65 0.785 -12.625 -2.755 1.00 0.00 C ATOM 1219 OE1 GLU B 65 1.450 -13.585 -2.314 1.00 0.00 O ATOM 1220 OE2 GLU B 65 0.459 -11.641 -2.058 1.00 0.00 O ATOM 0 H GLU B 65 -1.225 -15.864 -6.074 1.00 0.00 H new ATOM 0 HA GLU B 65 -2.032 -13.058 -5.683 1.00 0.00 H new ATOM 0 HB2 GLU B 65 -1.086 -14.167 -3.744 1.00 0.00 H new ATOM 0 HB3 GLU B 65 0.283 -14.742 -4.675 1.00 0.00 H new ATOM 0 HG2 GLU B 65 1.236 -12.578 -4.845 1.00 0.00 H new ATOM 0 HG3 GLU B 65 -0.264 -11.780 -4.416 1.00 0.00 H new ATOM 1227 N GLN B 66 0.072 -14.235 -7.849 1.00 0.00 N ATOM 1228 CA GLN B 66 0.936 -13.927 -8.984 1.00 0.00 C ATOM 1229 C GLN B 66 2.140 -13.110 -8.531 1.00 0.00 C ATOM 1230 O GLN B 66 2.621 -12.234 -9.249 1.00 0.00 O ATOM 1231 CB GLN B 66 0.156 -13.192 -10.082 1.00 0.00 C ATOM 1232 CG GLN B 66 -0.209 -11.757 -9.739 1.00 0.00 C ATOM 1233 CD GLN B 66 -0.637 -10.959 -10.956 1.00 0.00 C ATOM 1234 OE1 GLN B 66 0.121 -10.813 -11.915 1.00 0.00 O ATOM 1235 NE2 GLN B 66 -1.859 -10.438 -10.923 1.00 0.00 N ATOM 0 H GLN B 66 -0.174 -15.222 -7.770 1.00 0.00 H new ATOM 0 HA GLN B 66 1.298 -14.866 -9.404 1.00 0.00 H new ATOM 0 HB2 GLN B 66 0.750 -13.195 -10.996 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -0.758 -13.746 -10.294 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -1.016 -11.756 -9.006 1.00 0.00 H new ATOM 0 HG3 GLN B 66 0.647 -11.270 -9.272 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -2.454 -10.584 -10.107 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -2.202 -9.892 -11.713 1.00 0.00 H new ATOM 1244 N LEU B 67 2.618 -13.413 -7.327 1.00 0.00 N ATOM 1245 CA LEU B 67 3.764 -12.716 -6.754 1.00 0.00 C ATOM 1246 C LEU B 67 3.403 -11.277 -6.392 1.00 0.00 C ATOM 1247 O LEU B 67 4.281 -10.475 -6.080 1.00 0.00 O ATOM 1248 CB LEU B 67 4.943 -12.732 -7.731 1.00 0.00 C ATOM 1249 CG LEU B 67 6.273 -13.201 -7.138 1.00 0.00 C ATOM 1250 CD1 LEU B 67 6.609 -14.604 -7.621 1.00 0.00 C ATOM 1251 CD2 LEU B 67 7.390 -12.231 -7.495 1.00 0.00 C ATOM 0 H LEU B 67 2.227 -14.140 -6.728 1.00 0.00 H new ATOM 0 HA LEU B 67 4.054 -13.238 -5.842 1.00 0.00 H new ATOM 0 HB2 LEU B 67 4.690 -13.379 -8.571 1.00 0.00 H new ATOM 0 HB3 LEU B 67 5.076 -11.727 -8.132 1.00 0.00 H new ATOM 0 HG LEU B 67 6.174 -13.226 -6.053 1.00 0.00 H new ATOM 0 HD11 LEU B 67 7.558 -14.920 -7.189 1.00 0.00 H new ATOM 0 HD12 LEU B 67 5.823 -15.293 -7.313 1.00 0.00 H new ATOM 0 HD13 LEU B 67 6.687 -14.606 -8.708 1.00 0.00 H new ATOM 0 HD21 LEU B 67 8.328 -12.582 -7.064 1.00 0.00 H new ATOM 0 HD22 LEU B 67 7.488 -12.172 -8.579 1.00 0.00 H new ATOM 0 HD23 LEU B 67 7.155 -11.244 -7.098 1.00 0.00 H new ATOM 1263 N PHE B 68 2.102 -10.960 -6.434 1.00 0.00 N ATOM 1264 CA PHE B 68 1.610 -9.614 -6.114 1.00 0.00 C ATOM 1265 C PHE B 68 0.232 -9.386 -6.726 1.00 0.00 C ATOM 1266 O PHE B 68 -0.020 -9.765 -7.869 1.00 0.00 O ATOM 1267 CB PHE B 68 2.569 -8.530 -6.626 1.00 0.00 C ATOM 1268 CG PHE B 68 3.312 -7.816 -5.533 1.00 0.00 C ATOM 1269 CD1 PHE B 68 2.627 -7.084 -4.577 1.00 0.00 C ATOM 1270 CD2 PHE B 68 4.695 -7.874 -5.464 1.00 0.00 C ATOM 1271 CE1 PHE B 68 3.307 -6.424 -3.571 1.00 0.00 C ATOM 1272 CE2 PHE B 68 5.379 -7.216 -4.460 1.00 0.00 C ATOM 1273 CZ PHE B 68 4.684 -6.490 -3.512 1.00 0.00 C ATOM 0 H PHE B 68 1.368 -11.621 -6.688 1.00 0.00 H new ATOM 0 HA PHE B 68 1.546 -9.544 -5.028 1.00 0.00 H new ATOM 0 HB2 PHE B 68 3.289 -8.986 -7.305 1.00 0.00 H new ATOM 0 HB3 PHE B 68 2.003 -7.800 -7.205 1.00 0.00 H new ATOM 0 HD1 PHE B 68 1.549 -7.028 -4.618 1.00 0.00 H new ATOM 0 HD2 PHE B 68 5.244 -8.439 -6.203 1.00 0.00 H new ATOM 0 HE1 PHE B 68 2.761 -5.857 -2.832 1.00 0.00 H new ATOM 0 HE2 PHE B 68 6.457 -7.269 -4.416 1.00 0.00 H new ATOM 0 HZ PHE B 68 5.217 -5.975 -2.726 1.00 0.00 H new ATOM 1283 N LEU B 69 -0.657 -8.752 -5.968 1.00 0.00 N ATOM 1284 CA LEU B 69 -2.001 -8.469 -6.454 1.00 0.00 C ATOM 1285 C LEU B 69 -1.951 -7.474 -7.612 1.00 0.00 C ATOM 1286 O LEU B 69 -0.886 -7.213 -8.171 1.00 0.00 O ATOM 1287 CB LEU B 69 -2.872 -7.921 -5.322 1.00 0.00 C ATOM 1288 CG LEU B 69 -4.286 -8.501 -5.256 1.00 0.00 C ATOM 1289 CD1 LEU B 69 -4.248 -9.946 -4.788 1.00 0.00 C ATOM 1290 CD2 LEU B 69 -5.165 -7.663 -4.340 1.00 0.00 C ATOM 0 H LEU B 69 -0.472 -8.426 -5.019 1.00 0.00 H new ATOM 0 HA LEU B 69 -2.441 -9.399 -6.814 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -2.372 -8.114 -4.373 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -2.944 -6.839 -5.430 1.00 0.00 H new ATOM 0 HG LEU B 69 -4.715 -8.477 -6.258 1.00 0.00 H new ATOM 0 HD11 LEU B 69 -5.263 -10.342 -4.747 1.00 0.00 H new ATOM 0 HD12 LEU B 69 -3.655 -10.539 -5.485 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -3.799 -9.995 -3.796 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -6.167 -8.091 -4.306 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -4.740 -7.654 -3.336 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -5.219 -6.643 -4.721 1.00 0.00 H new ATOM 1302 N LEU B 70 -3.106 -6.920 -7.965 1.00 0.00 N ATOM 1303 CA LEU B 70 -3.187 -5.954 -9.058 1.00 0.00 C ATOM 1304 C LEU B 70 -2.392 -4.687 -8.741 1.00 0.00 C ATOM 1305 O LEU B 70 -2.109 -3.886 -9.631 1.00 0.00 O ATOM 1306 CB LEU B 70 -4.648 -5.594 -9.340 1.00 0.00 C ATOM 1307 CG LEU B 70 -5.373 -6.536 -10.301 1.00 0.00 C ATOM 1308 CD1 LEU B 70 -6.869 -6.264 -10.289 1.00 0.00 C ATOM 1309 CD2 LEU B 70 -4.815 -6.392 -11.709 1.00 0.00 C ATOM 0 H LEU B 70 -3.998 -7.122 -7.512 1.00 0.00 H new ATOM 0 HA LEU B 70 -2.752 -6.416 -9.944 1.00 0.00 H new ATOM 0 HB2 LEU B 70 -5.191 -5.576 -8.395 1.00 0.00 H new ATOM 0 HB3 LEU B 70 -4.685 -4.584 -9.748 1.00 0.00 H new ATOM 0 HG LEU B 70 -5.209 -7.561 -9.968 1.00 0.00 H new ATOM 0 HD11 LEU B 70 -7.368 -6.944 -10.979 1.00 0.00 H new ATOM 0 HD12 LEU B 70 -7.259 -6.418 -9.283 1.00 0.00 H new ATOM 0 HD13 LEU B 70 -7.054 -5.235 -10.597 1.00 0.00 H new ATOM 0 HD21 LEU B 70 -5.342 -7.070 -12.380 1.00 0.00 H new ATOM 0 HD22 LEU B 70 -4.949 -5.366 -12.050 1.00 0.00 H new ATOM 0 HD23 LEU B 70 -3.753 -6.637 -11.706 1.00 0.00 H new ATOM 1321 N ILE B 71 -2.038 -4.507 -7.471 1.00 0.00 N ATOM 1322 CA ILE B 71 -1.282 -3.332 -7.047 1.00 0.00 C ATOM 1323 C ILE B 71 0.035 -3.207 -7.810 1.00 0.00 C ATOM 1324 O ILE B 71 0.548 -2.104 -8.003 1.00 0.00 O ATOM 1325 CB ILE B 71 -0.987 -3.370 -5.533 1.00 0.00 C ATOM 1326 CG1 ILE B 71 -0.392 -2.037 -5.072 1.00 0.00 C ATOM 1327 CG2 ILE B 71 -0.050 -4.524 -5.198 1.00 0.00 C ATOM 1328 CD1 ILE B 71 -1.357 -1.190 -4.272 1.00 0.00 C ATOM 0 H ILE B 71 -2.262 -5.159 -6.719 1.00 0.00 H new ATOM 0 HA ILE B 71 -1.904 -2.465 -7.269 1.00 0.00 H new ATOM 0 HB ILE B 71 -1.925 -3.529 -5.001 1.00 0.00 H new ATOM 0 HG12 ILE B 71 0.494 -2.233 -4.468 1.00 0.00 H new ATOM 0 HG13 ILE B 71 -0.064 -1.473 -5.945 1.00 0.00 H new ATOM 0 HG21 ILE B 71 0.146 -4.534 -4.126 1.00 0.00 H new ATOM 0 HG22 ILE B 71 -0.514 -5.466 -5.491 1.00 0.00 H new ATOM 0 HG23 ILE B 71 0.889 -4.399 -5.737 1.00 0.00 H new ATOM 0 HD11 ILE B 71 -0.869 -0.261 -3.978 1.00 0.00 H new ATOM 0 HD12 ILE B 71 -2.233 -0.963 -4.880 1.00 0.00 H new ATOM 0 HD13 ILE B 71 -1.666 -1.735 -3.380 1.00 0.00 H new ATOM 1340 N PHE B 72 0.581 -4.341 -8.238 1.00 0.00 N ATOM 1341 CA PHE B 72 1.840 -4.351 -8.975 1.00 0.00 C ATOM 1342 C PHE B 72 1.605 -4.591 -10.465 1.00 0.00 C ATOM 1343 O PHE B 72 1.538 -5.735 -10.914 1.00 0.00 O ATOM 1344 CB PHE B 72 2.772 -5.428 -8.411 1.00 0.00 C ATOM 1345 CG PHE B 72 4.165 -4.934 -8.142 1.00 0.00 C ATOM 1346 CD1 PHE B 72 5.002 -4.579 -9.189 1.00 0.00 C ATOM 1347 CD2 PHE B 72 4.637 -4.823 -6.845 1.00 0.00 C ATOM 1348 CE1 PHE B 72 6.284 -4.126 -8.945 1.00 0.00 C ATOM 1349 CE2 PHE B 72 5.917 -4.371 -6.595 1.00 0.00 C ATOM 1350 CZ PHE B 72 6.743 -4.021 -7.647 1.00 0.00 C ATOM 0 H PHE B 72 0.172 -5.263 -8.088 1.00 0.00 H new ATOM 0 HA PHE B 72 2.308 -3.374 -8.858 1.00 0.00 H new ATOM 0 HB2 PHE B 72 2.347 -5.816 -7.485 1.00 0.00 H new ATOM 0 HB3 PHE B 72 2.819 -6.260 -9.113 1.00 0.00 H new ATOM 0 HD1 PHE B 72 4.648 -4.658 -10.206 1.00 0.00 H new ATOM 0 HD2 PHE B 72 3.996 -5.093 -6.019 1.00 0.00 H new ATOM 0 HE1 PHE B 72 6.927 -3.854 -9.769 1.00 0.00 H new ATOM 0 HE2 PHE B 72 6.273 -4.291 -5.579 1.00 0.00 H new ATOM 0 HZ PHE B 72 7.745 -3.666 -7.454 1.00 0.00 H new ATOM 1360 N PRO B 73 1.480 -3.510 -11.256 1.00 0.00 N ATOM 1361 CA PRO B 73 1.254 -3.610 -12.701 1.00 0.00 C ATOM 1362 C PRO B 73 2.498 -4.064 -13.462 1.00 0.00 C ATOM 1363 O PRO B 73 2.438 -4.329 -14.662 1.00 0.00 O ATOM 1364 CB PRO B 73 0.879 -2.181 -13.098 1.00 0.00 C ATOM 1365 CG PRO B 73 1.553 -1.322 -12.087 1.00 0.00 C ATOM 1366 CD PRO B 73 1.548 -2.106 -10.803 1.00 0.00 C ATOM 0 HA PRO B 73 0.493 -4.352 -12.941 1.00 0.00 H new ATOM 0 HB2 PRO B 73 1.219 -1.948 -14.107 1.00 0.00 H new ATOM 0 HB3 PRO B 73 -0.201 -2.036 -13.084 1.00 0.00 H new ATOM 0 HG2 PRO B 73 2.571 -1.084 -12.394 1.00 0.00 H new ATOM 0 HG3 PRO B 73 1.027 -0.375 -11.967 1.00 0.00 H new ATOM 0 HD2 PRO B 73 2.446 -1.917 -10.214 1.00 0.00 H new ATOM 0 HD3 PRO B 73 0.695 -1.845 -10.177 1.00 0.00 H new ATOM 1374 N ARG B 74 3.626 -4.149 -12.759 1.00 0.00 N ATOM 1375 CA ARG B 74 4.881 -4.568 -13.374 1.00 0.00 C ATOM 1376 C ARG B 74 5.348 -3.545 -14.406 1.00 0.00 C ATOM 1377 O ARG B 74 5.687 -3.896 -15.536 1.00 0.00 O ATOM 1378 CB ARG B 74 4.722 -5.942 -14.032 1.00 0.00 C ATOM 1379 CG ARG B 74 6.043 -6.638 -14.314 1.00 0.00 C ATOM 1380 CD ARG B 74 5.884 -8.150 -14.330 1.00 0.00 C ATOM 1381 NE ARG B 74 7.116 -8.827 -14.727 1.00 0.00 N ATOM 1382 CZ ARG B 74 8.147 -9.029 -13.909 1.00 0.00 C ATOM 1383 NH1 ARG B 74 8.099 -8.606 -12.652 1.00 0.00 N ATOM 1384 NH2 ARG B 74 9.229 -9.658 -14.349 1.00 0.00 N ATOM 0 H ARG B 74 3.695 -3.933 -11.764 1.00 0.00 H new ATOM 0 HA ARG B 74 5.635 -4.637 -12.590 1.00 0.00 H new ATOM 0 HB2 ARG B 74 4.117 -6.577 -13.385 1.00 0.00 H new ATOM 0 HB3 ARG B 74 4.175 -5.826 -14.968 1.00 0.00 H new ATOM 0 HG2 ARG B 74 6.435 -6.302 -15.274 1.00 0.00 H new ATOM 0 HG3 ARG B 74 6.773 -6.356 -13.556 1.00 0.00 H new ATOM 0 HD2 ARG B 74 5.585 -8.493 -13.340 1.00 0.00 H new ATOM 0 HD3 ARG B 74 5.083 -8.423 -15.017 1.00 0.00 H new ATOM 0 HE ARG B 74 7.191 -9.165 -15.687 1.00 0.00 H new ATOM 0 HH11 ARG B 74 7.269 -8.123 -12.308 1.00 0.00 H new ATOM 0 HH12 ARG B 74 8.892 -8.764 -12.030 1.00 0.00 H new ATOM 0 HH21 ARG B 74 9.271 -9.987 -15.314 1.00 0.00 H new ATOM 0 HH22 ARG B 74 10.019 -9.813 -13.723 1.00 0.00 H new ATOM 1398 N GLU B 75 5.362 -2.277 -14.007 1.00 0.00 N ATOM 1399 CA GLU B 75 5.788 -1.199 -14.892 1.00 0.00 C ATOM 1400 C GLU B 75 5.928 0.111 -14.123 1.00 0.00 C ATOM 1401 O GLU B 75 7.016 0.681 -14.043 1.00 0.00 O ATOM 1402 CB GLU B 75 4.790 -1.032 -16.042 1.00 0.00 C ATOM 1403 CG GLU B 75 5.337 -1.477 -17.389 1.00 0.00 C ATOM 1404 CD GLU B 75 4.291 -1.439 -18.485 1.00 0.00 C ATOM 1405 OE1 GLU B 75 3.538 -0.445 -18.553 1.00 0.00 O ATOM 1406 OE2 GLU B 75 4.224 -2.404 -19.275 1.00 0.00 O ATOM 0 H GLU B 75 5.083 -1.971 -13.075 1.00 0.00 H new ATOM 0 HA GLU B 75 6.763 -1.461 -15.304 1.00 0.00 H new ATOM 0 HB2 GLU B 75 3.890 -1.604 -15.817 1.00 0.00 H new ATOM 0 HB3 GLU B 75 4.494 0.015 -16.107 1.00 0.00 H new ATOM 0 HG2 GLU B 75 6.173 -0.835 -17.667 1.00 0.00 H new ATOM 0 HG3 GLU B 75 5.729 -2.490 -17.301 1.00 0.00 H new ATOM 1413 N ASP B 76 4.821 0.580 -13.556 1.00 0.00 N ATOM 1414 CA ASP B 76 4.822 1.823 -12.791 1.00 0.00 C ATOM 1415 C ASP B 76 4.741 1.537 -11.295 1.00 0.00 C ATOM 1416 O ASP B 76 4.006 0.652 -10.861 1.00 0.00 O ATOM 1417 CB ASP B 76 3.651 2.710 -13.218 1.00 0.00 C ATOM 1418 CG ASP B 76 4.037 3.685 -14.314 1.00 0.00 C ATOM 1419 OD1 ASP B 76 4.813 3.293 -15.211 1.00 0.00 O ATOM 1420 OD2 ASP B 76 3.562 4.839 -14.275 1.00 0.00 O ATOM 0 H ASP B 76 3.913 0.119 -13.611 1.00 0.00 H new ATOM 0 HA ASP B 76 5.756 2.347 -12.993 1.00 0.00 H new ATOM 0 HB2 ASP B 76 2.831 2.082 -13.566 1.00 0.00 H new ATOM 0 HB3 ASP B 76 3.284 3.264 -12.354 1.00 0.00 H new ATOM 1425 N LEU B 77 5.503 2.294 -10.511 1.00 0.00 N ATOM 1426 CA LEU B 77 5.519 2.120 -9.063 1.00 0.00 C ATOM 1427 C LEU B 77 4.830 3.288 -8.366 1.00 0.00 C ATOM 1428 O LEU B 77 5.222 3.687 -7.269 1.00 0.00 O ATOM 1429 CB LEU B 77 6.958 1.987 -8.559 1.00 0.00 C ATOM 1430 CG LEU B 77 7.590 0.609 -8.761 1.00 0.00 C ATOM 1431 CD1 LEU B 77 9.097 0.680 -8.573 1.00 0.00 C ATOM 1432 CD2 LEU B 77 6.977 -0.403 -7.806 1.00 0.00 C ATOM 0 H LEU B 77 6.117 3.033 -10.854 1.00 0.00 H new ATOM 0 HA LEU B 77 4.973 1.207 -8.827 1.00 0.00 H new ATOM 0 HB2 LEU B 77 7.574 2.730 -9.065 1.00 0.00 H new ATOM 0 HB3 LEU B 77 6.978 2.227 -7.496 1.00 0.00 H new ATOM 0 HG LEU B 77 7.388 0.283 -9.781 1.00 0.00 H new ATOM 0 HD11 LEU B 77 9.529 -0.310 -8.721 1.00 0.00 H new ATOM 0 HD12 LEU B 77 9.522 1.373 -9.299 1.00 0.00 H new ATOM 0 HD13 LEU B 77 9.322 1.027 -7.565 1.00 0.00 H new ATOM 0 HD21 LEU B 77 7.438 -1.378 -7.964 1.00 0.00 H new ATOM 0 HD22 LEU B 77 7.147 -0.083 -6.778 1.00 0.00 H new ATOM 0 HD23 LEU B 77 5.905 -0.475 -7.991 1.00 0.00 H new ATOM 1444 N ASP B 78 3.797 3.830 -9.005 1.00 0.00 N ATOM 1445 CA ASP B 78 3.053 4.951 -8.441 1.00 0.00 C ATOM 1446 C ASP B 78 1.697 5.106 -9.122 1.00 0.00 C ATOM 1447 O ASP B 78 1.167 6.213 -9.230 1.00 0.00 O ATOM 1448 CB ASP B 78 3.856 6.246 -8.580 1.00 0.00 C ATOM 1449 CG ASP B 78 4.185 6.573 -10.022 1.00 0.00 C ATOM 1450 OD1 ASP B 78 3.252 6.906 -10.783 1.00 0.00 O ATOM 1451 OD2 ASP B 78 5.375 6.495 -10.392 1.00 0.00 O ATOM 0 H ASP B 78 3.457 3.511 -9.912 1.00 0.00 H new ATOM 0 HA ASP B 78 2.886 4.745 -7.384 1.00 0.00 H new ATOM 0 HB2 ASP B 78 3.290 7.069 -8.144 1.00 0.00 H new ATOM 0 HB3 ASP B 78 4.781 6.159 -8.010 1.00 0.00 H new ATOM 1456 N MET B 79 1.137 3.990 -9.579 1.00 0.00 N ATOM 1457 CA MET B 79 -0.158 4.004 -10.248 1.00 0.00 C ATOM 1458 C MET B 79 -1.272 4.349 -9.263 1.00 0.00 C ATOM 1459 O MET B 79 -2.099 5.223 -9.527 1.00 0.00 O ATOM 1460 CB MET B 79 -0.433 2.646 -10.896 1.00 0.00 C ATOM 1461 CG MET B 79 -0.918 2.744 -12.334 1.00 0.00 C ATOM 1462 SD MET B 79 -0.739 1.193 -13.235 1.00 0.00 S ATOM 1463 CE MET B 79 -2.172 1.258 -14.307 1.00 0.00 C ATOM 0 H MET B 79 1.560 3.065 -9.498 1.00 0.00 H new ATOM 0 HA MET B 79 -0.134 4.769 -11.024 1.00 0.00 H new ATOM 0 HB2 MET B 79 0.478 2.049 -10.869 1.00 0.00 H new ATOM 0 HB3 MET B 79 -1.180 2.115 -10.305 1.00 0.00 H new ATOM 0 HG2 MET B 79 -1.966 3.044 -12.340 1.00 0.00 H new ATOM 0 HG3 MET B 79 -0.359 3.525 -12.849 1.00 0.00 H new ATOM 0 HE1 MET B 79 -2.201 0.364 -14.930 1.00 0.00 H new ATOM 0 HE2 MET B 79 -3.077 1.309 -13.702 1.00 0.00 H new ATOM 0 HE3 MET B 79 -2.111 2.141 -14.943 1.00 0.00 H new ATOM 1473 N ILE B 80 -1.288 3.656 -8.130 1.00 0.00 N ATOM 1474 CA ILE B 80 -2.300 3.888 -7.105 1.00 0.00 C ATOM 1475 C ILE B 80 -2.217 5.314 -6.570 1.00 0.00 C ATOM 1476 O ILE B 80 -3.234 5.993 -6.426 1.00 0.00 O ATOM 1477 CB ILE B 80 -2.154 2.898 -5.934 1.00 0.00 C ATOM 1478 CG1 ILE B 80 -2.096 1.461 -6.453 1.00 0.00 C ATOM 1479 CG2 ILE B 80 -3.305 3.064 -4.952 1.00 0.00 C ATOM 1480 CD1 ILE B 80 -3.290 1.075 -7.298 1.00 0.00 C ATOM 0 H ILE B 80 -0.612 2.929 -7.898 1.00 0.00 H new ATOM 0 HA ILE B 80 -3.271 3.735 -7.576 1.00 0.00 H new ATOM 0 HB ILE B 80 -1.221 3.114 -5.413 1.00 0.00 H new ATOM 0 HG12 ILE B 80 -1.188 1.332 -7.042 1.00 0.00 H new ATOM 0 HG13 ILE B 80 -2.026 0.780 -5.605 1.00 0.00 H new ATOM 0 HG21 ILE B 80 -3.187 2.357 -4.130 1.00 0.00 H new ATOM 0 HG22 ILE B 80 -3.304 4.081 -4.559 1.00 0.00 H new ATOM 0 HG23 ILE B 80 -4.249 2.873 -5.462 1.00 0.00 H new ATOM 0 HD11 ILE B 80 -3.181 0.043 -7.632 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -4.201 1.171 -6.707 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -3.350 1.732 -8.165 1.00 0.00 H new ATOM 1492 N LEU B 81 -1.001 5.765 -6.282 1.00 0.00 N ATOM 1493 CA LEU B 81 -0.791 7.113 -5.768 1.00 0.00 C ATOM 1494 C LEU B 81 -1.161 8.152 -6.821 1.00 0.00 C ATOM 1495 O LEU B 81 -1.596 9.256 -6.495 1.00 0.00 O ATOM 1496 CB LEU B 81 0.666 7.307 -5.338 1.00 0.00 C ATOM 1497 CG LEU B 81 1.341 6.077 -4.724 1.00 0.00 C ATOM 1498 CD1 LEU B 81 2.710 6.443 -4.171 1.00 0.00 C ATOM 1499 CD2 LEU B 81 0.468 5.476 -3.634 1.00 0.00 C ATOM 0 H LEU B 81 -0.148 5.218 -6.395 1.00 0.00 H new ATOM 0 HA LEU B 81 -1.435 7.246 -4.899 1.00 0.00 H new ATOM 0 HB2 LEU B 81 1.244 7.622 -6.207 1.00 0.00 H new ATOM 0 HB3 LEU B 81 0.708 8.122 -4.615 1.00 0.00 H new ATOM 0 HG LEU B 81 1.473 5.330 -5.507 1.00 0.00 H new ATOM 0 HD11 LEU B 81 3.176 5.558 -3.738 1.00 0.00 H new ATOM 0 HD12 LEU B 81 3.337 6.826 -4.976 1.00 0.00 H new ATOM 0 HD13 LEU B 81 2.599 7.207 -3.402 1.00 0.00 H new ATOM 0 HD21 LEU B 81 0.965 4.603 -3.210 1.00 0.00 H new ATOM 0 HD22 LEU B 81 0.303 6.216 -2.851 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -0.490 5.177 -4.059 1.00 0.00 H new ATOM 1511 N LYS B 82 -0.988 7.787 -8.090 1.00 0.00 N ATOM 1512 CA LYS B 82 -1.304 8.686 -9.193 1.00 0.00 C ATOM 1513 C LYS B 82 -2.812 8.788 -9.398 1.00 0.00 C ATOM 1514 O LYS B 82 -3.318 9.812 -9.855 1.00 0.00 O ATOM 1515 CB LYS B 82 -0.634 8.198 -10.480 1.00 0.00 C ATOM 1516 CG LYS B 82 0.739 8.803 -10.715 1.00 0.00 C ATOM 1517 CD LYS B 82 1.091 8.828 -12.194 1.00 0.00 C ATOM 1518 CE LYS B 82 1.923 10.051 -12.548 1.00 0.00 C ATOM 1519 NZ LYS B 82 3.068 9.704 -13.436 1.00 0.00 N ATOM 0 H LYS B 82 -0.631 6.876 -8.377 1.00 0.00 H new ATOM 0 HA LYS B 82 -0.923 9.676 -8.944 1.00 0.00 H new ATOM 0 HB2 LYS B 82 -0.543 7.112 -10.444 1.00 0.00 H new ATOM 0 HB3 LYS B 82 -1.277 8.436 -11.328 1.00 0.00 H new ATOM 0 HG2 LYS B 82 0.764 9.817 -10.317 1.00 0.00 H new ATOM 0 HG3 LYS B 82 1.489 8.229 -10.171 1.00 0.00 H new ATOM 0 HD2 LYS B 82 1.642 7.924 -12.453 1.00 0.00 H new ATOM 0 HD3 LYS B 82 0.176 8.825 -12.787 1.00 0.00 H new ATOM 0 HE2 LYS B 82 1.291 10.790 -13.041 1.00 0.00 H new ATOM 0 HE3 LYS B 82 2.298 10.512 -11.634 1.00 0.00 H new ATOM 0 HZ1 LYS B 82 3.611 10.564 -13.655 1.00 0.00 H new ATOM 0 HZ2 LYS B 82 3.685 9.018 -12.955 1.00 0.00 H new ATOM 0 HZ3 LYS B 82 2.709 9.287 -14.319 1.00 0.00 H new ATOM 1533 N MET B 83 -3.527 7.720 -9.050 1.00 0.00 N ATOM 1534 CA MET B 83 -4.977 7.696 -9.193 1.00 0.00 C ATOM 1535 C MET B 83 -5.649 8.301 -7.964 1.00 0.00 C ATOM 1536 O MET B 83 -6.158 9.421 -8.011 1.00 0.00 O ATOM 1537 CB MET B 83 -5.469 6.262 -9.403 1.00 0.00 C ATOM 1538 CG MET B 83 -5.152 5.708 -10.782 1.00 0.00 C ATOM 1539 SD MET B 83 -5.911 4.098 -11.073 1.00 0.00 S ATOM 1540 CE MET B 83 -4.489 3.020 -10.924 1.00 0.00 C ATOM 0 H MET B 83 -3.125 6.864 -8.668 1.00 0.00 H new ATOM 0 HA MET B 83 -5.242 8.293 -10.066 1.00 0.00 H new ATOM 0 HB2 MET B 83 -5.018 5.617 -8.649 1.00 0.00 H new ATOM 0 HB3 MET B 83 -6.547 6.230 -9.246 1.00 0.00 H new ATOM 0 HG2 MET B 83 -5.497 6.411 -11.540 1.00 0.00 H new ATOM 0 HG3 MET B 83 -4.071 5.622 -10.896 1.00 0.00 H new ATOM 0 HE1 MET B 83 -4.396 2.414 -11.825 1.00 0.00 H new ATOM 0 HE2 MET B 83 -3.589 3.621 -10.797 1.00 0.00 H new ATOM 0 HE3 MET B 83 -4.615 2.368 -10.059 1.00 0.00 H new ATOM 1550 N ASP B 84 -5.642 7.554 -6.865 1.00 0.00 N ATOM 1551 CA ASP B 84 -6.247 8.021 -5.624 1.00 0.00 C ATOM 1552 C ASP B 84 -5.422 9.152 -5.017 1.00 0.00 C ATOM 1553 O ASP B 84 -4.267 8.957 -4.641 1.00 0.00 O ATOM 1554 CB ASP B 84 -6.366 6.869 -4.625 1.00 0.00 C ATOM 1555 CG ASP B 84 -7.605 6.027 -4.861 1.00 0.00 C ATOM 1556 OD1 ASP B 84 -8.064 5.957 -6.022 1.00 0.00 O ATOM 1557 OD2 ASP B 84 -8.117 5.437 -3.887 1.00 0.00 O ATOM 0 H ASP B 84 -5.225 6.625 -6.809 1.00 0.00 H new ATOM 0 HA ASP B 84 -7.244 8.399 -5.851 1.00 0.00 H new ATOM 0 HB2 ASP B 84 -5.481 6.237 -4.696 1.00 0.00 H new ATOM 0 HB3 ASP B 84 -6.390 7.271 -3.612 1.00 0.00 H new ATOM 1562 N SER B 85 -6.024 10.335 -4.931 1.00 0.00 N ATOM 1563 CA SER B 85 -5.348 11.504 -4.372 1.00 0.00 C ATOM 1564 C SER B 85 -4.338 12.072 -5.369 1.00 0.00 C ATOM 1565 O SER B 85 -4.406 11.782 -6.564 1.00 0.00 O ATOM 1566 CB SER B 85 -4.649 11.147 -3.056 1.00 0.00 C ATOM 1567 OG SER B 85 -5.305 10.072 -2.406 1.00 0.00 O ATOM 0 H SER B 85 -6.980 10.510 -5.241 1.00 0.00 H new ATOM 0 HA SER B 85 -6.101 12.265 -4.170 1.00 0.00 H new ATOM 0 HB2 SER B 85 -3.611 10.878 -3.253 1.00 0.00 H new ATOM 0 HB3 SER B 85 -4.634 12.018 -2.401 1.00 0.00 H new ATOM 0 HG SER B 85 -4.839 9.862 -1.570 1.00 0.00 H new ATOM 1573 N LEU B 86 -3.407 12.884 -4.875 1.00 0.00 N ATOM 1574 CA LEU B 86 -2.390 13.491 -5.728 1.00 0.00 C ATOM 1575 C LEU B 86 -3.028 14.450 -6.731 1.00 0.00 C ATOM 1576 O LEU B 86 -2.482 14.693 -7.807 1.00 0.00 O ATOM 1577 CB LEU B 86 -1.594 12.409 -6.465 1.00 0.00 C ATOM 1578 CG LEU B 86 -0.159 12.212 -5.976 1.00 0.00 C ATOM 1579 CD1 LEU B 86 0.644 13.492 -6.150 1.00 0.00 C ATOM 1580 CD2 LEU B 86 -0.146 11.765 -4.523 1.00 0.00 C ATOM 0 H LEU B 86 -3.336 13.136 -3.889 1.00 0.00 H new ATOM 0 HA LEU B 86 -1.708 14.057 -5.094 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -2.126 11.462 -6.372 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -1.569 12.658 -7.526 1.00 0.00 H new ATOM 0 HG LEU B 86 0.305 11.431 -6.578 1.00 0.00 H new ATOM 0 HD11 LEU B 86 1.663 13.333 -5.797 1.00 0.00 H new ATOM 0 HD12 LEU B 86 0.664 13.768 -7.204 1.00 0.00 H new ATOM 0 HD13 LEU B 86 0.181 14.293 -5.574 1.00 0.00 H new ATOM 0 HD21 LEU B 86 0.884 11.630 -4.193 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -0.629 12.522 -3.905 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -0.684 10.822 -4.428 1.00 0.00 H new ATOM 1592 N ARG B 87 -4.188 14.991 -6.367 1.00 0.00 N ATOM 1593 CA ARG B 87 -4.905 15.924 -7.232 1.00 0.00 C ATOM 1594 C ARG B 87 -5.693 16.934 -6.404 1.00 0.00 C ATOM 1595 O ARG B 87 -5.728 18.118 -6.728 1.00 0.00 O ATOM 1596 CB ARG B 87 -5.848 15.166 -8.167 1.00 0.00 C ATOM 1597 CG ARG B 87 -5.131 14.382 -9.255 1.00 0.00 C ATOM 1598 CD ARG B 87 -6.051 13.361 -9.903 1.00 0.00 C ATOM 1599 NE ARG B 87 -6.825 13.938 -11.000 1.00 0.00 N ATOM 1600 CZ ARG B 87 -7.841 13.321 -11.595 1.00 0.00 C ATOM 1601 NH1 ARG B 87 -8.212 12.107 -11.202 1.00 0.00 N ATOM 1602 NH2 ARG B 87 -8.491 13.916 -12.586 1.00 0.00 N ATOM 0 H ARG B 87 -4.652 14.799 -5.479 1.00 0.00 H new ATOM 0 HA ARG B 87 -4.171 16.464 -7.830 1.00 0.00 H new ATOM 0 HB2 ARG B 87 -6.456 14.479 -7.577 1.00 0.00 H new ATOM 0 HB3 ARG B 87 -6.531 15.876 -8.633 1.00 0.00 H new ATOM 0 HG2 ARG B 87 -4.757 15.069 -10.014 1.00 0.00 H new ATOM 0 HG3 ARG B 87 -4.265 13.875 -8.829 1.00 0.00 H new ATOM 0 HD2 ARG B 87 -5.459 12.526 -10.277 1.00 0.00 H new ATOM 0 HD3 ARG B 87 -6.731 12.958 -9.152 1.00 0.00 H new ATOM 0 HE ARG B 87 -6.571 14.869 -11.329 1.00 0.00 H new ATOM 0 HH11 ARG B 87 -7.716 11.644 -10.440 1.00 0.00 H new ATOM 0 HH12 ARG B 87 -8.992 11.638 -11.662 1.00 0.00 H new ATOM 0 HH21 ARG B 87 -8.211 14.848 -12.892 1.00 0.00 H new ATOM 0 HH22 ARG B 87 -9.270 13.442 -13.042 1.00 0.00 H new ATOM 1616 N ASP B 88 -6.321 16.462 -5.329 1.00 0.00 N ATOM 1617 CA ASP B 88 -7.097 17.336 -4.454 1.00 0.00 C ATOM 1618 C ASP B 88 -6.178 18.254 -3.646 1.00 0.00 C ATOM 1619 O ASP B 88 -6.638 19.179 -2.976 1.00 0.00 O ATOM 1620 CB ASP B 88 -7.968 16.504 -3.511 1.00 0.00 C ATOM 1621 CG ASP B 88 -9.363 17.077 -3.356 1.00 0.00 C ATOM 1622 OD1 ASP B 88 -10.169 16.939 -4.300 1.00 0.00 O ATOM 1623 OD2 ASP B 88 -9.651 17.662 -2.290 1.00 0.00 O ATOM 0 H ASP B 88 -6.308 15.483 -5.044 1.00 0.00 H new ATOM 0 HA ASP B 88 -7.741 17.956 -5.078 1.00 0.00 H new ATOM 0 HB2 ASP B 88 -8.037 15.484 -3.890 1.00 0.00 H new ATOM 0 HB3 ASP B 88 -7.490 16.449 -2.533 1.00 0.00 H new ATOM 1628 N ILE B 89 -4.873 18.003 -3.733 1.00 0.00 N ATOM 1629 CA ILE B 89 -3.883 18.806 -3.033 1.00 0.00 C ATOM 1630 C ILE B 89 -3.462 19.961 -3.915 1.00 0.00 C ATOM 1631 O ILE B 89 -3.602 21.124 -3.547 1.00 0.00 O ATOM 1632 CB ILE B 89 -2.640 17.976 -2.660 1.00 0.00 C ATOM 1633 CG1 ILE B 89 -3.054 16.668 -1.987 1.00 0.00 C ATOM 1634 CG2 ILE B 89 -1.715 18.781 -1.756 1.00 0.00 C ATOM 1635 CD1 ILE B 89 -3.593 16.856 -0.590 1.00 0.00 C ATOM 0 H ILE B 89 -4.479 17.243 -4.287 1.00 0.00 H new ATOM 0 HA ILE B 89 -4.336 19.173 -2.112 1.00 0.00 H new ATOM 0 HB ILE B 89 -2.097 17.732 -3.573 1.00 0.00 H new ATOM 0 HG12 ILE B 89 -3.812 16.178 -2.598 1.00 0.00 H new ATOM 0 HG13 ILE B 89 -2.194 15.999 -1.950 1.00 0.00 H new ATOM 0 HG21 ILE B 89 -0.842 18.180 -1.502 1.00 0.00 H new ATOM 0 HG22 ILE B 89 -1.395 19.685 -2.275 1.00 0.00 H new ATOM 0 HG23 ILE B 89 -2.245 19.055 -0.844 1.00 0.00 H new ATOM 0 HD11 ILE B 89 -3.867 15.887 -0.172 1.00 0.00 H new ATOM 0 HD12 ILE B 89 -2.829 17.318 0.036 1.00 0.00 H new ATOM 0 HD13 ILE B 89 -4.473 17.499 -0.623 1.00 0.00 H new ATOM 1647 N GLU B 90 -2.978 19.622 -5.102 1.00 0.00 N ATOM 1648 CA GLU B 90 -2.571 20.624 -6.071 1.00 0.00 C ATOM 1649 C GLU B 90 -3.791 21.427 -6.514 1.00 0.00 C ATOM 1650 O GLU B 90 -3.668 22.535 -7.028 1.00 0.00 O ATOM 1651 CB GLU B 90 -1.917 19.947 -7.280 1.00 0.00 C ATOM 1652 CG GLU B 90 -1.597 20.903 -8.420 1.00 0.00 C ATOM 1653 CD GLU B 90 -2.430 20.637 -9.658 1.00 0.00 C ATOM 1654 OE1 GLU B 90 -2.499 19.466 -10.087 1.00 0.00 O ATOM 1655 OE2 GLU B 90 -3.015 21.598 -10.198 1.00 0.00 O ATOM 0 H GLU B 90 -2.858 18.659 -5.415 1.00 0.00 H new ATOM 0 HA GLU B 90 -1.846 21.297 -5.613 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -0.997 19.459 -6.958 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -2.580 19.165 -7.649 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -1.765 21.927 -8.088 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -0.540 20.819 -8.673 1.00 0.00 H new ATOM 1662 N ALA B 91 -4.972 20.847 -6.301 1.00 0.00 N ATOM 1663 CA ALA B 91 -6.227 21.486 -6.666 1.00 0.00 C ATOM 1664 C ALA B 91 -6.724 22.379 -5.542 1.00 0.00 C ATOM 1665 O ALA B 91 -6.901 23.583 -5.721 1.00 0.00 O ATOM 1666 CB ALA B 91 -7.272 20.435 -7.009 1.00 0.00 C ATOM 0 H ALA B 91 -5.081 19.927 -5.873 1.00 0.00 H new ATOM 0 HA ALA B 91 -6.053 22.108 -7.544 1.00 0.00 H new ATOM 0 HB1 ALA B 91 -8.206 20.926 -7.280 1.00 0.00 H new ATOM 0 HB2 ALA B 91 -6.921 19.833 -7.848 1.00 0.00 H new ATOM 0 HB3 ALA B 91 -7.438 19.791 -6.145 1.00 0.00 H new ATOM 1672 N LEU B 92 -6.936 21.787 -4.372 1.00 0.00 N ATOM 1673 CA LEU B 92 -7.399 22.546 -3.219 1.00 0.00 C ATOM 1674 C LEU B 92 -6.447 23.708 -2.932 1.00 0.00 C ATOM 1675 O LEU B 92 -6.837 24.716 -2.341 1.00 0.00 O ATOM 1676 CB LEU B 92 -7.513 21.639 -1.992 1.00 0.00 C ATOM 1677 CG LEU B 92 -8.246 22.253 -0.798 1.00 0.00 C ATOM 1678 CD1 LEU B 92 -9.685 22.582 -1.167 1.00 0.00 C ATOM 1679 CD2 LEU B 92 -8.202 21.311 0.395 1.00 0.00 C ATOM 0 H LEU B 92 -6.796 20.792 -4.198 1.00 0.00 H new ATOM 0 HA LEU B 92 -8.386 22.950 -3.444 1.00 0.00 H new ATOM 0 HB2 LEU B 92 -8.028 20.723 -2.283 1.00 0.00 H new ATOM 0 HB3 LEU B 92 -6.510 21.354 -1.675 1.00 0.00 H new ATOM 0 HG LEU B 92 -7.742 23.180 -0.523 1.00 0.00 H new ATOM 0 HD11 LEU B 92 -10.191 23.018 -0.306 1.00 0.00 H new ATOM 0 HD12 LEU B 92 -9.695 23.294 -1.992 1.00 0.00 H new ATOM 0 HD13 LEU B 92 -10.201 21.670 -1.468 1.00 0.00 H new ATOM 0 HD21 LEU B 92 -8.728 21.764 1.236 1.00 0.00 H new ATOM 0 HD22 LEU B 92 -8.681 20.368 0.132 1.00 0.00 H new ATOM 0 HD23 LEU B 92 -7.165 21.125 0.674 1.00 0.00 H new ATOM 1691 N LEU B 93 -5.196 23.561 -3.370 1.00 0.00 N ATOM 1692 CA LEU B 93 -4.189 24.594 -3.170 1.00 0.00 C ATOM 1693 C LEU B 93 -4.136 25.546 -4.360 1.00 0.00 C ATOM 1694 O LEU B 93 -3.995 26.754 -4.183 1.00 0.00 O ATOM 1695 CB LEU B 93 -2.811 23.971 -2.935 1.00 0.00 C ATOM 1696 CG LEU B 93 -2.491 23.645 -1.475 1.00 0.00 C ATOM 1697 CD1 LEU B 93 -2.727 22.171 -1.190 1.00 0.00 C ATOM 1698 CD2 LEU B 93 -1.057 24.030 -1.143 1.00 0.00 C ATOM 0 H LEU B 93 -4.860 22.735 -3.865 1.00 0.00 H new ATOM 0 HA LEU B 93 -4.471 25.164 -2.285 1.00 0.00 H new ATOM 0 HB2 LEU B 93 -2.738 23.055 -3.521 1.00 0.00 H new ATOM 0 HB3 LEU B 93 -2.051 24.653 -3.315 1.00 0.00 H new ATOM 0 HG LEU B 93 -3.159 24.227 -0.841 1.00 0.00 H new ATOM 0 HD11 LEU B 93 -2.494 21.960 -0.146 1.00 0.00 H new ATOM 0 HD12 LEU B 93 -3.771 21.925 -1.385 1.00 0.00 H new ATOM 0 HD13 LEU B 93 -2.086 21.569 -1.834 1.00 0.00 H new ATOM 0 HD21 LEU B 93 -0.848 23.791 -0.100 1.00 0.00 H new ATOM 0 HD22 LEU B 93 -0.373 23.476 -1.786 1.00 0.00 H new ATOM 0 HD23 LEU B 93 -0.921 25.099 -1.304 1.00 0.00 H new ATOM 1710 N THR B 94 -4.256 25.010 -5.576 1.00 0.00 N ATOM 1711 CA THR B 94 -4.220 25.866 -6.761 1.00 0.00 C ATOM 1712 C THR B 94 -5.481 26.726 -6.851 1.00 0.00 C ATOM 1713 O THR B 94 -5.550 27.654 -7.656 1.00 0.00 O ATOM 1714 CB THR B 94 -4.050 25.046 -8.039 1.00 0.00 C ATOM 1715 OG1 THR B 94 -3.747 25.890 -9.137 1.00 0.00 O ATOM 1716 CG2 THR B 94 -5.276 24.249 -8.406 1.00 0.00 C ATOM 0 H THR B 94 -4.376 24.015 -5.764 1.00 0.00 H new ATOM 0 HA THR B 94 -3.355 26.522 -6.661 1.00 0.00 H new ATOM 0 HB THR B 94 -3.234 24.354 -7.831 1.00 0.00 H new ATOM 0 HG1 THR B 94 -2.995 26.473 -8.904 1.00 0.00 H new ATOM 0 HG21 THR B 94 -5.086 23.691 -9.323 1.00 0.00 H new ATOM 0 HG22 THR B 94 -5.513 23.554 -7.600 1.00 0.00 H new ATOM 0 HG23 THR B 94 -6.117 24.925 -8.561 1.00 0.00 H new ATOM 1724 N GLY B 95 -6.478 26.410 -6.025 1.00 0.00 N ATOM 1725 CA GLY B 95 -7.717 27.163 -6.036 1.00 0.00 C ATOM 1726 C GLY B 95 -7.997 27.869 -4.721 1.00 0.00 C ATOM 1727 O GLY B 95 -8.544 28.973 -4.714 1.00 0.00 O ATOM 0 H GLY B 95 -6.447 25.646 -5.350 1.00 0.00 H new ATOM 0 HA2 GLY B 95 -7.679 27.901 -6.837 1.00 0.00 H new ATOM 0 HA3 GLY B 95 -8.543 26.489 -6.263 1.00 0.00 H new ATOM 1731 N LEU B 96 -7.635 27.240 -3.604 1.00 0.00 N ATOM 1732 CA LEU B 96 -7.871 27.838 -2.292 1.00 0.00 C ATOM 1733 C LEU B 96 -6.646 28.586 -1.773 1.00 0.00 C ATOM 1734 O LEU B 96 -6.703 29.241 -0.734 1.00 0.00 O ATOM 1735 CB LEU B 96 -8.301 26.767 -1.285 1.00 0.00 C ATOM 1736 CG LEU B 96 -9.411 27.189 -0.322 1.00 0.00 C ATOM 1737 CD1 LEU B 96 -8.988 28.409 0.482 1.00 0.00 C ATOM 1738 CD2 LEU B 96 -10.699 27.470 -1.083 1.00 0.00 C ATOM 0 H LEU B 96 -7.182 26.326 -3.581 1.00 0.00 H new ATOM 0 HA LEU B 96 -8.675 28.565 -2.409 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -8.634 25.887 -1.835 1.00 0.00 H new ATOM 0 HB3 LEU B 96 -7.430 26.468 -0.702 1.00 0.00 H new ATOM 0 HG LEU B 96 -9.593 26.369 0.372 1.00 0.00 H new ATOM 0 HD11 LEU B 96 -9.792 28.694 1.161 1.00 0.00 H new ATOM 0 HD12 LEU B 96 -8.093 28.173 1.057 1.00 0.00 H new ATOM 0 HD13 LEU B 96 -8.776 29.236 -0.196 1.00 0.00 H new ATOM 0 HD21 LEU B 96 -11.478 27.769 -0.382 1.00 0.00 H new ATOM 0 HD22 LEU B 96 -10.530 28.272 -1.801 1.00 0.00 H new ATOM 0 HD23 LEU B 96 -11.013 26.570 -1.612 1.00 0.00 H new ATOM 1750 N PHE B 97 -5.550 28.489 -2.512 1.00 0.00 N ATOM 1751 CA PHE B 97 -4.294 29.153 -2.154 1.00 0.00 C ATOM 1752 C PHE B 97 -4.049 29.147 -0.644 1.00 0.00 C ATOM 1753 O PHE B 97 -4.520 30.028 0.075 1.00 0.00 O ATOM 1754 CB PHE B 97 -4.285 30.592 -2.678 1.00 0.00 C ATOM 1755 CG PHE B 97 -5.501 31.387 -2.293 1.00 0.00 C ATOM 1756 CD1 PHE B 97 -6.668 31.291 -3.032 1.00 0.00 C ATOM 1757 CD2 PHE B 97 -5.474 32.232 -1.195 1.00 0.00 C ATOM 1758 CE1 PHE B 97 -7.788 32.023 -2.684 1.00 0.00 C ATOM 1759 CE2 PHE B 97 -6.589 32.967 -0.841 1.00 0.00 C ATOM 1760 CZ PHE B 97 -7.748 32.864 -1.587 1.00 0.00 C ATOM 0 H PHE B 97 -5.501 27.950 -3.376 1.00 0.00 H new ATOM 0 HA PHE B 97 -3.487 28.589 -2.622 1.00 0.00 H new ATOM 0 HB2 PHE B 97 -3.397 31.100 -2.302 1.00 0.00 H new ATOM 0 HB3 PHE B 97 -4.205 30.572 -3.765 1.00 0.00 H new ATOM 0 HD1 PHE B 97 -6.704 30.637 -3.890 1.00 0.00 H new ATOM 0 HD2 PHE B 97 -4.571 32.317 -0.609 1.00 0.00 H new ATOM 0 HE1 PHE B 97 -8.693 31.938 -3.268 1.00 0.00 H new ATOM 0 HE2 PHE B 97 -6.555 33.621 0.018 1.00 0.00 H new ATOM 0 HZ PHE B 97 -8.620 33.439 -1.314 1.00 0.00 H new ATOM 1770 N VAL B 98 -3.308 28.150 -0.171 1.00 0.00 N ATOM 1771 CA VAL B 98 -3.002 28.037 1.249 1.00 0.00 C ATOM 1772 C VAL B 98 -1.558 28.440 1.536 1.00 0.00 C ATOM 1773 O VAL B 98 -0.619 27.773 1.102 1.00 0.00 O ATOM 1774 CB VAL B 98 -3.241 26.603 1.767 1.00 0.00 C ATOM 1775 CG1 VAL B 98 -2.329 25.611 1.061 1.00 0.00 C ATOM 1776 CG2 VAL B 98 -3.040 26.540 3.275 1.00 0.00 C ATOM 0 H VAL B 98 -2.909 27.411 -0.750 1.00 0.00 H new ATOM 0 HA VAL B 98 -3.675 28.717 1.771 1.00 0.00 H new ATOM 0 HB VAL B 98 -4.272 26.329 1.545 1.00 0.00 H new ATOM 0 HG11 VAL B 98 -2.517 24.608 1.444 1.00 0.00 H new ATOM 0 HG12 VAL B 98 -2.527 25.633 -0.011 1.00 0.00 H new ATOM 0 HG13 VAL B 98 -1.289 25.880 1.243 1.00 0.00 H new ATOM 0 HG21 VAL B 98 -3.213 25.522 3.623 1.00 0.00 H new ATOM 0 HG22 VAL B 98 -2.021 26.839 3.519 1.00 0.00 H new ATOM 0 HG23 VAL B 98 -3.743 27.214 3.764 1.00 0.00 H new ATOM 1786 N GLN B 99 -1.391 29.538 2.266 1.00 0.00 N ATOM 1787 CA GLN B 99 -0.062 30.031 2.609 1.00 0.00 C ATOM 1788 C GLN B 99 0.396 29.473 3.952 1.00 0.00 C ATOM 1789 O GLN B 99 -0.421 29.124 4.803 1.00 0.00 O ATOM 1790 CB GLN B 99 -0.060 31.561 2.652 1.00 0.00 C ATOM 1791 CG GLN B 99 1.320 32.173 2.458 1.00 0.00 C ATOM 1792 CD GLN B 99 1.414 33.018 1.204 1.00 0.00 C ATOM 1793 OE1 GLN B 99 0.520 33.809 0.905 1.00 0.00 O ATOM 1794 NE2 GLN B 99 2.504 32.855 0.461 1.00 0.00 N ATOM 0 H GLN B 99 -2.158 30.103 2.631 1.00 0.00 H new ATOM 0 HA GLN B 99 0.633 29.694 1.840 1.00 0.00 H new ATOM 0 HB2 GLN B 99 -0.728 31.939 1.878 1.00 0.00 H new ATOM 0 HB3 GLN B 99 -0.463 31.890 3.610 1.00 0.00 H new ATOM 0 HG2 GLN B 99 1.566 32.787 3.324 1.00 0.00 H new ATOM 0 HG3 GLN B 99 2.063 31.377 2.411 1.00 0.00 H new ATOM 0 HE21 GLN B 99 3.221 32.188 0.746 1.00 0.00 H new ATOM 0 HE22 GLN B 99 2.624 33.397 -0.395 1.00 0.00 H new ATOM 1803 N ASP B 100 1.711 29.392 4.136 1.00 0.00 N ATOM 1804 CA ASP B 100 2.280 28.877 5.375 1.00 0.00 C ATOM 1805 C ASP B 100 3.725 29.338 5.542 1.00 0.00 C ATOM 1806 O ASP B 100 4.469 29.441 4.568 1.00 0.00 O ATOM 1807 CB ASP B 100 2.215 27.349 5.397 1.00 0.00 C ATOM 1808 CG ASP B 100 2.502 26.778 6.770 1.00 0.00 C ATOM 1809 OD1 ASP B 100 3.694 26.656 7.126 1.00 0.00 O ATOM 1810 OD2 ASP B 100 1.536 26.452 7.492 1.00 0.00 O ATOM 0 H ASP B 100 2.402 29.677 3.442 1.00 0.00 H new ATOM 0 HA ASP B 100 1.693 29.270 6.205 1.00 0.00 H new ATOM 0 HB2 ASP B 100 1.226 27.026 5.072 1.00 0.00 H new ATOM 0 HB3 ASP B 100 2.933 26.947 4.682 1.00 0.00 H new ATOM 1815 N ASN B 101 4.112 29.616 6.782 1.00 0.00 N ATOM 1816 CA ASN B 101 5.468 30.069 7.076 1.00 0.00 C ATOM 1817 C ASN B 101 6.304 28.939 7.670 1.00 0.00 C ATOM 1818 O ASN B 101 5.837 28.195 8.533 1.00 0.00 O ATOM 1819 CB ASN B 101 5.433 31.254 8.041 1.00 0.00 C ATOM 1820 CG ASN B 101 6.533 32.260 7.761 1.00 0.00 C ATOM 1821 OD1 ASN B 101 7.502 32.364 8.512 1.00 0.00 O ATOM 1822 ND2 ASN B 101 6.384 33.010 6.673 1.00 0.00 N ATOM 0 H ASN B 101 3.507 29.536 7.599 1.00 0.00 H new ATOM 0 HA ASN B 101 5.930 30.384 6.140 1.00 0.00 H new ATOM 0 HB2 ASN B 101 4.465 31.749 7.969 1.00 0.00 H new ATOM 0 HB3 ASN B 101 5.529 30.889 9.064 1.00 0.00 H new ATOM 0 HD21 ASN B 101 7.090 33.706 6.433 1.00 0.00 H new ATOM 0 HD22 ASN B 101 5.564 32.889 6.079 1.00 0.00 H new ATOM 1829 N VAL B 102 7.541 28.816 7.201 1.00 0.00 N ATOM 1830 CA VAL B 102 8.442 27.777 7.687 1.00 0.00 C ATOM 1831 C VAL B 102 9.893 28.246 7.647 1.00 0.00 C ATOM 1832 O VAL B 102 10.635 28.082 8.614 1.00 0.00 O ATOM 1833 CB VAL B 102 8.309 26.486 6.859 1.00 0.00 C ATOM 1834 CG1 VAL B 102 7.021 25.756 7.209 1.00 0.00 C ATOM 1835 CG2 VAL B 102 8.369 26.796 5.371 1.00 0.00 C ATOM 0 H VAL B 102 7.942 29.422 6.486 1.00 0.00 H new ATOM 0 HA VAL B 102 8.158 27.569 8.719 1.00 0.00 H new ATOM 0 HB VAL B 102 9.146 25.832 7.103 1.00 0.00 H new ATOM 0 HG11 VAL B 102 6.945 24.846 6.613 1.00 0.00 H new ATOM 0 HG12 VAL B 102 7.026 25.497 8.268 1.00 0.00 H new ATOM 0 HG13 VAL B 102 6.168 26.401 6.997 1.00 0.00 H new ATOM 0 HG21 VAL B 102 8.273 25.871 4.802 1.00 0.00 H new ATOM 0 HG22 VAL B 102 7.554 27.470 5.107 1.00 0.00 H new ATOM 0 HG23 VAL B 102 9.322 27.269 5.136 1.00 0.00 H new ATOM 1845 N ASN B 103 10.289 28.829 6.520 1.00 0.00 N ATOM 1846 CA ASN B 103 11.652 29.321 6.353 1.00 0.00 C ATOM 1847 C ASN B 103 11.748 30.794 6.741 1.00 0.00 C ATOM 1848 O ASN B 103 10.971 31.623 6.266 1.00 0.00 O ATOM 1849 CB ASN B 103 12.111 29.130 4.906 1.00 0.00 C ATOM 1850 CG ASN B 103 12.821 27.808 4.696 1.00 0.00 C ATOM 1851 OD1 ASN B 103 13.818 27.513 5.357 1.00 0.00 O ATOM 1852 ND2 ASN B 103 12.310 27.003 3.772 1.00 0.00 N ATOM 0 H ASN B 103 9.686 28.972 5.710 1.00 0.00 H new ATOM 0 HA ASN B 103 12.304 28.747 7.011 1.00 0.00 H new ATOM 0 HB2 ASN B 103 11.247 29.185 4.243 1.00 0.00 H new ATOM 0 HB3 ASN B 103 12.778 29.946 4.628 1.00 0.00 H new ATOM 0 HD21 ASN B 103 12.745 26.099 3.586 1.00 0.00 H new ATOM 0 HD22 ASN B 103 11.483 27.288 3.248 1.00 0.00 H new ATOM 1859 N LYS B 104 12.706 31.110 7.605 1.00 0.00 N ATOM 1860 CA LYS B 104 12.904 32.482 8.059 1.00 0.00 C ATOM 1861 C LYS B 104 14.207 33.055 7.508 1.00 0.00 C ATOM 1862 O LYS B 104 15.230 32.370 7.469 1.00 0.00 O ATOM 1863 CB LYS B 104 12.910 32.538 9.589 1.00 0.00 C ATOM 1864 CG LYS B 104 11.992 33.605 10.162 1.00 0.00 C ATOM 1865 CD LYS B 104 11.462 33.205 11.529 1.00 0.00 C ATOM 1866 CE LYS B 104 10.969 34.412 12.311 1.00 0.00 C ATOM 1867 NZ LYS B 104 12.086 35.321 12.691 1.00 0.00 N ATOM 0 H LYS B 104 13.358 30.435 8.005 1.00 0.00 H new ATOM 0 HA LYS B 104 12.078 33.087 7.685 1.00 0.00 H new ATOM 0 HB2 LYS B 104 12.612 31.566 9.981 1.00 0.00 H new ATOM 0 HB3 LYS B 104 13.927 32.723 9.934 1.00 0.00 H new ATOM 0 HG2 LYS B 104 12.533 34.548 10.242 1.00 0.00 H new ATOM 0 HG3 LYS B 104 11.157 33.773 9.481 1.00 0.00 H new ATOM 0 HD2 LYS B 104 10.648 32.490 11.410 1.00 0.00 H new ATOM 0 HD3 LYS B 104 12.248 32.702 12.092 1.00 0.00 H new ATOM 0 HE2 LYS B 104 10.242 34.961 11.712 1.00 0.00 H new ATOM 0 HE3 LYS B 104 10.452 34.076 13.210 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 11.805 35.890 13.515 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 12.927 34.757 12.930 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 12.307 35.951 11.894 1.00 0.00 H new ATOM 1881 N ASP B 105 14.163 34.314 7.086 1.00 0.00 N ATOM 1882 CA ASP B 105 15.341 34.979 6.538 1.00 0.00 C ATOM 1883 C ASP B 105 15.882 34.221 5.330 1.00 0.00 C ATOM 1884 O ASP B 105 16.566 33.207 5.475 1.00 0.00 O ATOM 1885 CB ASP B 105 16.428 35.101 7.607 1.00 0.00 C ATOM 1886 CG ASP B 105 17.187 36.410 7.513 1.00 0.00 C ATOM 1887 OD1 ASP B 105 17.546 36.809 6.385 1.00 0.00 O ATOM 1888 OD2 ASP B 105 17.422 37.037 8.567 1.00 0.00 O ATOM 0 H ASP B 105 13.325 34.895 7.113 1.00 0.00 H new ATOM 0 HA ASP B 105 15.046 35.977 6.215 1.00 0.00 H new ATOM 0 HB2 ASP B 105 15.974 35.018 8.594 1.00 0.00 H new ATOM 0 HB3 ASP B 105 17.127 34.271 7.507 1.00 0.00 H new ATOM 1893 N ALA B 106 15.572 34.719 4.138 1.00 0.00 N ATOM 1894 CA ALA B 106 16.026 34.090 2.903 1.00 0.00 C ATOM 1895 C ALA B 106 15.470 32.677 2.770 1.00 0.00 C ATOM 1896 O ALA B 106 15.471 32.145 1.639 1.00 0.00 O ATOM 1897 CB ALA B 106 17.547 34.067 2.851 1.00 0.00 C ATOM 1898 OXT ALA B 106 15.035 32.114 3.796 1.00 0.00 O ATOM 0 H ALA B 106 15.008 35.557 4.001 1.00 0.00 H new ATOM 0 HA ALA B 106 15.653 34.680 2.066 1.00 0.00 H new ATOM 0 HB1 ALA B 106 17.872 33.595 1.924 1.00 0.00 H new ATOM 0 HB2 ALA B 106 17.928 35.087 2.892 1.00 0.00 H new ATOM 0 HB3 ALA B 106 17.932 33.502 3.700 1.00 0.00 H new TER 1904 ALA B 106