USER MOD reduce.3.24.130724 H: found=0, std=0, add=958, rem=0, adj=16 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 24:sc= 0.593 USER MOD Single : A 53 HIS : no HD1:sc= -0.911 X(o=-0.91,f=-0.8) 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= -0.116 X(o=-0.12,f=0) USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ -142:sc= -0.455 (180deg=-0.667) USER MOD Single : A 83 MET CE :methyl -150:sc= -0.382 (180deg=-2.13!) USER MOD Single : A 85 SER OG : rot 100:sc= 1.05 USER MOD Single : A 94 THR OG1 : rot -36:sc= 0.136 USER MOD Single : A 99 GLN : amide:sc= -1.02 X(o=-1,f=-0.53) USER MOD Single : A 101 ASN : amide:sc= -1.07 K(o=-1.1,f=-3.9!) USER MOD Single : A 103 ASN : amide:sc= -0.268 X(o=-0.27,f=-0.083) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 THR OG1 : rot 31:sc= 0.356 USER MOD Single : B 53 HIS : no HD1:sc= -0.996 X(o=-1,f=-0.77) 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= -0.159 X(o=-0.16,f=0) USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 82 LYS NZ :NH3+ -142:sc= -0.451 (180deg=-0.68) USER MOD Single : B 83 MET CE :methyl -147:sc= -0.36 (180deg=-2.15!) USER MOD Single : B 85 SER OG : rot 104:sc= 1.03 USER MOD Single : B 94 THR OG1 : rot -35:sc= 0.171 USER MOD Single : B 99 GLN :FLIP amide:sc= -0.53 F(o=-1.1,f=-0.53) USER MOD Single : B 101 ASN : amide:sc= -1.08 K(o=-1.1,f=-4.1!) USER MOD Single : B 103 ASN : amide:sc= -0.277 X(o=-0.28,f=-0.53) USER MOD Single : B 104 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.223) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 50 -7.183 -28.828 -14.571 1.00 0.00 N ATOM 2 CA THR A 50 -6.898 -28.763 -13.113 1.00 0.00 C ATOM 3 C THR A 50 -6.800 -30.160 -12.507 1.00 0.00 C ATOM 4 O THR A 50 -7.377 -31.114 -13.029 1.00 0.00 O ATOM 5 CB THR A 50 -8.013 -27.970 -12.432 1.00 0.00 C ATOM 6 OG1 THR A 50 -8.497 -26.950 -13.286 1.00 0.00 O ATOM 7 CG2 THR A 50 -7.579 -27.317 -11.138 1.00 0.00 C ATOM 0 HA THR A 50 -5.938 -28.270 -12.959 1.00 0.00 H new ATOM 0 HB THR A 50 -8.791 -28.700 -12.209 1.00 0.00 H new ATOM 0 HG1 THR A 50 -8.310 -27.188 -14.218 1.00 0.00 H new ATOM 0 HG21 THR A 50 -8.418 -26.771 -10.707 1.00 0.00 H new ATOM 0 HG22 THR A 50 -7.247 -28.083 -10.437 1.00 0.00 H new ATOM 0 HG23 THR A 50 -6.759 -26.626 -11.336 1.00 0.00 H new ATOM 17 N ARG A 51 -6.069 -30.273 -11.404 1.00 0.00 N ATOM 18 CA ARG A 51 -5.896 -31.553 -10.727 1.00 0.00 C ATOM 19 C ARG A 51 -6.648 -31.571 -9.398 1.00 0.00 C ATOM 20 O ARG A 51 -7.073 -30.529 -8.900 1.00 0.00 O ATOM 21 CB ARG A 51 -4.409 -31.834 -10.496 1.00 0.00 C ATOM 22 CG ARG A 51 -3.907 -33.080 -11.210 1.00 0.00 C ATOM 23 CD ARG A 51 -3.784 -34.258 -10.256 1.00 0.00 C ATOM 24 NE ARG A 51 -3.901 -35.538 -10.950 1.00 0.00 N ATOM 25 CZ ARG A 51 -4.188 -36.687 -10.341 1.00 0.00 C ATOM 26 NH1 ARG A 51 -4.386 -36.721 -9.030 1.00 0.00 N ATOM 27 NH2 ARG A 51 -4.275 -37.806 -11.048 1.00 0.00 N ATOM 0 H ARG A 51 -5.586 -29.493 -10.959 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.309 -32.335 -11.365 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -3.829 -30.974 -10.832 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -4.230 -31.941 -9.426 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -4.590 -33.336 -12.020 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -2.937 -32.875 -11.663 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -2.824 -34.210 -9.743 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -4.558 -34.188 -9.492 1.00 0.00 H new ATOM 0 HE ARG A 51 -3.754 -35.553 -11.959 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -4.319 -35.864 -8.482 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -4.605 -37.605 -8.570 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -4.122 -37.785 -12.056 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -4.495 -38.687 -10.583 1.00 0.00 H new ATOM 41 N ALA A 52 -6.807 -32.763 -8.829 1.00 0.00 N ATOM 42 CA ALA A 52 -7.506 -32.916 -7.559 1.00 0.00 C ATOM 43 C ALA A 52 -6.566 -33.427 -6.471 1.00 0.00 C ATOM 44 O ALA A 52 -6.486 -34.630 -6.220 1.00 0.00 O ATOM 45 CB ALA A 52 -8.691 -33.858 -7.718 1.00 0.00 C ATOM 0 H ALA A 52 -6.461 -33.636 -9.228 1.00 0.00 H new ATOM 0 HA ALA A 52 -7.872 -31.935 -7.255 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -9.203 -33.963 -6.762 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -9.382 -33.452 -8.457 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -8.338 -34.835 -8.049 1.00 0.00 H new ATOM 51 N HIS A 53 -5.858 -32.504 -5.828 1.00 0.00 N ATOM 52 CA HIS A 53 -4.922 -32.856 -4.764 1.00 0.00 C ATOM 53 C HIS A 53 -4.232 -31.608 -4.220 1.00 0.00 C ATOM 54 O HIS A 53 -3.005 -31.505 -4.235 1.00 0.00 O ATOM 55 CB HIS A 53 -3.882 -33.857 -5.281 1.00 0.00 C ATOM 56 CG HIS A 53 -4.117 -35.257 -4.806 1.00 0.00 C ATOM 57 ND1 HIS A 53 -3.993 -36.360 -5.626 1.00 0.00 N ATOM 58 CD2 HIS A 53 -4.470 -35.734 -3.589 1.00 0.00 C ATOM 59 CE1 HIS A 53 -4.261 -37.453 -4.934 1.00 0.00 C ATOM 60 NE2 HIS A 53 -4.552 -37.100 -3.695 1.00 0.00 N ATOM 0 H HIS A 53 -5.914 -31.505 -6.025 1.00 0.00 H new ATOM 0 HA HIS A 53 -5.482 -33.320 -3.952 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -3.888 -33.845 -6.371 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -2.890 -33.535 -4.964 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -4.653 -35.149 -2.700 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -4.245 -38.463 -5.316 1.00 0.00 H new ATOM 0 HE2 HIS A 53 -4.798 -37.739 -2.939 1.00 0.00 H new ATOM 69 N LEU A 54 -5.030 -30.659 -3.744 1.00 0.00 N ATOM 70 CA LEU A 54 -4.497 -29.416 -3.200 1.00 0.00 C ATOM 71 C LEU A 54 -5.214 -29.037 -1.903 1.00 0.00 C ATOM 72 O LEU A 54 -4.570 -28.775 -0.890 1.00 0.00 O ATOM 73 CB LEU A 54 -4.630 -28.284 -4.223 1.00 0.00 C ATOM 74 CG LEU A 54 -4.415 -28.689 -5.686 1.00 0.00 C ATOM 75 CD1 LEU A 54 -5.421 -27.990 -6.586 1.00 0.00 C ATOM 76 CD2 LEU A 54 -2.994 -28.368 -6.123 1.00 0.00 C ATOM 0 H LEU A 54 -6.048 -30.727 -3.724 1.00 0.00 H new ATOM 0 HA LEU A 54 -3.441 -29.570 -2.978 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -5.624 -27.846 -4.128 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.912 -27.503 -3.971 1.00 0.00 H new ATOM 0 HG LEU A 54 -4.567 -29.765 -5.772 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -5.253 -28.289 -7.621 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.432 -28.268 -6.287 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -5.300 -26.910 -6.497 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.858 -28.662 -7.164 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -2.815 -27.298 -6.022 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -2.289 -28.914 -5.497 1.00 0.00 H new ATOM 88 N THR A 55 -6.550 -29.017 -1.960 1.00 0.00 N ATOM 89 CA THR A 55 -7.410 -28.682 -0.811 1.00 0.00 C ATOM 90 C THR A 55 -6.656 -28.007 0.341 1.00 0.00 C ATOM 91 O THR A 55 -6.712 -26.784 0.502 1.00 0.00 O ATOM 92 CB THR A 55 -8.113 -29.941 -0.303 1.00 0.00 C ATOM 93 OG1 THR A 55 -8.910 -30.515 -1.324 1.00 0.00 O ATOM 94 CG2 THR A 55 -9.010 -29.692 0.891 1.00 0.00 C ATOM 0 H THR A 55 -7.072 -29.234 -2.809 1.00 0.00 H new ATOM 0 HA THR A 55 -8.140 -27.958 -1.172 1.00 0.00 H new ATOM 0 HB THR A 55 -7.311 -30.613 0.002 1.00 0.00 H new ATOM 0 HG1 THR A 55 -9.351 -31.320 -0.981 1.00 0.00 H new ATOM 0 HG21 THR A 55 -9.476 -30.628 1.198 1.00 0.00 H new ATOM 0 HG22 THR A 55 -8.417 -29.295 1.715 1.00 0.00 H new ATOM 0 HG23 THR A 55 -9.784 -28.973 0.621 1.00 0.00 H new ATOM 102 N GLU A 56 -5.966 -28.810 1.146 1.00 0.00 N ATOM 103 CA GLU A 56 -5.218 -28.290 2.285 1.00 0.00 C ATOM 104 C GLU A 56 -4.067 -27.388 1.839 1.00 0.00 C ATOM 105 O GLU A 56 -3.979 -26.237 2.258 1.00 0.00 O ATOM 106 CB GLU A 56 -4.685 -29.438 3.147 1.00 0.00 C ATOM 107 CG GLU A 56 -3.840 -30.436 2.379 1.00 0.00 C ATOM 108 CD GLU A 56 -3.738 -31.778 3.080 1.00 0.00 C ATOM 109 OE1 GLU A 56 -3.184 -31.821 4.199 1.00 0.00 O ATOM 110 OE2 GLU A 56 -4.210 -32.783 2.508 1.00 0.00 O ATOM 0 H GLU A 56 -5.910 -29.822 1.030 1.00 0.00 H new ATOM 0 HA GLU A 56 -5.904 -27.688 2.880 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -4.091 -29.023 3.962 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -5.527 -29.961 3.601 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -4.267 -30.580 1.387 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -2.839 -30.027 2.239 1.00 0.00 H new ATOM 117 N VAL A 57 -3.186 -27.910 0.994 1.00 0.00 N ATOM 118 CA VAL A 57 -2.049 -27.136 0.514 1.00 0.00 C ATOM 119 C VAL A 57 -2.502 -25.876 -0.225 1.00 0.00 C ATOM 120 O VAL A 57 -2.030 -24.770 0.070 1.00 0.00 O ATOM 121 CB VAL A 57 -1.135 -27.968 -0.399 1.00 0.00 C ATOM 122 CG1 VAL A 57 0.205 -27.271 -0.574 1.00 0.00 C ATOM 123 CG2 VAL A 57 -0.944 -29.369 0.162 1.00 0.00 C ATOM 0 H VAL A 57 -3.237 -28.861 0.629 1.00 0.00 H new ATOM 0 HA VAL A 57 -1.480 -26.842 1.396 1.00 0.00 H new ATOM 0 HB VAL A 57 -1.610 -28.059 -1.376 1.00 0.00 H new ATOM 0 HG11 VAL A 57 0.844 -27.870 -1.223 1.00 0.00 H new ATOM 0 HG12 VAL A 57 0.049 -26.290 -1.023 1.00 0.00 H new ATOM 0 HG13 VAL A 57 0.683 -27.153 0.398 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -0.294 -29.941 -0.500 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -0.490 -29.306 1.151 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -1.911 -29.866 0.238 1.00 0.00 H new ATOM 133 N GLU A 58 -3.427 -26.025 -1.178 1.00 0.00 N ATOM 134 CA GLU A 58 -3.925 -24.865 -1.915 1.00 0.00 C ATOM 135 C GLU A 58 -4.407 -23.808 -0.933 1.00 0.00 C ATOM 136 O GLU A 58 -4.016 -22.646 -1.005 1.00 0.00 O ATOM 137 CB GLU A 58 -5.060 -25.250 -2.865 1.00 0.00 C ATOM 138 CG GLU A 58 -6.147 -26.067 -2.202 1.00 0.00 C ATOM 139 CD GLU A 58 -7.283 -25.212 -1.671 1.00 0.00 C ATOM 140 OE1 GLU A 58 -7.158 -23.968 -1.708 1.00 0.00 O ATOM 141 OE2 GLU A 58 -8.295 -25.785 -1.217 1.00 0.00 O ATOM 0 H GLU A 58 -3.837 -26.918 -1.452 1.00 0.00 H new ATOM 0 HA GLU A 58 -3.108 -24.466 -2.516 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -5.500 -24.343 -3.280 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -4.648 -25.816 -3.700 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -6.544 -26.786 -2.919 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -5.715 -26.640 -1.382 1.00 0.00 H new ATOM 148 N SER A 59 -5.227 -24.231 0.012 1.00 0.00 N ATOM 149 CA SER A 59 -5.724 -23.323 1.034 1.00 0.00 C ATOM 150 C SER A 59 -4.552 -22.775 1.846 1.00 0.00 C ATOM 151 O SER A 59 -4.657 -21.736 2.495 1.00 0.00 O ATOM 152 CB SER A 59 -6.714 -24.040 1.954 1.00 0.00 C ATOM 153 OG SER A 59 -6.965 -23.283 3.126 1.00 0.00 O ATOM 0 H SER A 59 -5.562 -25.191 0.095 1.00 0.00 H new ATOM 0 HA SER A 59 -6.244 -22.497 0.550 1.00 0.00 H new ATOM 0 HB2 SER A 59 -7.650 -24.212 1.422 1.00 0.00 H new ATOM 0 HB3 SER A 59 -6.318 -25.018 2.227 1.00 0.00 H new ATOM 0 HG SER A 59 -7.602 -23.763 3.695 1.00 0.00 H new ATOM 159 N ARG A 60 -3.438 -23.506 1.807 1.00 0.00 N ATOM 160 CA ARG A 60 -2.234 -23.139 2.532 1.00 0.00 C ATOM 161 C ARG A 60 -1.546 -21.933 1.930 1.00 0.00 C ATOM 162 O ARG A 60 -1.584 -20.851 2.508 1.00 0.00 O ATOM 163 CB ARG A 60 -1.257 -24.313 2.557 1.00 0.00 C ATOM 164 CG ARG A 60 -0.362 -24.332 3.787 1.00 0.00 C ATOM 165 CD ARG A 60 -0.885 -25.294 4.841 1.00 0.00 C ATOM 166 NE ARG A 60 0.197 -25.988 5.533 1.00 0.00 N ATOM 167 CZ ARG A 60 0.946 -25.434 6.483 1.00 0.00 C ATOM 168 NH1 ARG A 60 0.733 -24.178 6.857 1.00 0.00 N ATOM 169 NH2 ARG A 60 1.908 -26.138 7.062 1.00 0.00 N ATOM 0 H ARG A 60 -3.351 -24.369 1.270 1.00 0.00 H new ATOM 0 HA ARG A 60 -2.540 -22.881 3.546 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -1.820 -25.245 2.513 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -0.633 -24.275 1.664 1.00 0.00 H new ATOM 0 HG2 ARG A 60 0.649 -24.621 3.499 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -0.299 -23.329 4.208 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -1.486 -24.745 5.566 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -1.542 -26.025 4.370 1.00 0.00 H new ATOM 0 HE ARG A 60 0.390 -26.955 5.273 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -0.008 -23.633 6.416 1.00 0.00 H new ATOM 0 HH12 ARG A 60 1.310 -23.758 7.586 1.00 0.00 H new ATOM 0 HH21 ARG A 60 2.074 -27.104 6.779 1.00 0.00 H new ATOM 0 HH22 ARG A 60 2.483 -25.714 7.790 1.00 0.00 H new ATOM 183 N LEU A 61 -0.901 -22.104 0.780 1.00 0.00 N ATOM 184 CA LEU A 61 -0.204 -20.976 0.175 1.00 0.00 C ATOM 185 C LEU A 61 -1.188 -19.861 -0.140 1.00 0.00 C ATOM 186 O LEU A 61 -0.842 -18.675 -0.137 1.00 0.00 O ATOM 187 CB LEU A 61 0.576 -21.416 -1.056 1.00 0.00 C ATOM 188 CG LEU A 61 1.998 -21.881 -0.743 1.00 0.00 C ATOM 189 CD1 LEU A 61 2.831 -20.728 -0.207 1.00 0.00 C ATOM 190 CD2 LEU A 61 1.973 -23.029 0.256 1.00 0.00 C ATOM 0 H LEU A 61 -0.846 -22.982 0.263 1.00 0.00 H new ATOM 0 HA LEU A 61 0.523 -20.585 0.887 1.00 0.00 H new ATOM 0 HB2 LEU A 61 0.037 -22.226 -1.547 1.00 0.00 H new ATOM 0 HB3 LEU A 61 0.620 -20.588 -1.763 1.00 0.00 H new ATOM 0 HG LEU A 61 2.456 -22.235 -1.667 1.00 0.00 H new ATOM 0 HD11 LEU A 61 3.840 -21.078 0.010 1.00 0.00 H new ATOM 0 HD12 LEU A 61 2.875 -19.934 -0.952 1.00 0.00 H new ATOM 0 HD13 LEU A 61 2.376 -20.344 0.706 1.00 0.00 H new ATOM 0 HD21 LEU A 61 2.993 -23.349 0.468 1.00 0.00 H new ATOM 0 HD22 LEU A 61 1.497 -22.698 1.179 1.00 0.00 H new ATOM 0 HD23 LEU A 61 1.411 -23.864 -0.163 1.00 0.00 H new ATOM 202 N GLU A 62 -2.434 -20.249 -0.362 1.00 0.00 N ATOM 203 CA GLU A 62 -3.487 -19.292 -0.626 1.00 0.00 C ATOM 204 C GLU A 62 -3.737 -18.458 0.624 1.00 0.00 C ATOM 205 O GLU A 62 -3.956 -17.252 0.544 1.00 0.00 O ATOM 206 CB GLU A 62 -4.769 -20.010 -1.049 1.00 0.00 C ATOM 207 CG GLU A 62 -5.876 -19.069 -1.497 1.00 0.00 C ATOM 208 CD GLU A 62 -7.180 -19.307 -0.760 1.00 0.00 C ATOM 209 OE1 GLU A 62 -7.128 -19.731 0.414 1.00 0.00 O ATOM 210 OE2 GLU A 62 -8.251 -19.069 -1.356 1.00 0.00 O ATOM 0 H GLU A 62 -2.737 -21.223 -0.364 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.178 -18.637 -1.441 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -4.538 -20.699 -1.862 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -5.131 -20.611 -0.215 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.557 -18.039 -1.340 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -6.041 -19.192 -2.567 1.00 0.00 H new ATOM 217 N ARG A 63 -3.679 -19.108 1.787 1.00 0.00 N ATOM 218 CA ARG A 63 -3.883 -18.413 3.052 1.00 0.00 C ATOM 219 C ARG A 63 -2.588 -17.751 3.522 1.00 0.00 C ATOM 220 O ARG A 63 -2.584 -16.988 4.489 1.00 0.00 O ATOM 221 CB ARG A 63 -4.386 -19.391 4.115 1.00 0.00 C ATOM 222 CG ARG A 63 -4.831 -18.718 5.403 1.00 0.00 C ATOM 223 CD ARG A 63 -5.221 -19.739 6.460 1.00 0.00 C ATOM 224 NE ARG A 63 -4.052 -20.346 7.095 1.00 0.00 N ATOM 225 CZ ARG A 63 -4.119 -21.161 8.145 1.00 0.00 C ATOM 226 NH1 ARG A 63 -5.294 -21.470 8.680 1.00 0.00 N ATOM 227 NH2 ARG A 63 -3.010 -21.670 8.661 1.00 0.00 N ATOM 0 H ARG A 63 -3.494 -20.107 1.876 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.632 -17.636 2.899 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -5.220 -19.961 3.706 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -3.594 -20.105 4.343 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -4.026 -18.089 5.783 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -5.678 -18.063 5.199 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.836 -19.257 7.220 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -5.831 -20.518 6.003 1.00 0.00 H new ATOM 0 HE ARG A 63 -3.132 -20.132 6.711 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -6.151 -21.082 8.286 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -5.339 -22.095 9.485 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -2.104 -21.437 8.254 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -3.062 -22.295 9.466 1.00 0.00 H new ATOM 241 N LEU A 64 -1.485 -18.060 2.843 1.00 0.00 N ATOM 242 CA LEU A 64 -0.182 -17.512 3.202 1.00 0.00 C ATOM 243 C LEU A 64 0.105 -16.230 2.440 1.00 0.00 C ATOM 244 O LEU A 64 0.854 -15.370 2.904 1.00 0.00 O ATOM 245 CB LEU A 64 0.909 -18.577 2.960 1.00 0.00 C ATOM 246 CG LEU A 64 2.203 -18.125 2.250 1.00 0.00 C ATOM 247 CD1 LEU A 64 1.927 -17.684 0.815 1.00 0.00 C ATOM 248 CD2 LEU A 64 2.893 -17.017 3.035 1.00 0.00 C ATOM 0 H LEU A 64 -1.470 -18.688 2.040 1.00 0.00 H new ATOM 0 HA LEU A 64 -0.185 -17.253 4.261 1.00 0.00 H new ATOM 0 HB2 LEU A 64 1.186 -19.000 3.926 1.00 0.00 H new ATOM 0 HB3 LEU A 64 0.468 -19.383 2.374 1.00 0.00 H new ATOM 0 HG LEU A 64 2.874 -18.983 2.208 1.00 0.00 H new ATOM 0 HD11 LEU A 64 2.859 -17.372 0.344 1.00 0.00 H new ATOM 0 HD12 LEU A 64 1.498 -18.515 0.255 1.00 0.00 H new ATOM 0 HD13 LEU A 64 1.226 -16.849 0.819 1.00 0.00 H new ATOM 0 HD21 LEU A 64 3.802 -16.715 2.515 1.00 0.00 H new ATOM 0 HD22 LEU A 64 2.223 -16.161 3.122 1.00 0.00 H new ATOM 0 HD23 LEU A 64 3.148 -17.381 4.030 1.00 0.00 H new ATOM 260 N GLU A 65 -0.484 -16.111 1.269 1.00 0.00 N ATOM 261 CA GLU A 65 -0.271 -14.934 0.436 1.00 0.00 C ATOM 262 C GLU A 65 -1.536 -14.089 0.274 1.00 0.00 C ATOM 263 O GLU A 65 -1.493 -12.869 0.430 1.00 0.00 O ATOM 264 CB GLU A 65 0.255 -15.358 -0.930 1.00 0.00 C ATOM 265 CG GLU A 65 1.409 -14.503 -1.431 1.00 0.00 C ATOM 266 CD GLU A 65 2.560 -14.442 -0.446 1.00 0.00 C ATOM 267 OE1 GLU A 65 2.547 -13.549 0.426 1.00 0.00 O ATOM 268 OE2 GLU A 65 3.472 -15.288 -0.548 1.00 0.00 O ATOM 0 H GLU A 65 -1.112 -16.808 0.869 1.00 0.00 H new ATOM 0 HA GLU A 65 0.465 -14.309 0.941 1.00 0.00 H new ATOM 0 HB2 GLU A 65 0.580 -16.397 -0.878 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -0.559 -15.314 -1.653 1.00 0.00 H new ATOM 0 HG2 GLU A 65 1.768 -14.903 -2.379 1.00 0.00 H new ATOM 0 HG3 GLU A 65 1.050 -13.493 -1.627 1.00 0.00 H new ATOM 275 N GLN A 66 -2.658 -14.729 -0.055 1.00 0.00 N ATOM 276 CA GLN A 66 -3.916 -14.010 -0.253 1.00 0.00 C ATOM 277 C GLN A 66 -4.181 -13.017 0.877 1.00 0.00 C ATOM 278 O GLN A 66 -4.586 -11.882 0.630 1.00 0.00 O ATOM 279 CB GLN A 66 -5.080 -14.992 -0.373 1.00 0.00 C ATOM 280 CG GLN A 66 -6.258 -14.439 -1.149 1.00 0.00 C ATOM 281 CD GLN A 66 -7.531 -15.233 -0.927 1.00 0.00 C ATOM 282 OE1 GLN A 66 -8.379 -14.856 -0.119 1.00 0.00 O ATOM 283 NE2 GLN A 66 -7.670 -16.341 -1.646 1.00 0.00 N ATOM 0 H GLN A 66 -2.722 -15.738 -0.189 1.00 0.00 H new ATOM 0 HA GLN A 66 -3.828 -13.446 -1.181 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -4.729 -15.902 -0.860 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -5.413 -15.273 0.626 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -6.426 -13.402 -0.857 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -6.018 -14.435 -2.212 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -6.942 -16.616 -2.305 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -8.505 -16.917 -1.539 1.00 0.00 H new ATOM 292 N LEU A 67 -3.950 -13.446 2.112 1.00 0.00 N ATOM 293 CA LEU A 67 -4.167 -12.580 3.267 1.00 0.00 C ATOM 294 C LEU A 67 -2.858 -11.935 3.723 1.00 0.00 C ATOM 295 O LEU A 67 -2.729 -11.518 4.873 1.00 0.00 O ATOM 296 CB LEU A 67 -4.793 -13.367 4.420 1.00 0.00 C ATOM 297 CG LEU A 67 -3.968 -14.556 4.921 1.00 0.00 C ATOM 298 CD1 LEU A 67 -3.131 -14.157 6.129 1.00 0.00 C ATOM 299 CD2 LEU A 67 -4.881 -15.725 5.264 1.00 0.00 C ATOM 0 H LEU A 67 -3.615 -14.382 2.340 1.00 0.00 H new ATOM 0 HA LEU A 67 -4.854 -11.789 2.966 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -4.963 -12.686 5.254 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -5.770 -13.731 4.102 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.291 -14.867 4.126 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -2.552 -15.015 6.470 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -2.453 -13.349 5.852 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -3.787 -13.820 6.931 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -4.281 -16.563 5.619 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -5.581 -15.424 6.044 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -5.436 -16.026 4.375 1.00 0.00 H new ATOM 311 N PHE A 68 -1.892 -11.851 2.810 1.00 0.00 N ATOM 312 CA PHE A 68 -0.599 -11.252 3.119 1.00 0.00 C ATOM 313 C PHE A 68 -0.155 -10.321 1.995 1.00 0.00 C ATOM 314 O PHE A 68 0.410 -10.761 0.993 1.00 0.00 O ATOM 315 CB PHE A 68 0.454 -12.339 3.343 1.00 0.00 C ATOM 316 CG PHE A 68 1.646 -11.865 4.124 1.00 0.00 C ATOM 317 CD1 PHE A 68 1.555 -11.650 5.490 1.00 0.00 C ATOM 318 CD2 PHE A 68 2.857 -11.633 3.493 1.00 0.00 C ATOM 319 CE1 PHE A 68 2.649 -11.211 6.211 1.00 0.00 C ATOM 320 CE2 PHE A 68 3.955 -11.195 4.208 1.00 0.00 C ATOM 321 CZ PHE A 68 3.850 -10.984 5.570 1.00 0.00 C ATOM 0 H PHE A 68 -1.982 -12.190 1.852 1.00 0.00 H new ATOM 0 HA PHE A 68 -0.705 -10.669 4.034 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.005 -13.176 3.868 1.00 0.00 H new ATOM 0 HB3 PHE A 68 0.789 -12.715 2.376 1.00 0.00 H new ATOM 0 HD1 PHE A 68 0.618 -11.828 5.997 1.00 0.00 H new ATOM 0 HD2 PHE A 68 2.944 -11.797 2.429 1.00 0.00 H new ATOM 0 HE1 PHE A 68 2.564 -11.046 7.275 1.00 0.00 H new ATOM 0 HE2 PHE A 68 4.893 -11.018 3.704 1.00 0.00 H new ATOM 0 HZ PHE A 68 4.707 -10.642 6.132 1.00 0.00 H new ATOM 331 N LEU A 69 -0.424 -9.029 2.167 1.00 0.00 N ATOM 332 CA LEU A 69 -0.061 -8.030 1.166 1.00 0.00 C ATOM 333 C LEU A 69 0.102 -6.656 1.812 1.00 0.00 C ATOM 334 O LEU A 69 -0.428 -6.405 2.894 1.00 0.00 O ATOM 335 CB LEU A 69 -1.133 -7.975 0.070 1.00 0.00 C ATOM 336 CG LEU A 69 -0.614 -7.865 -1.368 1.00 0.00 C ATOM 337 CD1 LEU A 69 -0.168 -6.443 -1.670 1.00 0.00 C ATOM 338 CD2 LEU A 69 0.522 -8.848 -1.612 1.00 0.00 C ATOM 0 H LEU A 69 -0.892 -8.650 2.990 1.00 0.00 H new ATOM 0 HA LEU A 69 0.892 -8.315 0.719 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -1.749 -8.871 0.146 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -1.784 -7.123 0.267 1.00 0.00 H new ATOM 0 HG LEU A 69 -1.431 -8.119 -2.043 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.197 -6.386 -2.696 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.011 -5.763 -1.547 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.630 -6.159 -0.985 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.873 -8.751 -2.639 1.00 0.00 H new ATOM 0 HD22 LEU A 69 1.342 -8.634 -0.926 1.00 0.00 H new ATOM 0 HD23 LEU A 69 0.166 -9.865 -1.445 1.00 0.00 H new ATOM 350 N LEU A 70 0.835 -5.768 1.143 1.00 0.00 N ATOM 351 CA LEU A 70 1.064 -4.419 1.654 1.00 0.00 C ATOM 352 C LEU A 70 -0.248 -3.761 2.073 1.00 0.00 C ATOM 353 O LEU A 70 -0.271 -2.909 2.962 1.00 0.00 O ATOM 354 CB LEU A 70 1.758 -3.560 0.596 1.00 0.00 C ATOM 355 CG LEU A 70 3.162 -4.025 0.201 1.00 0.00 C ATOM 356 CD1 LEU A 70 3.564 -3.432 -1.140 1.00 0.00 C ATOM 357 CD2 LEU A 70 4.167 -3.645 1.279 1.00 0.00 C ATOM 0 H LEU A 70 1.280 -5.959 0.246 1.00 0.00 H new ATOM 0 HA LEU A 70 1.707 -4.498 2.531 1.00 0.00 H new ATOM 0 HB2 LEU A 70 1.135 -3.538 -0.298 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.822 -2.537 0.966 1.00 0.00 H new ATOM 0 HG LEU A 70 3.153 -5.111 0.104 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.565 -3.774 -1.404 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.858 -3.752 -1.906 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.558 -2.344 -1.073 1.00 0.00 H new ATOM 0 HD21 LEU A 70 5.161 -3.982 0.985 1.00 0.00 H new ATOM 0 HD22 LEU A 70 4.173 -2.562 1.405 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.887 -4.118 2.220 1.00 0.00 H new ATOM 369 N ILE A 71 -1.338 -4.167 1.431 1.00 0.00 N ATOM 370 CA ILE A 71 -2.657 -3.620 1.736 1.00 0.00 C ATOM 371 C ILE A 71 -3.116 -4.027 3.136 1.00 0.00 C ATOM 372 O ILE A 71 -4.071 -3.461 3.671 1.00 0.00 O ATOM 373 CB ILE A 71 -3.708 -4.084 0.709 1.00 0.00 C ATOM 374 CG1 ILE A 71 -3.201 -3.846 -0.715 1.00 0.00 C ATOM 375 CG2 ILE A 71 -5.026 -3.360 0.937 1.00 0.00 C ATOM 376 CD1 ILE A 71 -2.841 -2.403 -0.996 1.00 0.00 C ATOM 0 H ILE A 71 -1.335 -4.874 0.695 1.00 0.00 H new ATOM 0 HA ILE A 71 -2.566 -2.535 1.689 1.00 0.00 H new ATOM 0 HB ILE A 71 -3.876 -5.153 0.840 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -2.325 -4.471 -0.889 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -3.966 -4.165 -1.422 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -5.758 -3.698 0.204 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -5.391 -3.576 1.941 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -4.874 -2.286 0.830 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -2.490 -2.309 -2.024 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -3.720 -1.774 -0.854 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -2.054 -2.085 -0.313 1.00 0.00 H new ATOM 388 N PHE A 72 -2.438 -5.011 3.724 1.00 0.00 N ATOM 389 CA PHE A 72 -2.781 -5.491 5.060 1.00 0.00 C ATOM 390 C PHE A 72 -2.930 -4.329 6.042 1.00 0.00 C ATOM 391 O PHE A 72 -1.941 -3.728 6.460 1.00 0.00 O ATOM 392 CB PHE A 72 -1.708 -6.459 5.563 1.00 0.00 C ATOM 393 CG PHE A 72 -2.115 -7.222 6.791 1.00 0.00 C ATOM 394 CD1 PHE A 72 -2.048 -6.634 8.043 1.00 0.00 C ATOM 395 CD2 PHE A 72 -2.566 -8.528 6.693 1.00 0.00 C ATOM 396 CE1 PHE A 72 -2.422 -7.334 9.174 1.00 0.00 C ATOM 397 CE2 PHE A 72 -2.941 -9.234 7.820 1.00 0.00 C ATOM 398 CZ PHE A 72 -2.869 -8.635 9.064 1.00 0.00 C ATOM 0 H PHE A 72 -1.647 -5.492 3.295 1.00 0.00 H new ATOM 0 HA PHE A 72 -3.737 -6.011 4.996 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -1.467 -7.166 4.769 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -0.798 -5.899 5.778 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -1.699 -5.616 8.136 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -2.625 -9.000 5.724 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -2.365 -6.863 10.144 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -3.290 -10.252 7.729 1.00 0.00 H new ATOM 0 HZ PHE A 72 -3.162 -9.184 9.947 1.00 0.00 H new ATOM 408 N PRO A 73 -4.177 -3.994 6.426 1.00 0.00 N ATOM 409 CA PRO A 73 -4.443 -2.897 7.363 1.00 0.00 C ATOM 410 C PRO A 73 -3.985 -3.222 8.781 1.00 0.00 C ATOM 411 O PRO A 73 -4.347 -4.255 9.341 1.00 0.00 O ATOM 412 CB PRO A 73 -5.966 -2.749 7.316 1.00 0.00 C ATOM 413 CG PRO A 73 -6.464 -4.091 6.905 1.00 0.00 C ATOM 414 CD PRO A 73 -5.420 -4.654 5.981 1.00 0.00 C ATOM 0 HA PRO A 73 -3.904 -1.990 7.090 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -6.366 -2.459 8.288 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.267 -1.980 6.605 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -6.607 -4.736 7.772 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -7.428 -4.013 6.403 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -5.351 -5.739 6.066 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -5.643 -4.429 4.938 1.00 0.00 H new ATOM 422 N ARG A 74 -3.181 -2.331 9.356 1.00 0.00 N ATOM 423 CA ARG A 74 -2.671 -2.523 10.709 1.00 0.00 C ATOM 424 C ARG A 74 -1.831 -1.327 11.148 1.00 0.00 C ATOM 425 O ARG A 74 -1.916 -0.884 12.294 1.00 0.00 O ATOM 426 CB ARG A 74 -1.839 -3.806 10.786 1.00 0.00 C ATOM 427 CG ARG A 74 -2.289 -4.757 11.883 1.00 0.00 C ATOM 428 CD ARG A 74 -2.305 -4.076 13.242 1.00 0.00 C ATOM 429 NE ARG A 74 -1.780 -4.943 14.295 1.00 0.00 N ATOM 430 CZ ARG A 74 -2.454 -5.963 14.821 1.00 0.00 C ATOM 431 NH1 ARG A 74 -3.680 -6.246 14.398 1.00 0.00 N ATOM 432 NH2 ARG A 74 -1.902 -6.701 15.773 1.00 0.00 N ATOM 0 H ARG A 74 -2.870 -1.470 8.906 1.00 0.00 H new ATOM 0 HA ARG A 74 -3.523 -2.612 11.384 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -1.890 -4.321 9.827 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -0.794 -3.542 10.951 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -3.285 -5.134 11.652 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -1.622 -5.618 11.915 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -1.713 -3.162 13.196 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -3.325 -3.783 13.489 1.00 0.00 H new ATOM 0 HE ARG A 74 -0.841 -4.755 14.648 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -4.110 -5.681 13.666 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -4.192 -7.029 14.805 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -0.961 -6.487 16.103 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -2.418 -7.483 16.176 1.00 0.00 H new ATOM 446 N GLU A 75 -1.021 -0.810 10.232 1.00 0.00 N ATOM 447 CA GLU A 75 -0.166 0.335 10.526 1.00 0.00 C ATOM 448 C GLU A 75 -0.289 1.398 9.439 1.00 0.00 C ATOM 449 O GLU A 75 -0.998 1.211 8.451 1.00 0.00 O ATOM 450 CB GLU A 75 1.291 -0.110 10.659 1.00 0.00 C ATOM 451 CG GLU A 75 1.690 -0.472 12.080 1.00 0.00 C ATOM 452 CD GLU A 75 3.096 -1.032 12.167 1.00 0.00 C ATOM 453 OE1 GLU A 75 3.274 -2.234 11.884 1.00 0.00 O ATOM 454 OE2 GLU A 75 4.019 -0.267 12.516 1.00 0.00 O ATOM 0 H GLU A 75 -0.938 -1.165 9.279 1.00 0.00 H new ATOM 0 HA GLU A 75 -0.493 0.768 11.471 1.00 0.00 H new ATOM 0 HB2 GLU A 75 1.459 -0.971 10.013 1.00 0.00 H new ATOM 0 HB3 GLU A 75 1.940 0.689 10.301 1.00 0.00 H new ATOM 0 HG2 GLU A 75 1.616 0.414 12.711 1.00 0.00 H new ATOM 0 HG3 GLU A 75 0.986 -1.204 12.475 1.00 0.00 H new ATOM 461 N ASP A 76 0.405 2.515 9.630 1.00 0.00 N ATOM 462 CA ASP A 76 0.373 3.608 8.666 1.00 0.00 C ATOM 463 C ASP A 76 1.715 3.749 7.954 1.00 0.00 C ATOM 464 O ASP A 76 2.495 4.653 8.249 1.00 0.00 O ATOM 465 CB ASP A 76 0.013 4.921 9.364 1.00 0.00 C ATOM 466 CG ASP A 76 -1.454 4.995 9.737 1.00 0.00 C ATOM 467 OD1 ASP A 76 -1.859 4.306 10.696 1.00 0.00 O ATOM 468 OD2 ASP A 76 -2.200 5.742 9.068 1.00 0.00 O ATOM 0 H ASP A 76 0.996 2.687 10.443 1.00 0.00 H new ATOM 0 HA ASP A 76 -0.389 3.378 7.921 1.00 0.00 H new ATOM 0 HB2 ASP A 76 0.619 5.029 10.263 1.00 0.00 H new ATOM 0 HB3 ASP A 76 0.261 5.757 8.710 1.00 0.00 H new ATOM 473 N LEU A 77 1.977 2.846 7.014 1.00 0.00 N ATOM 474 CA LEU A 77 3.224 2.869 6.259 1.00 0.00 C ATOM 475 C LEU A 77 3.216 4.001 5.235 1.00 0.00 C ATOM 476 O LEU A 77 4.227 4.672 5.029 1.00 0.00 O ATOM 477 CB LEU A 77 3.444 1.526 5.558 1.00 0.00 C ATOM 478 CG LEU A 77 4.780 0.845 5.862 1.00 0.00 C ATOM 479 CD1 LEU A 77 5.935 1.683 5.339 1.00 0.00 C ATOM 480 CD2 LEU A 77 4.926 0.608 7.357 1.00 0.00 C ATOM 0 H LEU A 77 1.342 2.090 6.757 1.00 0.00 H new ATOM 0 HA LEU A 77 4.043 3.042 6.957 1.00 0.00 H new ATOM 0 HB2 LEU A 77 2.637 0.850 5.841 1.00 0.00 H new ATOM 0 HB3 LEU A 77 3.369 1.679 4.481 1.00 0.00 H new ATOM 0 HG LEU A 77 4.800 -0.120 5.356 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.878 1.184 5.564 1.00 0.00 H new ATOM 0 HD12 LEU A 77 5.837 1.805 4.260 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.920 2.662 5.817 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.881 0.123 7.557 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.887 1.562 7.882 1.00 0.00 H new ATOM 0 HD23 LEU A 77 4.115 -0.031 7.705 1.00 0.00 H new ATOM 492 N ASP A 78 2.067 4.207 4.602 1.00 0.00 N ATOM 493 CA ASP A 78 1.921 5.259 3.602 1.00 0.00 C ATOM 494 C ASP A 78 0.512 5.839 3.626 1.00 0.00 C ATOM 495 O ASP A 78 -0.395 5.316 2.978 1.00 0.00 O ATOM 496 CB ASP A 78 2.237 4.717 2.207 1.00 0.00 C ATOM 497 CG ASP A 78 3.700 4.349 2.045 1.00 0.00 C ATOM 498 OD1 ASP A 78 4.554 5.254 2.155 1.00 0.00 O ATOM 499 OD2 ASP A 78 3.990 3.158 1.808 1.00 0.00 O ATOM 0 H ASP A 78 1.222 3.659 4.763 1.00 0.00 H new ATOM 0 HA ASP A 78 2.627 6.053 3.843 1.00 0.00 H new ATOM 0 HB2 ASP A 78 1.621 3.839 2.014 1.00 0.00 H new ATOM 0 HB3 ASP A 78 1.969 5.465 1.461 1.00 0.00 H new ATOM 504 N MET A 79 0.334 6.920 4.377 1.00 0.00 N ATOM 505 CA MET A 79 -0.969 7.570 4.486 1.00 0.00 C ATOM 506 C MET A 79 -1.460 8.049 3.121 1.00 0.00 C ATOM 507 O MET A 79 -2.661 8.205 2.906 1.00 0.00 O ATOM 508 CB MET A 79 -0.892 8.750 5.456 1.00 0.00 C ATOM 509 CG MET A 79 0.327 9.634 5.244 1.00 0.00 C ATOM 510 SD MET A 79 0.118 11.283 5.939 1.00 0.00 S ATOM 511 CE MET A 79 1.826 11.790 6.128 1.00 0.00 C ATOM 0 H MET A 79 1.074 7.365 4.919 1.00 0.00 H new ATOM 0 HA MET A 79 -1.680 6.838 4.868 1.00 0.00 H new ATOM 0 HB2 MET A 79 -1.792 9.355 5.351 1.00 0.00 H new ATOM 0 HB3 MET A 79 -0.881 8.370 6.477 1.00 0.00 H new ATOM 0 HG2 MET A 79 1.198 9.160 5.698 1.00 0.00 H new ATOM 0 HG3 MET A 79 0.529 9.717 4.176 1.00 0.00 H new ATOM 0 HE1 MET A 79 1.863 12.795 6.549 1.00 0.00 H new ATOM 0 HE2 MET A 79 2.339 11.098 6.795 1.00 0.00 H new ATOM 0 HE3 MET A 79 2.316 11.786 5.155 1.00 0.00 H new ATOM 521 N ILE A 80 -0.525 8.283 2.204 1.00 0.00 N ATOM 522 CA ILE A 80 -0.866 8.747 0.865 1.00 0.00 C ATOM 523 C ILE A 80 -1.702 7.713 0.114 1.00 0.00 C ATOM 524 O ILE A 80 -2.800 8.010 -0.353 1.00 0.00 O ATOM 525 CB ILE A 80 0.398 9.065 0.041 1.00 0.00 C ATOM 526 CG1 ILE A 80 1.321 10.005 0.820 1.00 0.00 C ATOM 527 CG2 ILE A 80 0.019 9.679 -1.299 1.00 0.00 C ATOM 528 CD1 ILE A 80 0.654 11.297 1.239 1.00 0.00 C ATOM 0 H ILE A 80 0.474 8.158 2.365 1.00 0.00 H new ATOM 0 HA ILE A 80 -1.451 9.659 0.989 1.00 0.00 H new ATOM 0 HB ILE A 80 0.933 8.134 -0.146 1.00 0.00 H new ATOM 0 HG12 ILE A 80 1.686 9.489 1.708 1.00 0.00 H new ATOM 0 HG13 ILE A 80 2.191 10.237 0.206 1.00 0.00 H new ATOM 0 HG21 ILE A 80 0.923 9.897 -1.868 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -0.601 8.978 -1.858 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -0.537 10.602 -1.132 1.00 0.00 H new ATOM 0 HD11 ILE A 80 1.367 11.914 1.786 1.00 0.00 H new ATOM 0 HD12 ILE A 80 0.314 11.834 0.354 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -0.200 11.075 1.879 1.00 0.00 H new ATOM 540 N LEU A 81 -1.170 6.501 -0.004 1.00 0.00 N ATOM 541 CA LEU A 81 -1.867 5.425 -0.707 1.00 0.00 C ATOM 542 C LEU A 81 -2.887 4.731 0.196 1.00 0.00 C ATOM 543 O LEU A 81 -3.694 3.930 -0.274 1.00 0.00 O ATOM 544 CB LEU A 81 -0.862 4.402 -1.240 1.00 0.00 C ATOM 545 CG LEU A 81 0.226 3.975 -0.250 1.00 0.00 C ATOM 546 CD1 LEU A 81 0.199 2.468 -0.039 1.00 0.00 C ATOM 547 CD2 LEU A 81 1.595 4.421 -0.746 1.00 0.00 C ATOM 0 H LEU A 81 -0.261 6.238 0.376 1.00 0.00 H new ATOM 0 HA LEU A 81 -2.406 5.872 -1.542 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -1.407 3.514 -1.560 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -0.381 4.817 -2.126 1.00 0.00 H new ATOM 0 HG LEU A 81 0.030 4.456 0.708 1.00 0.00 H new ATOM 0 HD11 LEU A 81 0.980 2.185 0.667 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.773 2.173 0.357 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.371 1.964 -0.990 1.00 0.00 H new ATOM 0 HD21 LEU A 81 2.359 4.111 -0.033 1.00 0.00 H new ATOM 0 HD22 LEU A 81 1.797 3.965 -1.715 1.00 0.00 H new ATOM 0 HD23 LEU A 81 1.610 5.506 -0.845 1.00 0.00 H new ATOM 559 N LYS A 82 -2.845 5.034 1.490 1.00 0.00 N ATOM 560 CA LYS A 82 -3.765 4.426 2.447 1.00 0.00 C ATOM 561 C LYS A 82 -5.059 5.230 2.559 1.00 0.00 C ATOM 562 O LYS A 82 -6.110 4.681 2.888 1.00 0.00 O ATOM 563 CB LYS A 82 -3.102 4.316 3.821 1.00 0.00 C ATOM 564 CG LYS A 82 -2.187 3.112 3.960 1.00 0.00 C ATOM 565 CD LYS A 82 -2.977 1.817 4.043 1.00 0.00 C ATOM 566 CE LYS A 82 -3.425 1.528 5.467 1.00 0.00 C ATOM 567 NZ LYS A 82 -3.600 0.070 5.709 1.00 0.00 N ATOM 0 H LYS A 82 -2.185 5.695 1.900 1.00 0.00 H new ATOM 0 HA LYS A 82 -4.013 3.428 2.085 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -2.527 5.222 4.011 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -3.877 4.263 4.586 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -1.507 3.070 3.109 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -1.573 3.222 4.854 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -3.849 1.879 3.392 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -2.365 0.992 3.679 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -2.690 1.926 6.167 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -4.365 2.044 5.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.426 -0.084 6.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -3.746 -0.417 4.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -2.750 -0.309 6.173 1.00 0.00 H new ATOM 581 N MET A 83 -4.977 6.530 2.290 1.00 0.00 N ATOM 582 CA MET A 83 -6.145 7.398 2.373 1.00 0.00 C ATOM 583 C MET A 83 -6.559 7.916 0.994 1.00 0.00 C ATOM 584 O MET A 83 -7.674 8.409 0.817 1.00 0.00 O ATOM 585 CB MET A 83 -5.863 8.563 3.328 1.00 0.00 C ATOM 586 CG MET A 83 -5.062 9.706 2.715 1.00 0.00 C ATOM 587 SD MET A 83 -5.935 11.283 2.780 1.00 0.00 S ATOM 588 CE MET A 83 -4.980 12.148 4.025 1.00 0.00 C ATOM 0 H MET A 83 -4.117 7.003 2.014 1.00 0.00 H new ATOM 0 HA MET A 83 -6.977 6.812 2.763 1.00 0.00 H new ATOM 0 HB2 MET A 83 -6.813 8.956 3.691 1.00 0.00 H new ATOM 0 HB3 MET A 83 -5.323 8.182 4.195 1.00 0.00 H new ATOM 0 HG2 MET A 83 -4.111 9.800 3.240 1.00 0.00 H new ATOM 0 HG3 MET A 83 -4.831 9.466 1.677 1.00 0.00 H new ATOM 0 HE1 MET A 83 -5.625 12.847 4.557 1.00 0.00 H new ATOM 0 HE2 MET A 83 -4.565 11.428 4.730 1.00 0.00 H new ATOM 0 HE3 MET A 83 -4.169 12.696 3.546 1.00 0.00 H new ATOM 598 N ASP A 84 -5.658 7.803 0.019 1.00 0.00 N ATOM 599 CA ASP A 84 -5.934 8.259 -1.340 1.00 0.00 C ATOM 600 C ASP A 84 -5.984 9.783 -1.407 1.00 0.00 C ATOM 601 O ASP A 84 -5.135 10.414 -2.035 1.00 0.00 O ATOM 602 CB ASP A 84 -7.254 7.670 -1.847 1.00 0.00 C ATOM 603 CG ASP A 84 -7.189 7.280 -3.310 1.00 0.00 C ATOM 604 OD1 ASP A 84 -6.449 7.942 -4.068 1.00 0.00 O ATOM 605 OD2 ASP A 84 -7.876 6.312 -3.697 1.00 0.00 O ATOM 0 H ASP A 84 -4.730 7.399 0.146 1.00 0.00 H new ATOM 0 HA ASP A 84 -5.123 7.912 -1.980 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -7.510 6.794 -1.251 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -8.052 8.398 -1.703 1.00 0.00 H new ATOM 610 N SER A 85 -6.985 10.367 -0.753 1.00 0.00 N ATOM 611 CA SER A 85 -7.148 11.819 -0.739 1.00 0.00 C ATOM 612 C SER A 85 -7.491 12.348 -2.126 1.00 0.00 C ATOM 613 O SER A 85 -7.757 11.577 -3.049 1.00 0.00 O ATOM 614 CB SER A 85 -5.873 12.495 -0.226 1.00 0.00 C ATOM 615 OG SER A 85 -6.175 13.521 0.703 1.00 0.00 O ATOM 0 H SER A 85 -7.695 9.858 -0.226 1.00 0.00 H new ATOM 0 HA SER A 85 -7.973 12.055 -0.067 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.229 11.752 0.245 1.00 0.00 H new ATOM 0 HB3 SER A 85 -5.317 12.913 -1.065 1.00 0.00 H new ATOM 0 HG SER A 85 -6.038 13.188 1.614 1.00 0.00 H new ATOM 621 N LEU A 86 -7.485 13.670 -2.264 1.00 0.00 N ATOM 622 CA LEU A 86 -7.794 14.310 -3.535 1.00 0.00 C ATOM 623 C LEU A 86 -7.433 15.791 -3.497 1.00 0.00 C ATOM 624 O LEU A 86 -6.862 16.328 -4.446 1.00 0.00 O ATOM 625 CB LEU A 86 -9.278 14.145 -3.871 1.00 0.00 C ATOM 626 CG LEU A 86 -9.595 14.021 -5.363 1.00 0.00 C ATOM 627 CD1 LEU A 86 -9.804 12.566 -5.747 1.00 0.00 C ATOM 628 CD2 LEU A 86 -10.820 14.850 -5.720 1.00 0.00 C ATOM 0 H LEU A 86 -7.269 14.320 -1.508 1.00 0.00 H new ATOM 0 HA LEU A 86 -7.199 13.826 -4.310 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -9.654 13.258 -3.360 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -9.823 14.999 -3.469 1.00 0.00 H new ATOM 0 HG LEU A 86 -8.745 14.405 -5.927 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -10.028 12.499 -6.812 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -8.899 11.999 -5.531 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -10.635 12.154 -5.175 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -11.030 14.749 -6.785 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -11.677 14.498 -5.146 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -10.632 15.898 -5.485 1.00 0.00 H new ATOM 640 N ARG A 87 -7.772 16.448 -2.390 1.00 0.00 N ATOM 641 CA ARG A 87 -7.483 17.868 -2.226 1.00 0.00 C ATOM 642 C ARG A 87 -6.362 18.079 -1.220 1.00 0.00 C ATOM 643 O ARG A 87 -5.276 18.500 -1.596 1.00 0.00 O ATOM 644 CB ARG A 87 -8.739 18.628 -1.788 1.00 0.00 C ATOM 645 CG ARG A 87 -10.035 18.031 -2.317 1.00 0.00 C ATOM 646 CD ARG A 87 -11.246 18.818 -1.844 1.00 0.00 C ATOM 647 NE ARG A 87 -12.500 18.159 -2.202 1.00 0.00 N ATOM 648 CZ ARG A 87 -13.703 18.631 -1.880 1.00 0.00 C ATOM 649 NH1 ARG A 87 -13.820 19.760 -1.194 1.00 0.00 N ATOM 650 NH2 ARG A 87 -14.793 17.968 -2.245 1.00 0.00 N ATOM 0 H ARG A 87 -8.246 16.019 -1.595 1.00 0.00 H new ATOM 0 HA ARG A 87 -7.159 18.259 -3.190 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -8.778 18.649 -0.699 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -8.662 19.662 -2.125 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -10.012 18.017 -3.407 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -10.121 16.996 -1.987 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -11.198 18.943 -0.762 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -11.223 19.816 -2.281 1.00 0.00 H new ATOM 0 HE ARG A 87 -12.451 17.287 -2.729 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -12.985 20.273 -0.910 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -14.745 20.116 -0.951 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -14.709 17.098 -2.771 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -15.715 18.328 -1.999 1.00 0.00 H new ATOM 664 N ASP A 88 -6.645 17.772 0.051 1.00 0.00 N ATOM 665 CA ASP A 88 -5.683 17.902 1.161 1.00 0.00 C ATOM 666 C ASP A 88 -4.533 18.878 0.875 1.00 0.00 C ATOM 667 O ASP A 88 -4.355 19.865 1.592 1.00 0.00 O ATOM 668 CB ASP A 88 -5.109 16.525 1.510 1.00 0.00 C ATOM 669 CG ASP A 88 -5.732 15.942 2.763 1.00 0.00 C ATOM 670 OD1 ASP A 88 -6.143 16.728 3.644 1.00 0.00 O ATOM 671 OD2 ASP A 88 -5.811 14.700 2.863 1.00 0.00 O ATOM 0 H ASP A 88 -7.557 17.422 0.345 1.00 0.00 H new ATOM 0 HA ASP A 88 -6.240 18.317 2.001 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -5.272 15.844 0.675 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -4.031 16.608 1.648 1.00 0.00 H new ATOM 676 N ILE A 89 -3.767 18.600 -0.173 1.00 0.00 N ATOM 677 CA ILE A 89 -2.645 19.448 -0.557 1.00 0.00 C ATOM 678 C ILE A 89 -3.145 20.591 -1.412 1.00 0.00 C ATOM 679 O ILE A 89 -2.998 21.761 -1.061 1.00 0.00 O ATOM 680 CB ILE A 89 -1.575 18.662 -1.337 1.00 0.00 C ATOM 681 CG1 ILE A 89 -1.255 17.347 -0.630 1.00 0.00 C ATOM 682 CG2 ILE A 89 -0.315 19.502 -1.507 1.00 0.00 C ATOM 683 CD1 ILE A 89 -0.622 17.542 0.725 1.00 0.00 C ATOM 0 H ILE A 89 -3.904 17.788 -0.776 1.00 0.00 H new ATOM 0 HA ILE A 89 -2.187 19.828 0.356 1.00 0.00 H new ATOM 0 HB ILE A 89 -1.969 18.431 -2.327 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -2.173 16.770 -0.516 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -0.584 16.759 -1.256 1.00 0.00 H new ATOM 0 HG21 ILE A 89 0.431 18.931 -2.060 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -0.556 20.412 -2.056 1.00 0.00 H new ATOM 0 HG23 ILE A 89 0.083 19.764 -0.527 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -0.419 16.570 1.175 1.00 0.00 H new ATOM 0 HD12 ILE A 89 0.312 18.093 0.614 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -1.301 18.104 1.366 1.00 0.00 H new ATOM 695 N GLU A 90 -3.781 20.236 -2.519 1.00 0.00 N ATOM 696 CA GLU A 90 -4.356 21.222 -3.409 1.00 0.00 C ATOM 697 C GLU A 90 -5.504 21.936 -2.699 1.00 0.00 C ATOM 698 O GLU A 90 -5.982 22.967 -3.161 1.00 0.00 O ATOM 699 CB GLU A 90 -4.857 20.560 -4.693 1.00 0.00 C ATOM 700 CG GLU A 90 -5.362 21.549 -5.731 1.00 0.00 C ATOM 701 CD GLU A 90 -6.873 21.545 -5.855 1.00 0.00 C ATOM 702 OE1 GLU A 90 -7.446 20.463 -6.101 1.00 0.00 O ATOM 703 OE2 GLU A 90 -7.484 22.624 -5.705 1.00 0.00 O ATOM 0 H GLU A 90 -3.910 19.270 -2.819 1.00 0.00 H new ATOM 0 HA GLU A 90 -3.590 21.949 -3.679 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -4.049 19.971 -5.127 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -5.660 19.866 -4.444 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -5.026 22.551 -5.466 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -4.921 21.311 -6.699 1.00 0.00 H new ATOM 710 N ALA A 91 -5.926 21.387 -1.554 1.00 0.00 N ATOM 711 CA ALA A 91 -7.000 21.986 -0.770 1.00 0.00 C ATOM 712 C ALA A 91 -6.432 23.022 0.186 1.00 0.00 C ATOM 713 O ALA A 91 -6.807 24.193 0.152 1.00 0.00 O ATOM 714 CB ALA A 91 -7.768 20.920 -0.002 1.00 0.00 C ATOM 0 H ALA A 91 -5.539 20.532 -1.155 1.00 0.00 H new ATOM 0 HA ALA A 91 -7.693 22.478 -1.452 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -8.564 21.390 0.575 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -8.201 20.207 -0.704 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -7.090 20.398 0.673 1.00 0.00 H new ATOM 720 N LEU A 92 -5.502 22.587 1.029 1.00 0.00 N ATOM 721 CA LEU A 92 -4.865 23.490 1.977 1.00 0.00 C ATOM 722 C LEU A 92 -4.149 24.610 1.226 1.00 0.00 C ATOM 723 O LEU A 92 -3.887 25.678 1.782 1.00 0.00 O ATOM 724 CB LEU A 92 -3.874 22.732 2.864 1.00 0.00 C ATOM 725 CG LEU A 92 -3.988 23.029 4.360 1.00 0.00 C ATOM 726 CD1 LEU A 92 -3.818 24.517 4.623 1.00 0.00 C ATOM 727 CD2 LEU A 92 -5.324 22.539 4.899 1.00 0.00 C ATOM 0 H LEU A 92 -5.175 21.622 1.075 1.00 0.00 H new ATOM 0 HA LEU A 92 -5.635 23.923 2.616 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -4.016 21.662 2.709 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -2.862 22.970 2.538 1.00 0.00 H new ATOM 0 HG LEU A 92 -3.191 22.496 4.879 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -3.902 24.709 5.693 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -2.837 24.839 4.273 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -4.593 25.071 4.093 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -5.389 22.758 5.965 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -6.135 23.044 4.375 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -5.406 21.463 4.744 1.00 0.00 H new ATOM 739 N LEU A 93 -3.843 24.358 -0.047 1.00 0.00 N ATOM 740 CA LEU A 93 -3.166 25.340 -0.880 1.00 0.00 C ATOM 741 C LEU A 93 -4.173 26.178 -1.662 1.00 0.00 C ATOM 742 O LEU A 93 -3.960 27.372 -1.872 1.00 0.00 O ATOM 743 CB LEU A 93 -2.197 24.647 -1.838 1.00 0.00 C ATOM 744 CG LEU A 93 -0.792 24.420 -1.278 1.00 0.00 C ATOM 745 CD1 LEU A 93 -0.144 23.212 -1.935 1.00 0.00 C ATOM 746 CD2 LEU A 93 0.067 25.662 -1.472 1.00 0.00 C ATOM 0 H LEU A 93 -4.055 23.480 -0.520 1.00 0.00 H new ATOM 0 HA LEU A 93 -2.601 26.006 -0.228 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -2.619 23.683 -2.124 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -2.118 25.243 -2.747 1.00 0.00 H new ATOM 0 HG LEU A 93 -0.875 24.224 -0.209 1.00 0.00 H new ATOM 0 HD11 LEU A 93 0.855 23.066 -1.524 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -0.748 22.325 -1.743 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -0.073 23.377 -3.010 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.063 25.482 -1.068 1.00 0.00 H new ATOM 0 HD22 LEU A 93 0.143 25.890 -2.535 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -0.389 26.505 -0.952 1.00 0.00 H new ATOM 758 N THR A 94 -5.275 25.567 -2.087 1.00 0.00 N ATOM 759 CA THR A 94 -6.289 26.311 -2.829 1.00 0.00 C ATOM 760 C THR A 94 -7.102 27.200 -1.888 1.00 0.00 C ATOM 761 O THR A 94 -7.851 28.069 -2.335 1.00 0.00 O ATOM 762 CB THR A 94 -7.216 25.375 -3.607 1.00 0.00 C ATOM 763 OG1 THR A 94 -8.023 26.111 -4.509 1.00 0.00 O ATOM 764 CG2 THR A 94 -8.137 24.574 -2.722 1.00 0.00 C ATOM 0 H THR A 94 -5.487 24.581 -1.935 1.00 0.00 H new ATOM 0 HA THR A 94 -5.770 26.943 -3.549 1.00 0.00 H new ATOM 0 HB THR A 94 -6.556 24.686 -4.134 1.00 0.00 H new ATOM 0 HG1 THR A 94 -8.267 26.970 -4.104 1.00 0.00 H new ATOM 0 HG21 THR A 94 -8.766 23.932 -3.338 1.00 0.00 H new ATOM 0 HG22 THR A 94 -7.546 23.959 -2.043 1.00 0.00 H new ATOM 0 HG23 THR A 94 -8.766 25.251 -2.144 1.00 0.00 H new ATOM 772 N GLY A 95 -6.952 26.978 -0.581 1.00 0.00 N ATOM 773 CA GLY A 95 -7.681 27.768 0.394 1.00 0.00 C ATOM 774 C GLY A 95 -6.774 28.550 1.330 1.00 0.00 C ATOM 775 O GLY A 95 -7.154 29.612 1.820 1.00 0.00 O ATOM 0 H GLY A 95 -6.339 26.266 -0.184 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -8.338 28.463 -0.129 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -8.318 27.108 0.983 1.00 0.00 H new ATOM 779 N LEU A 96 -5.577 28.026 1.590 1.00 0.00 N ATOM 780 CA LEU A 96 -4.635 28.695 2.488 1.00 0.00 C ATOM 781 C LEU A 96 -3.334 29.072 1.783 1.00 0.00 C ATOM 782 O LEU A 96 -2.420 29.616 2.401 1.00 0.00 O ATOM 783 CB LEU A 96 -4.327 27.804 3.688 1.00 0.00 C ATOM 784 CG LEU A 96 -4.089 28.549 5.004 1.00 0.00 C ATOM 785 CD1 LEU A 96 -4.592 27.727 6.182 1.00 0.00 C ATOM 786 CD2 LEU A 96 -2.612 28.874 5.172 1.00 0.00 C ATOM 0 H LEU A 96 -5.238 27.148 1.196 1.00 0.00 H new ATOM 0 HA LEU A 96 -5.111 29.617 2.823 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -5.155 27.108 3.827 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -3.444 27.207 3.461 1.00 0.00 H new ATOM 0 HG LEU A 96 -4.647 29.485 4.976 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -4.414 28.273 7.109 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -5.660 27.544 6.068 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -4.062 26.775 6.214 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -2.461 29.404 6.113 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -2.035 27.950 5.179 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -2.281 29.502 4.345 1.00 0.00 H new ATOM 798 N PHE A 97 -3.270 28.788 0.491 1.00 0.00 N ATOM 799 CA PHE A 97 -2.098 29.092 -0.328 1.00 0.00 C ATOM 800 C PHE A 97 -0.785 28.870 0.435 1.00 0.00 C ATOM 801 O PHE A 97 -0.256 27.759 0.455 1.00 0.00 O ATOM 802 CB PHE A 97 -2.185 30.526 -0.873 1.00 0.00 C ATOM 803 CG PHE A 97 -2.973 31.473 -0.003 1.00 0.00 C ATOM 804 CD1 PHE A 97 -4.348 31.337 0.123 1.00 0.00 C ATOM 805 CD2 PHE A 97 -2.342 32.499 0.683 1.00 0.00 C ATOM 806 CE1 PHE A 97 -5.075 32.205 0.916 1.00 0.00 C ATOM 807 CE2 PHE A 97 -3.064 33.368 1.477 1.00 0.00 C ATOM 808 CZ PHE A 97 -4.432 33.221 1.595 1.00 0.00 C ATOM 0 H PHE A 97 -4.028 28.340 -0.023 1.00 0.00 H new ATOM 0 HA PHE A 97 -2.095 28.398 -1.168 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -1.175 30.918 -0.995 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -2.638 30.499 -1.864 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -4.856 30.544 -0.405 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -1.272 32.620 0.595 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -6.145 32.089 1.004 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -2.559 34.163 2.006 1.00 0.00 H new ATOM 0 HZ PHE A 97 -4.998 33.899 2.217 1.00 0.00 H new ATOM 818 N VAL A 98 -0.266 29.924 1.058 1.00 0.00 N ATOM 819 CA VAL A 98 0.978 29.832 1.814 1.00 0.00 C ATOM 820 C VAL A 98 0.755 29.161 3.165 1.00 0.00 C ATOM 821 O VAL A 98 -0.232 29.433 3.848 1.00 0.00 O ATOM 822 CB VAL A 98 1.597 31.223 2.043 1.00 0.00 C ATOM 823 CG1 VAL A 98 2.992 31.097 2.638 1.00 0.00 C ATOM 824 CG2 VAL A 98 1.635 32.014 0.744 1.00 0.00 C ATOM 0 H VAL A 98 -0.688 30.852 1.054 1.00 0.00 H new ATOM 0 HA VAL A 98 1.664 29.227 1.221 1.00 0.00 H new ATOM 0 HB VAL A 98 0.971 31.764 2.753 1.00 0.00 H new ATOM 0 HG11 VAL A 98 3.413 32.091 2.792 1.00 0.00 H new ATOM 0 HG12 VAL A 98 2.934 30.575 3.593 1.00 0.00 H new ATOM 0 HG13 VAL A 98 3.629 30.535 1.955 1.00 0.00 H new ATOM 0 HG21 VAL A 98 2.076 32.994 0.927 1.00 0.00 H new ATOM 0 HG22 VAL A 98 2.235 31.478 0.009 1.00 0.00 H new ATOM 0 HG23 VAL A 98 0.621 32.138 0.364 1.00 0.00 H new ATOM 834 N GLN A 99 1.680 28.287 3.545 1.00 0.00 N ATOM 835 CA GLN A 99 1.590 27.580 4.819 1.00 0.00 C ATOM 836 C GLN A 99 2.863 27.776 5.635 1.00 0.00 C ATOM 837 O GLN A 99 3.897 28.176 5.101 1.00 0.00 O ATOM 838 CB GLN A 99 1.344 26.088 4.583 1.00 0.00 C ATOM 839 CG GLN A 99 -0.123 25.735 4.394 1.00 0.00 C ATOM 840 CD GLN A 99 -0.318 24.476 3.576 1.00 0.00 C ATOM 841 OE1 GLN A 99 -0.186 23.362 4.084 1.00 0.00 O ATOM 842 NE2 GLN A 99 -0.638 24.644 2.297 1.00 0.00 N ATOM 0 H GLN A 99 2.502 28.050 2.989 1.00 0.00 H new ATOM 0 HA GLN A 99 0.751 27.993 5.380 1.00 0.00 H new ATOM 0 HB2 GLN A 99 1.902 25.771 3.702 1.00 0.00 H new ATOM 0 HB3 GLN A 99 1.738 25.525 5.429 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -0.590 25.606 5.370 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -0.632 26.565 3.904 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -0.738 25.585 1.916 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -0.784 23.832 1.697 1.00 0.00 H new ATOM 851 N ASP A 100 2.781 27.493 6.931 1.00 0.00 N ATOM 852 CA ASP A 100 3.931 27.642 7.817 1.00 0.00 C ATOM 853 C ASP A 100 4.419 26.283 8.307 1.00 0.00 C ATOM 854 O ASP A 100 3.702 25.570 9.009 1.00 0.00 O ATOM 855 CB ASP A 100 3.571 28.530 9.009 1.00 0.00 C ATOM 856 CG ASP A 100 3.946 29.981 8.782 1.00 0.00 C ATOM 857 OD1 ASP A 100 3.430 30.584 7.816 1.00 0.00 O ATOM 858 OD2 ASP A 100 4.757 30.515 9.568 1.00 0.00 O ATOM 0 H ASP A 100 1.933 27.160 7.390 1.00 0.00 H new ATOM 0 HA ASP A 100 4.735 28.114 7.253 1.00 0.00 H new ATOM 0 HB2 ASP A 100 2.500 28.460 9.201 1.00 0.00 H new ATOM 0 HB3 ASP A 100 4.079 28.161 9.900 1.00 0.00 H new ATOM 863 N ASN A 101 5.643 25.930 7.930 1.00 0.00 N ATOM 864 CA ASN A 101 6.228 24.654 8.330 1.00 0.00 C ATOM 865 C ASN A 101 7.688 24.826 8.737 1.00 0.00 C ATOM 866 O ASN A 101 8.324 25.826 8.401 1.00 0.00 O ATOM 867 CB ASN A 101 6.120 23.643 7.189 1.00 0.00 C ATOM 868 CG ASN A 101 4.763 22.969 7.141 1.00 0.00 C ATOM 869 OD1 ASN A 101 3.745 23.571 7.484 1.00 0.00 O ATOM 870 ND2 ASN A 101 4.741 21.710 6.715 1.00 0.00 N ATOM 0 H ASN A 101 6.249 26.508 7.349 1.00 0.00 H new ATOM 0 HA ASN A 101 5.673 24.282 9.191 1.00 0.00 H new ATOM 0 HB2 ASN A 101 6.306 24.148 6.241 1.00 0.00 H new ATOM 0 HB3 ASN A 101 6.895 22.885 7.304 1.00 0.00 H new ATOM 0 HD21 ASN A 101 3.856 21.205 6.663 1.00 0.00 H new ATOM 0 HD22 ASN A 101 5.609 21.249 6.440 1.00 0.00 H new ATOM 877 N VAL A 102 8.213 23.843 9.463 1.00 0.00 N ATOM 878 CA VAL A 102 9.597 23.882 9.917 1.00 0.00 C ATOM 879 C VAL A 102 10.036 22.522 10.450 1.00 0.00 C ATOM 880 O VAL A 102 9.211 21.715 10.878 1.00 0.00 O ATOM 881 CB VAL A 102 9.798 24.948 11.015 1.00 0.00 C ATOM 882 CG1 VAL A 102 8.934 24.640 12.228 1.00 0.00 C ATOM 883 CG2 VAL A 102 11.266 25.045 11.406 1.00 0.00 C ATOM 0 H VAL A 102 7.699 23.010 9.749 1.00 0.00 H new ATOM 0 HA VAL A 102 10.209 24.144 9.054 1.00 0.00 H new ATOM 0 HB VAL A 102 9.488 25.914 10.616 1.00 0.00 H new ATOM 0 HG11 VAL A 102 9.091 25.404 12.990 1.00 0.00 H new ATOM 0 HG12 VAL A 102 7.884 24.631 11.934 1.00 0.00 H new ATOM 0 HG13 VAL A 102 9.207 23.664 12.631 1.00 0.00 H new ATOM 0 HG21 VAL A 102 11.387 25.802 12.181 1.00 0.00 H new ATOM 0 HG22 VAL A 102 11.606 24.081 11.784 1.00 0.00 H new ATOM 0 HG23 VAL A 102 11.857 25.322 10.533 1.00 0.00 H new ATOM 893 N ASN A 103 11.342 22.273 10.423 1.00 0.00 N ATOM 894 CA ASN A 103 11.889 21.009 10.902 1.00 0.00 C ATOM 895 C ASN A 103 12.495 21.170 12.294 1.00 0.00 C ATOM 896 O ASN A 103 12.807 22.282 12.720 1.00 0.00 O ATOM 897 CB ASN A 103 12.950 20.485 9.932 1.00 0.00 C ATOM 898 CG ASN A 103 14.071 21.481 9.710 1.00 0.00 C ATOM 899 OD1 ASN A 103 15.072 21.476 10.427 1.00 0.00 O ATOM 900 ND2 ASN A 103 13.910 22.343 8.713 1.00 0.00 N ATOM 0 H ASN A 103 12.040 22.930 10.075 1.00 0.00 H new ATOM 0 HA ASN A 103 11.072 20.290 10.960 1.00 0.00 H new ATOM 0 HB2 ASN A 103 13.365 19.555 10.320 1.00 0.00 H new ATOM 0 HB3 ASN A 103 12.481 20.251 8.976 1.00 0.00 H new ATOM 0 HD21 ASN A 103 14.632 23.036 8.517 1.00 0.00 H new ATOM 0 HD22 ASN A 103 13.064 22.312 8.143 1.00 0.00 H new ATOM 907 N LYS A 104 12.658 20.054 12.997 1.00 0.00 N ATOM 908 CA LYS A 104 13.230 20.065 14.341 1.00 0.00 C ATOM 909 C LYS A 104 12.545 21.109 15.221 1.00 0.00 C ATOM 910 O LYS A 104 11.571 21.738 14.812 1.00 0.00 O ATOM 911 CB LYS A 104 14.734 20.344 14.274 1.00 0.00 C ATOM 912 CG LYS A 104 15.551 19.505 15.242 1.00 0.00 C ATOM 913 CD LYS A 104 16.950 19.243 14.706 1.00 0.00 C ATOM 914 CE LYS A 104 17.534 17.961 15.278 1.00 0.00 C ATOM 915 NZ LYS A 104 17.027 16.755 14.567 1.00 0.00 N ATOM 0 H LYS A 104 12.401 19.127 12.658 1.00 0.00 H new ATOM 0 HA LYS A 104 13.067 19.083 14.785 1.00 0.00 H new ATOM 0 HB2 LYS A 104 15.085 20.158 13.259 1.00 0.00 H new ATOM 0 HB3 LYS A 104 14.909 21.399 14.483 1.00 0.00 H new ATOM 0 HG2 LYS A 104 15.618 20.016 16.202 1.00 0.00 H new ATOM 0 HG3 LYS A 104 15.045 18.556 15.420 1.00 0.00 H new ATOM 0 HD2 LYS A 104 16.918 19.176 13.619 1.00 0.00 H new ATOM 0 HD3 LYS A 104 17.599 20.083 14.954 1.00 0.00 H new ATOM 0 HE2 LYS A 104 18.621 17.994 15.207 1.00 0.00 H new ATOM 0 HE3 LYS A 104 17.286 17.890 16.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 17.449 15.902 14.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 15.992 16.709 14.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 17.286 16.810 13.561 1.00 0.00 H new ATOM 929 N ASP A 105 13.065 21.286 16.432 1.00 0.00 N ATOM 930 CA ASP A 105 12.506 22.252 17.371 1.00 0.00 C ATOM 931 C ASP A 105 13.324 22.297 18.658 1.00 0.00 C ATOM 932 O ASP A 105 14.349 21.627 18.777 1.00 0.00 O ATOM 933 CB ASP A 105 11.048 21.906 17.686 1.00 0.00 C ATOM 934 CG ASP A 105 10.095 23.027 17.321 1.00 0.00 C ATOM 935 OD1 ASP A 105 10.536 24.195 17.290 1.00 0.00 O ATOM 936 OD2 ASP A 105 8.907 22.737 17.064 1.00 0.00 O ATOM 0 H ASP A 105 13.873 20.773 16.786 1.00 0.00 H new ATOM 0 HA ASP A 105 12.544 23.237 16.906 1.00 0.00 H new ATOM 0 HB2 ASP A 105 10.767 21.003 17.144 1.00 0.00 H new ATOM 0 HB3 ASP A 105 10.952 21.683 18.749 1.00 0.00 H new ATOM 941 N ALA A 106 12.863 23.092 19.619 1.00 0.00 N ATOM 942 CA ALA A 106 13.551 23.223 20.897 1.00 0.00 C ATOM 943 C ALA A 106 12.557 23.278 22.051 1.00 0.00 C ATOM 944 O ALA A 106 12.026 24.375 22.324 1.00 0.00 O ATOM 945 CB ALA A 106 14.431 24.464 20.897 1.00 0.00 C ATOM 946 OXT ALA A 106 12.317 22.222 22.675 1.00 0.00 O ATOM 0 H ALA A 106 12.016 23.655 19.536 1.00 0.00 H new ATOM 0 HA ALA A 106 14.181 22.344 21.035 1.00 0.00 H new ATOM 0 HB1 ALA A 106 14.939 24.550 21.858 1.00 0.00 H new ATOM 0 HB2 ALA A 106 15.171 24.385 20.101 1.00 0.00 H new ATOM 0 HB3 ALA A 106 13.814 25.347 20.733 1.00 0.00 H new TER 952 ALA A 106 ATOM 953 N THR B 50 0.526 -31.778 4.466 1.00 0.00 N ATOM 954 CA THR B 50 1.205 -31.913 5.781 1.00 0.00 C ATOM 955 C THR B 50 2.565 -31.219 5.768 1.00 0.00 C ATOM 956 O THR B 50 2.824 -30.352 4.934 1.00 0.00 O ATOM 957 CB THR B 50 1.363 -33.402 6.094 1.00 0.00 C ATOM 958 OG1 THR B 50 1.864 -33.586 7.406 1.00 0.00 O ATOM 959 CG2 THR B 50 2.296 -34.121 5.143 1.00 0.00 C ATOM 0 HA THR B 50 0.603 -31.433 6.553 1.00 0.00 H new ATOM 0 HB THR B 50 0.365 -33.826 5.986 1.00 0.00 H new ATOM 0 HG1 THR B 50 1.554 -32.855 7.980 1.00 0.00 H new ATOM 0 HG21 THR B 50 2.362 -35.172 5.423 1.00 0.00 H new ATOM 0 HG22 THR B 50 1.912 -34.040 4.126 1.00 0.00 H new ATOM 0 HG23 THR B 50 3.287 -33.669 5.194 1.00 0.00 H new ATOM 969 N ARG B 51 3.434 -31.603 6.703 1.00 0.00 N ATOM 970 CA ARG B 51 4.767 -31.016 6.800 1.00 0.00 C ATOM 971 C ARG B 51 5.507 -31.100 5.468 1.00 0.00 C ATOM 972 O ARG B 51 5.938 -30.084 4.921 1.00 0.00 O ATOM 973 CB ARG B 51 5.577 -31.719 7.891 1.00 0.00 C ATOM 974 CG ARG B 51 6.654 -30.843 8.509 1.00 0.00 C ATOM 975 CD ARG B 51 7.303 -31.520 9.706 1.00 0.00 C ATOM 976 NE ARG B 51 7.911 -32.800 9.347 1.00 0.00 N ATOM 977 CZ ARG B 51 9.097 -32.916 8.752 1.00 0.00 C ATOM 978 NH1 ARG B 51 9.802 -31.837 8.444 1.00 0.00 N ATOM 979 NH2 ARG B 51 9.576 -34.119 8.462 1.00 0.00 N ATOM 0 H ARG B 51 3.237 -32.318 7.403 1.00 0.00 H new ATOM 0 HA ARG B 51 4.651 -29.964 7.060 1.00 0.00 H new ATOM 0 HB2 ARG B 51 4.899 -32.055 8.676 1.00 0.00 H new ATOM 0 HB3 ARG B 51 6.043 -32.610 7.469 1.00 0.00 H new ATOM 0 HG2 ARG B 51 7.414 -30.617 7.761 1.00 0.00 H new ATOM 0 HG3 ARG B 51 6.219 -29.893 8.819 1.00 0.00 H new ATOM 0 HD2 ARG B 51 8.064 -30.862 10.126 1.00 0.00 H new ATOM 0 HD3 ARG B 51 6.555 -31.679 10.483 1.00 0.00 H new ATOM 0 HE ARG B 51 7.397 -33.654 9.565 1.00 0.00 H new ATOM 0 HH11 ARG B 51 9.437 -30.910 8.663 1.00 0.00 H new ATOM 0 HH12 ARG B 51 10.709 -31.934 7.988 1.00 0.00 H new ATOM 0 HH21 ARG B 51 9.036 -34.953 8.695 1.00 0.00 H new ATOM 0 HH22 ARG B 51 10.484 -34.210 8.006 1.00 0.00 H new ATOM 993 N ALA B 52 5.659 -32.315 4.951 1.00 0.00 N ATOM 994 CA ALA B 52 6.354 -32.528 3.686 1.00 0.00 C ATOM 995 C ALA B 52 5.419 -33.106 2.629 1.00 0.00 C ATOM 996 O ALA B 52 5.353 -34.321 2.442 1.00 0.00 O ATOM 997 CB ALA B 52 7.551 -33.443 3.892 1.00 0.00 C ATOM 0 H ALA B 52 5.310 -33.168 5.389 1.00 0.00 H new ATOM 0 HA ALA B 52 6.705 -31.560 3.327 1.00 0.00 H new ATOM 0 HB1 ALA B 52 8.061 -33.594 2.941 1.00 0.00 H new ATOM 0 HB2 ALA B 52 8.239 -32.987 4.604 1.00 0.00 H new ATOM 0 HB3 ALA B 52 7.212 -34.404 4.279 1.00 0.00 H new ATOM 1003 N HIS B 53 4.698 -32.226 1.939 1.00 0.00 N ATOM 1004 CA HIS B 53 3.767 -32.646 0.896 1.00 0.00 C ATOM 1005 C HIS B 53 3.059 -31.437 0.288 1.00 0.00 C ATOM 1006 O HIS B 53 1.830 -31.350 0.297 1.00 0.00 O ATOM 1007 CB HIS B 53 2.742 -33.633 1.464 1.00 0.00 C ATOM 1008 CG HIS B 53 2.994 -35.054 1.064 1.00 0.00 C ATOM 1009 ND1 HIS B 53 2.887 -36.113 1.939 1.00 0.00 N ATOM 1010 CD2 HIS B 53 3.353 -35.586 -0.129 1.00 0.00 C ATOM 1011 CE1 HIS B 53 3.168 -37.237 1.302 1.00 0.00 C ATOM 1012 NE2 HIS B 53 3.454 -36.943 0.048 1.00 0.00 N ATOM 0 H HIS B 53 4.741 -31.217 2.084 1.00 0.00 H new ATOM 0 HA HIS B 53 4.334 -33.144 0.109 1.00 0.00 H new ATOM 0 HB2 HIS B 53 2.747 -33.564 2.552 1.00 0.00 H new ATOM 0 HB3 HIS B 53 1.746 -33.342 1.131 1.00 0.00 H new ATOM 0 HD2 HIS B 53 3.527 -35.044 -1.047 1.00 0.00 H new ATOM 0 HE1 HIS B 53 3.164 -38.227 1.734 1.00 0.00 H new ATOM 0 HE2 HIS B 53 3.709 -37.617 -0.674 1.00 0.00 H new ATOM 1021 N LEU B 54 3.845 -30.502 -0.237 1.00 0.00 N ATOM 1022 CA LEU B 54 3.295 -29.297 -0.845 1.00 0.00 C ATOM 1023 C LEU B 54 4.005 -28.977 -2.160 1.00 0.00 C ATOM 1024 O LEU B 54 3.357 -28.776 -3.184 1.00 0.00 O ATOM 1025 CB LEU B 54 3.414 -28.112 0.119 1.00 0.00 C ATOM 1026 CG LEU B 54 3.205 -28.444 1.600 1.00 0.00 C ATOM 1027 CD1 LEU B 54 4.202 -27.685 2.464 1.00 0.00 C ATOM 1028 CD2 LEU B 54 1.780 -28.120 2.023 1.00 0.00 C ATOM 0 H LEU B 54 4.863 -30.556 -0.253 1.00 0.00 H new ATOM 0 HA LEU B 54 2.241 -29.476 -1.058 1.00 0.00 H new ATOM 0 HB2 LEU B 54 4.402 -27.667 0.000 1.00 0.00 H new ATOM 0 HB3 LEU B 54 2.686 -27.355 -0.172 1.00 0.00 H new ATOM 0 HG LEU B 54 3.372 -29.512 1.739 1.00 0.00 H new ATOM 0 HD11 LEU B 54 4.038 -27.934 3.513 1.00 0.00 H new ATOM 0 HD12 LEU B 54 5.217 -27.964 2.179 1.00 0.00 H new ATOM 0 HD13 LEU B 54 4.066 -26.613 2.320 1.00 0.00 H new ATOM 0 HD21 LEU B 54 1.650 -28.362 3.078 1.00 0.00 H new ATOM 0 HD22 LEU B 54 1.587 -27.059 1.868 1.00 0.00 H new ATOM 0 HD23 LEU B 54 1.081 -28.707 1.427 1.00 0.00 H new ATOM 1040 N THR B 55 5.341 -28.936 -2.106 1.00 0.00 N ATOM 1041 CA THR B 55 6.196 -28.649 -3.272 1.00 0.00 C ATOM 1042 C THR B 55 5.431 -28.045 -4.457 1.00 0.00 C ATOM 1043 O THR B 55 5.470 -26.832 -4.681 1.00 0.00 O ATOM 1044 CB THR B 55 6.916 -29.923 -3.715 1.00 0.00 C ATOM 1045 OG1 THR B 55 7.721 -30.433 -2.667 1.00 0.00 O ATOM 1046 CG2 THR B 55 7.808 -29.724 -4.923 1.00 0.00 C ATOM 0 H THR B 55 5.867 -29.102 -1.248 1.00 0.00 H new ATOM 0 HA THR B 55 6.917 -27.897 -2.951 1.00 0.00 H new ATOM 0 HB THR B 55 6.123 -30.621 -3.983 1.00 0.00 H new ATOM 0 HG1 THR B 55 8.172 -31.249 -2.969 1.00 0.00 H new ATOM 0 HG21 THR B 55 8.287 -30.669 -5.181 1.00 0.00 H new ATOM 0 HG22 THR B 55 7.208 -29.379 -5.765 1.00 0.00 H new ATOM 0 HG23 THR B 55 8.572 -28.981 -4.693 1.00 0.00 H new ATOM 1054 N GLU B 56 4.751 -28.898 -5.217 1.00 0.00 N ATOM 1055 CA GLU B 56 3.996 -28.446 -6.381 1.00 0.00 C ATOM 1056 C GLU B 56 2.834 -27.538 -5.980 1.00 0.00 C ATOM 1057 O GLU B 56 2.727 -26.412 -6.458 1.00 0.00 O ATOM 1058 CB GLU B 56 3.478 -29.644 -7.181 1.00 0.00 C ATOM 1059 CG GLU B 56 2.646 -30.612 -6.362 1.00 0.00 C ATOM 1060 CD GLU B 56 2.562 -31.989 -6.991 1.00 0.00 C ATOM 1061 OE1 GLU B 56 2.008 -32.099 -8.106 1.00 0.00 O ATOM 1062 OE2 GLU B 56 3.050 -32.958 -6.370 1.00 0.00 O ATOM 0 H GLU B 56 4.707 -29.903 -5.049 1.00 0.00 H new ATOM 0 HA GLU B 56 4.673 -27.866 -7.007 1.00 0.00 H new ATOM 0 HB2 GLU B 56 2.879 -29.280 -8.016 1.00 0.00 H new ATOM 0 HB3 GLU B 56 4.327 -30.179 -7.607 1.00 0.00 H new ATOM 0 HG2 GLU B 56 3.075 -30.699 -5.364 1.00 0.00 H new ATOM 0 HG3 GLU B 56 1.640 -30.209 -6.243 1.00 0.00 H new ATOM 1069 N VAL B 57 1.961 -28.028 -5.107 1.00 0.00 N ATOM 1070 CA VAL B 57 0.813 -27.245 -4.666 1.00 0.00 C ATOM 1071 C VAL B 57 1.249 -25.942 -3.995 1.00 0.00 C ATOM 1072 O VAL B 57 0.762 -24.861 -4.346 1.00 0.00 O ATOM 1073 CB VAL B 57 -0.089 -28.040 -3.709 1.00 0.00 C ATOM 1074 CG1 VAL B 57 -1.438 -27.354 -3.569 1.00 0.00 C ATOM 1075 CG2 VAL B 57 -0.261 -29.472 -4.196 1.00 0.00 C ATOM 0 H VAL B 57 2.025 -28.958 -4.693 1.00 0.00 H new ATOM 0 HA VAL B 57 0.240 -27.006 -5.562 1.00 0.00 H new ATOM 0 HB VAL B 57 0.387 -28.072 -2.729 1.00 0.00 H new ATOM 0 HG11 VAL B 57 -2.068 -27.926 -2.889 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -1.296 -26.349 -3.173 1.00 0.00 H new ATOM 0 HG13 VAL B 57 -1.919 -27.294 -4.545 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -0.903 -30.017 -3.504 1.00 0.00 H new ATOM 0 HG22 VAL B 57 -0.716 -29.467 -5.186 1.00 0.00 H new ATOM 0 HG23 VAL B 57 0.713 -29.958 -4.247 1.00 0.00 H new ATOM 1085 N GLU B 58 2.177 -26.029 -3.037 1.00 0.00 N ATOM 1086 CA GLU B 58 2.661 -24.827 -2.362 1.00 0.00 C ATOM 1087 C GLU B 58 3.127 -23.816 -3.397 1.00 0.00 C ATOM 1088 O GLU B 58 2.722 -22.656 -3.385 1.00 0.00 O ATOM 1089 CB GLU B 58 3.801 -25.147 -1.394 1.00 0.00 C ATOM 1090 CG GLU B 58 4.898 -25.982 -2.017 1.00 0.00 C ATOM 1091 CD GLU B 58 6.022 -25.142 -2.593 1.00 0.00 C ATOM 1092 OE1 GLU B 58 5.881 -23.900 -2.619 1.00 0.00 O ATOM 1093 OE2 GLU B 58 7.042 -25.723 -3.017 1.00 0.00 O ATOM 0 H GLU B 58 2.599 -26.901 -2.718 1.00 0.00 H new ATOM 0 HA GLU B 58 1.839 -24.409 -1.781 1.00 0.00 H new ATOM 0 HB2 GLU B 58 4.228 -24.214 -1.026 1.00 0.00 H new ATOM 0 HB3 GLU B 58 3.398 -25.676 -0.530 1.00 0.00 H new ATOM 0 HG2 GLU B 58 5.305 -26.658 -1.265 1.00 0.00 H new ATOM 0 HG3 GLU B 58 4.473 -26.602 -2.806 1.00 0.00 H new ATOM 1100 N SER B 59 3.951 -24.277 -4.321 1.00 0.00 N ATOM 1101 CA SER B 59 4.436 -23.416 -5.388 1.00 0.00 C ATOM 1102 C SER B 59 3.255 -22.927 -6.226 1.00 0.00 C ATOM 1103 O SER B 59 3.345 -21.921 -6.928 1.00 0.00 O ATOM 1104 CB SER B 59 5.435 -24.166 -6.272 1.00 0.00 C ATOM 1105 OG SER B 59 5.674 -23.467 -7.481 1.00 0.00 O ATOM 0 H SER B 59 4.297 -25.236 -4.356 1.00 0.00 H new ATOM 0 HA SER B 59 4.946 -22.559 -4.947 1.00 0.00 H new ATOM 0 HB2 SER B 59 6.373 -24.298 -5.734 1.00 0.00 H new ATOM 0 HB3 SER B 59 5.052 -25.162 -6.494 1.00 0.00 H new ATOM 0 HG SER B 59 6.317 -23.967 -8.026 1.00 0.00 H new ATOM 1111 N ARG B 60 2.152 -23.669 -6.147 1.00 0.00 N ATOM 1112 CA ARG B 60 0.944 -23.356 -6.889 1.00 0.00 C ATOM 1113 C ARG B 60 0.240 -22.130 -6.348 1.00 0.00 C ATOM 1114 O ARG B 60 0.262 -21.078 -6.980 1.00 0.00 O ATOM 1115 CB ARG B 60 -0.020 -24.542 -6.852 1.00 0.00 C ATOM 1116 CG ARG B 60 -0.914 -24.638 -8.077 1.00 0.00 C ATOM 1117 CD ARG B 60 -0.379 -25.646 -9.081 1.00 0.00 C ATOM 1118 NE ARG B 60 -1.454 -26.390 -9.735 1.00 0.00 N ATOM 1119 CZ ARG B 60 -2.209 -25.895 -10.712 1.00 0.00 C ATOM 1120 NH1 ARG B 60 -2.015 -24.657 -11.150 1.00 0.00 N ATOM 1121 NH2 ARG B 60 -3.163 -26.640 -11.252 1.00 0.00 N ATOM 0 H ARG B 60 2.076 -24.503 -5.565 1.00 0.00 H new ATOM 0 HA ARG B 60 1.247 -23.147 -7.915 1.00 0.00 H new ATOM 0 HB2 ARG B 60 0.555 -25.464 -6.759 1.00 0.00 H new ATOM 0 HB3 ARG B 60 -0.644 -24.464 -5.962 1.00 0.00 H new ATOM 0 HG2 ARG B 60 -1.920 -24.926 -7.772 1.00 0.00 H new ATOM 0 HG3 ARG B 60 -0.992 -23.659 -8.549 1.00 0.00 H new ATOM 0 HD2 ARG B 60 0.214 -25.128 -9.835 1.00 0.00 H new ATOM 0 HD3 ARG B 60 0.288 -26.343 -8.574 1.00 0.00 H new ATOM 0 HE ARG B 60 -1.636 -27.344 -9.424 1.00 0.00 H new ATOM 0 HH11 ARG B 60 -1.283 -24.079 -10.737 1.00 0.00 H new ATOM 0 HH12 ARG B 60 -2.598 -24.284 -11.899 1.00 0.00 H new ATOM 0 HH21 ARG B 60 -3.317 -27.591 -10.918 1.00 0.00 H new ATOM 0 HH22 ARG B 60 -3.743 -26.262 -12.001 1.00 0.00 H new ATOM 1135 N LEU B 61 -0.404 -22.250 -5.190 1.00 0.00 N ATOM 1136 CA LEU B 61 -1.114 -21.101 -4.644 1.00 0.00 C ATOM 1137 C LEU B 61 -0.144 -19.958 -4.386 1.00 0.00 C ATOM 1138 O LEU B 61 -0.507 -18.779 -4.450 1.00 0.00 O ATOM 1139 CB LEU B 61 -1.887 -21.488 -3.391 1.00 0.00 C ATOM 1140 CG LEU B 61 -3.304 -21.988 -3.676 1.00 0.00 C ATOM 1141 CD1 LEU B 61 -4.152 -20.874 -4.270 1.00 0.00 C ATOM 1142 CD2 LEU B 61 -3.264 -23.184 -4.616 1.00 0.00 C ATOM 0 H LEU B 61 -0.449 -23.101 -4.629 1.00 0.00 H new ATOM 0 HA LEU B 61 -1.845 -20.756 -5.376 1.00 0.00 H new ATOM 0 HB2 LEU B 61 -1.337 -22.265 -2.860 1.00 0.00 H new ATOM 0 HB3 LEU B 61 -1.942 -20.625 -2.727 1.00 0.00 H new ATOM 0 HG LEU B 61 -3.756 -22.301 -2.735 1.00 0.00 H new ATOM 0 HD11 LEU B 61 -5.157 -21.247 -4.467 1.00 0.00 H new ATOM 0 HD12 LEU B 61 -4.205 -20.043 -3.567 1.00 0.00 H new ATOM 0 HD13 LEU B 61 -3.703 -20.533 -5.203 1.00 0.00 H new ATOM 0 HD21 LEU B 61 -4.280 -23.529 -4.810 1.00 0.00 H new ATOM 0 HD22 LEU B 61 -2.794 -22.893 -5.556 1.00 0.00 H new ATOM 0 HD23 LEU B 61 -2.689 -23.988 -4.157 1.00 0.00 H new ATOM 1154 N GLU B 62 1.106 -20.319 -4.148 1.00 0.00 N ATOM 1155 CA GLU B 62 2.147 -19.334 -3.935 1.00 0.00 C ATOM 1156 C GLU B 62 2.383 -18.563 -5.227 1.00 0.00 C ATOM 1157 O GLU B 62 2.586 -17.351 -5.210 1.00 0.00 O ATOM 1158 CB GLU B 62 3.438 -20.011 -3.478 1.00 0.00 C ATOM 1159 CG GLU B 62 4.532 -19.034 -3.081 1.00 0.00 C ATOM 1160 CD GLU B 62 5.838 -19.293 -3.807 1.00 0.00 C ATOM 1161 OE1 GLU B 62 5.792 -19.778 -4.957 1.00 0.00 O ATOM 1162 OE2 GLU B 62 6.907 -19.009 -3.227 1.00 0.00 O ATOM 0 H GLU B 62 1.422 -21.288 -4.098 1.00 0.00 H new ATOM 0 HA GLU B 62 1.831 -18.642 -3.154 1.00 0.00 H new ATOM 0 HB2 GLU B 62 3.217 -20.660 -2.630 1.00 0.00 H new ATOM 0 HB3 GLU B 62 3.807 -20.650 -4.281 1.00 0.00 H new ATOM 0 HG2 GLU B 62 4.200 -18.017 -3.291 1.00 0.00 H new ATOM 0 HG3 GLU B 62 4.699 -19.099 -2.006 1.00 0.00 H new ATOM 1169 N ARG B 63 2.333 -19.272 -6.355 1.00 0.00 N ATOM 1170 CA ARG B 63 2.526 -18.642 -7.655 1.00 0.00 C ATOM 1171 C ARG B 63 1.223 -18.021 -8.156 1.00 0.00 C ATOM 1172 O ARG B 63 1.208 -17.312 -9.163 1.00 0.00 O ATOM 1173 CB ARG B 63 3.041 -19.667 -8.667 1.00 0.00 C ATOM 1174 CG ARG B 63 3.476 -19.055 -9.989 1.00 0.00 C ATOM 1175 CD ARG B 63 3.880 -20.124 -10.991 1.00 0.00 C ATOM 1176 NE ARG B 63 2.719 -20.777 -11.593 1.00 0.00 N ATOM 1177 CZ ARG B 63 2.796 -21.646 -12.600 1.00 0.00 C ATOM 1178 NH1 ARG B 63 3.975 -21.967 -13.119 1.00 0.00 N ATOM 1179 NH2 ARG B 63 1.692 -22.195 -13.087 1.00 0.00 N ATOM 0 H ARG B 63 2.161 -20.277 -6.392 1.00 0.00 H new ATOM 0 HA ARG B 63 3.265 -17.849 -7.544 1.00 0.00 H new ATOM 0 HB2 ARG B 63 3.883 -20.204 -8.231 1.00 0.00 H new ATOM 0 HB3 ARG B 63 2.259 -20.402 -8.857 1.00 0.00 H new ATOM 0 HG2 ARG B 63 2.662 -18.458 -10.400 1.00 0.00 H new ATOM 0 HG3 ARG B 63 4.313 -18.378 -9.820 1.00 0.00 H new ATOM 0 HD2 ARG B 63 4.490 -19.674 -11.775 1.00 0.00 H new ATOM 0 HD3 ARG B 63 4.499 -20.871 -10.494 1.00 0.00 H new ATOM 0 HE ARG B 63 1.796 -20.554 -11.220 1.00 0.00 H new ATOM 0 HH11 ARG B 63 4.827 -21.548 -12.747 1.00 0.00 H new ATOM 0 HH12 ARG B 63 4.029 -22.633 -13.890 1.00 0.00 H new ATOM 0 HH21 ARG B 63 0.784 -21.952 -12.691 1.00 0.00 H new ATOM 0 HH22 ARG B 63 1.751 -22.860 -13.858 1.00 0.00 H new ATOM 1193 N LEU B 64 0.125 -18.310 -7.461 1.00 0.00 N ATOM 1194 CA LEU B 64 -1.186 -17.798 -7.846 1.00 0.00 C ATOM 1195 C LEU B 64 -1.490 -16.483 -7.150 1.00 0.00 C ATOM 1196 O LEU B 64 -2.250 -15.658 -7.657 1.00 0.00 O ATOM 1197 CB LEU B 64 -2.263 -18.864 -7.546 1.00 0.00 C ATOM 1198 CG LEU B 64 -3.561 -18.393 -6.859 1.00 0.00 C ATOM 1199 CD1 LEU B 64 -3.290 -17.875 -5.449 1.00 0.00 C ATOM 1200 CD2 LEU B 64 -4.268 -17.337 -7.700 1.00 0.00 C ATOM 0 H LEU B 64 0.118 -18.897 -6.627 1.00 0.00 H new ATOM 0 HA LEU B 64 -1.187 -17.594 -8.917 1.00 0.00 H new ATOM 0 HB2 LEU B 64 -2.535 -19.341 -8.488 1.00 0.00 H new ATOM 0 HB3 LEU B 64 -1.810 -19.632 -6.919 1.00 0.00 H new ATOM 0 HG LEU B 64 -4.220 -19.256 -6.772 1.00 0.00 H new ATOM 0 HD11 LEU B 64 -4.226 -17.551 -4.994 1.00 0.00 H new ATOM 0 HD12 LEU B 64 -2.850 -18.670 -4.847 1.00 0.00 H new ATOM 0 HD13 LEU B 64 -2.600 -17.033 -5.497 1.00 0.00 H new ATOM 0 HD21 LEU B 64 -5.181 -17.021 -7.195 1.00 0.00 H new ATOM 0 HD22 LEU B 64 -3.610 -16.478 -7.833 1.00 0.00 H new ATOM 0 HD23 LEU B 64 -4.519 -17.756 -8.674 1.00 0.00 H new ATOM 1212 N GLU B 65 -0.902 -16.296 -5.986 1.00 0.00 N ATOM 1213 CA GLU B 65 -1.130 -15.080 -5.217 1.00 0.00 C ATOM 1214 C GLU B 65 0.125 -14.213 -5.100 1.00 0.00 C ATOM 1215 O GLU B 65 0.064 -13.002 -5.319 1.00 0.00 O ATOM 1216 CB GLU B 65 -1.649 -15.439 -3.829 1.00 0.00 C ATOM 1217 CG GLU B 65 -2.812 -14.575 -3.370 1.00 0.00 C ATOM 1218 CD GLU B 65 -3.965 -14.582 -4.355 1.00 0.00 C ATOM 1219 OE1 GLU B 65 -3.966 -13.735 -5.273 1.00 0.00 O ATOM 1220 OE2 GLU B 65 -4.867 -15.434 -4.210 1.00 0.00 O ATOM 0 H GLU B 65 -0.266 -16.963 -5.550 1.00 0.00 H new ATOM 0 HA GLU B 65 -1.874 -14.491 -5.754 1.00 0.00 H new ATOM 0 HB2 GLU B 65 -1.960 -16.484 -3.826 1.00 0.00 H new ATOM 0 HB3 GLU B 65 -0.834 -15.347 -3.111 1.00 0.00 H new ATOM 0 HG2 GLU B 65 -3.164 -14.930 -2.401 1.00 0.00 H new ATOM 0 HG3 GLU B 65 -2.466 -13.551 -3.228 1.00 0.00 H new ATOM 1227 N GLN B 66 1.254 -14.820 -4.739 1.00 0.00 N ATOM 1228 CA GLN B 66 2.503 -14.073 -4.581 1.00 0.00 C ATOM 1229 C GLN B 66 2.755 -13.137 -5.762 1.00 0.00 C ATOM 1230 O GLN B 66 3.144 -11.984 -5.573 1.00 0.00 O ATOM 1231 CB GLN B 66 3.681 -15.033 -4.414 1.00 0.00 C ATOM 1232 CG GLN B 66 4.852 -14.424 -3.667 1.00 0.00 C ATOM 1233 CD GLN B 66 6.135 -15.211 -3.851 1.00 0.00 C ATOM 1234 OE1 GLN B 66 6.977 -14.864 -4.679 1.00 0.00 O ATOM 1235 NE2 GLN B 66 6.289 -16.279 -3.077 1.00 0.00 N ATOM 0 H GLN B 66 1.331 -15.820 -4.551 1.00 0.00 H new ATOM 0 HA GLN B 66 2.407 -13.462 -3.684 1.00 0.00 H new ATOM 0 HB2 GLN B 66 3.343 -15.922 -3.882 1.00 0.00 H new ATOM 0 HB3 GLN B 66 4.017 -15.359 -5.398 1.00 0.00 H new ATOM 0 HG2 GLN B 66 5.005 -13.401 -4.011 1.00 0.00 H new ATOM 0 HG3 GLN B 66 4.612 -14.370 -2.605 1.00 0.00 H new ATOM 0 HE21 GLN B 66 5.565 -16.530 -2.404 1.00 0.00 H new ATOM 0 HE22 GLN B 66 7.131 -16.849 -3.156 1.00 0.00 H new ATOM 1244 N LEU B 67 2.528 -13.631 -6.974 1.00 0.00 N ATOM 1245 CA LEU B 67 2.732 -12.824 -8.170 1.00 0.00 C ATOM 1246 C LEU B 67 1.414 -12.222 -8.656 1.00 0.00 C ATOM 1247 O LEU B 67 1.278 -11.869 -9.827 1.00 0.00 O ATOM 1248 CB LEU B 67 3.367 -13.661 -9.283 1.00 0.00 C ATOM 1249 CG LEU B 67 2.559 -14.884 -9.722 1.00 0.00 C ATOM 1250 CD1 LEU B 67 1.715 -14.560 -10.946 1.00 0.00 C ATOM 1251 CD2 LEU B 67 3.487 -16.058 -10.003 1.00 0.00 C ATOM 0 H LEU B 67 2.204 -14.581 -7.153 1.00 0.00 H new ATOM 0 HA LEU B 67 3.409 -12.010 -7.911 1.00 0.00 H new ATOM 0 HB2 LEU B 67 3.527 -13.021 -10.151 1.00 0.00 H new ATOM 0 HB3 LEU B 67 4.349 -13.996 -8.949 1.00 0.00 H new ATOM 0 HG LEU B 67 1.886 -15.163 -8.911 1.00 0.00 H new ATOM 0 HD11 LEU B 67 1.149 -15.443 -11.242 1.00 0.00 H new ATOM 0 HD12 LEU B 67 1.026 -13.750 -10.709 1.00 0.00 H new ATOM 0 HD13 LEU B 67 2.365 -14.255 -11.766 1.00 0.00 H new ATOM 0 HD21 LEU B 67 2.898 -16.921 -10.314 1.00 0.00 H new ATOM 0 HD22 LEU B 67 4.184 -15.789 -10.797 1.00 0.00 H new ATOM 0 HD23 LEU B 67 4.044 -16.306 -9.099 1.00 0.00 H new ATOM 1263 N PHE B 68 0.449 -12.105 -7.748 1.00 0.00 N ATOM 1264 CA PHE B 68 -0.853 -11.541 -8.087 1.00 0.00 C ATOM 1265 C PHE B 68 -1.314 -10.558 -7.017 1.00 0.00 C ATOM 1266 O PHE B 68 -1.868 -10.955 -5.992 1.00 0.00 O ATOM 1267 CB PHE B 68 -1.891 -12.652 -8.256 1.00 0.00 C ATOM 1268 CG PHE B 68 -3.089 -12.233 -9.057 1.00 0.00 C ATOM 1269 CD1 PHE B 68 -3.003 -12.086 -10.432 1.00 0.00 C ATOM 1270 CD2 PHE B 68 -4.303 -11.985 -8.435 1.00 0.00 C ATOM 1271 CE1 PHE B 68 -4.105 -11.701 -11.172 1.00 0.00 C ATOM 1272 CE2 PHE B 68 -5.408 -11.598 -9.170 1.00 0.00 C ATOM 1273 CZ PHE B 68 -5.308 -11.457 -10.540 1.00 0.00 C ATOM 0 H PHE B 68 0.544 -12.393 -6.774 1.00 0.00 H new ATOM 0 HA PHE B 68 -0.752 -11.005 -9.031 1.00 0.00 H new ATOM 0 HB2 PHE B 68 -1.421 -13.508 -8.741 1.00 0.00 H new ATOM 0 HB3 PHE B 68 -2.220 -12.984 -7.271 1.00 0.00 H new ATOM 0 HD1 PHE B 68 -2.064 -12.274 -10.931 1.00 0.00 H new ATOM 0 HD2 PHE B 68 -4.386 -12.095 -7.364 1.00 0.00 H new ATOM 0 HE1 PHE B 68 -4.025 -11.591 -12.243 1.00 0.00 H new ATOM 0 HE2 PHE B 68 -6.348 -11.406 -8.674 1.00 0.00 H new ATOM 0 HZ PHE B 68 -6.170 -11.156 -11.117 1.00 0.00 H new ATOM 1283 N LEU B 69 -1.082 -9.273 -7.264 1.00 0.00 N ATOM 1284 CA LEU B 69 -1.473 -8.232 -6.324 1.00 0.00 C ATOM 1285 C LEU B 69 -1.649 -6.895 -7.038 1.00 0.00 C ATOM 1286 O LEU B 69 -1.147 -6.703 -8.145 1.00 0.00 O ATOM 1287 CB LEU B 69 -0.430 -8.094 -5.211 1.00 0.00 C ATOM 1288 CG LEU B 69 1.019 -8.331 -5.644 1.00 0.00 C ATOM 1289 CD1 LEU B 69 1.372 -7.457 -6.838 1.00 0.00 C ATOM 1290 CD2 LEU B 69 1.970 -8.067 -4.487 1.00 0.00 C ATOM 0 H LEU B 69 -0.625 -8.929 -8.108 1.00 0.00 H new ATOM 0 HA LEU B 69 -2.427 -8.519 -5.882 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -0.506 -7.093 -4.785 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -0.675 -8.798 -4.416 1.00 0.00 H new ATOM 0 HG LEU B 69 1.122 -9.374 -5.943 1.00 0.00 H new ATOM 0 HD11 LEU B 69 2.406 -7.640 -7.130 1.00 0.00 H new ATOM 0 HD12 LEU B 69 0.712 -7.696 -7.672 1.00 0.00 H new ATOM 0 HD13 LEU B 69 1.252 -6.408 -6.569 1.00 0.00 H new ATOM 0 HD21 LEU B 69 2.996 -8.240 -4.812 1.00 0.00 H new ATOM 0 HD22 LEU B 69 1.864 -7.034 -4.157 1.00 0.00 H new ATOM 0 HD23 LEU B 69 1.733 -8.738 -3.661 1.00 0.00 H new ATOM 1302 N LEU B 70 -2.366 -5.976 -6.399 1.00 0.00 N ATOM 1303 CA LEU B 70 -2.609 -4.656 -6.975 1.00 0.00 C ATOM 1304 C LEU B 70 -1.304 -4.006 -7.429 1.00 0.00 C ATOM 1305 O LEU B 70 -1.291 -3.201 -8.360 1.00 0.00 O ATOM 1306 CB LEU B 70 -3.312 -3.756 -5.958 1.00 0.00 C ATOM 1307 CG LEU B 70 -4.708 -4.220 -5.540 1.00 0.00 C ATOM 1308 CD1 LEU B 70 -5.119 -3.565 -4.230 1.00 0.00 C ATOM 1309 CD2 LEU B 70 -5.721 -3.911 -6.632 1.00 0.00 C ATOM 0 H LEU B 70 -2.789 -6.120 -5.482 1.00 0.00 H new ATOM 0 HA LEU B 70 -3.251 -4.782 -7.847 1.00 0.00 H new ATOM 0 HB2 LEU B 70 -2.688 -3.683 -5.067 1.00 0.00 H new ATOM 0 HB3 LEU B 70 -3.389 -2.752 -6.376 1.00 0.00 H new ATOM 0 HG LEU B 70 -4.681 -5.299 -5.390 1.00 0.00 H new ATOM 0 HD11 LEU B 70 -6.115 -3.907 -3.949 1.00 0.00 H new ATOM 0 HD12 LEU B 70 -4.408 -3.836 -3.449 1.00 0.00 H new ATOM 0 HD13 LEU B 70 -5.129 -2.482 -4.352 1.00 0.00 H new ATOM 0 HD21 LEU B 70 -6.709 -4.248 -6.318 1.00 0.00 H new ATOM 0 HD22 LEU B 70 -5.745 -2.836 -6.813 1.00 0.00 H new ATOM 0 HD23 LEU B 70 -5.436 -4.427 -7.549 1.00 0.00 H new ATOM 1321 N ILE B 71 -0.208 -4.364 -6.767 1.00 0.00 N ATOM 1322 CA ILE B 71 1.101 -3.818 -7.103 1.00 0.00 C ATOM 1323 C ILE B 71 1.566 -4.292 -8.479 1.00 0.00 C ATOM 1324 O ILE B 71 2.511 -3.741 -9.046 1.00 0.00 O ATOM 1325 CB ILE B 71 2.161 -4.214 -6.055 1.00 0.00 C ATOM 1326 CG1 ILE B 71 1.652 -3.909 -4.643 1.00 0.00 C ATOM 1327 CG2 ILE B 71 3.469 -3.485 -6.321 1.00 0.00 C ATOM 1328 CD1 ILE B 71 1.273 -2.458 -4.437 1.00 0.00 C ATOM 0 H ILE B 71 -0.201 -5.030 -5.995 1.00 0.00 H new ATOM 0 HA ILE B 71 0.993 -2.733 -7.114 1.00 0.00 H new ATOM 0 HB ILE B 71 2.344 -5.286 -6.132 1.00 0.00 H new ATOM 0 HG12 ILE B 71 0.785 -4.536 -4.435 1.00 0.00 H new ATOM 0 HG13 ILE B 71 2.422 -4.181 -3.921 1.00 0.00 H new ATOM 0 HG21 ILE B 71 4.206 -3.776 -5.573 1.00 0.00 H new ATOM 0 HG22 ILE B 71 3.836 -3.747 -7.313 1.00 0.00 H new ATOM 0 HG23 ILE B 71 3.303 -2.409 -6.268 1.00 0.00 H new ATOM 0 HD11 ILE B 71 0.922 -2.315 -3.415 1.00 0.00 H new ATOM 0 HD12 ILE B 71 2.144 -1.826 -4.613 1.00 0.00 H new ATOM 0 HD13 ILE B 71 0.481 -2.186 -5.134 1.00 0.00 H new ATOM 1340 N PHE B 72 0.900 -5.313 -9.015 1.00 0.00 N ATOM 1341 CA PHE B 72 1.248 -5.856 -10.325 1.00 0.00 C ATOM 1342 C PHE B 72 1.383 -4.745 -11.367 1.00 0.00 C ATOM 1343 O PHE B 72 0.384 -4.180 -11.813 1.00 0.00 O ATOM 1344 CB PHE B 72 0.188 -6.863 -10.776 1.00 0.00 C ATOM 1345 CG PHE B 72 0.605 -7.684 -11.964 1.00 0.00 C ATOM 1346 CD1 PHE B 72 0.528 -7.161 -13.245 1.00 0.00 C ATOM 1347 CD2 PHE B 72 1.073 -8.978 -11.799 1.00 0.00 C ATOM 1348 CE1 PHE B 72 0.911 -7.913 -14.339 1.00 0.00 C ATOM 1349 CE2 PHE B 72 1.458 -9.735 -12.889 1.00 0.00 C ATOM 1350 CZ PHE B 72 1.377 -9.202 -14.161 1.00 0.00 C ATOM 0 H PHE B 72 0.116 -5.781 -8.561 1.00 0.00 H new ATOM 0 HA PHE B 72 2.211 -6.359 -10.235 1.00 0.00 H new ATOM 0 HB2 PHE B 72 -0.043 -7.531 -9.946 1.00 0.00 H new ATOM 0 HB3 PHE B 72 -0.730 -6.328 -11.019 1.00 0.00 H new ATOM 0 HD1 PHE B 72 0.165 -6.154 -13.390 1.00 0.00 H new ATOM 0 HD2 PHE B 72 1.138 -9.400 -10.807 1.00 0.00 H new ATOM 0 HE1 PHE B 72 0.846 -7.494 -15.332 1.00 0.00 H new ATOM 0 HE2 PHE B 72 1.822 -10.742 -12.747 1.00 0.00 H new ATOM 0 HZ PHE B 72 1.677 -9.791 -15.015 1.00 0.00 H new ATOM 1360 N PRO B 73 2.624 -4.413 -11.769 1.00 0.00 N ATOM 1361 CA PRO B 73 2.874 -3.364 -12.763 1.00 0.00 C ATOM 1362 C PRO B 73 2.418 -3.768 -14.161 1.00 0.00 C ATOM 1363 O PRO B 73 2.796 -4.824 -14.667 1.00 0.00 O ATOM 1364 CB PRO B 73 4.395 -3.193 -12.725 1.00 0.00 C ATOM 1365 CG PRO B 73 4.912 -4.504 -12.246 1.00 0.00 C ATOM 1366 CD PRO B 73 3.875 -5.033 -11.293 1.00 0.00 C ATOM 0 HA PRO B 73 2.323 -2.451 -12.538 1.00 0.00 H new ATOM 0 HB2 PRO B 73 4.790 -2.948 -13.711 1.00 0.00 H new ATOM 0 HB3 PRO B 73 4.686 -2.384 -12.055 1.00 0.00 H new ATOM 0 HG2 PRO B 73 5.065 -5.191 -13.078 1.00 0.00 H new ATOM 0 HG3 PRO B 73 5.875 -4.386 -11.749 1.00 0.00 H new ATOM 0 HD2 PRO B 73 3.820 -6.121 -11.322 1.00 0.00 H new ATOM 0 HD3 PRO B 73 4.096 -4.753 -10.263 1.00 0.00 H new ATOM 1374 N ARG B 74 1.604 -2.919 -14.779 1.00 0.00 N ATOM 1375 CA ARG B 74 1.095 -3.185 -16.119 1.00 0.00 C ATOM 1376 C ARG B 74 0.243 -2.022 -16.617 1.00 0.00 C ATOM 1377 O ARG B 74 0.312 -1.643 -17.787 1.00 0.00 O ATOM 1378 CB ARG B 74 0.279 -4.481 -16.130 1.00 0.00 C ATOM 1379 CG ARG B 74 0.742 -5.482 -17.176 1.00 0.00 C ATOM 1380 CD ARG B 74 0.747 -4.872 -18.570 1.00 0.00 C ATOM 1381 NE ARG B 74 0.232 -5.799 -19.574 1.00 0.00 N ATOM 1382 CZ ARG B 74 0.920 -6.835 -20.049 1.00 0.00 C ATOM 1383 NH1 ARG B 74 2.150 -7.080 -19.612 1.00 0.00 N ATOM 1384 NH2 ARG B 74 0.377 -7.629 -20.961 1.00 0.00 N ATOM 0 H ARG B 74 1.283 -2.040 -14.373 1.00 0.00 H new ATOM 0 HA ARG B 74 1.946 -3.298 -16.790 1.00 0.00 H new ATOM 0 HB2 ARG B 74 0.336 -4.945 -15.145 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -0.769 -4.239 -16.309 1.00 0.00 H new ATOM 0 HG2 ARG B 74 1.744 -5.832 -16.928 1.00 0.00 H new ATOM 0 HG3 ARG B 74 0.087 -6.353 -17.162 1.00 0.00 H new ATOM 0 HD2 ARG B 74 0.143 -3.964 -18.571 1.00 0.00 H new ATOM 0 HD3 ARG B 74 1.763 -4.579 -18.834 1.00 0.00 H new ATOM 0 HE ARG B 74 -0.710 -5.644 -19.932 1.00 0.00 H new ATOM 0 HH11 ARG B 74 2.572 -6.473 -18.909 1.00 0.00 H new ATOM 0 HH12 ARG B 74 2.673 -7.875 -19.979 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -0.568 -7.446 -21.299 1.00 0.00 H new ATOM 0 HH22 ARG B 74 0.904 -8.423 -21.325 1.00 0.00 H new ATOM 1398 N GLU B 75 -0.560 -1.458 -15.720 1.00 0.00 N ATOM 1399 CA GLU B 75 -1.426 -0.337 -16.065 1.00 0.00 C ATOM 1400 C GLU B 75 -1.268 0.801 -15.060 1.00 0.00 C ATOM 1401 O GLU B 75 -0.440 0.730 -14.153 1.00 0.00 O ATOM 1402 CB GLU B 75 -2.887 -0.791 -16.118 1.00 0.00 C ATOM 1403 CG GLU B 75 -3.566 -0.504 -17.447 1.00 0.00 C ATOM 1404 CD GLU B 75 -2.967 -1.300 -18.591 1.00 0.00 C ATOM 1405 OE1 GLU B 75 -3.010 -2.548 -18.532 1.00 0.00 O ATOM 1406 OE2 GLU B 75 -2.454 -0.678 -19.544 1.00 0.00 O ATOM 0 H GLU B 75 -0.629 -1.760 -14.748 1.00 0.00 H new ATOM 0 HA GLU B 75 -1.132 0.029 -17.049 1.00 0.00 H new ATOM 0 HB2 GLU B 75 -2.933 -1.862 -15.920 1.00 0.00 H new ATOM 0 HB3 GLU B 75 -3.442 -0.295 -15.322 1.00 0.00 H new ATOM 0 HG2 GLU B 75 -4.628 -0.735 -17.366 1.00 0.00 H new ATOM 0 HG3 GLU B 75 -3.487 0.560 -17.669 1.00 0.00 H new ATOM 1413 N ASP B 76 -2.067 1.850 -15.231 1.00 0.00 N ATOM 1414 CA ASP B 76 -2.013 3.003 -14.339 1.00 0.00 C ATOM 1415 C ASP B 76 -2.743 2.715 -13.031 1.00 0.00 C ATOM 1416 O ASP B 76 -2.120 2.584 -11.977 1.00 0.00 O ATOM 1417 CB ASP B 76 -2.626 4.229 -15.018 1.00 0.00 C ATOM 1418 CG ASP B 76 -1.883 4.624 -16.279 1.00 0.00 C ATOM 1419 OD1 ASP B 76 -0.687 4.970 -16.178 1.00 0.00 O ATOM 1420 OD2 ASP B 76 -2.494 4.584 -17.368 1.00 0.00 O ATOM 0 H ASP B 76 -2.758 1.925 -15.977 1.00 0.00 H new ATOM 0 HA ASP B 76 -0.966 3.206 -14.113 1.00 0.00 H new ATOM 0 HB2 ASP B 76 -3.668 4.022 -15.263 1.00 0.00 H new ATOM 0 HB3 ASP B 76 -2.623 5.067 -14.320 1.00 0.00 H new ATOM 1425 N LEU B 77 -4.068 2.617 -13.107 1.00 0.00 N ATOM 1426 CA LEU B 77 -4.890 2.343 -11.931 1.00 0.00 C ATOM 1427 C LEU B 77 -4.884 3.529 -10.971 1.00 0.00 C ATOM 1428 O LEU B 77 -5.901 4.196 -10.788 1.00 0.00 O ATOM 1429 CB LEU B 77 -4.395 1.085 -11.212 1.00 0.00 C ATOM 1430 CG LEU B 77 -4.162 -0.127 -12.115 1.00 0.00 C ATOM 1431 CD1 LEU B 77 -3.222 -1.117 -11.446 1.00 0.00 C ATOM 1432 CD2 LEU B 77 -5.485 -0.793 -12.460 1.00 0.00 C ATOM 0 H LEU B 77 -4.596 2.724 -13.973 1.00 0.00 H new ATOM 0 HA LEU B 77 -5.913 2.178 -12.269 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -3.463 1.321 -10.699 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -5.121 0.814 -10.445 1.00 0.00 H new ATOM 0 HG LEU B 77 -3.697 0.214 -13.040 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -3.068 -1.973 -12.103 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -2.265 -0.634 -11.249 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -3.658 -1.455 -10.506 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -5.302 -1.654 -13.103 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -5.976 -1.122 -11.544 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -6.126 -0.081 -12.980 1.00 0.00 H new ATOM 1444 N ASP B 78 -3.732 3.786 -10.359 1.00 0.00 N ATOM 1445 CA ASP B 78 -3.597 4.892 -9.418 1.00 0.00 C ATOM 1446 C ASP B 78 -2.194 5.486 -9.474 1.00 0.00 C ATOM 1447 O ASP B 78 -1.280 5.008 -8.804 1.00 0.00 O ATOM 1448 CB ASP B 78 -3.904 4.420 -7.995 1.00 0.00 C ATOM 1449 CG ASP B 78 -5.361 4.041 -7.813 1.00 0.00 C ATOM 1450 OD1 ASP B 78 -6.228 4.926 -7.968 1.00 0.00 O ATOM 1451 OD2 ASP B 78 -5.635 2.860 -7.514 1.00 0.00 O ATOM 0 H ASP B 78 -2.879 3.244 -10.498 1.00 0.00 H new ATOM 0 HA ASP B 78 -4.312 5.664 -9.701 1.00 0.00 H new ATOM 0 HB2 ASP B 78 -3.276 3.562 -7.756 1.00 0.00 H new ATOM 0 HB3 ASP B 78 -3.646 5.210 -7.290 1.00 0.00 H new ATOM 1456 N MET B 79 -2.031 6.531 -10.279 1.00 0.00 N ATOM 1457 CA MET B 79 -0.740 7.190 -10.424 1.00 0.00 C ATOM 1458 C MET B 79 -0.253 7.745 -9.087 1.00 0.00 C ATOM 1459 O MET B 79 0.947 7.929 -8.883 1.00 0.00 O ATOM 1460 CB MET B 79 -0.832 8.318 -11.454 1.00 0.00 C ATOM 1461 CG MET B 79 -2.062 9.195 -11.285 1.00 0.00 C ATOM 1462 SD MET B 79 -1.876 10.810 -12.066 1.00 0.00 S ATOM 1463 CE MET B 79 -3.592 11.284 -12.277 1.00 0.00 C ATOM 0 H MET B 79 -2.778 6.939 -10.841 1.00 0.00 H new ATOM 0 HA MET B 79 -0.021 6.447 -10.770 1.00 0.00 H new ATOM 0 HB2 MET B 79 0.060 8.940 -11.381 1.00 0.00 H new ATOM 0 HB3 MET B 79 -0.838 7.886 -12.455 1.00 0.00 H new ATOM 0 HG2 MET B 79 -2.927 8.687 -11.711 1.00 0.00 H new ATOM 0 HG3 MET B 79 -2.264 9.331 -10.222 1.00 0.00 H new ATOM 0 HE1 MET B 79 -3.643 12.265 -12.750 1.00 0.00 H new ATOM 0 HE2 MET B 79 -4.097 10.551 -12.906 1.00 0.00 H new ATOM 0 HE3 MET B 79 -4.081 11.325 -11.303 1.00 0.00 H new ATOM 1473 N ILE B 80 -1.189 8.014 -8.182 1.00 0.00 N ATOM 1474 CA ILE B 80 -0.853 8.553 -6.869 1.00 0.00 C ATOM 1475 C ILE B 80 -0.004 7.571 -6.067 1.00 0.00 C ATOM 1476 O ILE B 80 1.091 7.907 -5.616 1.00 0.00 O ATOM 1477 CB ILE B 80 -2.121 8.895 -6.060 1.00 0.00 C ATOM 1478 CG1 ILE B 80 -3.057 9.781 -6.885 1.00 0.00 C ATOM 1479 CG2 ILE B 80 -1.749 9.583 -4.754 1.00 0.00 C ATOM 1480 CD1 ILE B 80 -2.409 11.058 -7.372 1.00 0.00 C ATOM 0 H ILE B 80 -2.187 7.867 -8.334 1.00 0.00 H new ATOM 0 HA ILE B 80 -0.281 9.465 -7.042 1.00 0.00 H new ATOM 0 HB ILE B 80 -2.642 7.967 -5.824 1.00 0.00 H new ATOM 0 HG12 ILE B 80 -3.416 9.215 -7.745 1.00 0.00 H new ATOM 0 HG13 ILE B 80 -3.930 10.033 -6.283 1.00 0.00 H new ATOM 0 HG21 ILE B 80 -2.655 9.817 -4.195 1.00 0.00 H new ATOM 0 HG22 ILE B 80 -1.118 8.921 -4.161 1.00 0.00 H new ATOM 0 HG23 ILE B 80 -1.207 10.504 -4.969 1.00 0.00 H new ATOM 0 HD11 ILE B 80 -3.131 11.635 -7.949 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -2.075 11.646 -6.517 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -1.553 10.815 -8.001 1.00 0.00 H new ATOM 1492 N LEU B 81 -0.518 6.358 -5.886 1.00 0.00 N ATOM 1493 CA LEU B 81 0.194 5.330 -5.130 1.00 0.00 C ATOM 1494 C LEU B 81 1.222 4.604 -5.997 1.00 0.00 C ATOM 1495 O LEU B 81 2.041 3.839 -5.487 1.00 0.00 O ATOM 1496 CB LEU B 81 -0.798 4.323 -4.543 1.00 0.00 C ATOM 1497 CG LEU B 81 -1.881 3.830 -5.506 1.00 0.00 C ATOM 1498 CD1 LEU B 81 -1.833 2.316 -5.641 1.00 0.00 C ATOM 1499 CD2 LEU B 81 -3.256 4.281 -5.033 1.00 0.00 C ATOM 0 H LEU B 81 -1.423 6.062 -6.251 1.00 0.00 H new ATOM 0 HA LEU B 81 0.729 5.826 -4.320 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -0.241 3.460 -4.178 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -1.283 4.778 -3.680 1.00 0.00 H new ATOM 0 HG LEU B 81 -1.692 4.265 -6.487 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -2.611 1.987 -6.330 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -0.858 2.016 -6.025 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -1.995 1.858 -4.665 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -4.015 3.923 -5.728 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -3.451 3.874 -4.041 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -3.287 5.370 -4.991 1.00 0.00 H new ATOM 1511 N LYS B 82 1.174 4.838 -7.305 1.00 0.00 N ATOM 1512 CA LYS B 82 2.103 4.195 -8.229 1.00 0.00 C ATOM 1513 C LYS B 82 3.386 5.008 -8.385 1.00 0.00 C ATOM 1514 O LYS B 82 4.444 4.459 -8.689 1.00 0.00 O ATOM 1515 CB LYS B 82 1.440 4.006 -9.595 1.00 0.00 C ATOM 1516 CG LYS B 82 0.540 2.783 -9.670 1.00 0.00 C ATOM 1517 CD LYS B 82 1.348 1.498 -9.688 1.00 0.00 C ATOM 1518 CE LYS B 82 1.798 1.142 -11.096 1.00 0.00 C ATOM 1519 NZ LYS B 82 1.993 -0.325 -11.263 1.00 0.00 N ATOM 0 H LYS B 82 0.504 5.466 -7.748 1.00 0.00 H new ATOM 0 HA LYS B 82 2.366 3.222 -7.814 1.00 0.00 H new ATOM 0 HB2 LYS B 82 0.853 4.894 -9.831 1.00 0.00 H new ATOM 0 HB3 LYS B 82 2.215 3.924 -10.357 1.00 0.00 H new ATOM 0 HG2 LYS B 82 -0.138 2.776 -8.816 1.00 0.00 H new ATOM 0 HG3 LYS B 82 -0.077 2.839 -10.567 1.00 0.00 H new ATOM 0 HD2 LYS B 82 2.220 1.606 -9.043 1.00 0.00 H new ATOM 0 HD3 LYS B 82 0.748 0.684 -9.280 1.00 0.00 H new ATOM 0 HE2 LYS B 82 1.057 1.494 -11.814 1.00 0.00 H new ATOM 0 HE3 LYS B 82 2.730 1.660 -11.321 1.00 0.00 H new ATOM 0 HZ1 LYS B 82 2.821 -0.498 -11.868 1.00 0.00 H new ATOM 0 HZ2 LYS B 82 2.147 -0.763 -10.332 1.00 0.00 H new ATOM 0 HZ3 LYS B 82 1.148 -0.739 -11.705 1.00 0.00 H new ATOM 1533 N MET B 83 3.286 6.320 -8.185 1.00 0.00 N ATOM 1534 CA MET B 83 4.441 7.198 -8.313 1.00 0.00 C ATOM 1535 C MET B 83 4.849 7.793 -6.964 1.00 0.00 C ATOM 1536 O MET B 83 5.958 8.308 -6.814 1.00 0.00 O ATOM 1537 CB MET B 83 4.142 8.308 -9.328 1.00 0.00 C ATOM 1538 CG MET B 83 3.327 9.471 -8.772 1.00 0.00 C ATOM 1539 SD MET B 83 4.180 11.053 -8.920 1.00 0.00 S ATOM 1540 CE MET B 83 3.211 11.839 -10.207 1.00 0.00 C ATOM 0 H MET B 83 2.419 6.795 -7.935 1.00 0.00 H new ATOM 0 HA MET B 83 5.281 6.604 -8.672 1.00 0.00 H new ATOM 0 HB2 MET B 83 5.086 8.694 -9.714 1.00 0.00 H new ATOM 0 HB3 MET B 83 3.605 7.876 -10.172 1.00 0.00 H new ATOM 0 HG2 MET B 83 2.374 9.526 -9.299 1.00 0.00 H new ATOM 0 HG3 MET B 83 3.101 9.282 -7.723 1.00 0.00 H new ATOM 0 HE1 MET B 83 3.857 12.477 -10.810 1.00 0.00 H new ATOM 0 HE2 MET B 83 2.761 11.075 -10.841 1.00 0.00 H new ATOM 0 HE3 MET B 83 2.425 12.443 -9.753 1.00 0.00 H new ATOM 1550 N ASP B 84 3.950 7.717 -5.983 1.00 0.00 N ATOM 1551 CA ASP B 84 4.222 8.247 -4.649 1.00 0.00 C ATOM 1552 C ASP B 84 4.252 9.772 -4.662 1.00 0.00 C ATOM 1553 O ASP B 84 3.396 10.424 -4.064 1.00 0.00 O ATOM 1554 CB ASP B 84 5.550 7.702 -4.116 1.00 0.00 C ATOM 1555 CG ASP B 84 5.492 7.387 -2.633 1.00 0.00 C ATOM 1556 OD1 ASP B 84 4.745 8.078 -1.909 1.00 0.00 O ATOM 1557 OD2 ASP B 84 6.193 6.450 -2.198 1.00 0.00 O ATOM 0 H ASP B 84 3.028 7.294 -6.088 1.00 0.00 H new ATOM 0 HA ASP B 84 3.416 7.924 -3.990 1.00 0.00 H new ATOM 0 HB2 ASP B 84 5.816 6.800 -4.666 1.00 0.00 H new ATOM 0 HB3 ASP B 84 6.339 8.432 -4.299 1.00 0.00 H new ATOM 1562 N SER B 85 5.244 10.336 -5.346 1.00 0.00 N ATOM 1563 CA SER B 85 5.388 11.786 -5.438 1.00 0.00 C ATOM 1564 C SER B 85 5.727 12.390 -4.078 1.00 0.00 C ATOM 1565 O SER B 85 6.003 11.672 -3.117 1.00 0.00 O ATOM 1566 CB SER B 85 4.103 12.417 -5.981 1.00 0.00 C ATOM 1567 OG SER B 85 4.391 13.400 -6.962 1.00 0.00 O ATOM 0 H SER B 85 5.961 9.810 -5.845 1.00 0.00 H new ATOM 0 HA SER B 85 6.208 11.998 -6.124 1.00 0.00 H new ATOM 0 HB2 SER B 85 3.469 11.643 -6.413 1.00 0.00 H new ATOM 0 HB3 SER B 85 3.542 12.869 -5.163 1.00 0.00 H new ATOM 0 HG SER B 85 4.197 13.040 -7.853 1.00 0.00 H new ATOM 1573 N LEU B 86 5.703 13.717 -4.009 1.00 0.00 N ATOM 1574 CA LEU B 86 6.007 14.426 -2.773 1.00 0.00 C ATOM 1575 C LEU B 86 5.627 15.899 -2.887 1.00 0.00 C ATOM 1576 O LEU B 86 5.053 16.477 -1.963 1.00 0.00 O ATOM 1577 CB LEU B 86 7.494 14.293 -2.435 1.00 0.00 C ATOM 1578 CG LEU B 86 7.799 13.955 -0.975 1.00 0.00 C ATOM 1579 CD1 LEU B 86 7.270 15.044 -0.054 1.00 0.00 C ATOM 1580 CD2 LEU B 86 7.203 12.605 -0.604 1.00 0.00 C ATOM 0 H LEU B 86 5.476 14.324 -4.797 1.00 0.00 H new ATOM 0 HA LEU B 86 5.420 13.978 -1.971 1.00 0.00 H new ATOM 0 HB2 LEU B 86 7.927 13.519 -3.069 1.00 0.00 H new ATOM 0 HB3 LEU B 86 7.993 15.229 -2.687 1.00 0.00 H new ATOM 0 HG LEU B 86 8.881 13.898 -0.854 1.00 0.00 H new ATOM 0 HD11 LEU B 86 7.496 14.787 0.981 1.00 0.00 H new ATOM 0 HD12 LEU B 86 7.744 15.993 -0.304 1.00 0.00 H new ATOM 0 HD13 LEU B 86 6.191 15.133 -0.178 1.00 0.00 H new ATOM 0 HD21 LEU B 86 7.430 12.381 0.438 1.00 0.00 H new ATOM 0 HD22 LEU B 86 6.122 12.634 -0.742 1.00 0.00 H new ATOM 0 HD23 LEU B 86 7.629 11.831 -1.242 1.00 0.00 H new ATOM 1592 N ARG B 87 5.951 16.501 -4.028 1.00 0.00 N ATOM 1593 CA ARG B 87 5.643 17.908 -4.263 1.00 0.00 C ATOM 1594 C ARG B 87 4.518 18.052 -5.278 1.00 0.00 C ATOM 1595 O ARG B 87 3.427 18.478 -4.923 1.00 0.00 O ATOM 1596 CB ARG B 87 6.888 18.661 -4.743 1.00 0.00 C ATOM 1597 CG ARG B 87 8.192 18.111 -4.185 1.00 0.00 C ATOM 1598 CD ARG B 87 9.392 18.888 -4.701 1.00 0.00 C ATOM 1599 NE ARG B 87 10.655 18.265 -4.310 1.00 0.00 N ATOM 1600 CZ ARG B 87 11.851 18.735 -4.659 1.00 0.00 C ATOM 1601 NH1 ARG B 87 11.953 19.830 -5.402 1.00 0.00 N ATOM 1602 NH2 ARG B 87 12.951 18.108 -4.262 1.00 0.00 N ATOM 0 H ARG B 87 6.426 16.037 -4.803 1.00 0.00 H new ATOM 0 HA ARG B 87 5.315 18.344 -3.319 1.00 0.00 H new ATOM 0 HB2 ARG B 87 6.926 18.625 -5.832 1.00 0.00 H new ATOM 0 HB3 ARG B 87 6.797 19.710 -4.462 1.00 0.00 H new ATOM 0 HG2 ARG B 87 8.170 18.155 -3.096 1.00 0.00 H new ATOM 0 HG3 ARG B 87 8.292 17.061 -4.460 1.00 0.00 H new ATOM 0 HD2 ARG B 87 9.341 18.954 -5.788 1.00 0.00 H new ATOM 0 HD3 ARG B 87 9.356 19.908 -4.317 1.00 0.00 H new ATOM 0 HE ARG B 87 10.618 17.422 -3.737 1.00 0.00 H new ATOM 0 HH11 ARG B 87 11.112 20.318 -5.710 1.00 0.00 H new ATOM 0 HH12 ARG B 87 12.873 20.184 -5.665 1.00 0.00 H new ATOM 0 HH21 ARG B 87 12.880 17.267 -3.690 1.00 0.00 H new ATOM 0 HH22 ARG B 87 13.867 18.467 -4.529 1.00 0.00 H new ATOM 1616 N ASP B 88 4.805 17.684 -6.531 1.00 0.00 N ATOM 1617 CA ASP B 88 3.838 17.743 -7.644 1.00 0.00 C ATOM 1618 C ASP B 88 2.677 18.718 -7.408 1.00 0.00 C ATOM 1619 O ASP B 88 2.484 19.663 -8.174 1.00 0.00 O ATOM 1620 CB ASP B 88 3.284 16.345 -7.921 1.00 0.00 C ATOM 1621 CG ASP B 88 3.914 15.705 -9.143 1.00 0.00 C ATOM 1622 OD1 ASP B 88 4.312 16.449 -10.064 1.00 0.00 O ATOM 1623 OD2 ASP B 88 4.008 14.460 -9.180 1.00 0.00 O ATOM 0 H ASP B 88 5.722 17.333 -6.809 1.00 0.00 H new ATOM 0 HA ASP B 88 4.388 18.121 -8.506 1.00 0.00 H new ATOM 0 HB2 ASP B 88 3.457 15.710 -7.052 1.00 0.00 H new ATOM 0 HB3 ASP B 88 2.205 16.406 -8.062 1.00 0.00 H new ATOM 1628 N ILE B 89 1.915 18.484 -6.345 1.00 0.00 N ATOM 1629 CA ILE B 89 0.782 19.335 -6.005 1.00 0.00 C ATOM 1630 C ILE B 89 1.268 20.527 -5.210 1.00 0.00 C ATOM 1631 O ILE B 89 1.104 21.677 -5.620 1.00 0.00 O ATOM 1632 CB ILE B 89 -0.277 18.576 -5.181 1.00 0.00 C ATOM 1633 CG1 ILE B 89 -0.580 17.223 -5.822 1.00 0.00 C ATOM 1634 CG2 ILE B 89 -1.547 19.407 -5.055 1.00 0.00 C ATOM 1635 CD1 ILE B 89 -1.217 17.339 -7.183 1.00 0.00 C ATOM 0 H ILE B 89 2.063 17.707 -5.701 1.00 0.00 H new ATOM 0 HA ILE B 89 0.318 19.660 -6.936 1.00 0.00 H new ATOM 0 HB ILE B 89 0.119 18.401 -4.181 1.00 0.00 H new ATOM 0 HG12 ILE B 89 0.346 16.654 -5.909 1.00 0.00 H new ATOM 0 HG13 ILE B 89 -1.241 16.657 -5.166 1.00 0.00 H new ATOM 0 HG21 ILE B 89 -2.285 18.857 -4.471 1.00 0.00 H new ATOM 0 HG22 ILE B 89 -1.318 20.349 -4.556 1.00 0.00 H new ATOM 0 HG23 ILE B 89 -1.949 19.610 -6.048 1.00 0.00 H new ATOM 0 HD11 ILE B 89 -1.406 16.343 -7.582 1.00 0.00 H new ATOM 0 HD12 ILE B 89 -2.159 17.881 -7.099 1.00 0.00 H new ATOM 0 HD13 ILE B 89 -0.547 17.878 -7.853 1.00 0.00 H new ATOM 1647 N GLU B 90 1.909 20.238 -4.087 1.00 0.00 N ATOM 1648 CA GLU B 90 2.473 21.278 -3.251 1.00 0.00 C ATOM 1649 C GLU B 90 3.608 21.969 -3.999 1.00 0.00 C ATOM 1650 O GLU B 90 4.074 23.029 -3.591 1.00 0.00 O ATOM 1651 CB GLU B 90 2.982 20.689 -1.934 1.00 0.00 C ATOM 1652 CG GLU B 90 3.475 21.737 -0.950 1.00 0.00 C ATOM 1653 CD GLU B 90 4.986 21.760 -0.829 1.00 0.00 C ATOM 1654 OE1 GLU B 90 5.574 20.700 -0.527 1.00 0.00 O ATOM 1655 OE2 GLU B 90 5.582 22.838 -1.035 1.00 0.00 O ATOM 0 H GLU B 90 2.050 19.290 -3.737 1.00 0.00 H new ATOM 0 HA GLU B 90 1.699 22.009 -3.018 1.00 0.00 H new ATOM 0 HB2 GLU B 90 2.181 20.114 -1.469 1.00 0.00 H new ATOM 0 HB3 GLU B 90 3.793 19.992 -2.146 1.00 0.00 H new ATOM 0 HG2 GLU B 90 3.125 22.720 -1.266 1.00 0.00 H new ATOM 0 HG3 GLU B 90 3.039 21.543 0.030 1.00 0.00 H new ATOM 1662 N ALA B 91 4.038 21.366 -5.114 1.00 0.00 N ATOM 1663 CA ALA B 91 5.103 21.940 -5.929 1.00 0.00 C ATOM 1664 C ALA B 91 4.520 22.917 -6.937 1.00 0.00 C ATOM 1665 O ALA B 91 4.878 24.093 -6.963 1.00 0.00 O ATOM 1666 CB ALA B 91 5.884 20.846 -6.642 1.00 0.00 C ATOM 0 H ALA B 91 3.664 20.485 -5.467 1.00 0.00 H new ATOM 0 HA ALA B 91 5.789 22.477 -5.274 1.00 0.00 H new ATOM 0 HB1 ALA B 91 6.673 21.296 -7.244 1.00 0.00 H new ATOM 0 HB2 ALA B 91 6.327 20.176 -5.905 1.00 0.00 H new ATOM 0 HB3 ALA B 91 5.212 20.281 -7.288 1.00 0.00 H new ATOM 1672 N LEU B 92 3.596 22.426 -7.755 1.00 0.00 N ATOM 1673 CA LEU B 92 2.945 23.271 -8.746 1.00 0.00 C ATOM 1674 C LEU B 92 2.215 24.419 -8.054 1.00 0.00 C ATOM 1675 O LEU B 92 1.938 25.453 -8.664 1.00 0.00 O ATOM 1676 CB LEU B 92 1.965 22.455 -9.592 1.00 0.00 C ATOM 1677 CG LEU B 92 2.073 22.675 -11.103 1.00 0.00 C ATOM 1678 CD1 LEU B 92 1.882 24.145 -11.442 1.00 0.00 C ATOM 1679 CD2 LEU B 92 3.414 22.176 -11.618 1.00 0.00 C ATOM 0 H LEU B 92 3.283 21.455 -7.751 1.00 0.00 H new ATOM 0 HA LEU B 92 3.708 23.682 -9.407 1.00 0.00 H new ATOM 0 HB2 LEU B 92 2.122 21.397 -9.382 1.00 0.00 H new ATOM 0 HB3 LEU B 92 0.950 22.695 -9.277 1.00 0.00 H new ATOM 0 HG LEU B 92 1.283 22.105 -11.593 1.00 0.00 H new ATOM 0 HD11 LEU B 92 1.962 24.283 -12.520 1.00 0.00 H new ATOM 0 HD12 LEU B 92 0.897 24.471 -11.106 1.00 0.00 H new ATOM 0 HD13 LEU B 92 2.650 24.736 -10.943 1.00 0.00 H new ATOM 0 HD21 LEU B 92 3.474 22.340 -12.694 1.00 0.00 H new ATOM 0 HD22 LEU B 92 4.219 22.719 -11.122 1.00 0.00 H new ATOM 0 HD23 LEU B 92 3.511 21.111 -11.407 1.00 0.00 H new ATOM 1691 N LEU B 93 1.914 24.229 -6.769 1.00 0.00 N ATOM 1692 CA LEU B 93 1.224 25.243 -5.986 1.00 0.00 C ATOM 1693 C LEU B 93 2.219 26.134 -5.251 1.00 0.00 C ATOM 1694 O LEU B 93 1.991 27.333 -5.102 1.00 0.00 O ATOM 1695 CB LEU B 93 0.266 24.587 -4.992 1.00 0.00 C ATOM 1696 CG LEU B 93 -1.136 24.312 -5.538 1.00 0.00 C ATOM 1697 CD1 LEU B 93 -1.767 23.131 -4.820 1.00 0.00 C ATOM 1698 CD2 LEU B 93 -2.013 25.551 -5.407 1.00 0.00 C ATOM 0 H LEU B 93 2.140 23.379 -6.252 1.00 0.00 H new ATOM 0 HA LEU B 93 0.648 25.866 -6.670 1.00 0.00 H new ATOM 0 HB2 LEU B 93 0.701 23.646 -4.657 1.00 0.00 H new ATOM 0 HB3 LEU B 93 0.180 25.228 -4.115 1.00 0.00 H new ATOM 0 HG LEU B 93 -1.050 24.063 -6.596 1.00 0.00 H new ATOM 0 HD11 LEU B 93 -2.764 22.951 -5.222 1.00 0.00 H new ATOM 0 HD12 LEU B 93 -1.151 22.244 -4.967 1.00 0.00 H new ATOM 0 HD13 LEU B 93 -1.840 23.350 -3.755 1.00 0.00 H new ATOM 0 HD21 LEU B 93 -3.007 25.337 -5.800 1.00 0.00 H new ATOM 0 HD22 LEU B 93 -2.091 25.832 -4.357 1.00 0.00 H new ATOM 0 HD23 LEU B 93 -1.569 26.372 -5.970 1.00 0.00 H new ATOM 1710 N THR B 94 3.330 25.560 -4.796 1.00 0.00 N ATOM 1711 CA THR B 94 4.336 26.356 -4.096 1.00 0.00 C ATOM 1712 C THR B 94 5.136 27.206 -5.082 1.00 0.00 C ATOM 1713 O THR B 94 5.874 28.105 -4.682 1.00 0.00 O ATOM 1714 CB THR B 94 5.275 25.473 -3.273 1.00 0.00 C ATOM 1715 OG1 THR B 94 6.072 26.265 -2.410 1.00 0.00 O ATOM 1716 CG2 THR B 94 6.206 24.639 -4.117 1.00 0.00 C ATOM 0 H THR B 94 3.554 24.570 -4.895 1.00 0.00 H new ATOM 0 HA THR B 94 3.810 27.019 -3.409 1.00 0.00 H new ATOM 0 HB THR B 94 4.625 24.802 -2.711 1.00 0.00 H new ATOM 0 HG1 THR B 94 6.291 27.112 -2.852 1.00 0.00 H new ATOM 0 HG21 THR B 94 6.844 24.037 -3.469 1.00 0.00 H new ATOM 0 HG22 THR B 94 5.622 23.983 -4.763 1.00 0.00 H new ATOM 0 HG23 THR B 94 6.826 25.293 -4.730 1.00 0.00 H new ATOM 1724 N GLY B 95 4.987 26.914 -6.376 1.00 0.00 N ATOM 1725 CA GLY B 95 5.705 27.661 -7.392 1.00 0.00 C ATOM 1726 C GLY B 95 4.786 28.381 -8.365 1.00 0.00 C ATOM 1727 O GLY B 95 5.151 29.422 -8.911 1.00 0.00 O ATOM 0 H GLY B 95 4.383 26.175 -6.734 1.00 0.00 H new ATOM 0 HA2 GLY B 95 6.354 28.390 -6.907 1.00 0.00 H new ATOM 0 HA3 GLY B 95 6.350 26.980 -7.947 1.00 0.00 H new ATOM 1731 N LEU B 96 3.595 27.828 -8.597 1.00 0.00 N ATOM 1732 CA LEU B 96 2.644 28.438 -9.525 1.00 0.00 C ATOM 1733 C LEU B 96 1.341 28.834 -8.840 1.00 0.00 C ATOM 1734 O LEU B 96 0.418 29.331 -9.485 1.00 0.00 O ATOM 1735 CB LEU B 96 2.348 27.483 -10.680 1.00 0.00 C ATOM 1736 CG LEU B 96 2.098 28.156 -12.030 1.00 0.00 C ATOM 1737 CD1 LEU B 96 2.612 27.281 -13.165 1.00 0.00 C ATOM 1738 CD2 LEU B 96 0.617 28.451 -12.212 1.00 0.00 C ATOM 0 H LEU B 96 3.268 26.967 -8.159 1.00 0.00 H new ATOM 0 HA LEU B 96 3.107 29.348 -9.906 1.00 0.00 H new ATOM 0 HB2 LEU B 96 3.186 26.794 -10.785 1.00 0.00 H new ATOM 0 HB3 LEU B 96 1.474 26.885 -10.422 1.00 0.00 H new ATOM 0 HG LEU B 96 2.642 29.100 -12.050 1.00 0.00 H new ATOM 0 HD11 LEU B 96 2.426 27.775 -14.118 1.00 0.00 H new ATOM 0 HD12 LEU B 96 3.683 27.119 -13.043 1.00 0.00 H new ATOM 0 HD13 LEU B 96 2.096 26.321 -13.147 1.00 0.00 H new ATOM 0 HD21 LEU B 96 0.457 28.930 -13.178 1.00 0.00 H new ATOM 0 HD22 LEU B 96 0.053 27.519 -12.171 1.00 0.00 H new ATOM 0 HD23 LEU B 96 0.278 29.116 -11.417 1.00 0.00 H new ATOM 1750 N PHE B 97 1.280 28.616 -7.535 1.00 0.00 N ATOM 1751 CA PHE B 97 0.105 28.948 -6.729 1.00 0.00 C ATOM 1752 C PHE B 97 -1.205 28.669 -7.479 1.00 0.00 C ATOM 1753 O PHE B 97 -1.720 27.552 -7.441 1.00 0.00 O ATOM 1754 CB PHE B 97 0.173 30.407 -6.262 1.00 0.00 C ATOM 1755 CG PHE B 97 0.948 31.319 -7.179 1.00 0.00 C ATOM 1756 CD1 PHE B 97 2.325 31.196 -7.299 1.00 0.00 C ATOM 1757 CD2 PHE B 97 0.302 32.299 -7.916 1.00 0.00 C ATOM 1758 CE1 PHE B 97 3.039 32.031 -8.138 1.00 0.00 C ATOM 1759 CE2 PHE B 97 1.011 33.136 -8.756 1.00 0.00 C ATOM 1760 CZ PHE B 97 2.381 33.002 -8.867 1.00 0.00 C ATOM 0 H PHE B 97 2.044 28.203 -7.000 1.00 0.00 H new ATOM 0 HA PHE B 97 0.112 28.300 -5.852 1.00 0.00 H new ATOM 0 HB2 PHE B 97 -0.842 30.791 -6.161 1.00 0.00 H new ATOM 0 HB3 PHE B 97 0.626 30.438 -5.271 1.00 0.00 H new ATOM 0 HD1 PHE B 97 2.845 30.439 -6.730 1.00 0.00 H new ATOM 0 HD2 PHE B 97 -0.769 32.410 -7.833 1.00 0.00 H new ATOM 0 HE1 PHE B 97 4.110 31.924 -8.223 1.00 0.00 H new ATOM 0 HE2 PHE B 97 0.494 33.894 -9.325 1.00 0.00 H new ATOM 0 HZ PHE B 97 2.937 33.656 -9.523 1.00 0.00 H new ATOM 1770 N VAL B 98 -1.739 29.682 -8.154 1.00 0.00 N ATOM 1771 CA VAL B 98 -2.982 29.533 -8.902 1.00 0.00 C ATOM 1772 C VAL B 98 -2.751 28.798 -10.218 1.00 0.00 C ATOM 1773 O VAL B 98 -1.769 29.047 -10.916 1.00 0.00 O ATOM 1774 CB VAL B 98 -3.621 30.902 -9.203 1.00 0.00 C ATOM 1775 CG1 VAL B 98 -5.015 30.726 -9.788 1.00 0.00 C ATOM 1776 CG2 VAL B 98 -3.667 31.758 -7.946 1.00 0.00 C ATOM 0 H VAL B 98 -1.330 30.615 -8.198 1.00 0.00 H new ATOM 0 HA VAL B 98 -3.657 28.949 -8.276 1.00 0.00 H new ATOM 0 HB VAL B 98 -3.005 31.414 -9.942 1.00 0.00 H new ATOM 0 HG11 VAL B 98 -5.449 31.704 -9.994 1.00 0.00 H new ATOM 0 HG12 VAL B 98 -4.951 30.155 -10.714 1.00 0.00 H new ATOM 0 HG13 VAL B 98 -5.644 30.192 -9.075 1.00 0.00 H new ATOM 0 HG21 VAL B 98 -4.122 32.721 -8.178 1.00 0.00 H new ATOM 0 HG22 VAL B 98 -4.258 31.252 -7.183 1.00 0.00 H new ATOM 0 HG23 VAL B 98 -2.654 31.915 -7.575 1.00 0.00 H new ATOM 1786 N GLN B 99 -3.666 27.891 -10.552 1.00 0.00 N ATOM 1787 CA GLN B 99 -3.566 27.121 -11.786 1.00 0.00 C ATOM 1788 C GLN B 99 -4.843 27.258 -12.609 1.00 0.00 C ATOM 1789 O GLN B 99 -5.882 27.671 -12.095 1.00 0.00 O ATOM 1790 CB GLN B 99 -3.300 25.648 -11.473 1.00 0.00 C ATOM 1791 CG GLN B 99 -1.828 25.324 -11.270 1.00 0.00 C ATOM 1792 CD GLN B 99 -1.615 24.110 -10.387 1.00 0.00 C ATOM 1793 OE1 GLN B 99 -1.298 24.350 -9.120 1.00 0.00 O flip ATOM 1794 NE2 GLN B 99 -1.734 22.971 -10.838 1.00 0.00 N flip ATOM 0 H GLN B 99 -4.485 27.672 -9.984 1.00 0.00 H new ATOM 0 HA GLN B 99 -2.733 27.514 -12.368 1.00 0.00 H new ATOM 0 HB2 GLN B 99 -3.851 25.371 -10.575 1.00 0.00 H new ATOM 0 HB3 GLN B 99 -3.689 25.036 -12.287 1.00 0.00 H new ATOM 0 HG2 GLN B 99 -1.361 25.150 -12.239 1.00 0.00 H new ATOM 0 HG3 GLN B 99 -1.328 26.185 -10.825 1.00 0.00 H new ATOM 0 HE21 GLN B 99 -1.979 22.834 -11.819 1.00 0.00 H new ATOM 0 HE22 GLN B 99 -1.588 22.164 -10.231 1.00 0.00 H new ATOM 1803 N ASP B 100 -4.759 26.911 -13.888 1.00 0.00 N ATOM 1804 CA ASP B 100 -5.910 26.996 -14.780 1.00 0.00 C ATOM 1805 C ASP B 100 -6.381 25.608 -15.198 1.00 0.00 C ATOM 1806 O ASP B 100 -5.656 24.869 -15.864 1.00 0.00 O ATOM 1807 CB ASP B 100 -5.565 27.826 -16.017 1.00 0.00 C ATOM 1808 CG ASP B 100 -5.958 29.283 -15.865 1.00 0.00 C ATOM 1809 OD1 ASP B 100 -5.451 29.941 -14.932 1.00 0.00 O ATOM 1810 OD2 ASP B 100 -6.777 29.764 -16.675 1.00 0.00 O ATOM 0 H ASP B 100 -3.906 26.568 -14.331 1.00 0.00 H new ATOM 0 HA ASP B 100 -6.720 27.485 -14.239 1.00 0.00 H new ATOM 0 HB2 ASP B 100 -4.494 27.760 -16.208 1.00 0.00 H new ATOM 0 HB3 ASP B 100 -6.071 27.405 -16.886 1.00 0.00 H new ATOM 1815 N ASN B 101 -7.601 25.259 -14.802 1.00 0.00 N ATOM 1816 CA ASN B 101 -8.168 23.957 -15.134 1.00 0.00 C ATOM 1817 C ASN B 101 -9.631 24.087 -15.547 1.00 0.00 C ATOM 1818 O ASN B 101 -10.280 25.095 -15.264 1.00 0.00 O ATOM 1819 CB ASN B 101 -8.046 23.005 -13.943 1.00 0.00 C ATOM 1820 CG ASN B 101 -6.680 22.355 -13.861 1.00 0.00 C ATOM 1821 OD1 ASN B 101 -5.671 22.952 -14.237 1.00 0.00 O ATOM 1822 ND2 ASN B 101 -6.641 21.121 -13.371 1.00 0.00 N ATOM 0 H ASN B 101 -8.215 25.859 -14.251 1.00 0.00 H new ATOM 0 HA ASN B 101 -7.607 23.550 -15.975 1.00 0.00 H new ATOM 0 HB2 ASN B 101 -8.240 23.554 -13.021 1.00 0.00 H new ATOM 0 HB3 ASN B 101 -8.810 22.231 -14.020 1.00 0.00 H new ATOM 0 HD21 ASN B 101 -5.750 20.631 -13.295 1.00 0.00 H new ATOM 0 HD22 ASN B 101 -7.502 20.664 -13.071 1.00 0.00 H new ATOM 1829 N VAL B 102 -10.143 23.061 -16.220 1.00 0.00 N ATOM 1830 CA VAL B 102 -11.528 23.058 -16.675 1.00 0.00 C ATOM 1831 C VAL B 102 -11.950 21.665 -17.136 1.00 0.00 C ATOM 1832 O VAL B 102 -11.114 20.850 -17.523 1.00 0.00 O ATOM 1833 CB VAL B 102 -11.745 24.062 -17.824 1.00 0.00 C ATOM 1834 CG1 VAL B 102 -10.877 23.704 -19.023 1.00 0.00 C ATOM 1835 CG2 VAL B 102 -13.214 24.118 -18.217 1.00 0.00 C ATOM 0 H VAL B 102 -9.618 22.220 -16.462 1.00 0.00 H new ATOM 0 HA VAL B 102 -12.143 23.357 -15.826 1.00 0.00 H new ATOM 0 HB VAL B 102 -11.449 25.051 -17.475 1.00 0.00 H new ATOM 0 HG11 VAL B 102 -11.046 24.425 -19.823 1.00 0.00 H new ATOM 0 HG12 VAL B 102 -9.827 23.725 -18.731 1.00 0.00 H new ATOM 0 HG13 VAL B 102 -11.136 22.705 -19.375 1.00 0.00 H new ATOM 0 HG21 VAL B 102 -13.346 24.832 -19.030 1.00 0.00 H new ATOM 0 HG22 VAL B 102 -13.541 23.131 -18.545 1.00 0.00 H new ATOM 0 HG23 VAL B 102 -13.809 24.431 -17.359 1.00 0.00 H new ATOM 1845 N ASN B 103 -13.252 21.401 -17.091 1.00 0.00 N ATOM 1846 CA ASN B 103 -13.783 20.108 -17.506 1.00 0.00 C ATOM 1847 C ASN B 103 -14.387 20.190 -18.905 1.00 0.00 C ATOM 1848 O ASN B 103 -14.697 21.274 -19.394 1.00 0.00 O ATOM 1849 CB ASN B 103 -14.836 19.622 -16.509 1.00 0.00 C ATOM 1850 CG ASN B 103 -15.970 20.613 -16.337 1.00 0.00 C ATOM 1851 OD1 ASN B 103 -16.972 20.557 -17.050 1.00 0.00 O ATOM 1852 ND2 ASN B 103 -15.818 21.526 -15.385 1.00 0.00 N ATOM 0 H ASN B 103 -13.958 22.065 -16.772 1.00 0.00 H new ATOM 0 HA ASN B 103 -12.959 19.395 -17.529 1.00 0.00 H new ATOM 0 HB2 ASN B 103 -15.239 18.668 -16.847 1.00 0.00 H new ATOM 0 HB3 ASN B 103 -14.363 19.444 -15.543 1.00 0.00 H new ATOM 0 HD21 ASN B 103 -16.549 22.218 -15.221 1.00 0.00 H new ATOM 0 HD22 ASN B 103 -14.970 21.535 -14.818 1.00 0.00 H new ATOM 1859 N LYS B 104 -14.543 19.031 -19.544 1.00 0.00 N ATOM 1860 CA LYS B 104 -15.103 18.956 -20.893 1.00 0.00 C ATOM 1861 C LYS B 104 -14.437 19.965 -21.827 1.00 0.00 C ATOM 1862 O LYS B 104 -13.467 20.624 -21.456 1.00 0.00 O ATOM 1863 CB LYS B 104 -16.621 19.174 -20.863 1.00 0.00 C ATOM 1864 CG LYS B 104 -17.047 20.617 -20.620 1.00 0.00 C ATOM 1865 CD LYS B 104 -18.286 20.977 -21.425 1.00 0.00 C ATOM 1866 CE LYS B 104 -19.449 20.045 -21.120 1.00 0.00 C ATOM 1867 NZ LYS B 104 -19.745 19.137 -22.263 1.00 0.00 N ATOM 0 H LYS B 104 -14.288 18.127 -19.147 1.00 0.00 H new ATOM 0 HA LYS B 104 -14.903 17.957 -21.280 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -17.042 18.839 -21.811 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -17.050 18.545 -20.083 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -17.246 20.765 -19.559 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -16.231 21.288 -20.887 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -18.576 22.004 -21.205 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -18.054 20.932 -22.489 1.00 0.00 H new ATOM 0 HE2 LYS B 104 -19.217 19.452 -20.235 1.00 0.00 H new ATOM 0 HE3 LYS B 104 -20.335 20.635 -20.885 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 -20.744 18.849 -22.228 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 -19.559 19.633 -23.158 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -19.139 18.294 -22.202 1.00 0.00 H new ATOM 1881 N ASP B 105 -14.965 20.076 -23.042 1.00 0.00 N ATOM 1882 CA ASP B 105 -14.421 21.004 -24.030 1.00 0.00 C ATOM 1883 C ASP B 105 -15.241 20.973 -25.316 1.00 0.00 C ATOM 1884 O ASP B 105 -16.259 20.284 -25.399 1.00 0.00 O ATOM 1885 CB ASP B 105 -12.959 20.664 -24.329 1.00 0.00 C ATOM 1886 CG ASP B 105 -12.022 21.817 -24.021 1.00 0.00 C ATOM 1887 OD1 ASP B 105 -12.480 22.978 -24.050 1.00 0.00 O ATOM 1888 OD2 ASP B 105 -10.831 21.557 -23.752 1.00 0.00 O ATOM 0 H ASP B 105 -15.767 19.536 -23.367 1.00 0.00 H new ATOM 0 HA ASP B 105 -14.473 22.011 -23.615 1.00 0.00 H new ATOM 0 HB2 ASP B 105 -12.664 19.793 -23.743 1.00 0.00 H new ATOM 0 HB3 ASP B 105 -12.860 20.390 -25.379 1.00 0.00 H new ATOM 1893 N ALA B 106 -14.791 21.722 -26.317 1.00 0.00 N ATOM 1894 CA ALA B 106 -15.483 21.781 -27.599 1.00 0.00 C ATOM 1895 C ALA B 106 -14.492 21.788 -28.757 1.00 0.00 C ATOM 1896 O ALA B 106 -13.976 22.877 -29.087 1.00 0.00 O ATOM 1897 CB ALA B 106 -16.379 23.008 -27.659 1.00 0.00 C ATOM 1898 OXT ALA B 106 -14.239 20.705 -29.326 1.00 0.00 O ATOM 0 H ALA B 106 -13.950 22.297 -26.265 1.00 0.00 H new ATOM 0 HA ALA B 106 -16.103 20.889 -27.692 1.00 0.00 H new ATOM 0 HB1 ALA B 106 -16.889 23.039 -28.622 1.00 0.00 H new ATOM 0 HB2 ALA B 106 -17.117 22.959 -26.858 1.00 0.00 H new ATOM 0 HB3 ALA B 106 -15.774 23.907 -27.540 1.00 0.00 H new TER 1904 ALA B 106